NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 4.6075 8.2548 109.1246 45.7366 0.0000 175.1393 17 I 3.8130 7.2100 119.5917 62.9513 37.5618 175.4145 18 T 3.9929 7.6936 116.7604 62.8542 70.0573 174.6375 19 G 3.4898 7.6398 113.0689 45.1217 0.0000 171.0784 20 T 4.4712 7.4987 117.4259 61.9205 69.8663 174.6268 21 W 4.6823 8.7511 126.1649 54.8837 32.9784 174.0877 22 Y 5.5406 9.7625 120.7315 56.4147 41.4073 174.9138 23 N 5.4286 8.8411 120.8538 51.0895 39.9984 175.9081 24 Q 4.1649 8.6711 116.4957 58.7065 28.9551 177.4516 25 L 4.1102 7.7795 117.7210 55.9229 42.0284 176.7034 26 G 4.3934 8.8230 109.2899 46.5873 0.0000 174.3478 27 S 4.2564 7.7168 114.9825 56.8097 64.0479 173.4324 28 T 5.0959 9.1826 120.1971 61.7615 72.7814 172.9922 29 F 5.1151 8.9518 119.6117 55.1988 41.6504 173.2696 30 I 4.6907 8.3113 123.4061 59.5127 39.3419 175.0832 31 V 4.8157 8.6043 120.1463 59.6793 36.1673 174.8811 32 T 4.7009 8.5649 119.5837 61.7167 71.1015 173.2653 33 A 4.5716 8.6520 130.1496 51.0459 19.3451 177.2008 34 G 4.0538 9.4062 110.3809 45.1963 0.0000 174.3019 35 A 4.2445 8.6173 122.3865 54.8389 18.5677 178.7771 36 D 4.2704 8.0304 114.6283 56.0646 41.5566 176.9890 37 G 3.3237 8.2963 106.9759 44.5891 0.0000 172.3815 38 A 4.8319 7.9121 121.4516 51.0488 20.5686 176.8235 39 L 5.2926 8.9142 121.7149 53.1216 44.7292 175.8613 40 T 4.9162 8.8802 113.3997 59.6823 72.4260 174.2949 41 G 4.2380 7.4270 109.7837 46.2715 0.0000 171.3256 42 T 5.1921 7.5891 109.4342 60.0124 72.6955 172.5831 43 Y 5.0805 10.0574 125.4138 55.9400 41.2498 173.9430 44 E 5.3012 9.1410 125.5311 55.0981 31.8689 176.7446 45 S 4.5182 8.7336 117.4591 59.4945 65.0724 174.5288 *49 N 4.3773 7.9807 115.8633 52.0248 38.4101 174.7437 50 A 3.9053 8.6045 124.0044 55.6468 18.4420 179.6311 51 E 3.5895 7.8943 113.2994 59.0462 29.7022 177.9669 52 S 4.9474 8.4489 113.7383 58.2220 64.5503 173.5713 53 R 5.0451 7.8444 119.4784 55.2034 30.9650 175.6310 54 Y 4.9070 9.0679 119.9018 56.0728 42.7776 174.7736 55 V 4.0907 8.6149 122.7795 62.8106 32.7180 175.0776 56 L 5.1206 8.9430 127.5614 54.3154 43.8718 175.1925 57 T 5.0130 8.6619 114.7313 61.1134 71.4323 173.1046 58 G 4.5886 8.7114 113.1243 46.2334 0.0000 171.8068 59 R 5.5769 8.7922 117.3877 54.8695 34.7654 174.2543 60 Y 5.3184 8.6820 118.5759 55.2194 41.9857 174.6662 61 D 4.2898 9.2584 121.1476 54.2062 40.7215 176.6179 62 S 4.4041 8.1578 120.4403 58.7313 63.7064 174.7217 63 A 4.6728 8.4676 123.8541 50.1817 18.5535 174.1277 64 P 5.1222 0.0000 0.0000 60.6968 32.7761 176.8758 65 A 4.2605 8.3683 122.6726 52.8084 18.9782 177.4066 66 T 4.5084 8.1935 107.2760 61.5344 69.8721 176.0031 67 D 4.3581 8.1148 121.8397 55.1029 39.2219 177.2525 68 G 4.1169 7.8246 107.2799 45.2335 0.0000 174.0836 69 S 4.2219 9.3453 117.4015 58.0731 63.2556 174.5843 70 G 3.9528 8.4726 111.7025 46.5414 0.0000 172.2863 71 T 4.8152 9.1008 116.6852 61.5596 70.2244 174.7782 72 A 4.8070 8.6918 129.5531 52.0870 19.9355 175.9985 73 L 5.0514 8.7900 121.1987 55.4510 44.8382 174.1500 74 G 4.5808 9.2320 104.5673 45.8005 0.0000 172.2581 75 W 5.6214 8.4340 116.6829 55.8485 32.1469 173.3714 76 T 5.2432 9.1118 116.5327 61.8364 72.2511 173.3553 77 V 4.5706 8.4950 124.0551 60.9650 34.4028 174.0054 78 A 4.4943 8.3700 129.6519 49.9495 20.0801 177.9695 79 W 4.2789 8.8396 125.1710 55.4253 28.0663 176.1742 80 K 5.2473 7.8113 118.4140 54.6255 35.4714 174.5625 81 N 5.0890 9.0304 122.9206 51.6764 39.9164 174.2449 82 N 4.3764 8.7480 113.8934 55.7145 38.7094 175.2529 83 Y 4.5664 7.7570 113.6146 58.1806 40.1824 175.5939 84 R 4.7343 8.8972 114.8817 54.6124 32.8250 173.8926 85 N 5.0673 8.4314 116.3604 52.7040 40.2120 173.6815 86 A 4.2844 9.1928 129.1308 52.1483 19.2576 176.4146 87 H 4.2150 8.8478 113.3930 56.2313 27.0493 174.1807 88 S 5.2682 7.7731 110.4792 57.2909 67.1445 172.6107 89 A 5.0342 8.9424 121.2648 50.8001 22.8293 175.2206 90 T 5.0430 8.7801 118.3166 61.7162 72.0289 173.2712 91 T 4.9213 8.8107 115.6420 59.6346 71.7859 172.7333 92 W 4.9124 8.7414 125.5620 54.8646 31.3199 174.7413 93 S 4.8098 8.6805 120.5243 56.8899 64.3986 173.0752 94 G 4.3702 8.6012 113.9740 46.3730 0.0000 171.6690 95 Q 5.2240 8.7698 117.5688 54.8068 32.7512 173.4129 96 Y 4.8389 9.5049 123.5825 56.7113 40.6922 174.2411 97 V 4.1533 8.3710 127.1425 61.0278 33.8441 175.2968 98 G 3.5377 7.7958 116.7924 45.1259 0.0000 170.2322 99 G 3.9535 8.7770 104.0945 44.0767 0.0000 172.7079 100 A 4.0034 8.2240 120.9076 55.2382 19.1702 178.7055 101 E 4.3088 7.7552 116.1503 55.0067 29.5925 177.1438 102 A 4.5199 7.8316 120.1014 53.0540 19.3086 178.4536 103 R 5.3588 9.4821 117.4182 55.0438 33.8865 173.8924 104 I 4.8931 9.2209 121.5325 59.8384 39.8200 174.2257 105 N 5.4675 9.1875 125.5442 51.9956 40.5795 174.4332 106 T 5.2707 9.3841 113.3037 60.2390 73.1516 172.5128 107 Q 5.1830 9.0598 121.7577 53.9806 31.5600 174.8606 108 W 5.2420 8.7371 119.8108 54.5186 32.2382 173.9273 109 L 5.2737 8.9760 120.7248 52.8793 44.8167 175.2375 110 L 5.1048 9.2488 125.5720 53.6298 44.8927 174.9270 111 T 5.1295 8.7392 123.0413 61.9739 71.1979 173.4799 112 S 5.1294 8.8490 122.5227 56.3850 65.0451 174.4508 113 G 3.8423 8.8133 112.5862 46.7422 0.0000 172.9292 114 T 4.7789 8.3404 114.3865 59.5997 72.4147 173.2277 115 T 4.1860 8.0048 111.9190 60.7003 70.2951 175.5307 116 E 3.9244 8.8526 120.7274 59.6979 29.1483 179.3357 117 A 4.1495 7.3327 119.6731 54.6404 18.5226 178.4137 118 N 4.7333 7.8711 112.1824 53.1631 39.1570 176.6394 119 A 4.1291 8.3295 126.2124 53.8777 18.1921 180.0325 120 W 4.3310 8.2680 113.8606 58.4174 28.3651 176.7478 121 K 4.1834 6.5702 118.2848 56.2048 32.2403 177.2079 122 S 4.2980 7.9574 116.3541 60.2957 63.8261 173.3145 123 T 5.0796 7.6764 117.3875 61.7043 70.4945 173.7372 124 L 4.7835 9.1643 127.1154 53.4654 44.1199 176.0535 125 V 4.2663 7.6162 119.7423 60.3420 34.7539 175.1363 126 G 3.2737 6.1507 107.1098 45.9963 0.0000 171.4876 127 H 5.5316 8.2425 113.9623 54.1990 32.0447 172.1889 128 D 4.9213 9.2809 117.4648 53.4399 45.1702 173.8498 129 T 5.2428 7.9098 120.8553 61.8243 71.5142 173.3733 130 F 5.4812 9.6683 125.4752 56.0038 42.1800 174.6889 131 T 5.5355 9.5065 112.7614 60.0134 72.1985 174.7655 132 K 3.5154 8.7196 119.6151 57.1365 32.6408 177.5815 133 V 3.9098 7.6465 123.1888 62.8170 31.6998 174.7881 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 8.25 4.61 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 0.00 0.00 0.00 17 I 7.21 3.81 1.32 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.36 0.58 0.00 0.00 18 T 7.69 3.99 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 1.15 0.00 0.00 19 G 7.64 3.49 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 0.00 20 T 7.50 4.47 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 0.61 0.00 0.00 21 W 8.75 4.68 0.00 1.96 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 22 Y 9.76 5.54 0.00 2.90 2.86 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 23 N 8.84 5.43 0.00 2.70 2.51 0.00 0.00 6.62 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 24 Q 8.67 4.16 0.00 2.22 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.11 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 25 L 7.78 4.11 0.00 2.11 1.82 0.97 0.87 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 26 G 8.82 4.39 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 27 S 7.72 4.26 0.00 4.29 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 28 T 9.18 5.10 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 0.96 0.00 0.00 29 F 8.95 5.12 0.00 2.78 2.50 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 0.00 30 I 8.31 4.69 1.76 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.11 0.81 0.00 0.00 31 V 8.60 4.82 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 0.66 0.00 0.00 0.62 0.00 0.00 32 T 8.56 4.70 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 8.65 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 9.41 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 35 A 8.62 4.24 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 8.03 4.27 0.00 2.62 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 37 G 8.30 3.32 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 0.00 38 A 7.91 4.83 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 39 L 8.91 5.29 0.00 1.80 1.57 0.81 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.88 4.92 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 41 G 7.43 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 0.00 0.00 0.00 0.00 42 T 7.59 5.19 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 10.06 5.08 0.00 2.95 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 44 E 9.14 5.30 0.00 2.12 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 2.19 2.30 0.00 45 S 8.73 4.52 0.00 3.91 4.07 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 *49 N 7.98 4.38 0.00 3.01 2.95 0.00 0.00 6.13 7.69 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 50 A 8.60 3.91 1.12 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 0.00 0.00 51 E 7.89 3.59 0.00 1.82 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 2.18 1.93 0.00 52 S 8.45 4.95 0.00 3.81 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 53 R 7.84 5.05 0.00 1.79 1.85 0.00 3.09 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 54 Y 9.07 4.91 0.00 2.84 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 8.61 4.09 2.11 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 0.79 0.00 0.00 0.95 0.00 0.00 56 L 8.94 5.12 0.00 1.71 1.64 0.60 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.66 5.01 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 58 G 8.71 4.59 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 0.00 0.00 0.00 59 R 8.79 5.58 0.00 1.76 1.86 0.00 3.28 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 60 Y 8.68 5.32 0.00 3.08 2.88 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 61 D 9.26 4.29 0.00 2.78 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 62 S 8.16 4.40 0.00 3.93 3.49 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 63 A 8.47 4.67 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 5.12 0.00 2.27 2.17 0.00 3.46 0.00 0.00 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 65 A 8.37 4.26 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 66 T 8.19 4.51 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 8.11 4.36 0.00 2.80 2.88 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 68 G 7.82 4.12 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 0.00 0.00 0.00 69 S 9.35 4.22 0.00 3.89 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.47 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 T 9.10 4.82 4.61 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 1.44 0.00 0.00 72 A 8.69 4.81 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 73 L 8.79 5.05 0.00 2.07 1.99 1.22 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.23 4.58 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 0.00 75 W 8.43 5.62 0.00 3.46 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 76 T 9.11 5.24 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 1.17 0.00 0.00 77 V 8.50 4.57 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 -0.48 0.00 0.00 0.64 0.00 0.00 78 A 8.37 4.49 1.18 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 79 W 8.84 4.28 0.00 3.28 2.93 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 80 K 7.81 5.25 0.00 1.93 1.71 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.45 7.81 81 N 9.03 5.09 0.00 2.87 2.73 0.00 0.00 6.66 7.82 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 82 N 8.75 4.38 0.00 1.73 2.29 0.00 0.00 6.61 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 7.76 4.57 0.00 2.97 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 84 R 8.90 4.73 0.00 2.01 2.07 0.00 3.04 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 85 N 8.43 5.07 0.00 2.66 2.64 0.00 0.00 6.94 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 9.19 4.28 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 87 H 8.85 4.21 0.00 3.37 3.37 0.00 5.60 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 88 S 7.77 5.27 0.00 3.96 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 89 A 8.94 5.03 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 8.78 5.04 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 -0.51 0.00 0.00 91 T 8.81 4.92 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 1.16 0.00 0.00 92 W 8.74 4.91 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 4.81 0.00 3.81 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 94 G 8.60 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 0.00 0.00 0.00 0.00 95 Q 8.77 5.22 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 96 Y 9.50 4.84 0.00 3.00 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 97 V 8.37 4.15 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 0.81 0.00 0.00 0.90 0.00 0.00 98 G 7.80 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.78 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 0.00 100 A 8.22 4.00 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 0.00 101 E 7.76 4.31 0.00 1.95 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 2.31 2.41 0.00 102 A 7.83 4.52 1.50 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 0.00 0.00 0.00 103 R 9.48 5.36 0.00 1.94 2.29 0.00 2.79 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 104 I 9.22 4.89 1.84 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 1.09 -0.13 1.17 0.00 0.00 105 N 9.19 5.47 0.00 2.72 2.81 0.00 0.00 6.05 6.64 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 0.00 106 T 9.38 5.27 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 1.45 0.00 0.00 107 Q 9.06 5.18 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 108 W 8.74 5.24 0.00 2.65 2.36 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 0.00 109 L 8.98 5.27 0.00 1.47 1.53 0.87 0.46 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 9.25 5.10 0.00 1.59 1.64 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.74 5.13 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 1.20 0.00 0.00 112 S 8.85 5.13 0.00 3.65 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 8.81 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.34 4.78 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 1.19 0.00 0.00 115 T 8.00 4.19 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 1.20 0.00 0.00 116 E 8.85 3.92 0.00 2.09 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 2.41 2.46 0.00 117 A 7.33 4.15 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 0.00 118 N 7.87 4.73 0.00 2.80 2.67 0.00 0.00 6.81 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.33 4.13 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 0.00 120 W 8.27 4.33 0.00 3.56 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 0.00 121 K 6.57 4.18 0.00 1.15 0.74 0.00 1.21 0.00 0.00 1.21 0.00 0.00 2.72 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.30 0.74 7.81 122 S 7.96 4.30 0.00 4.15 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 0.00 123 T 7.68 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 1.19 0.00 0.00 124 L 9.16 4.78 0.00 1.77 1.73 0.98 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.62 4.27 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 0.51 0.00 0.00 0.65 0.00 0.00 126 G 6.15 3.27 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 0.00 127 H 8.24 5.53 0.00 3.19 3.17 0.00 5.73 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.28 4.92 0.00 3.17 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 5.24 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 1.36 0.00 0.00 130 F 9.67 5.48 0.00 3.05 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 0.00 131 T 9.51 5.54 4.41 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 1.48 0.00 0.00 132 K 8.72 3.52 0.00 1.54 1.59 0.00 1.30 0.00 0.00 0.86 0.00 0.00 2.75 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.72 7.81 133 V 7.65 3.91 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 0.73 0.00 0.00 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.