NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.3982 8.0433 122.6806 54.8404 43.2056 174.9982 4 I 4.6396 8.4181 125.6060 58.0310 38.6835 169.8352 5 V 4.4047 9.7316 128.7510 61.0946 34.8218 173.5206 6 N 5.1014 8.9238 125.5954 52.1888 40.3878 174.0809 7 V 4.7710 8.6972 124.7448 61.3901 33.7100 174.3800 8 I 4.8841 8.9433 129.8602 59.7260 39.9246 174.2926 9 N 5.3680 9.3551 125.7747 51.8182 40.7485 175.6908 10 G 4.3248 9.2486 114.5582 44.0271 0.0000 170.8082 11 P 4.4406 0.0000 0.0000 64.4557 32.0256 176.6751 12 N 4.5889 9.4689 118.2498 53.6703 37.5706 176.3134 13 L 4.2310 7.5820 117.5060 56.8246 41.9301 178.5437 14 G 3.6196 8.0381 106.4656 47.7072 0.0000 174.2221 15 R 4.4358 7.5423 117.8257 55.8643 30.2989 176.5008 16 L 3.9338 7.9048 119.7789 56.1030 42.3987 177.3530 17 G 4.0660 8.7877 111.5814 46.9825 0.0000 173.9078 18 R 4.4880 7.6428 112.1063 56.7336 32.5091 175.7927 *24 Y 4.3655 7.9468 115.6569 56.6630 38.5749 177.7073 25 G 4.5087 8.3733 114.1914 43.2893 0.0000 172.3797 26 G 3.8261 8.6230 105.8593 46.8487 0.0000 174.3357 27 T 4.4163 8.0278 116.4517 62.7877 69.0321 175.2098 28 T 5.0256 8.3771 118.6871 60.3706 71.5945 175.2290 29 H 4.0507 8.5644 119.5996 59.3688 29.8627 176.6377 30 D 4.3377 8.0790 120.2581 57.5476 40.5889 178.5310 31 E 3.9625 7.9091 119.0084 59.1193 29.3711 179.1798 32 L 3.8022 7.8251 120.5028 58.0137 42.1286 179.0572 33 V 3.3943 7.8885 118.2960 66.0755 31.4025 177.8928 34 A 3.9699 8.0207 120.3156 55.0139 18.1664 179.6876 35 L 3.9092 7.9713 117.5573 57.9158 41.6802 179.7433 36 I 3.6864 7.7886 119.7688 64.5196 37.1771 178.3904 37 E 3.9362 8.2482 119.4090 59.2673 29.1589 179.5191 38 R 3.8684 7.9879 118.8743 59.3702 30.2775 178.2168 39 E 3.9303 8.3652 119.0045 59.1128 29.6432 178.5555 40 A 3.9772 8.2422 120.7599 55.1347 18.3103 179.4292 41 A 3.9845 7.9147 118.9458 55.4519 18.2211 179.7792 42 E 3.9354 7.8566 115.7609 59.1939 29.6275 178.8535 43 L 4.3334 7.6972 116.8391 54.8554 41.9469 177.6378 44 G 3.8462 7.6236 107.0135 45.7881 0.0000 173.0544 45 L 4.8039 8.1476 118.4979 52.4577 44.9209 175.6456 46 K 4.6117 9.0986 121.8411 54.6455 34.5282 174.4530 47 A 5.1734 8.6203 128.7367 50.1279 21.4068 175.5880 48 V 4.0923 8.7442 123.1973 61.2327 33.4818 174.3996 49 V 4.6536 8.1894 128.4142 61.3551 32.8637 175.0392 50 R 4.5485 8.8605 126.2879 54.3264 34.2796 174.1039 51 Q 5.1870 8.4689 121.4355 54.8130 32.1482 173.9766 52 S 4.8009 8.9767 119.4661 57.4351 65.5778 173.6622 53 D 4.5831 8.8977 124.3177 54.9123 41.5517 176.7090 54 S 4.5121 7.9384 115.7023 56.6337 63.6205 173.7628 55 E 3.8277 8.7188 129.6314 59.3942 29.5575 178.3830 56 A 3.8766 7.9006 120.2094 55.3396 18.4936 179.2145 57 Q 3.4303 7.5451 117.8618 58.9716 29.0053 178.4609 58 L 3.9880 7.5207 119.8633 57.7704 41.6310 179.3681 59 L 3.8562 7.9880 119.1302 57.7587 41.5350 179.0965 60 D 4.3013 7.8951 117.7834 57.3017 41.2210 178.4682 61 W 4.5257 7.8456 119.1513 59.7310 28.9139 178.7291 62 I 3.7930 7.9817 119.9933 64.6833 36.5926 178.0200 63 H 4.2634 8.2574 117.1633 59.1676 28.5322 177.8814 64 Q 4.0659 8.3521 119.5144 58.9855 28.5588 178.7475 65 A 4.0694 8.1857 121.5018 54.8394 18.1856 179.6329 66 A 3.9719 8.2100 119.6907 55.5719 18.2869 179.6762 67 D 4.3158 8.1820 116.0213 56.8125 40.9897 177.9032 68 A 4.3474 7.9939 118.3889 50.8696 19.7180 176.4657 69 A 3.7423 7.3744 119.3053 52.9912 16.8795 176.8772 70 E 4.6839 7.9878 118.5293 55.0934 31.5831 175.8853 71 P 4.6154 0.0000 0.0000 63.0047 33.0751 175.2883 72 V 4.8591 8.5853 122.1415 61.2945 34.7147 174.2079 73 I 4.7596 9.0803 129.6254 59.9335 38.7539 174.3622 74 L 5.0890 9.0399 130.5293 53.2041 44.7417 174.5858 75 N 5.2089 9.4007 125.4400 51.0975 40.0609 174.4208 76 A 4.4178 8.6733 128.1731 51.5148 20.4226 178.3562 77 G 3.8452 7.9314 106.1138 46.5441 0.0000 178.2735 78 G 3.8102 8.6950 112.5592 47.8264 0.0000 174.8049 79 L 4.3349 7.7140 121.1606 56.5396 41.4810 179.0438 80 T 3.8875 7.6560 116.3332 66.7368 68.2378 175.0666 81 H 5.0007 7.7360 114.8368 56.2015 29.4885 175.7996 82 T 4.5217 7.8067 109.6572 61.5478 70.4827 173.1306 83 S 4.5746 8.0577 117.4677 56.5293 62.2922 174.5293 84 V 3.2752 7.8455 128.4852 65.5031 31.3106 177.5459 85 A 3.9296 7.7511 120.4037 54.9702 18.2953 179.2018 86 L 3.9167 8.1651 119.1279 57.9992 42.2546 179.0828 87 R 3.9155 7.6375 117.7670 59.6325 29.8255 178.2831 88 D 4.3682 8.0757 117.2489 57.2000 41.1057 178.3414 89 A 4.1931 7.9786 121.2267 55.5032 18.3287 179.5533 90 C 4.2309 8.2955 114.5835 62.3915 27.9186 175.9460 91 A 4.1300 7.6467 121.3008 54.5509 17.9666 179.0180 92 E 4.1192 7.9044 116.2634 57.8515 29.8430 177.7728 93 L 4.0755 7.1952 119.4121 55.2386 42.0966 177.1027 94 S 4.4575 8.6433 116.9535 59.3344 64.3351 174.4459 95 A 4.4479 7.6942 121.3826 50.3196 19.6904 175.5875 96 P 4.3652 0.0000 0.0000 63.0360 32.8685 175.1146 97 L 5.1953 8.7184 125.3090 53.3331 44.8304 174.8774 98 I 4.8462 8.7808 127.3064 59.4415 40.1459 174.1220 99 E 4.7559 8.9813 129.0210 55.2658 30.6442 174.9962 100 V 4.8026 8.6495 126.8126 61.3346 34.9680 173.8063 101 H 4.9633 8.8790 123.5953 54.1727 32.3179 174.4648 102 I 3.9806 8.6846 124.2561 64.4050 37.8237 176.7701 103 S 4.6336 7.9004 114.3280 56.8126 64.4865 173.5542 104 N 4.4436 8.4259 120.1835 53.2432 37.7565 175.9672 105 V 3.6564 8.1499 125.9979 63.8436 31.6393 176.6945 106 H 4.5125 8.1126 116.2213 56.1142 29.0797 175.2747 107 A 4.6280 7.8001 121.7949 51.7385 19.5613 177.4003 108 R 4.7525 7.2007 116.9002 55.7059 32.3694 175.3451 109 E 3.9864 8.2348 120.1765 57.2461 30.3813 177.8933 110 E 3.9738 8.5381 120.9598 59.1879 29.7553 179.2508 111 F 4.4473 7.6805 112.2936 58.7898 38.2473 176.2908 112 R 3.6909 6.8766 118.9190 57.5059 30.1102 177.2061 113 R 4.2147 7.4306 115.5073 56.3400 30.2309 175.4861 114 H 4.9279 7.9152 117.7214 54.1025 32.3192 172.6937 115 S 4.7107 7.9513 119.4525 56.6265 65.0684 173.5239 116 Y 4.2437 8.5660 124.9470 60.3312 38.3720 177.5385 117 L 4.3016 7.9167 119.6431 57.0769 41.1423 178.8302 118 S 4.1868 7.9485 115.2472 61.4680 62.6195 175.1257 119 P 4.4285 0.0000 0.0000 64.6841 31.1883 177.0835 120 I 4.1884 6.9916 105.0619 60.5190 38.3845 175.7816 121 A 4.3291 7.3835 123.9839 52.2137 19.2063 177.9509 122 T 4.0805 8.8094 117.9347 66.3618 68.8627 175.1741 123 G 4.1542 7.7084 106.0532 44.7179 0.0000 171.1904 124 V 4.8731 8.0938 118.9381 60.9816 34.4634 174.3771 125 I 4.4966 8.8627 128.9422 59.5049 39.4301 174.8135 126 V 4.5941 7.9815 125.9798 62.0690 34.8187 176.2178 127 G 3.9314 8.8060 114.5346 46.0424 0.0000 173.5393 128 L 4.4384 7.4518 118.2290 53.9218 42.5449 178.9606 129 G 3.8022 7.8184 107.9447 46.2971 0.0000 175.5065 130 I 4.0298 8.2473 117.4579 63.7665 38.0767 178.2115 131 Q 4.2205 8.2202 119.8209 58.2090 29.0059 177.6192 132 G 3.6360 7.9569 106.7474 48.4047 0.0000 175.2168 133 Y 4.0871 7.7771 118.8757 60.9639 37.9970 178.6795 134 L 4.1399 7.9035 119.4261 57.6390 41.8377 179.3444 135 L 4.0719 8.3079 119.0775 57.5335 41.6409 179.2901 136 A 4.0317 8.0030 120.7056 55.0971 18.3027 179.6226 137 L 4.0053 8.0438 117.5686 58.0605 41.4865 179.8084 138 R 3.9468 7.8232 117.4123 59.3171 30.3598 177.5649 139 Y 4.2038 8.0938 119.5214 60.8537 38.4160 178.2759 140 L 4.0145 8.0676 119.0755 57.5011 41.4853 179.1268 141 A 4.1055 7.9228 119.7017 53.8329 18.4290 178.0880 142 E 4.3753 7.4868 115.3965 56.3505 29.9513 175.4024 143 H 4.2568 7.5390 119.8216 56.5689 29.7719 173.0207 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 3 L 8.04 4.40 0.00 1.36 1.64 0.92 0.60 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 4 I 8.42 4.64 1.97 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 1.22 1.12 0.94 0.00 0.00 5 V 9.73 4.40 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 1.10 0.00 0.00 0.95 0.00 0.00 6 N 8.92 5.10 0.00 2.80 2.67 0.00 0.00 6.13 7.07 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 7 V 8.70 4.77 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 1.06 0.00 0.00 0.97 0.00 0.00 8 I 8.94 4.88 1.96 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.61 1.18 0.00 0.00 9 N 9.36 5.37 0.00 2.83 2.82 0.00 0.00 6.43 7.15 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 10 G 9.25 4.32 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 11 P 0.00 4.44 0.00 2.08 2.04 0.00 4.01 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.29 0.00 12 N 9.47 4.59 0.00 3.02 3.04 0.00 0.00 6.85 6.26 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 13 L 7.58 4.23 0.00 1.86 1.83 1.15 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.04 3.62 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 0.00 0.00 0.00 15 R 7.54 4.44 0.00 2.05 1.97 0.00 3.35 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 16 L 7.90 3.93 0.00 1.74 1.87 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.79 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 0.00 0.00 0.00 18 R 7.64 4.49 0.00 1.93 1.87 0.00 3.25 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 *24 Y 7.95 4.37 0.00 2.36 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 0.00 0.00 0.00 0.00 25 G 8.37 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.62 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 27 T 8.03 4.42 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 1.19 0.00 0.00 28 T 8.38 5.03 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 29 H 8.56 4.05 0.00 3.21 3.32 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.08 4.34 0.00 2.72 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 31 E 7.91 3.96 0.00 2.11 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 2.31 2.30 0.00 32 L 7.83 3.80 0.00 1.69 1.65 0.49 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.89 3.39 2.17 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 0.88 0.00 0.00 0.86 0.00 0.00 34 A 8.02 3.97 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 35 L 7.97 3.91 0.00 1.83 1.70 0.90 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 36 I 7.79 3.69 1.88 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.56 0.87 0.00 0.00 37 E 8.25 3.94 0.00 2.03 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 2.29 2.36 0.00 38 R 7.99 3.87 0.00 2.08 2.01 0.00 3.09 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 39 E 8.37 3.93 0.00 2.21 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 2.33 2.38 0.00 40 A 8.24 3.98 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 41 A 7.91 3.98 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 42 E 7.86 3.94 0.00 2.11 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 2.34 2.47 0.00 43 L 7.70 4.33 0.00 1.79 1.71 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.62 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 45 L 8.15 4.80 0.00 1.46 1.57 0.93 0.75 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 46 K 9.10 4.61 0.00 1.74 1.62 0.00 1.57 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.33 7.81 47 A 8.62 5.17 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 48 V 8.74 4.09 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 0.85 0.00 0.00 0.87 0.00 0.00 49 V 8.19 4.65 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 0.70 0.00 0.00 0.82 0.00 0.00 50 R 8.86 4.55 0.00 0.68 0.66 0.00 2.69 0.00 0.00 2.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 51 Q 8.47 5.19 0.00 1.90 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.15 0.00 52 S 8.98 4.80 0.00 3.99 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 53 D 8.90 4.58 0.00 2.71 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 54 S 7.94 4.51 0.00 3.82 3.60 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 55 E 8.72 3.83 0.00 2.04 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 2.33 2.35 0.00 56 A 7.90 3.88 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 57 Q 7.55 3.43 0.00 1.79 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 1.68 1.16 0.00 58 L 7.52 3.99 0.00 1.89 1.74 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.99 3.86 0.00 1.75 1.58 0.89 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 60 D 7.90 4.30 0.00 2.62 2.52 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 61 W 7.85 4.53 0.00 3.65 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 62 I 7.98 3.79 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.87 0.98 0.00 0.00 63 H 8.26 4.26 0.00 3.37 3.35 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.35 4.07 0.00 2.40 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.64 0.00 65 A 8.19 4.07 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.21 3.97 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 67 D 8.18 4.32 0.00 2.84 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 68 A 7.99 4.35 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 69 A 7.37 3.74 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 70 E 7.99 4.68 0.00 1.88 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 2.28 2.47 0.00 71 P 0.00 4.62 0.00 2.10 2.02 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 72 V 8.59 4.86 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 1.09 0.00 0.00 0.96 0.00 0.00 73 I 9.08 4.76 1.96 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.62 0.97 0.00 0.00 74 L 9.04 5.09 0.00 1.73 1.49 1.04 0.24 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 75 N 9.40 5.21 0.00 2.78 3.04 0.00 0.00 6.95 7.77 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 76 A 8.67 4.42 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 77 G 7.93 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 78 G 8.70 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 79 L 7.71 4.33 0.00 1.82 1.74 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 80 T 7.66 3.89 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 1.25 0.00 0.00 81 H 7.74 5.00 0.00 3.24 3.46 0.00 5.59 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 82 T 7.81 4.52 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 1.35 0.00 0.00 83 S 8.06 4.57 0.00 3.90 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 84 V 7.85 3.28 1.85 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 0.86 0.00 0.00 0.22 0.00 0.00 85 A 7.75 3.93 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 86 L 8.17 3.92 0.00 1.74 1.66 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 87 R 7.64 3.92 0.00 2.01 2.09 0.00 3.40 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 88 D 8.08 4.37 0.00 2.83 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 89 A 7.98 4.19 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 90 C 8.30 4.23 0.00 3.17 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 91 A 7.65 4.13 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 92 E 7.90 4.12 0.00 2.20 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 2.37 0.00 93 L 7.20 4.08 0.00 1.67 1.65 0.98 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.64 4.46 0.00 3.98 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 95 A 7.69 4.45 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 96 P 0.00 4.37 0.00 2.19 2.13 0.00 3.59 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 97 L 8.72 5.20 0.00 1.77 1.50 1.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.78 4.85 1.83 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 0.93 0.57 0.79 0.00 0.00 99 E 8.98 4.76 0.00 2.01 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 2.17 2.19 0.00 100 V 8.65 4.80 1.63 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 0.24 0.00 0.00 0.64 0.00 0.00 101 H 8.88 4.96 0.00 3.01 3.09 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.68 3.98 1.92 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.06 0.96 0.00 0.00 103 S 7.90 4.63 0.00 3.96 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 0.00 104 N 8.43 4.44 0.00 2.74 2.76 0.00 0.00 6.67 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 0.00 105 V 8.15 3.66 1.84 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 0.43 0.00 0.00 0.81 0.00 0.00 106 H 8.11 4.51 0.00 3.27 3.33 0.00 5.64 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 0.00 107 A 7.80 4.63 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 0.00 108 R 7.20 4.75 0.00 1.59 1.62 0.00 3.17 0.00 0.00 3.13 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.65 0.00 109 E 8.23 3.99 0.00 1.16 1.41 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 2.38 2.28 0.00 110 E 8.54 3.97 0.00 1.99 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 0.00 2.36 2.23 0.00 111 F 7.68 4.45 0.00 3.04 3.18 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 0.00 112 R 6.88 3.69 0.00 1.63 1.77 0.00 2.91 0.00 0.00 3.12 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.61 0.00 113 R 7.43 4.21 0.00 1.93 1.98 0.00 3.07 0.00 0.00 3.39 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 114 H 7.92 4.93 0.00 3.01 3.11 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 S 7.95 4.71 0.00 3.77 3.60 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 0.00 116 Y 8.57 4.24 0.00 3.05 2.96 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 0.00 117 L 7.92 4.30 0.00 1.70 1.72 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 118 S 7.95 4.19 0.00 3.87 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 0.00 119 P 0.00 4.43 0.00 2.05 2.13 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 120 I 6.99 4.19 1.89 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 1.27 0.64 0.94 0.00 0.00 121 A 7.38 4.33 1.36 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 0.00 122 T 8.81 4.08 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 1.24 0.00 0.00 123 G 7.71 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 0.00 0.00 0.00 124 V 8.09 4.87 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 0.90 0.00 0.00 0.97 0.00 0.00 125 I 8.86 4.50 1.75 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.48 0.84 0.00 0.00 126 V 7.98 4.59 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 1.01 0.00 0.00 0.93 0.00 0.00 127 G 8.81 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 0.00 128 L 7.45 4.44 0.00 1.65 1.68 0.90 0.83 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 0.00 129 G 7.82 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 0.00 0.00 0.00 130 I 8.25 4.03 1.93 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 1.55 1.49 0.95 0.00 0.00 131 Q 8.22 4.22 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.62 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 132 G 7.96 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 0.00 133 Y 7.78 4.09 0.00 3.14 2.98 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 0.00 134 L 7.90 4.14 0.00 1.82 1.75 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.31 4.07 0.00 1.69 1.73 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.00 4.03 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 0.00 137 L 8.04 4.01 0.00 2.00 1.77 0.97 0.87 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 0.00 138 R 7.82 3.95 0.00 1.88 2.15 0.00 3.30 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 139 Y 8.09 4.20 0.00 3.14 3.14 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 0.00 140 L 8.07 4.01 0.00 1.96 1.74 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 141 A 7.92 4.11 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 0.00 142 E 7.49 4.38 0.00 2.16 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 2.18 2.28 0.00 143 H 7.54 4.26 0.00 2.83 2.96 0.00 5.93 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.