NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8855 8.1676 115.8992 57.2375 40.2073 176.9836 11 H 3.7177 6.1801 117.4957 56.7813 28.6955 173.9846 12 E 4.1490 8.2521 121.2596 59.0215 30.4720 179.5239 13 M 4.3189 7.1988 115.9737 55.7059 31.6921 177.4933 14 R 4.5215 7.8104 117.8311 55.7818 33.2150 175.7239 15 E 4.0130 7.9864 117.0896 55.1712 29.9005 174.7594 16 P 4.5716 0.0000 0.0000 63.1968 32.4654 174.9899 17 R 4.4651 7.9462 115.8684 55.3702 33.5407 173.7371 18 I 4.4113 8.1779 120.5174 60.6111 37.3093 175.8374 19 E 4.2003 9.5200 130.0447 58.5052 29.9888 176.7442 20 K 4.6665 7.4742 115.6834 56.0298 36.0212 174.2445 21 V 4.6617 8.7050 121.7760 61.3627 34.3639 174.5572 22 V 5.1730 8.3422 129.5335 60.8248 33.0792 174.7694 23 V 4.6017 7.9654 122.2157 60.2901 33.2553 174.7905 24 H 5.2487 9.0672 124.5518 54.7259 33.6530 172.1012 25 M 4.4823 8.5258 123.1586 53.4867 34.5411 175.1180 26 G 3.4538 8.2701 112.3640 45.8809 0.0000 171.8797 27 I 3.8405 8.2915 128.3007 59.1902 36.4864 174.8732 28 G 3.2399 7.2727 118.8255 45.3574 0.0000 173.0218 29 H 4.5105 7.4863 114.4289 55.7449 31.9636 174.2099 *35 A 4.3205 8.0804 124.2377 52.2237 18.7702 178.8053 36 N 4.4487 9.3294 124.9784 54.3343 38.6027 177.3347 37 A 4.0489 7.8790 121.4405 53.8025 19.3071 179.0577 38 E 4.0846 8.1539 116.1056 59.3881 29.0031 178.9271 39 D 4.4140 7.6777 119.1955 57.3230 40.8686 178.9158 40 I 3.8824 7.4697 112.4202 63.8848 37.7474 178.3437 41 L 4.1061 7.9352 120.4849 57.3192 41.5113 179.4168 42 G 3.6384 7.9419 105.2522 48.0620 0.0000 175.6694 43 E 4.0655 7.6413 118.7560 58.8201 29.5318 178.8960 44 I 4.0014 7.8104 118.4283 63.4638 38.1335 177.4251 45 T 4.3005 7.8781 109.7363 65.2525 69.4919 175.2780 46 G 3.9252 7.3155 109.3641 44.6072 0.0000 173.4563 47 Q 4.6784 7.2456 115.2841 53.6529 31.3868 174.9552 48 M 4.0569 8.3936 118.7910 55.1371 32.7144 174.1130 49 P 4.8778 0.0000 0.0000 61.9512 33.9634 174.8731 50 V 4.5746 8.1848 111.6943 59.3320 35.5278 176.2941 51 R 4.6060 8.6259 122.3171 56.6736 31.3006 175.9547 52 T 4.5483 8.7332 116.6660 62.1997 71.9041 173.8552 53 K 5.0831 8.5931 126.5913 55.5693 34.9969 174.8020 54 A 4.5987 7.4474 119.2815 52.2931 22.6650 176.3625 55 K 4.5719 8.0394 117.1701 55.7533 36.3726 173.5748 56 R 4.1135 8.8030 127.5306 55.9255 30.0050 176.6431 57 T 4.1642 8.4385 119.2124 63.5490 69.3015 173.8742 58 V 4.4611 8.4182 125.4404 60.7053 34.0124 176.7632 59 G 3.7943 8.7188 115.0008 47.7684 0.0000 173.2016 60 E 4.2774 7.9975 118.5581 56.6842 30.3415 176.1908 61 F 4.0880 8.2579 115.9543 60.8445 38.3427 175.1612 62 D 4.7173 8.0643 120.6119 53.0912 41.7745 177.4751 63 I 3.6996 7.2552 112.8625 62.8467 38.7966 176.8170 64 R 4.0185 7.5924 121.2137 54.9250 28.2495 174.8168 65 E 3.6430 8.2178 127.7239 59.3007 30.0555 176.2417 66 G 4.1794 7.7215 118.4693 46.0197 0.0000 171.4427 67 D 4.7541 8.2941 124.1597 50.8806 42.5521 173.2488 68 P 4.5975 0.0000 0.0000 64.0674 31.3799 176.0300 69 I 4.4120 9.1583 121.8690 62.5830 41.5768 174.7823 70 G 3.9521 7.6482 106.7641 46.2836 0.0000 171.4287 71 A 5.3290 8.1597 120.3670 51.4841 23.6212 175.5871 72 K 5.3890 8.5370 116.8893 57.4062 36.7818 175.0992 73 V 4.5650 7.9455 120.0779 61.7406 34.8288 173.2597 74 T 4.7247 8.5433 118.9824 60.5468 69.7764 173.9082 75 L 4.6495 8.8033 127.6177 53.2525 43.7028 176.1875 76 R 4.7993 7.9349 120.7427 54.7648 34.1719 176.3285 77 D 4.2492 8.9260 120.4740 55.4539 39.3024 176.0829 78 E 3.9522 9.0403 123.2887 61.2140 29.0675 178.5507 79 M 4.1297 8.2649 117.5495 58.3406 31.7916 178.6943 80 A 3.9814 7.9468 120.6967 55.0665 18.8538 179.4558 81 E 3.9441 8.1076 116.4831 59.7976 29.4725 179.3804 82 E 3.9473 8.4429 117.4123 59.0845 29.6966 178.8980 83 F 4.3653 7.7291 120.7304 60.9793 39.5557 177.5676 84 L 4.0531 8.4359 118.9936 57.7979 41.1377 179.4497 85 Q 3.9108 8.1884 117.8647 58.1374 28.6926 177.8334 86 T 4.3360 7.5680 107.0299 61.5459 69.8096 175.3318 87 A 4.1650 7.2277 123.7182 54.3623 19.6648 179.1420 88 L 3.8265 7.9762 117.6559 57.6679 41.5049 178.0526 89 P 4.2572 0.0000 0.0000 65.4868 31.3278 178.2276 90 L 4.1103 7.6402 116.2056 55.5014 41.7815 176.8319 91 A 4.6205 6.8958 121.1458 50.4982 20.9754 176.7559 92 E 4.5383 8.0167 119.2823 53.4226 29.3789 175.7115 93 L 3.9574 7.9076 120.4960 55.0504 42.5217 176.3624 94 A 4.7437 8.2107 123.2113 50.5574 21.6986 176.5068 95 T 4.1164 8.5213 114.9383 66.7921 69.0106 178.0058 96 S 4.3811 8.1641 115.5600 61.4682 62.9451 176.0114 97 Q 4.1943 7.9632 113.6586 56.6398 28.0452 175.1192 98 F 5.0598 8.1205 117.5259 55.5411 41.1899 175.3426 99 D 4.6922 9.7892 125.1687 53.8401 41.7178 176.9485 100 D 4.5383 8.6260 122.9592 56.9161 40.9688 177.4433 101 T 4.2498 7.7626 113.5163 63.5114 68.8037 175.2708 102 G 3.9975 8.4104 109.7753 45.9133 0.0000 172.9134 103 N 5.3510 8.0007 115.8355 51.4191 42.4835 173.3882 104 F 4.8235 7.8609 111.7203 56.6086 41.2984 173.1717 105 S 4.9786 8.5713 114.8054 56.7237 65.8056 172.7582 106 F 4.8768 8.2363 118.6844 56.4683 41.1015 174.0818 107 G 3.8980 8.8999 105.9734 44.8233 0.0000 174.8297 *128 L 4.1324 8.1504 126.1781 55.2291 42.7229 176.2366 129 D 4.9931 8.8206 126.6062 52.9831 43.7108 176.0611 130 V 4.5865 7.8055 119.9693 61.4639 34.7614 174.2352 131 T 4.6284 8.3845 124.2938 61.4893 71.7641 173.1014 132 V 4.4932 7.5736 125.4508 61.0188 34.1594 173.6546 133 N 4.8105 9.2726 127.8387 52.3437 40.0077 173.4355 134 L 5.2511 8.1068 126.3470 53.3164 44.3837 176.1623 135 V 4.1330 7.7660 119.2506 60.9849 34.1775 171.9770 136 R 3.9461 8.7775 120.7683 56.2637 30.9362 177.6298 137 P 3.4959 0.0000 0.0000 64.5134 33.4335 176.7818 138 G 3.9715 7.6332 109.5025 45.4620 0.0000 173.1683 139 Y 4.3895 7.7425 118.1681 59.8246 39.9612 176.9635 140 R 3.8044 8.2216 119.4616 59.4989 29.7588 178.0422 141 V 3.5296 7.8872 117.2588 65.4088 31.1886 176.6550 142 A 4.6205 7.5469 118.5997 51.2026 19.3935 177.2785 143 K 4.1943 7.3425 115.1834 56.0593 33.8817 176.5916 144 R 4.2701 7.6391 115.4718 55.6562 30.7202 176.1604 145 D 4.5272 8.4535 116.5563 56.4116 41.4954 177.7220 146 K 4.0244 7.9331 117.2455 57.2233 32.5204 176.7062 147 A 3.8081 8.7483 126.8628 52.7155 16.2984 177.0303 148 S 4.5427 7.9284 112.5960 60.2697 63.9752 173.5990 149 R 4.6769 8.6949 120.6683 54.8191 33.8532 173.9274 150 S 4.4049 8.5707 119.3491 57.7142 63.4296 173.8319 151 I 3.8885 8.2952 127.6370 60.4871 37.6913 174.4536 152 P 4.4489 0.0000 0.0000 62.6437 32.0783 177.6207 153 T 3.9959 8.4946 111.0472 64.4889 68.8499 176.3511 154 K 4.2106 8.0504 120.1109 58.2182 32.3621 176.7330 155 H 4.7305 7.9082 116.5575 55.7706 30.7558 174.6626 156 R 4.2053 7.3001 116.9612 55.9547 30.6004 176.3242 157 L 4.1006 8.3053 123.4440 55.2569 42.9908 176.2536 158 N 5.1293 8.2369 119.9347 50.5048 42.7564 174.2009 159 P 4.3211 0.0000 0.0000 65.7844 31.5027 178.8261 160 A 3.8476 7.8875 118.8044 55.4818 18.3182 179.3611 161 D 4.3823 8.1384 116.2507 56.9736 40.7201 178.9705 162 A 4.1306 8.0616 121.7332 55.0745 18.5637 179.3566 163 V 3.2208 7.8438 116.9672 66.2834 31.3525 177.6575 164 A 4.0793 7.9149 119.9441 55.3509 17.9802 179.0506 165 F 4.0656 7.8003 117.5975 61.6253 39.5247 177.3398 166 I 3.7421 7.9525 117.8116 64.5105 37.3236 177.7164 167 E 4.5863 8.8746 122.1878 58.6031 29.0281 178.0774 168 S 4.3921 7.9879 110.9172 57.9828 63.7026 175.1304 169 T 4.7501 7.4958 116.4736 62.7407 70.1723 173.0107 170 Y 3.4207 8.2857 124.0082 58.0874 35.3529 168.2472 171 D 4.3482 6.8157 117.4775 53.5954 42.2778 174.9787 172 V 4.6659 8.1579 117.5796 61.1256 34.8523 175.4809 173 E 4.3733 8.3827 121.9151 56.5880 31.8370 176.4490 174 V 4.0896 8.2936 117.3928 62.8464 32.5907 173.7310 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 10 F 8.17 4.89 0.00 3.36 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 11 H 6.18 3.72 0.00 3.04 2.46 0.00 5.46 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.25 4.15 0.00 1.70 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 2.31 2.21 0.00 13 M 7.20 4.32 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 14 R 7.81 4.52 0.00 1.95 1.87 0.00 3.29 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 15 E 7.99 4.01 0.00 2.19 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 0.00 2.46 2.26 0.00 16 P 0.00 4.57 0.00 0.67 1.54 0.00 3.57 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 1.86 1.92 0.00 17 R 7.95 4.47 0.00 1.84 1.91 0.00 2.75 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 18 I 8.18 4.41 1.94 0.00 0.00 1.00 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 0.79 0.95 0.00 0.00 19 E 9.52 4.20 0.00 1.91 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 2.22 2.07 0.00 20 K 7.47 4.67 0.00 1.77 1.81 0.00 1.46 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.31 1.32 7.81 21 V 8.70 4.66 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 0.75 0.00 0.00 0.96 0.00 0.00 22 V 8.34 5.17 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 0.96 0.00 0.00 0.84 0.00 0.00 23 V 7.97 4.60 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 0.21 0.00 0.00 0.71 0.00 0.00 24 H 9.07 5.25 0.00 3.16 2.98 0.00 5.52 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 25 M 8.53 4.48 0.00 1.92 1.87 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 26 G 8.27 3.45 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 0.00 0.00 0.00 0.00 27 I 8.29 3.84 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.69 0.76 0.00 0.00 28 G 7.27 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 0.00 0.00 0.00 29 H 7.49 4.51 0.00 3.19 3.38 0.00 5.76 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 *35 A 8.08 4.32 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 36 N 9.33 4.45 0.00 2.89 3.10 0.00 0.00 5.84 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 37 A 7.88 4.05 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 38 E 8.15 4.08 0.00 2.06 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 2.31 2.47 0.00 39 D 7.68 4.41 0.00 2.60 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 40 I 7.47 3.88 1.89 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 1.71 0.72 0.92 0.00 0.00 41 L 7.94 4.11 0.00 1.83 1.71 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.94 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 0.00 0.00 0.00 43 E 7.64 4.07 0.00 2.02 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 2.35 2.46 0.00 44 I 7.81 4.00 2.02 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.87 1.06 0.00 0.00 45 T 7.88 4.30 4.06 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 0.91 0.00 0.00 46 G 7.32 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 47 Q 7.25 4.68 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 48 M 8.39 4.06 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 49 P 0.00 4.88 0.00 2.08 2.01 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.12 0.00 50 V 8.18 4.57 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 0.78 0.00 0.00 0.97 0.00 0.00 51 R 8.63 4.61 0.00 1.68 1.85 0.00 3.30 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 52 T 8.73 4.55 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 1.20 0.00 0.00 53 K 8.59 5.08 0.00 1.61 1.73 0.00 1.82 0.00 0.00 2.61 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.25 7.81 54 A 7.45 4.60 1.16 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 0.00 0.00 55 K 8.04 4.57 0.00 1.57 1.65 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.70 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.42 7.81 56 R 8.80 4.11 0.00 1.98 2.01 0.00 3.20 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 57 T 8.44 4.16 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 V 8.42 4.46 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 1.02 0.00 0.00 0.96 0.00 0.00 59 G 8.72 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.00 4.28 0.00 2.14 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 0.00 2.28 2.33 0.00 61 F 8.26 4.09 0.00 3.08 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 62 D 8.06 4.72 0.00 2.68 2.47 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 63 I 7.26 3.70 1.84 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 1.07 0.40 0.94 0.00 0.00 64 R 7.59 4.02 0.00 1.67 2.01 0.00 3.19 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 65 E 8.22 3.64 0.00 2.01 1.78 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 2.46 2.30 0.00 66 G 7.72 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.29 4.75 0.00 2.64 2.67 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 68 P 0.00 4.60 0.00 1.94 2.04 0.00 3.60 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 69 I 9.16 4.41 1.96 0.00 0.00 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 1.13 1.00 0.90 0.00 0.00 70 G 7.65 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 0.00 0.00 0.00 71 A 8.16 5.33 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 72 K 8.54 5.39 0.00 1.79 1.88 0.00 1.50 0.00 0.00 1.62 0.00 0.00 2.75 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.29 1.16 7.81 73 V 7.95 4.56 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 0.87 0.00 0.00 0.85 0.00 0.00 74 T 8.54 4.72 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 1.15 0.00 0.00 75 L 8.80 4.65 0.00 1.55 1.54 0.49 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.93 4.80 0.00 1.62 1.76 0.00 3.33 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 77 D 8.93 4.25 0.00 2.88 2.34 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 78 E 9.04 3.95 0.00 2.02 2.20 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 2.42 2.43 0.00 79 M 8.26 4.13 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 80 A 7.95 3.98 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 81 E 8.11 3.94 0.00 2.04 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 2.44 2.57 0.00 82 E 8.44 3.95 0.00 2.04 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 2.36 2.41 0.00 83 F 7.73 4.37 0.00 3.14 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 84 L 8.44 4.05 0.00 1.91 1.77 1.06 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.19 3.91 0.00 1.94 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.72 0.00 0.00 0.00 0.00 0.00 2.19 2.50 0.00 86 T 7.57 4.34 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 1.16 0.00 0.00 87 A 7.23 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.98 3.83 0.00 1.72 1.72 0.98 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.26 0.00 1.98 2.10 0.00 3.51 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 2.14 2.17 0.00 90 L 7.64 4.11 0.00 1.72 1.74 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 91 A 6.90 4.62 0.44 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 92 E 8.02 4.54 0.00 1.91 1.86 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 2.16 2.25 0.00 93 L 7.91 3.96 0.00 1.60 1.66 0.82 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.21 4.74 1.27 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 0.00 0.00 0.00 95 T 8.52 4.12 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 1.17 0.00 0.00 96 S 8.16 4.38 0.00 4.06 4.18 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 0.00 0.00 0.00 0.00 97 Q 7.96 4.19 0.00 2.43 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 98 F 8.12 5.06 0.00 3.15 3.04 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 99 D 9.79 4.69 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 0.00 100 D 8.63 4.54 0.00 2.73 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 0.00 101 T 7.76 4.25 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 102 G 8.41 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.00 5.35 0.00 2.72 2.77 0.00 0.00 6.55 8.13 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 0.00 104 F 7.86 4.82 0.00 2.81 1.90 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 0.00 105 S 8.57 4.98 0.00 3.70 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 0.00 106 F 8.24 4.88 0.00 3.13 3.33 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 0.00 107 G 8.90 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 *128 L 8.15 4.13 0.00 1.69 1.70 0.95 1.18 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 0.00 129 D 8.82 4.99 0.00 2.60 2.45 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 0.00 130 V 7.81 4.59 0.94 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 0.95 0.00 0.00 0.96 0.00 0.00 131 T 8.38 4.63 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 1.04 0.00 0.00 132 V 7.57 4.49 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 1.01 0.00 0.00 0.66 0.00 0.00 133 N 9.27 4.81 0.00 2.70 2.75 0.00 0.00 6.63 6.58 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 0.00 134 L 8.11 5.25 0.00 1.74 1.48 1.22 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.77 4.13 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.50 0.00 0.00 136 R 8.78 3.95 0.00 1.64 1.75 0.00 3.22 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.52 0.00 137 P 0.00 3.50 0.00 2.11 2.06 0.00 3.64 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.11 0.00 138 G 7.63 3.97 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 0.00 0.00 0.00 139 Y 7.74 4.39 0.00 3.11 2.99 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 0.00 140 R 8.22 3.80 0.00 1.92 1.94 0.00 3.25 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 141 V 7.89 3.53 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 0.95 0.00 0.00 1.00 0.00 0.00 142 A 7.55 4.62 1.10 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 0.00 0.00 143 K 7.34 4.19 0.00 1.57 1.75 0.00 1.71 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.67 1.20 7.81 144 R 7.64 4.27 0.00 1.90 1.92 0.00 3.02 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.55 0.00 145 D 8.45 4.53 0.00 2.66 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 0.00 146 K 7.93 4.02 0.00 1.73 1.74 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.42 7.81 147 A 8.75 3.81 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 0.00 148 S 7.93 4.54 0.00 3.90 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.69 4.68 0.00 1.88 1.71 0.00 3.12 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 150 S 8.57 4.40 0.00 3.91 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 0.00 151 I 8.30 3.89 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.16 1.04 0.00 0.00 152 P 0.00 4.45 0.00 2.21 2.00 0.00 3.63 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 2.12 2.09 0.00 153 T 8.49 4.00 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 1.23 0.00 0.00 154 K 8.05 4.21 0.00 1.79 1.94 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.50 7.81 155 H 7.91 4.73 0.00 3.10 3.34 0.00 5.94 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.30 4.21 0.00 2.08 1.86 0.00 3.26 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.77 0.00 157 L 8.31 4.10 0.00 1.51 1.74 0.85 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.24 5.13 0.00 2.82 2.68 0.00 0.00 6.93 8.03 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 0.00 159 P 0.00 4.32 0.00 2.14 2.15 0.00 3.62 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.41 0.00 160 A 7.89 3.85 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 0.00 161 D 8.14 4.38 0.00 2.82 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 0.00 162 A 8.06 4.13 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 0.00 0.00 0.00 0.00 0.00 163 V 7.84 3.22 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 0.76 0.00 0.00 0.09 0.00 0.00 164 A 7.91 4.08 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 0.00 165 F 7.80 4.07 0.00 2.99 3.33 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 0.00 166 I 7.95 3.74 2.05 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 1.71 1.15 0.91 0.00 0.00 167 E 8.87 4.59 0.00 2.05 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 2.27 2.14 0.00 168 S 7.99 4.39 0.00 3.90 3.89 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 0.00 0.00 0.00 169 T 7.50 4.75 4.18 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 0.00 0.00 0.00 1.04 0.00 0.00 170 Y 8.29 3.42 0.00 2.96 3.04 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 0.00 171 D 6.82 4.35 0.00 2.83 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 0.00 172 V 8.16 4.67 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 0.85 0.00 0.00 0.90 0.00 0.00 173 E 8.38 4.37 0.00 2.00 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 2.34 2.23 0.00 174 V 8.29 4.09 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 1.09 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.