NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 3.9600 8.3549 109.7289 45.2394 0.0000 174.7801 17 I 3.9351 7.3067 118.9452 62.0129 38.1983 175.1576 18 T 3.9304 7.7807 116.1507 64.3710 70.0555 172.7634 19 G 3.5466 7.6842 110.5004 44.3791 0.0000 171.6574 20 T 4.5815 7.7045 116.4238 61.6845 69.9807 174.6410 21 W 4.5933 8.3012 125.6072 54.7665 33.2888 173.9374 22 Y 5.3941 9.0250 120.0090 56.3667 40.6464 175.1986 23 A 4.8113 9.5857 126.2188 50.6495 20.6122 178.3017 24 Q 4.0332 8.0070 115.5700 58.4496 28.8581 178.1083 25 L 4.5029 7.8360 115.1692 53.8000 42.4516 175.9942 26 G 4.1081 8.3315 110.0317 46.0704 0.0000 175.3966 27 S 4.5157 8.3790 115.3597 59.3796 64.1507 173.9251 28 T 5.2719 8.5203 118.7096 61.7488 72.5658 172.9951 29 F 5.1410 9.0063 119.3438 55.1492 41.7448 173.3484 30 I 4.8624 8.7915 123.0991 59.4774 39.6777 175.0140 31 V 4.8519 8.4610 125.7275 60.2135 35.4780 174.3375 32 T 4.7791 9.0490 119.5577 61.7967 71.0472 172.9570 33 A 4.5985 8.2616 129.0420 50.1576 19.8875 177.1869 34 G 3.9886 9.7474 111.8432 44.5189 0.0000 174.0527 35 A 4.0953 8.4392 122.1663 54.4228 18.5695 178.3654 36 D 4.4537 8.1073 114.1707 53.9508 40.2607 177.7083 37 G 3.3814 8.2927 109.1869 45.1140 0.0000 172.4605 38 A 5.0409 8.0955 120.7822 50.2752 21.6761 176.5710 39 L 5.1789 8.5057 120.3010 53.1357 44.5853 175.9187 40 T 4.9440 8.9922 113.3266 59.4172 72.5090 174.4595 41 G 3.9940 7.2863 108.9793 46.5491 0.0000 171.3061 42 T 5.1689 7.9561 110.8277 60.2604 73.0477 172.6165 43 Y 5.0202 9.1954 124.7265 56.1269 41.4774 174.4246 44 E 5.6004 9.0276 124.7703 53.6706 33.3368 176.5250 *50 A 4.2217 8.4800 121.7076 52.3351 20.2664 178.6978 51 E 3.3869 7.8233 112.1726 57.9985 29.5876 177.5956 52 S 4.7772 7.8795 113.7457 57.8788 63.4631 172.5794 53 R 4.9225 7.2515 120.7124 56.0188 31.0752 175.2197 54 Y 4.9405 8.9866 122.2047 56.1087 42.7343 174.6713 55 V 4.3924 8.5918 122.8389 62.7718 32.0471 175.0795 56 L 5.1626 8.6768 127.0312 54.4391 44.0313 175.1603 57 T 4.7631 8.5473 113.9037 61.3757 71.6412 173.2572 58 G 4.2853 8.5941 112.4929 46.5182 0.0000 171.9449 59 R 5.5999 8.6986 117.4237 55.3719 35.0159 174.0099 60 Y 5.1982 8.4320 117.9618 55.7056 41.7808 174.5800 61 D 4.2609 9.1109 120.9736 54.5369 40.3117 176.5445 62 S 4.2904 8.0536 119.9469 58.5616 63.7696 175.0438 63 A 4.6412 8.0787 123.6774 50.3562 18.8288 173.9121 64 P 5.0494 0.0000 0.0000 60.5841 32.9143 177.1798 65 A 4.2263 8.3217 121.8723 52.6630 18.8314 177.6733 66 T 4.4369 8.2994 108.5385 61.9445 69.8896 175.4691 67 D 4.7058 7.9762 121.3932 53.7510 39.3302 177.1767 68 G 4.0165 7.8915 110.6481 45.8392 0.0000 174.8818 69 S 4.3113 7.6021 113.6032 57.7640 63.6057 173.9209 70 G 4.0152 8.2528 108.8525 45.9390 0.0000 172.7204 71 T 4.8013 8.7281 116.3036 61.5479 70.2538 174.7078 72 A 4.8155 8.6703 129.3556 52.0797 20.1306 175.8579 73 L 5.1174 8.7305 119.8528 55.4228 44.6703 174.2305 74 G 5.0128 9.0489 105.1701 45.5166 0.0000 172.1365 75 W 5.7635 8.1188 116.8571 55.5825 32.0046 173.2517 76 T 5.1777 9.2961 117.0348 61.8176 72.2252 173.2956 77 V 4.5728 8.4716 124.0471 60.9532 34.4456 173.9520 78 A 4.3932 8.2629 129.7323 49.6977 20.1103 177.7480 79 W 4.3111 8.6350 125.8047 56.3444 28.6106 176.1396 80 K 5.3203 7.6948 118.1809 54.8940 35.4577 174.5211 81 N 4.9020 9.1673 120.7443 52.3889 39.6595 174.4332 82 N 4.3389 8.7211 114.3494 55.7251 38.6199 175.2685 83 Y 4.6410 8.4142 114.5563 57.9826 40.3679 175.3895 84 R 4.5551 7.7585 113.8648 55.5145 32.4129 173.6873 85 N 5.2065 8.5073 116.5954 52.6750 40.5562 173.3581 86 A 4.3972 8.9104 128.3477 51.4410 19.7710 176.4294 87 H 4.1368 8.5355 114.3930 56.3751 27.0131 173.2056 88 S 5.0586 7.4606 111.3596 58.0874 66.7993 174.5557 89 A 4.9429 8.9780 120.6502 50.9020 22.9197 175.2660 90 T 4.9725 8.4013 117.1005 61.7159 71.9148 173.3503 91 T 4.9699 8.3772 115.3868 59.5994 72.0452 172.7062 92 W 4.9929 8.6974 124.5302 54.8184 31.8693 174.6799 93 S 4.7500 8.6770 119.1157 56.7118 64.8549 172.6657 94 G 4.5161 8.4106 113.5806 46.7098 0.0000 171.6803 95 Q 5.2047 8.4041 118.6629 54.9576 32.8128 173.6417 96 Y 4.7788 9.0935 123.3921 57.1473 40.5595 174.0446 97 V 4.3396 8.3727 127.0614 60.9684 33.9748 175.7119 98 G 3.8455 8.1848 115.6773 45.0816 0.0000 169.8594 99 G 3.8688 8.6988 103.4137 44.0293 0.0000 173.2286 100 A 4.0502 8.7802 121.2866 54.5585 19.0661 178.4117 101 E 4.5839 7.7426 115.0155 54.4381 29.0306 175.3631 102 A 4.5369 7.5847 121.7536 52.9654 19.7514 178.2438 103 R 5.2163 8.8748 115.5868 55.4540 33.7517 173.8090 104 I 4.9325 8.6502 120.5520 59.7899 40.2431 174.3316 105 N 5.3592 9.0430 125.7037 52.0391 40.4517 174.4905 106 T 5.2933 9.3347 113.7318 60.0261 73.0385 172.6628 107 Q 5.1366 9.0558 120.5577 53.8417 32.3982 174.8922 108 W 5.4004 8.2681 118.2896 54.6590 32.4368 173.7928 109 L 5.2256 8.6014 120.3696 52.9219 44.6644 175.2013 110 L 5.0529 9.2838 126.4387 53.7249 44.4924 174.8716 111 T 5.0165 8.7231 123.6186 62.0112 70.8699 173.8510 112 S 5.2035 8.3965 122.1662 56.5461 65.2303 174.3265 113 G 3.9012 8.5818 111.6599 46.4391 0.0000 173.0435 114 T 4.7800 8.2992 113.8305 59.4346 72.2912 173.1320 115 T 4.2860 8.0289 111.8676 60.7090 69.9159 175.1839 116 E 3.9036 8.9073 120.7597 59.5687 29.3548 178.8026 117 A 4.3433 7.9514 118.8283 53.6170 19.4033 177.4207 118 N 4.8771 7.9498 112.4190 52.8979 39.1455 176.5494 119 A 4.1800 8.3873 123.8884 54.2239 18.5048 180.4768 120 W 4.3333 8.3615 111.9254 58.5893 28.3308 176.6864 121 K 3.9726 6.5890 117.9326 56.2449 32.4159 177.3723 122 S 4.2849 7.8071 115.8247 60.4290 63.7120 173.3445 123 T 5.0850 7.5290 117.2350 61.7649 71.2147 173.4848 124 L 4.6719 8.9354 127.1200 53.7277 43.7404 176.1087 125 V 4.4975 8.0779 121.0473 60.2753 34.1647 175.2835 126 G 2.9042 6.9434 109.3318 45.9863 0.0000 170.9417 127 H 5.2205 7.8673 113.9024 55.1111 31.4454 172.2929 128 D 4.8089 8.8365 116.7260 53.8999 44.3173 174.0902 129 T 5.2723 8.3257 119.1033 61.8569 72.6323 172.7607 130 F 5.6524 9.5809 124.5152 56.0982 42.4498 174.5676 131 T 5.4724 8.9905 111.3054 60.1180 72.2236 174.8134 132 K 3.5879 8.6850 120.1778 58.0322 32.6319 177.6029 133 V 3.7868 7.7159 122.4991 62.9726 31.4795 175.3625 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 16 G 8.35 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 17 I 7.31 3.94 1.45 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 -0.09 0.58 0.00 0.00 18 T 7.78 3.93 4.17 0.00 0.00 0.00 0.00 0.00 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 19 G 7.68 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.70 4.58 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 0.62 0.00 0.00 21 W 8.30 4.59 0.00 1.78 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 9.03 5.39 0.00 2.95 2.83 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 23 A 9.59 4.81 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 24 Q 8.01 4.03 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.72 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 25 L 7.84 4.50 0.00 1.69 1.77 0.96 0.99 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 26 G 8.33 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 0.00 0.00 0.00 27 S 8.38 4.52 0.00 4.01 3.78 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 28 T 8.52 5.27 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 0.98 0.00 0.00 29 F 9.01 5.14 0.00 2.84 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.79 4.86 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.54 0.82 0.00 0.00 31 V 8.46 4.85 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 0.74 0.00 0.00 0.77 0.00 0.00 32 T 9.05 4.78 4.19 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 1.17 0.00 0.00 33 A 8.26 4.60 0.66 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 34 G 9.75 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 35 A 8.44 4.10 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 36 D 8.11 4.45 0.00 2.83 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 37 G 8.29 3.38 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 0.00 38 A 8.10 5.04 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 39 L 8.51 5.18 0.00 1.74 1.46 1.09 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.99 4.94 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 1.21 0.00 0.00 41 G 7.29 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 42 T 7.96 5.17 4.29 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 1.22 0.00 0.00 43 Y 9.20 5.02 0.00 2.94 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 44 E 9.03 5.60 0.00 1.94 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 2.27 2.08 0.00 *50 A 8.48 4.22 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 51 E 7.82 3.39 0.00 1.90 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 2.07 2.08 0.00 52 S 7.88 4.78 0.00 4.21 4.17 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.25 4.92 0.00 1.84 1.81 0.00 3.27 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 54 Y 8.99 4.94 0.00 2.98 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 55 V 8.59 4.39 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 0.79 0.00 0.00 0.95 0.00 0.00 56 L 8.68 5.16 0.00 1.89 1.65 0.52 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.55 4.76 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 1.23 0.00 0.00 58 G 8.59 4.29 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 0.00 59 R 8.70 5.60 0.00 1.78 1.81 0.00 3.35 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 60 Y 8.43 5.20 0.00 2.99 2.85 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 0.00 0.00 0.00 61 D 9.11 4.26 0.00 2.79 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 62 S 8.05 4.29 0.00 3.87 3.35 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 0.00 0.00 0.00 0.00 63 A 8.08 4.64 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 64 P 0.00 5.05 0.00 2.26 2.16 0.00 3.43 0.00 0.00 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 65 A 8.32 4.23 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 66 T 8.30 4.44 4.26 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 1.24 0.00 0.00 67 D 7.98 4.71 0.00 2.80 2.80 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 68 G 7.89 4.02 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 69 S 7.60 4.31 0.00 3.98 3.91 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 70 G 8.25 4.02 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 71 T 8.73 4.80 4.53 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 72 A 8.67 4.82 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 73 L 8.73 5.12 0.00 1.96 1.94 1.21 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.05 5.01 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 0.00 0.00 0.00 75 W 8.12 5.76 0.00 3.41 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 76 T 9.30 5.18 4.26 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 1.20 0.00 0.00 77 V 8.47 4.57 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 0.79 0.00 0.00 78 A 8.26 4.39 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 79 W 8.64 4.31 0.00 3.42 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 80 K 7.69 5.32 0.00 1.94 1.71 0.00 1.83 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.45 7.81 81 N 9.17 4.90 0.00 2.81 2.79 0.00 0.00 6.95 6.91 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 82 N 8.72 4.34 0.00 2.31 2.28 0.00 0.00 6.60 7.46 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 83 Y 8.41 4.64 0.00 2.98 2.97 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 84 R 7.76 4.56 0.00 2.20 2.08 0.00 2.93 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 85 N 8.51 5.21 0.00 2.65 2.63 0.00 0.00 6.90 7.96 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 86 A 8.91 4.40 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 87 H 8.54 4.14 0.00 3.33 3.31 0.00 5.66 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 88 S 7.46 5.06 0.00 4.06 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 89 A 8.98 4.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 8.40 4.97 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 -0.72 0.00 0.00 91 T 8.38 4.97 4.16 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 1.14 0.00 0.00 92 W 8.70 4.99 0.00 1.78 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 0.00 0.00 0.00 0.00 93 S 8.68 4.75 0.00 3.81 3.64 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 0.00 94 G 8.41 4.52 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 95 Q 8.40 5.20 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 96 Y 9.09 4.78 0.00 3.05 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 97 V 8.37 4.34 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 0.83 0.00 0.00 0.91 0.00 0.00 98 G 8.18 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.70 3.87 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 0.00 0.00 0.00 100 A 8.78 4.05 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 0.00 101 E 7.74 4.58 0.00 1.93 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 2.21 2.23 0.00 102 A 7.58 4.54 1.46 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 0.00 0.00 103 R 8.87 5.22 0.00 2.13 2.16 0.00 2.76 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 104 I 8.65 4.93 1.84 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.07 1.12 0.00 0.00 105 N 9.04 5.36 0.00 2.77 2.82 0.00 0.00 6.07 7.21 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 0.00 106 T 9.33 5.29 4.49 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 1.45 0.00 0.00 107 Q 9.06 5.14 0.00 1.93 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 108 W 8.27 5.40 0.00 2.74 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 0.00 0.00 0.00 0.00 109 L 8.60 5.23 0.00 1.56 1.55 0.88 0.52 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 0.00 110 L 9.28 5.05 0.00 1.57 1.63 0.96 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.72 5.02 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 1.19 0.00 0.00 112 S 8.40 5.20 0.00 3.73 3.74 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 0.00 113 G 8.58 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 0.00 114 T 8.30 4.78 4.19 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 1.22 0.00 0.00 115 T 8.03 4.29 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 1.21 0.00 0.00 116 E 8.91 3.90 0.00 1.99 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 2.34 2.29 0.00 117 A 7.95 4.34 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 7.95 4.88 0.00 2.70 2.68 0.00 0.00 6.69 7.37 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 0.00 119 A 8.39 4.18 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 0.00 120 W 8.36 4.33 0.00 3.60 3.25 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 0.00 121 K 6.59 3.97 0.00 1.20 0.74 0.00 1.29 0.00 0.00 1.34 0.00 0.00 2.84 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.30 0.84 7.81 122 S 7.81 4.28 0.00 3.98 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 0.00 123 T 7.53 5.08 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 1.24 0.00 0.00 124 L 8.94 4.67 0.00 1.80 1.75 0.95 0.82 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 0.00 125 V 8.08 4.50 1.94 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 0.57 0.00 0.00 0.70 0.00 0.00 126 G 6.94 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 0.00 0.00 0.00 127 H 7.87 5.22 0.00 3.21 3.09 0.00 5.77 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.84 4.81 0.00 3.25 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 0.00 129 T 8.33 5.27 4.30 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 1.33 0.00 0.00 130 F 9.58 5.65 0.00 3.13 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 0.00 131 T 8.99 5.47 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 1.38 0.00 0.00 132 K 8.68 3.59 0.00 1.57 1.67 0.00 1.55 0.00 0.00 1.39 0.00 0.00 2.34 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.46 0.24 7.81 133 V 7.72 3.79 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 0.71 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.