NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 33 A 4.4578 8.2229 123.5851 52.6363 20.3257 179.4325 *34 Y 4.0520 7.6229 112.5374 58.1166 37.1121 175.6359 35 E 4.6081 8.9128 117.6245 57.4439 30.9803 175.5591 36 E 4.4652 7.6494 118.4094 55.4222 30.8689 176.4378 37 A 4.8760 8.3769 125.7753 51.5653 19.6454 175.2666 38 E 5.1592 8.4516 121.4380 55.2925 32.6645 177.1221 39 I 4.2144 6.8146 123.7367 60.9450 37.4737 175.7724 40 T 4.4275 8.4487 116.1618 61.6394 70.6773 174.2015 41 K 4.5364 7.3025 121.9256 55.2748 35.8126 174.1559 42 V 4.2845 8.9046 126.5836 61.0737 33.8084 174.5791 43 G 3.8832 8.2630 114.2672 44.3866 0.0000 170.5252 44 A 5.0668 8.1266 118.9785 51.1148 22.5274 174.7711 45 Y 5.1190 7.5942 116.3593 56.3515 41.9192 172.8754 46 H 4.8513 9.4814 119.8387 54.6963 32.7845 172.1512 47 R 5.2235 8.5684 124.7751 54.8981 32.2642 175.5534 48 F 4.6858 7.8753 115.0873 55.9114 41.6302 172.7762 49 Y 4.7489 8.5589 119.1618 58.1668 37.6596 176.5129 50 S 4.2859 9.0100 119.7014 59.6832 63.5690 175.5260 51 G 4.0188 8.5347 108.9684 44.9782 0.0000 173.0360 52 D 4.8345 7.9068 119.6125 53.5949 42.6924 175.5531 53 K 5.0273 8.2497 119.0582 54.2267 35.5157 175.7616 54 D 4.4622 9.0754 123.6436 54.4731 41.6762 177.4767 55 A 4.0762 8.8067 127.8522 54.7050 18.9795 178.5954 56 I 4.1624 8.0868 115.4865 63.3245 38.0627 176.9067 57 T 4.2004 8.1844 107.6425 61.1405 69.5317 175.9434 58 G 3.9083 8.1889 109.6744 45.0442 0.0000 173.2390 59 E 4.1043 7.8281 121.5901 55.8151 30.8670 175.8290 60 N 4.8054 8.7673 124.0801 53.9083 39.3159 174.5007 61 I 4.1115 8.8410 125.5141 60.8253 38.8074 174.9830 62 V 4.3831 8.2779 126.6301 61.2255 32.6675 174.8665 63 A 4.2365 7.9973 130.3678 50.9785 20.3582 175.3965 64 E 4.8229 8.4604 121.4629 54.1581 32.3115 174.7984 65 K 4.3853 8.9727 128.9609 54.3620 34.2736 174.5978 66 E 4.4931 8.6643 129.3400 56.0606 30.3136 176.1237 67 L 4.4239 8.6766 127.2598 54.1503 42.8552 176.7276 68 D 4.8066 8.7521 122.3671 54.7931 42.0529 175.5768 69 R 5.3555 8.3631 116.4158 55.2373 32.6686 174.1034 70 T 4.7485 8.7329 110.3990 60.0436 72.1826 172.4007 71 N 5.3199 8.6366 119.3064 51.5384 42.4284 173.8988 72 N 4.7610 9.1908 120.1589 52.0784 41.4613 173.0195 73 I 4.4926 8.3367 127.4483 60.1273 38.6032 175.4520 74 D 4.7809 9.4330 129.4690 52.1231 40.9571 176.4401 75 S 4.0176 8.6610 119.3425 60.6854 62.8945 176.1198 76 E 3.9932 8.0799 116.2756 58.4553 29.4982 176.8319 77 H 4.7107 7.9371 114.6350 54.7558 29.7040 174.2120 78 G 3.3625 7.7738 108.1948 46.0980 0.0000 173.5070 79 V 5.2602 7.7722 117.6452 59.4537 35.1040 174.0333 80 A 5.2834 9.6903 125.5456 50.6075 21.6980 175.0534 81 T 5.2027 9.0501 119.1786 61.8586 72.3485 173.3177 82 A 4.8127 8.5666 124.7675 50.1363 23.3341 175.0762 83 V 4.3793 8.0227 119.9931 61.0515 34.2471 174.4111 84 F 5.5559 8.7658 126.7754 56.2252 41.7986 174.8374 85 T 5.1339 8.7684 119.0305 61.7445 71.6343 173.3183 86 I 4.3710 8.5780 127.9812 60.1795 37.5743 174.7028 87 P 4.4433 0.0000 0.0000 61.8729 31.9882 176.0867 88 A 4.1206 8.4325 122.6276 51.9406 18.8749 177.6331 89 A 4.1480 8.5523 123.7383 52.5368 19.1252 177.5893 90 G 4.1271 9.5782 109.7560 46.1646 0.0000 174.6881 91 G 3.8116 8.6079 109.6824 46.7663 0.0000 176.2009 92 K 4.2938 8.8720 122.1623 58.0416 32.7445 177.5232 93 F 4.5702 8.2860 124.1429 57.1388 37.7154 174.5692 94 T 4.3820 7.3719 116.3001 60.5310 71.4521 175.2456 95 E 3.7221 8.4993 120.1865 59.3729 29.1516 179.3852 96 A 3.8961 7.7501 119.3528 55.1518 18.6922 178.8916 97 E 3.7965 7.7482 117.2093 59.2584 29.8109 178.6742 98 R 3.3299 7.4652 118.9033 59.3682 29.7397 178.0676 99 A 4.0788 7.7103 118.6748 54.1387 18.4036 178.2668 100 K 4.0948 7.7417 115.6322 57.2551 32.7094 177.2018 101 V 3.9276 7.3459 119.8464 61.9178 32.1911 175.1053 102 S 4.6846 8.1407 119.7989 56.7935 65.8077 174.8483 103 L 4.1400 8.5514 122.7396 58.2086 41.6942 178.8675 104 S 4.6073 8.0126 114.0324 60.4392 63.1936 173.9041 105 N 4.9847 7.8972 120.1745 52.2494 38.2348 173.8577 106 L 4.5436 8.5493 120.4584 53.9243 44.6108 175.4343 107 V 4.4619 8.0886 125.1374 61.5121 33.0830 174.4648 108 V 4.5319 8.4421 127.6956 61.2659 34.6541 173.5654 109 Y 5.0574 8.5908 123.3252 55.6180 41.9718 173.8704 110 V 4.5172 7.6868 111.5564 59.6344 35.9200 174.6475 111 N 5.0577 8.4457 118.8176 51.8869 41.5411 174.3856 112 V 4.7971 7.8866 113.2253 59.1432 36.4518 175.1474 113 S 4.2523 8.5298 117.2043 59.1209 64.0240 175.0651 114 T 3.9147 8.4875 118.3729 65.5083 68.4801 174.2720 115 A 3.6732 8.8140 126.9056 52.4676 16.2950 176.9991 116 A 4.6557 7.7907 118.6077 51.8220 20.3941 177.7236 117 R 4.8527 8.4323 117.0040 54.3243 34.4597 174.7906 118 V 4.8823 8.5861 121.7710 60.3401 34.1061 175.0094 119 T 4.8301 9.1615 119.9022 61.0241 72.1054 171.8106 120 P 4.3151 0.0000 0.0000 62.5274 32.1741 176.3779 121 L 4.2742 8.2705 125.6375 54.5319 43.3002 177.0275 122 D 4.4359 8.4359 119.8283 55.1136 39.9742 177.4466 123 G 4.0310 8.8540 112.7247 44.5512 0.0000 174.1150 124 S 3.9525 7.5039 115.4715 57.0979 63.3649 172.4433 125 P 4.3556 0.0000 0.0000 62.1378 32.2855 176.3483 126 K 4.2104 8.2078 118.6619 56.0649 32.8015 177.0300 127 F 4.8333 8.3591 120.8861 58.8861 39.4583 176.2815 128 G 4.1149 9.4982 112.4543 44.4309 0.0000 173.4055 129 V 4.5337 7.1181 117.9985 59.8891 34.1829 173.5958 130 P 4.6317 0.0000 0.0000 63.4611 31.8046 175.3266 131 A 4.6118 9.0611 124.6394 50.5269 23.5086 174.9176 132 D 4.8453 8.4671 119.1157 52.9101 41.0311 175.4557 133 W 5.0401 9.2560 127.6446 56.7778 30.1613 178.2148 134 T 4.2002 8.4852 109.5353 62.7459 68.6547 174.3686 135 R 4.7256 7.2576 120.4870 54.1008 34.1320 174.6226 136 E 4.6210 8.4863 117.8369 57.0437 30.8635 175.5878 137 H 5.0182 9.3817 116.6981 54.3037 33.8157 172.5002 138 K 5.2909 8.2734 119.7709 55.2358 34.9356 175.1144 139 Y 5.1321 9.1534 119.8660 56.3955 42.9437 174.0023 140 S 5.2304 9.3872 117.6535 57.0477 64.8693 173.7191 141 V 4.8484 9.0390 128.0398 60.6641 34.6025 173.9285 *143 A 4.5464 8.3062 120.5984 51.6064 19.6089 177.7494 144 A 4.0793 8.7845 120.7349 55.0719 18.6769 178.6908 145 D 4.4227 7.9380 111.9784 54.0634 39.7772 177.4060 146 G 3.9820 8.3216 109.7433 45.2665 0.0000 173.9745 147 T 4.3472 7.8874 109.6927 61.5916 69.8357 173.7933 148 K 5.1005 8.3849 120.2688 54.8370 36.7852 175.6620 149 K 4.6266 8.9849 121.8552 55.0187 35.8194 175.0657 150 I 4.7426 8.3993 127.9769 60.7028 38.2432 175.1718 151 W 5.0424 9.6934 126.4482 55.2450 32.9114 174.4622 152 T 5.0342 9.2664 121.1604 62.4181 70.1031 173.8093 153 V 5.1365 9.5572 126.7900 61.0786 34.4017 174.0721 154 K 5.1933 9.0888 128.7906 54.8576 35.2279 175.2041 155 V 5.1105 8.7140 119.0060 59.8812 35.8576 174.4202 156 T 4.8691 8.4141 111.6138 60.0007 72.8062 172.2918 157 L 5.2707 8.4698 122.9264 53.4914 45.0348 175.0519 158 N 5.2063 9.5685 123.2013 51.3873 42.2632 175.0699 159 K 4.1975 8.4044 120.1461 56.7633 33.2435 176.2640 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 33 A 8.22 4.46 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 *34 Y 7.62 4.05 0.00 2.33 2.31 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 35 E 8.91 4.61 0.00 1.95 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 2.30 2.64 0.00 36 E 7.65 4.47 0.00 2.03 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 2.34 2.27 0.00 37 A 8.38 4.88 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 38 E 8.45 5.16 0.00 1.94 1.95 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 2.38 2.52 0.00 39 I 6.81 4.21 0.56 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 -0.36 0.46 0.00 0.00 40 T 8.45 4.43 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 1.14 0.00 0.00 41 K 7.30 4.54 0.00 1.71 1.48 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.16 1.30 7.81 42 V 8.90 4.28 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 0.63 0.00 0.00 0.70 0.00 0.00 43 G 8.26 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 44 A 8.13 5.07 -0.20 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 45 Y 7.59 5.12 0.00 3.03 3.16 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 0.00 46 H 9.48 4.85 0.00 3.20 3.19 0.00 5.75 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.57 5.22 0.00 1.75 1.71 0.00 3.41 0.00 0.00 3.46 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.76 0.00 48 F 7.88 4.69 0.00 3.12 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 49 Y 8.56 4.75 0.00 3.02 2.94 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 50 S 9.01 4.29 0.00 4.01 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 51 G 8.53 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 52 D 7.91 4.83 0.00 2.65 2.59 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 0.00 0.00 0.00 53 K 8.25 5.03 0.00 1.59 1.80 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.37 7.81 54 D 9.08 4.46 0.00 2.85 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 55 A 8.81 4.08 1.29 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 56 I 8.09 4.16 2.00 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 1.46 0.63 0.91 0.00 0.00 57 T 8.18 4.20 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 58 G 8.19 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 0.00 0.00 0.00 59 E 7.83 4.10 0.00 2.15 1.83 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 2.32 2.37 0.00 60 N 8.77 4.81 0.00 2.65 2.61 0.00 0.00 7.05 7.45 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 61 I 8.84 4.11 1.88 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 1.11 0.77 0.86 0.00 0.00 62 V 8.28 4.38 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 0.49 0.00 0.00 0.68 0.00 0.00 63 A 8.00 4.24 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.46 4.82 0.00 1.78 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 2.01 2.19 0.00 65 K 8.97 4.39 0.00 1.62 1.37 0.00 1.32 0.00 0.00 1.37 0.00 0.00 2.71 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.30 0.92 7.81 66 E 8.66 4.49 0.00 1.97 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 2.32 2.44 0.00 67 L 8.68 4.42 0.00 1.34 1.69 0.75 0.87 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 68 D 8.75 4.81 0.00 2.79 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 69 R 8.36 5.36 0.00 1.83 2.12 0.00 3.08 0.00 0.00 3.31 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 70 T 8.73 4.75 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 1.18 0.00 0.00 71 N 8.64 5.32 0.00 2.50 2.63 0.00 0.00 6.66 8.00 0.00 0.00 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 N 9.19 4.76 0.00 2.72 2.65 0.00 0.00 7.27 7.74 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 73 I 8.34 4.49 1.88 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.66 1.03 0.00 0.00 74 D 9.43 4.78 0.00 2.79 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 75 S 8.66 4.02 0.00 4.19 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 76 E 8.08 3.99 0.00 2.00 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 2.22 1.87 0.00 77 H 7.94 4.71 0.00 3.24 3.30 0.00 5.85 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 78 G 7.77 3.36 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 0.00 79 V 7.77 5.26 2.16 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 0.83 0.00 0.00 1.08 0.00 0.00 80 A 9.69 5.28 1.21 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 0.00 0.00 0.00 81 T 9.05 5.20 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 82 A 8.57 4.81 0.49 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 83 V 8.02 4.38 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 0.92 0.00 0.00 0.84 0.00 0.00 84 F 8.77 5.56 0.00 3.00 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 85 T 8.77 5.13 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 1.25 0.00 0.00 86 I 8.58 4.37 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.68 1.14 0.00 0.00 87 P 0.00 4.44 0.00 2.08 2.02 0.00 3.68 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 88 A 8.43 4.12 1.29 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 89 A 8.55 4.15 1.14 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 0.00 0.00 90 G 9.58 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 91 G 8.61 3.81 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 0.00 0.00 0.00 92 K 8.87 4.29 0.00 1.97 2.14 0.00 2.04 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.52 1.42 7.81 93 F 8.29 4.57 0.00 3.21 3.22 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 94 T 7.37 4.38 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 1.27 0.00 0.00 95 E 8.50 3.72 0.00 2.04 1.95 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 2.40 1.95 0.00 96 A 7.75 3.90 1.24 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 0.00 0.00 97 E 7.75 3.80 0.00 1.83 1.54 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 0.00 1.47 1.82 0.00 98 R 7.47 3.33 0.00 0.95 1.71 0.00 3.03 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 99 A 7.71 4.08 1.29 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 0.00 100 K 7.74 4.09 0.00 1.85 1.87 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.50 7.81 101 V 7.35 3.93 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 0.77 0.00 0.00 0.80 0.00 0.00 102 S 8.14 4.68 0.00 4.02 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 0.00 103 L 8.55 4.14 0.00 1.83 1.79 1.12 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 104 S 8.01 4.61 0.00 3.92 3.92 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 0.00 105 N 7.90 4.98 0.00 2.72 2.75 0.00 0.00 7.04 7.87 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 0.00 106 L 8.55 4.54 0.00 2.15 1.72 0.84 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.09 4.46 1.77 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 0.28 0.00 0.00 0.85 0.00 0.00 108 V 8.44 4.53 1.71 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 0.68 0.00 0.00 -0.25 0.00 0.00 109 Y 8.59 5.06 0.00 2.90 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 0.00 110 V 7.69 4.52 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 -0.29 0.00 0.00 0.35 0.00 0.00 111 N 8.45 5.06 0.00 2.57 2.63 0.00 0.00 7.13 7.71 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 0.00 112 V 7.89 4.80 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 0.58 0.00 0.00 0.91 0.00 0.00 113 S 8.53 4.25 0.00 3.91 3.83 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 0.00 114 T 8.49 3.91 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 0.00 115 A 8.81 3.67 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 0.00 116 A 7.79 4.66 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 0.00 117 R 8.43 4.85 0.00 1.77 1.83 0.00 3.11 0.00 0.00 3.42 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 118 V 8.59 4.88 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 0.92 0.00 0.00 1.29 0.00 0.00 119 T 9.16 4.83 4.33 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 1.25 0.00 0.00 120 P 0.00 4.32 0.00 1.80 1.92 0.00 3.72 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 2.02 2.18 0.00 121 L 8.27 4.27 0.00 1.52 1.49 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.44 4.44 0.00 2.69 2.49 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 0.00 123 G 8.85 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 0.00 124 S 7.50 3.95 0.00 3.41 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 0.00 125 P 0.00 4.36 0.00 2.06 1.77 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.97 0.00 126 K 8.21 4.21 0.00 1.88 1.83 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.45 7.81 127 F 8.36 4.83 0.00 3.16 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 0.00 128 G 9.50 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 0.00 129 V 7.12 4.53 2.14 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 0.85 0.00 0.00 0.99 0.00 0.00 130 P 0.00 4.63 0.00 2.01 2.22 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 131 A 9.06 4.61 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 0.00 132 D 8.47 4.85 0.00 2.68 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 0.00 133 W 9.26 5.04 0.00 3.51 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 0.00 134 T 8.49 4.20 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 1.32 0.00 0.00 135 R 7.26 4.73 0.00 1.49 1.72 0.00 3.13 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 136 E 8.49 4.62 0.00 2.25 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 2.29 2.37 0.00 137 H 9.38 5.02 0.00 3.06 2.86 0.00 5.58 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 8.27 5.29 0.00 1.57 1.69 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.40 7.81 139 Y 9.15 5.13 0.00 3.25 3.08 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 0.00 140 S 9.39 5.23 0.00 3.92 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 0.00 141 V 9.04 4.85 2.49 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 1.26 0.00 0.00 1.04 0.00 0.00 *143 A 8.31 4.55 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 0.00 144 A 8.78 4.08 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 0.00 145 D 7.94 4.42 0.00 2.84 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 0.00 146 G 8.32 3.98 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 0.00 147 T 7.89 4.35 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 1.27 0.00 0.00 148 K 8.38 5.10 0.00 1.64 1.77 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.59 7.81 149 K 8.98 4.63 0.00 1.83 1.89 0.00 1.60 0.00 0.00 2.03 0.00 0.00 2.55 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 1.20 7.81 150 I 8.40 4.74 1.85 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 1.35 0.95 1.00 0.00 0.00 151 W 9.69 5.04 0.00 3.40 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 0.00 152 T 9.27 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 1.40 0.00 0.00 153 V 9.56 5.14 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 1.06 0.00 0.00 1.20 0.00 0.00 154 K 9.09 5.19 0.00 2.10 1.66 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.48 7.81 155 V 8.71 5.11 1.91 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 0.57 0.00 0.00 0.99 0.00 0.00 156 T 8.41 4.87 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 1.22 0.00 0.00 157 L 8.47 5.27 0.00 1.72 1.60 1.08 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 158 N 9.57 5.21 0.00 2.72 2.68 0.00 0.00 6.41 7.91 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 0.00 159 K 8.40 4.20 0.00 1.70 1.65 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.42 7.81 * Residues marked with a * may have inaccurate shift predictions.