NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 30 D 4.6176 8.2233 120.1874 53.8559 41.5536 175.5359 31 E 3.7390 8.3631 124.9574 58.3048 29.5889 176.9831 32 A 3.9417 8.1008 120.6358 54.8229 18.9616 179.0474 33 K 2.4800 7.5849 118.0378 59.1591 32.1748 179.0246 34 I 3.5191 7.5247 119.9566 64.2793 37.0197 178.3367 35 S 4.0474 8.1360 113.7434 61.3397 62.2399 176.0699 36 A 4.1516 8.0636 123.4875 55.4668 18.1573 179.5687 37 Q 4.0360 8.3059 116.9511 59.3275 28.7333 179.4671 38 S 4.3275 8.2352 116.2289 61.3515 62.8522 176.4640 39 F 4.3473 8.5143 123.4799 61.4379 39.1192 176.3173 40 Y 4.0948 8.3446 119.2258 61.0270 38.5722 178.2933 41 Q 3.7468 8.2910 118.7062 59.0426 28.7326 179.2014 42 R 3.6896 7.8887 118.9844 58.9457 30.0040 178.8552 43 L 3.8271 7.8724 120.6176 57.8957 41.9290 178.7437 44 L 3.7411 7.7755 120.5794 57.9050 41.9197 178.7206 45 L 3.8208 7.7817 120.2351 57.9708 41.9480 178.5846 46 L 3.3945 7.9470 120.4937 57.9692 41.9857 178.4692 47 N 4.2320 8.1391 116.8826 56.6360 38.8885 176.3930 48 E 3.8636 8.2977 120.9674 59.2988 29.6697 178.3578 49 E 3.8181 8.6541 119.4263 59.0501 29.6266 178.5225 50 A 4.5858 7.9304 122.3789 54.8275 18.2737 179.7339 51 I 3.9768 7.4323 118.1704 64.1573 37.2898 178.4824 52 L 4.1725 7.9677 118.9245 57.3388 41.5576 179.0065 53 S 4.4865 8.4860 113.2578 58.5087 63.6272 175.5702 54 G 3.9377 8.2362 109.6772 45.2678 0.0000 173.1575 55 Q 4.4342 7.6678 118.4545 54.7584 31.2919 174.4654 56 D 4.9547 8.0995 120.9486 53.4200 43.1744 175.5290 57 F 5.5444 9.4142 120.4553 56.2467 43.8884 173.4810 58 G 4.2157 9.3436 106.1385 45.6928 0.0000 172.2134 59 V 4.5967 8.4761 119.6442 60.7728 34.5991 173.9803 60 R 4.6687 8.4370 128.3459 54.6604 32.1227 174.6652 61 I 4.3510 8.5797 127.3066 59.6311 39.4068 175.2078 62 D 4.5583 8.8450 129.0711 52.5581 40.9144 177.7443 63 V 3.5413 8.4905 127.4622 66.3926 32.0861 178.7731 64 D 4.3744 8.1825 117.8937 55.8952 39.7262 179.2356 65 T 4.3376 7.8023 106.4755 60.5160 69.8068 174.3084 66 R 3.6889 7.3686 120.8331 57.8555 28.3971 175.3328 67 R 5.0589 7.8169 116.7844 54.4548 33.4072 174.6040 68 L 4.9365 8.7758 125.3727 53.1601 44.8851 175.4469 69 T 4.9625 8.4799 120.7573 61.6252 71.9510 173.0092 70 F 5.2096 9.5475 125.1420 56.0045 40.9913 174.9152 71 L 5.5844 9.2820 123.6435 52.9786 45.7974 175.2329 72 Q 4.7710 9.7589 122.8011 54.0917 32.1680 174.1663 73 L 3.6658 7.8111 128.6075 54.5451 42.5016 175.8644 74 T 4.5061 8.4115 117.1185 59.6982 71.1260 175.5744 75 A 3.8611 8.6049 127.2556 55.3802 18.7005 178.8714 76 D 4.4973 7.9658 113.7689 55.4294 39.8910 177.0916 77 K 4.5074 7.7458 115.7098 54.8974 34.5519 178.2617 78 G 3.6066 7.9532 107.8697 45.7507 0.0000 173.6089 79 W 4.9288 8.7075 123.5176 57.0395 29.6389 175.9955 80 Q 4.8191 9.4470 123.0426 53.5742 33.1254 174.7891 81 K 4.4449 8.8941 120.8996 56.9203 32.8535 176.6938 82 W 4.7946 9.3571 135.0000 57.1420 30.7737 175.4581 83 Q 4.2545 8.7535 127.5546 54.8220 28.9418 175.3131 84 N 4.5615 7.8028 118.9070 51.8953 39.5619 173.8781 85 D 4.5224 8.2950 117.4749 53.3856 39.8700 176.6918 86 K 4.1290 7.9507 120.4993 56.9261 33.1485 175.9044 *88 T 4.0625 7.5382 107.3428 62.2371 69.7397 173.1448 89 N 5.1698 8.4879 118.5960 52.9856 39.1035 173.6031 90 Q 5.0687 8.0503 120.6830 55.2680 32.2405 173.6006 91 T 4.7921 9.3500 123.2814 62.0451 71.8505 173.1233 92 T 4.9624 8.2966 121.6034 61.4043 70.8469 174.1844 93 L 4.1825 8.5338 126.8987 54.3316 42.5787 177.6588 94 K 4.1160 8.6350 121.3409 56.1517 32.8196 177.7178 95 E 3.9126 8.9889 119.6121 59.7769 29.2646 178.7123 96 G 3.7715 8.1374 105.9883 46.3848 0.0000 172.2549 97 L 5.2433 7.7928 121.8793 53.6133 44.7966 176.2251 98 Q 4.6939 8.7393 121.0589 53.7830 32.9713 174.7100 99 L 4.9086 7.9654 116.5420 55.1495 44.0385 175.1814 100 D 5.1919 9.1539 119.3473 52.6806 44.7932 174.1616 101 F 5.7145 8.9691 119.0929 55.1802 41.3629 173.4031 102 E 4.4328 9.1265 118.3133 54.4701 32.5906 174.8008 103 L 4.5516 8.1950 122.0067 53.7396 43.3745 177.0553 *104 G 3.7387 8.3400 107.4645 45.3809 0.0000 173.0952 *136 E 4.1144 8.2818 119.5528 55.3117 30.7234 173.7880 137 P 4.2511 0.0000 0.0000 62.4101 31.9854 176.1724 138 A 3.7692 8.4504 125.2086 51.5134 18.9120 175.6492 139 P 4.0704 0.0000 0.0000 62.4511 32.1054 176.7055 140 Q 3.8741 8.0455 118.8059 57.6423 29.8121 175.8186 141 L 4.3450 7.2497 119.7520 52.7637 43.9027 175.7067 142 F 4.9077 8.8076 124.1469 56.4643 40.9946 175.4530 143 V 4.7539 9.2516 124.1360 61.2242 32.7564 174.5343 144 L 5.1997 8.9137 127.7245 52.7893 43.5136 177.9661 145 S 4.3396 9.1978 115.1690 60.8241 63.1116 176.4229 146 S 4.1663 7.9779 114.7962 59.5875 62.9567 175.1051 147 G 4.0109 8.1700 109.9454 44.9859 0.0000 173.6463 148 E 4.3004 7.9362 119.8189 56.3255 30.6906 176.1235 149 V 4.9976 8.2350 122.5275 60.9786 34.6596 175.1078 150 T 4.0776 8.6720 123.8532 63.8872 68.9330 172.2180 151 P 5.0639 0.0000 0.0000 62.4948 32.1236 175.5614 152 F 5.1163 8.3194 117.3072 56.6057 41.4493 172.7316 153 T 4.9194 9.1891 115.7499 61.6889 72.4032 172.7627 154 L 5.3539 9.4112 128.6419 53.5174 44.8116 174.9785 155 S 5.4598 9.5464 122.6028 56.9362 65.9652 173.1378 156 I 5.0043 9.2798 124.7023 59.4712 40.4194 174.6174 157 F 5.4206 7.9662 120.4352 54.7098 42.0867 171.9437 158 P 4.8478 0.0000 0.0000 62.2066 32.3965 176.1983 159 K 4.1019 9.1921 125.7459 58.0538 32.2208 177.1372 160 G 3.8416 9.2993 114.9480 45.9426 0.0000 174.2143 *161 Q 3.6033 8.1404 114.6790 55.3803 26.0786 177.4317 162 E 4.6502 7.6253 117.9945 54.4588 31.8014 174.5606 163 P 4.4966 0.0000 0.0000 62.4048 32.7676 175.8304 164 D 4.5696 8.3040 117.3674 53.6580 39.9824 175.4159 165 E 4.7169 7.8215 120.2510 54.8174 31.7522 175.7756 166 Q 4.9639 8.5806 124.9594 54.1931 32.5232 174.3484 167 W 4.8410 9.4141 124.1339 55.0980 31.8127 175.4525 168 R 5.3280 9.1158 122.1597 54.4311 33.8679 174.5780 169 V 5.0245 9.0324 121.9914 61.6125 34.7560 174.5119 170 T 4.5418 9.0655 123.1963 61.7302 73.6157 172.4883 171 A 5.0492 7.6198 127.3501 50.4167 21.3501 176.8982 172 Q 4.6065 9.2132 125.0640 55.4298 30.1606 177.8114 173 E 4.1505 8.5668 115.1703 58.6090 29.8737 177.6510 174 N 4.5589 8.0229 113.0632 53.7036 37.9203 175.6855 175 G 4.1289 7.7367 106.3477 45.7259 0.0000 174.5509 176 T 4.1066 8.1277 110.4444 61.5065 69.6276 172.9130 177 L 5.1838 8.3749 123.7294 53.5609 43.3085 176.0915 178 R 4.7602 9.3657 122.4807 54.2231 34.5075 173.9131 179 L 4.9255 8.2966 124.2758 53.3028 43.9150 175.1847 180 L 4.8750 8.9049 126.6176 52.7530 44.4253 176.4057 181 A 2.5800 8.8925 126.1421 49.8156 20.0599 174.6800 182 P 3.9960 0.0000 0.0000 64.3597 31.4607 177.4271 183 G 3.8278 8.9343 111.6418 45.5702 0.0000 173.1772 184 E 4.0576 7.7977 124.1765 56.5085 29.4469 176.4630 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 30 D 8.22 4.62 0.00 2.70 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 31 E 8.36 3.74 0.00 2.09 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 0.00 2.39 2.37 0.00 32 A 8.10 3.94 1.45 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 33 K 7.58 2.48 0.00 1.25 1.59 0.00 1.60 0.00 0.00 1.47 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.74 0.21 7.81 34 I 7.52 3.52 1.90 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 1.32 0.60 0.86 0.00 0.00 35 S 8.14 4.05 0.00 3.92 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 36 A 8.06 4.15 1.49 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 37 Q 8.31 4.04 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 38 S 8.24 4.33 0.00 4.07 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 39 F 8.51 4.35 0.00 3.26 3.37 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 40 Y 8.34 4.09 0.00 3.21 3.21 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 41 Q 8.29 3.75 0.00 2.26 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 42 R 7.89 3.69 0.00 1.59 1.16 0.00 2.39 0.00 0.00 2.84 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.62 0.00 43 L 7.87 3.83 0.00 1.15 1.49 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 44 L 7.78 3.74 0.00 1.27 1.44 0.64 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.78 3.82 0.00 1.78 1.70 0.91 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.95 3.39 0.00 1.84 1.73 0.48 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.14 4.23 0.00 2.78 2.97 0.00 0.00 6.89 7.19 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 48 E 8.30 3.86 0.00 2.09 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 2.27 2.29 0.00 49 E 8.65 3.82 0.00 1.95 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 1.65 1.87 0.00 50 A 7.93 4.59 1.58 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 51 I 7.43 3.98 2.01 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 1.55 1.33 0.92 0.00 0.00 52 L 7.97 4.17 0.00 1.68 1.74 0.92 0.77 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 53 S 8.49 4.49 0.00 4.07 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 0.00 54 G 8.24 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 55 Q 7.67 4.43 0.00 1.84 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 56 D 8.10 4.95 0.00 2.42 2.63 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 0.00 0.00 0.00 0.00 57 F 9.41 5.54 0.00 2.86 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 58 G 9.34 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 0.00 0.00 0.00 0.00 59 V 8.48 4.60 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 0.54 0.00 0.00 0.91 0.00 0.00 60 R 8.44 4.67 0.00 1.63 1.53 0.00 2.97 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.46 0.00 61 I 8.58 4.35 0.81 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.14 0.47 0.00 0.00 62 D 8.84 4.56 0.00 2.46 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 63 V 8.49 3.54 2.13 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 1.04 0.00 0.00 1.10 0.00 0.00 64 D 8.18 4.37 0.00 2.74 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 65 T 7.80 4.34 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 1.19 0.00 0.00 66 R 7.37 3.69 0.00 1.96 1.92 0.00 3.13 0.00 0.00 3.04 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.00 67 R 7.82 5.06 0.00 1.81 1.65 0.00 3.01 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 68 L 8.78 4.94 0.00 1.52 1.15 0.69 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.48 4.96 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 1.24 0.00 0.00 70 F 9.55 5.21 0.00 3.08 3.19 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 0.00 71 L 9.28 5.58 0.00 1.71 1.97 0.69 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 9.76 4.77 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.00 0.00 0.00 0.00 0.00 0.00 1.86 1.27 0.00 73 L 7.81 3.67 0.00 0.27 0.84 -0.20 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.41 4.51 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 1.26 0.00 0.00 75 A 8.60 3.86 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 76 D 7.97 4.50 0.00 2.78 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 77 K 7.75 4.51 0.00 1.73 1.82 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.36 1.34 7.81 78 G 7.95 3.61 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 79 W 8.71 4.93 0.00 3.24 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 80 Q 9.45 4.82 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.96 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 81 K 8.89 4.44 0.00 1.74 1.89 0.00 1.80 0.00 0.00 1.91 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.67 7.81 82 W 9.36 4.79 0.00 3.56 3.41 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 83 Q 8.75 4.25 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.51 0.00 0.00 0.00 0.00 0.00 2.59 2.32 0.00 84 N 7.80 4.56 0.00 2.01 1.42 0.00 0.00 6.25 8.06 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 85 D 8.30 4.52 0.00 2.72 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 86 K 7.95 4.13 0.00 1.59 1.76 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.27 7.81 *88 T 7.54 4.06 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 1.17 0.00 0.00 89 N 8.49 5.17 0.00 3.28 3.34 0.00 0.00 5.46 7.44 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 90 Q 8.05 5.07 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 91 T 9.35 4.79 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 1.26 0.00 0.00 92 T 8.30 4.96 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 1.24 0.00 0.00 93 L 8.53 4.18 0.00 1.46 1.54 0.78 0.75 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 94 K 8.64 4.12 0.00 1.88 1.71 0.00 1.81 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.53 1.01 7.81 95 E 8.99 3.91 0.00 2.06 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 2.28 2.33 0.00 96 G 8.14 3.77 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 0.00 0.00 0.00 97 L 7.79 5.24 0.00 1.57 1.43 0.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.74 4.69 0.00 1.64 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.71 0.00 0.00 0.00 0.00 0.00 2.18 2.14 0.00 99 L 7.97 4.91 0.00 1.56 1.39 0.87 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 100 D 9.15 5.19 0.00 3.14 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 0.00 101 F 8.97 5.71 0.00 3.33 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 0.00 102 E 9.13 4.43 0.00 1.94 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 0.00 2.34 2.26 0.00 103 L 8.20 4.55 0.00 1.50 1.66 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 *104 G 8.34 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 0.00 0.00 0.00 *136 E 8.28 4.11 0.00 2.34 2.02 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 2.29 2.39 0.00 137 P 0.00 4.25 0.00 1.98 1.97 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 138 A 8.45 3.77 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 0.00 139 P 0.00 4.07 0.00 1.68 1.39 0.00 2.32 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.44 0.00 140 Q 8.05 3.87 0.00 1.80 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.82 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 141 L 7.25 4.35 0.00 1.32 1.30 -0.26 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 142 F 8.81 4.91 0.00 3.07 3.05 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 0.00 143 V 9.25 4.75 2.35 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 1.08 0.00 0.00 0.99 0.00 0.00 144 L 8.91 5.20 0.00 1.71 1.62 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 145 S 9.20 4.34 0.00 4.03 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 0.00 146 S 7.98 4.17 0.00 4.02 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 0.00 147 G 8.17 4.01 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 0.00 148 E 7.94 4.30 0.00 2.01 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 2.30 0.00 149 V 8.23 5.00 2.23 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 1.06 0.00 0.00 1.03 0.00 0.00 150 T 8.67 4.08 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 1.39 0.00 0.00 151 P 0.00 5.06 0.00 2.02 2.06 0.00 3.89 0.00 0.00 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 152 F 8.32 5.12 0.00 3.43 3.23 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 0.00 153 T 9.19 4.92 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 0.00 154 L 9.41 5.35 0.00 2.00 1.78 0.87 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 155 S 9.55 5.46 0.00 4.05 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 0.00 156 I 9.28 5.00 1.97 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 1.19 0.75 0.85 0.00 0.00 157 F 7.97 5.42 0.00 3.15 3.26 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 0.00 158 P 0.00 4.85 0.00 2.32 2.08 0.00 3.96 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.19 0.00 159 K 9.19 4.10 0.00 1.68 1.81 0.00 1.89 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.44 7.81 160 G 9.30 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 *161 Q 8.14 3.60 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.52 6.58 0.00 0.00 0.00 0.00 0.00 2.22 2.18 0.00 162 E 7.63 4.65 0.00 2.10 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 2.24 2.37 0.00 163 P 0.00 4.50 0.00 2.21 2.12 0.00 3.81 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 164 D 8.30 4.57 0.00 2.63 2.64 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 0.00 165 E 7.82 4.72 0.00 2.11 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 0.00 2.50 2.51 0.00 166 Q 8.58 4.96 0.00 1.91 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.50 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 167 W 9.41 4.84 0.00 3.33 3.21 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 0.00 168 R 9.12 5.33 0.00 1.73 1.82 0.00 3.06 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 169 V 9.03 5.02 2.63 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 1.36 0.00 0.00 1.33 0.00 0.00 170 T 9.07 4.54 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 1.10 0.00 0.00 171 A 7.62 5.05 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 0.00 172 Q 9.21 4.61 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 173 E 8.57 4.15 0.00 1.99 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 2.23 1.87 0.00 174 N 8.02 4.56 0.00 2.84 2.98 0.00 0.00 6.25 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 G 7.74 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 0.00 176 T 8.13 4.11 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 1.23 0.00 0.00 177 L 8.37 5.18 0.00 1.65 1.78 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 178 R 9.37 4.76 0.00 1.65 1.74 0.00 3.08 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 179 L 8.30 4.93 0.00 0.47 1.00 1.12 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.90 4.88 0.00 1.52 1.42 0.89 0.45 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 0.00 181 A 8.89 2.58 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 0.00 182 P 0.00 4.00 0.00 1.74 1.89 0.00 2.61 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 183 G 8.93 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 0.00 0.00 0.00 184 E 7.80 4.06 0.00 1.98 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 0.00 2.24 2.07 0.00 * Residues marked with a * may have inaccurate shift predictions.