NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4355 8.3344 115.4175 57.5165 64.4165 172.4714 3 I 3.8520 8.2483 120.6296 60.9264 38.2863 173.4008 4 S 5.0965 9.9228 124.2156 56.6510 66.6038 172.1470 5 I 5.0610 8.6035 125.5484 59.7987 41.1484 174.3073 6 S 5.3074 8.6044 122.9492 57.0837 65.6961 173.0859 7 Y 4.7200 8.0991 121.4573 56.2041 41.2202 173.7296 8 S 4.4338 8.7406 117.9999 58.4268 62.9971 174.9915 9 T 3.8938 8.6692 117.7068 64.4288 68.5885 176.3751 10 T 3.6211 7.6096 117.4069 66.1201 68.6569 173.8284 11 Y 4.4565 7.9310 116.5699 57.4939 38.5554 177.3111 12 S 4.3129 8.6255 119.6833 61.8508 62.9564 176.7331 13 G 4.0738 8.2028 105.1123 45.8701 0.0000 173.9249 14 W 4.4790 8.7116 121.4151 56.5636 30.0057 176.0560 15 T 4.9596 8.3247 113.4288 60.6068 70.7654 176.1575 16 V 3.5020 7.9034 121.3686 65.9777 31.6460 178.0660 17 A 4.0279 8.4619 120.9680 55.4770 18.3387 179.3905 18 D 4.4603 8.1758 117.1225 57.6634 40.9387 178.4635 19 Y 4.2150 8.7726 120.4391 60.9080 38.9391 178.0569 20 L 4.0819 8.7056 120.1389 57.4891 41.6381 179.4330 21 A 3.9871 8.1810 120.8552 55.3047 18.4216 179.2420 22 D 4.3376 8.1531 116.3853 57.1505 41.2595 178.0490 23 W 3.9858 8.3538 129.2766 60.6257 30.6432 178.1823 24 S 3.9962 8.2589 114.7352 61.4981 62.0719 176.4571 25 A 4.0352 7.9308 122.4231 55.1438 18.1514 178.6633 26 Y 4.2444 7.7115 117.0865 60.9316 38.9367 177.9108 27 F 3.4462 7.3038 120.2765 61.3061 39.5380 175.6217 28 G 3.6698 9.0277 105.7356 44.0335 0.0000 170.1627 29 D 5.1924 8.4041 117.5532 52.5465 43.6853 176.5745 30 V 4.3509 7.8234 118.4760 59.5933 33.8755 175.6120 *37 V 3.8819 8.1707 123.1579 62.8763 32.3628 174.5132 38 V 4.4337 8.4862 127.3148 61.2012 33.4964 174.2807 39 D 4.7176 8.2384 124.5614 52.3130 41.8573 175.2599 40 G 3.7824 8.9293 107.1514 49.2446 0.0000 174.6921 41 S 4.3737 8.0183 111.5270 59.3884 63.1281 174.0932 42 N 4.9640 8.2270 116.7546 54.0845 41.5624 175.4175 43 T 3.9775 8.1355 107.8196 62.7887 69.3532 175.4743 44 G 3.5862 8.6007 108.5518 45.3790 0.0000 172.0271 45 G 4.3437 7.2652 104.0019 45.2194 0.0000 172.4657 46 F 5.5723 9.0544 120.8259 55.5376 41.6641 174.6892 47 N 4.9656 9.4760 120.5326 51.6363 40.5759 173.4817 48 P 4.2379 0.0000 0.0000 63.3436 31.9914 177.1688 49 G 3.9079 8.0955 104.9640 43.7887 0.0000 171.1758 50 P 4.2177 0.0000 0.0000 64.5169 31.6136 177.0648 51 F 4.9912 7.5675 114.9073 56.8615 40.0269 173.6513 52 D 4.4041 6.8008 119.6387 52.7670 45.6648 175.0463 53 G 4.1804 8.0688 106.4157 46.7692 0.0000 173.1330 54 S 5.4085 8.3167 113.2409 59.5212 64.4600 174.1974 55 Q 5.1177 8.0486 119.6497 54.7359 33.2301 172.6335 56 Y 4.7081 9.2648 124.7876 55.5318 41.5928 174.1657 57 A 4.1646 7.2080 126.9941 48.6583 23.0932 174.4847 58 L 4.4207 7.0563 121.1171 53.1411 45.7444 174.9532 59 K 4.7895 8.3835 126.6069 54.7586 33.9803 175.9624 60 S 3.4255 8.2095 120.2165 57.9091 62.7531 174.5919 61 T 3.9339 7.9116 115.2201 63.5648 69.3623 175.7898 62 A 4.1194 7.6313 124.8947 53.5737 19.2912 176.4796 63 S 4.7039 6.9948 106.9850 56.3950 66.0460 173.0864 64 D 4.6489 8.3869 117.4509 55.1676 41.5589 176.7685 65 A 4.8062 7.3986 121.8275 52.6646 19.6475 176.5931 66 A 5.5238 9.3512 120.4363 51.1454 23.2703 175.2901 67 F 5.4902 8.9667 113.9424 55.6248 42.3699 173.5112 68 I 4.7857 9.1329 119.3716 59.6495 41.5817 174.0458 69 A 5.1386 9.5210 129.1259 50.1248 21.3934 175.3214 70 G 4.3803 9.1449 110.1178 43.9522 0.0000 172.7234 71 G 4.4080 8.1662 116.3200 46.0681 0.0000 174.7846 72 D 4.9456 7.1593 132.6101 52.2460 43.5102 172.5026 73 L 5.1081 9.0859 125.6089 52.9704 45.6680 175.4205 74 H 5.0464 8.6679 118.1018 52.9665 32.9186 171.6244 75 Y 5.5599 8.5576 124.3328 56.1918 40.4528 175.7841 76 T 4.0338 8.7057 116.1819 61.6100 71.3199 177.1765 77 L 2.4400 5.6200 123.4033 56.0923 41.9659 175.6971 78 F 4.6782 7.8490 113.1608 57.4894 39.6087 175.8168 79 S 4.2948 7.8802 118.7235 57.6343 63.3105 173.2543 80 N 4.4707 8.5191 122.7964 53.0486 39.1985 172.4767 81 P 4.5206 0.0000 0.0000 61.5276 32.5428 176.1833 82 S 4.4391 8.3584 116.7536 58.9873 64.0528 173.3247 83 H 3.8265 8.1661 117.8803 57.7003 26.6381 175.4057 84 T 4.6255 7.7357 115.2404 61.6745 71.3201 175.0193 85 L 5.0004 9.1107 129.3916 54.3102 43.3020 175.4302 86 W 5.1944 9.7228 122.8759 55.0491 32.4108 171.6464 87 G 3.8576 8.5876 103.3650 44.1991 0.0000 172.0477 88 K 4.9046 8.7269 120.3717 54.8117 34.5444 175.5139 89 L 4.9098 8.8705 127.8409 53.9171 43.3278 175.9881 90 D 4.8354 9.3098 127.8163 55.3389 42.9986 176.9601 91 S 5.3498 7.9440 111.1520 56.5766 67.1974 173.2740 92 I 5.1613 8.9497 121.4826 59.6280 40.7711 174.0639 93 A 4.9935 9.5682 129.5263 50.1742 21.4436 174.7961 94 L 4.4073 8.3772 123.2933 53.0134 44.3239 174.5407 95 G 4.2006 9.0211 115.1858 46.7810 0.0000 175.6982 96 D 5.0428 9.2541 123.0620 54.5341 44.7951 171.4867 97 T 3.5185 9.4182 124.7143 63.7091 65.5749 170.5943 98 L 4.5598 7.9267 125.5549 54.8848 43.3225 175.8626 99 T 4.6440 8.6851 114.4031 60.3843 72.3192 174.5550 100 G 4.3483 7.9024 109.2344 46.1985 0.0000 172.8164 101 G 2.7687 7.3816 103.9403 45.7820 0.0000 172.9838 102 A 4.0363 8.4716 122.0604 54.8420 18.5278 178.9097 103 S 4.5234 7.8449 107.1267 58.4207 63.2582 174.3694 104 S 4.3610 7.7370 115.4110 57.4985 64.2507 172.4609 105 G 3.6135 8.2043 106.7696 45.5657 0.0000 174.1793 106 G 3.9054 7.9880 106.2684 45.4857 0.0000 171.4465 107 Y 4.6714 9.3534 119.7944 57.9404 39.3412 174.7545 108 A 4.7885 9.0311 123.1224 50.6304 23.3359 174.8981 109 L 4.7479 8.3593 120.2617 53.4714 42.6141 176.5600 110 D 4.3751 9.0326 124.3288 56.6734 42.0405 175.8287 111 S 4.5614 8.2752 114.3869 56.2135 63.5692 171.6749 112 Q 4.2879 8.3991 125.9996 55.2493 28.9221 174.9795 113 E 4.1673 8.9906 127.0180 58.5748 30.2257 176.7842 114 V 4.6666 7.8678 118.6658 60.9765 35.6199 173.7385 115 S 5.0186 8.5811 119.9102 56.5053 66.8757 172.6213 116 F 5.2849 9.1325 120.0961 56.0105 42.0562 174.4817 117 S 5.1287 9.2134 119.1664 56.4190 67.3014 173.3278 118 N 4.4621 8.8811 114.9311 54.2188 36.0813 176.3136 119 L 4.0434 8.3894 119.5838 57.2964 41.8808 179.3815 120 G 3.8598 8.2363 103.9545 46.1253 0.0000 172.6451 121 L 4.6168 7.6521 118.7011 53.4938 43.6825 175.8546 122 D 5.0997 8.5042 122.0089 53.3806 44.1709 174.3032 123 S 5.0196 9.4561 122.5495 56.1654 66.5661 172.2222 124 P 5.0327 0.0000 0.0000 61.2781 33.0026 176.5381 125 I 2.7128 7.2464 119.1160 63.7569 37.7006 177.8851 126 A 3.8439 7.5591 121.5444 54.6737 18.5306 177.9421 127 Q 4.1877 7.9576 114.2163 55.7990 30.2348 177.3763 128 G 3.7084 7.6423 108.0969 47.3036 0.0000 175.8501 129 R 4.0414 8.5993 123.2048 56.5543 30.0254 176.2090 130 D 4.7447 7.8157 117.3063 54.1090 41.5455 177.6659 131 G 3.8114 7.5868 106.5768 44.4842 0.0000 174.5536 132 T 3.8939 8.5702 121.2840 66.6787 68.5893 176.7962 133 V 3.5885 7.7286 119.6775 66.3769 31.4244 177.3989 134 H 4.1262 8.3101 117.1465 59.4960 29.8076 177.2820 135 K 4.0822 8.3942 120.4770 59.2163 31.6682 179.5334 136 V 3.4714 8.6115 119.4092 66.1009 31.5439 178.3666 137 V 3.5103 7.9721 117.9243 66.0550 31.4265 177.3910 138 Y 4.1935 8.2719 119.6387 60.4399 38.5628 177.8686 139 G 3.9557 7.9610 108.1082 47.2337 0.0000 175.2722 140 L 3.7284 7.3638 121.8253 57.6491 41.5696 179.6674 141 M 4.3635 8.1038 118.2157 58.0432 31.6626 177.9726 142 S 4.8524 6.8383 113.3892 56.6718 63.6057 174.0449 143 G 3.7153 8.2768 108.6996 46.8482 0.0000 174.3277 144 D 4.4211 8.4081 120.7770 51.9255 42.6216 174.5062 145 S 4.7414 8.4534 121.1405 58.3380 63.4726 175.7725 146 S 4.1494 8.3202 120.6261 61.9096 62.7801 176.2511 147 A 4.0015 7.8617 123.9626 54.6133 18.1226 179.2028 148 L 3.7485 7.7128 118.4301 58.4403 42.1887 178.5410 149 Q 3.9455 8.4903 118.3985 59.0998 28.1563 179.0715 150 G 3.8504 8.7131 106.4163 48.4334 0.0000 175.4622 151 Q 4.0307 7.9480 120.0877 58.6498 28.6607 178.9214 152 I 3.6362 7.8379 121.0322 64.2903 37.1039 177.8089 153 D 4.2772 8.2593 118.8000 57.4039 40.9367 178.3674 154 A 4.0380 7.7105 120.1699 54.9775 17.9116 179.6298 155 L 3.9851 7.7482 117.3596 57.8445 41.7748 179.8048 156 L 4.0526 8.1439 119.0861 57.7448 41.4074 179.5775 157 K 4.0990 7.9425 117.1058 59.4231 32.0167 178.8648 158 A 4.1744 7.6974 119.6176 54.4331 18.4228 179.6122 159 V 3.8157 7.1806 115.6729 64.7787 32.0439 176.2072 160 D 4.4710 7.7136 117.1980 52.6651 44.0886 173.9982 161 P 4.4074 0.0000 0.0000 64.7062 31.5786 177.4767 162 S 4.3167 8.5646 113.0850 60.1807 63.5060 174.8824 163 L 4.3463 7.6871 120.5777 54.2738 42.3397 175.7361 164 S 4.6130 8.1869 114.7608 57.3963 66.0168 176.0277 165 I 3.6989 8.8811 114.4150 62.9897 37.1005 176.9288 166 N 4.7419 7.9583 117.8211 53.1448 39.0245 175.2974 167 S 4.4600 7.9820 116.4991 58.1493 63.8863 174.2029 168 T 4.5783 8.3307 114.0441 61.1986 70.7106 176.0772 169 F 3.7439 8.3579 120.8892 60.8204 38.8301 177.6375 170 D 4.5037 8.1193 118.3858 57.8192 40.6263 179.1530 171 Q 4.0356 8.1195 118.2962 58.9389 28.7090 178.7701 172 L 4.1027 7.9726 119.4790 57.1250 41.6124 179.3302 173 A 4.5042 8.5004 122.5789 54.6868 18.1397 179.5105 174 A 4.0033 8.0346 118.0034 55.0539 18.5411 179.1178 175 A 4.1534 7.7249 117.3990 53.2792 18.6418 178.4981 176 G 3.9476 8.0811 106.1371 44.9497 0.0000 175.0983 177 V 3.9123 7.8115 119.1720 65.0933 32.7827 175.7343 178 A 5.2808 7.9707 121.2359 51.0641 22.1281 176.0302 179 H 4.9038 8.8716 115.8912 54.6700 32.9615 173.6527 180 A 3.6508 8.3911 125.8504 51.6662 19.5289 176.0038 181 T 4.5591 8.0554 108.9970 59.0477 72.8194 171.8300 182 P 4.8443 0.0000 0.0000 63.0867 32.8397 176.8555 183 A 4.1018 8.1098 122.2066 53.2163 18.9437 176.2169 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 2 S 8.33 4.44 0.00 4.02 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 3 I 8.25 3.85 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 1.36 1.26 0.96 0.00 0.00 4 S 9.92 5.10 0.00 3.97 3.67 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 5 I 8.60 5.06 1.96 0.00 0.00 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 1.29 0.81 0.92 0.00 0.00 6 S 8.60 5.31 0.00 3.63 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 7 Y 8.10 4.72 0.00 2.21 2.15 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 8 S 8.74 4.43 0.00 4.05 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 9 T 8.67 3.89 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 1.21 0.00 0.00 10 T 7.61 3.62 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 11 Y 7.93 4.46 0.00 2.63 2.51 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 12 S 8.63 4.31 0.00 4.06 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 13 G 8.20 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 14 W 8.71 4.48 0.00 3.92 3.52 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 15 T 8.32 4.96 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 1.27 0.00 0.00 16 V 7.90 3.50 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 1.26 0.00 0.00 0.41 0.00 0.00 17 A 8.46 4.03 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 18 D 8.18 4.46 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 8.77 4.22 0.00 3.40 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 20 L 8.71 4.08 0.00 1.84 1.73 0.81 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.18 3.99 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 22 D 8.15 4.34 0.00 3.32 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 23 W 8.35 3.99 0.00 2.68 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 24 S 8.26 4.00 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 25 A 7.93 4.04 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 26 Y 7.71 4.24 0.00 2.80 2.92 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 27 F 7.30 3.45 0.00 1.63 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 28 G 9.03 3.67 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 0.00 0.00 0.00 29 D 8.40 5.19 0.00 2.77 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.82 4.35 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 0.59 0.00 0.00 1.11 0.00 0.00 *37 V 8.17 3.88 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 0.77 0.00 0.00 0.96 0.00 0.00 38 V 8.49 4.43 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 1.01 0.00 0.00 1.02 0.00 0.00 39 D 8.24 4.72 0.00 2.88 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 40 G 8.93 3.78 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 0.00 0.00 0.00 41 S 8.02 4.37 0.00 4.00 3.99 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 42 N 8.23 4.96 0.00 2.79 3.02 0.00 0.00 7.14 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 43 T 8.14 3.98 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 1.38 0.00 0.00 44 G 8.60 3.59 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 45 G 7.27 4.34 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 0.00 46 F 9.05 5.57 0.00 3.12 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 47 N 9.48 4.97 0.00 2.79 2.78 0.00 0.00 7.38 7.48 0.00 0.00 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 P 0.00 4.24 0.00 2.07 2.07 0.00 3.76 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 2.02 2.07 0.00 49 G 8.10 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 50 P 0.00 4.22 0.00 0.73 1.76 0.00 3.42 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.63 0.00 51 F 7.57 4.99 0.00 3.02 2.91 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 52 D 6.80 4.40 0.00 2.50 2.42 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 53 G 8.07 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.10 0.00 0.00 62 A 7.63 4.12 1.09 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 0.00 0.00 0.00 0.00 0.00 63 S 6.99 4.70 0.00 3.55 3.47 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 64 D 8.39 4.65 0.00 2.70 2.79 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 65 A 7.40 4.81 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 66 A 9.35 5.52 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 67 F 8.97 5.49 0.00 2.92 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 68 I 9.13 4.79 1.88 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 0.96 0.80 0.91 0.00 0.00 69 A 9.52 5.14 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 70 G 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3.71 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 0.00 0.00 0.00 129 R 8.60 4.04 0.00 1.71 1.76 0.00 3.07 0.00 0.00 3.10 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.52 0.00 130 D 7.82 4.74 0.00 2.83 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 0.00 131 G 7.59 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 0.00 132 T 8.57 3.89 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 1.22 0.00 0.00 133 V 7.73 3.59 2.19 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 1.07 0.00 0.00 1.04 0.00 0.00 134 H 8.31 4.13 0.00 3.62 3.56 0.00 5.92 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 0.00 135 K 8.39 4.08 0.00 1.88 1.89 0.00 1.76 0.00 0.00 1.62 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.76 7.81 136 V 8.61 3.47 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 0.89 0.00 0.00 0.89 0.00 0.00 137 V 7.97 3.51 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 1.08 0.00 0.00 1.03 0.00 0.00 138 Y 8.27 4.19 0.00 2.89 2.92 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 0.00 139 G 7.96 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 0.00 0.00 0.00 0.00 140 L 7.36 3.73 0.00 1.04 0.58 0.36 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 141 M 8.10 4.36 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.12 2.93 0.00 142 S 6.84 4.85 0.00 3.71 3.67 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 0.00 143 G 8.28 3.72 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 0.00 0.00 0.00 144 D 8.41 4.42 0.00 2.55 2.46 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 0.00 145 S 8.45 4.74 0.00 4.01 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 0.00 146 S 8.32 4.15 0.00 4.08 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 0.00 147 A 7.86 4.00 1.35 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 0.00 0.00 148 L 7.71 3.75 0.00 1.58 1.67 0.61 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 149 Q 8.49 3.95 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 150 G 8.71 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 0.00 151 Q 7.95 4.03 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 152 I 7.84 3.64 1.81 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.37 0.88 0.00 0.00 153 D 8.26 4.28 0.00 2.86 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 0.00 154 A 7.71 4.04 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 0.00 155 L 7.75 3.99 0.00 1.80 1.75 1.02 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.14 4.05 0.00 1.68 1.70 0.88 0.55 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 0.00 157 K 7.94 4.10 0.00 1.79 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.64 7.81 158 A 7.70 4.17 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 0.00 159 V 7.18 3.82 2.22 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 0.84 0.00 0.00 1.05 0.00 0.00 160 D 7.71 4.47 0.00 2.74 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 0.00 161 P 0.00 4.41 0.00 2.08 2.11 0.00 3.72 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 2.03 2.09 0.00 162 S 8.56 4.32 0.00 3.95 3.99 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 0.00 163 L 7.69 4.35 0.00 1.82 1.62 0.92 0.59 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 0.00 164 S 8.19 4.61 0.00 4.13 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 0.00 165 I 8.88 3.70 1.84 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 1.27 1.02 0.88 0.00 0.00 166 N 7.96 4.74 0.00 2.72 2.85 0.00 0.00 6.99 7.11 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 0.00 167 S 7.98 4.46 0.00 3.84 3.70 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 0.00 168 T 8.33 4.58 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 0.00 169 F 8.36 3.74 0.00 2.69 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 0.00 170 D 8.12 4.50 0.00 2.83 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 0.00 171 Q 8.12 4.04 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 172 L 7.97 4.10 0.00 1.82 1.71 0.80 0.68 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 0.00 173 A 8.50 4.50 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 0.00 174 A 8.03 4.00 1.35 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 0.00 0.00 175 A 7.72 4.15 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 0.00 176 G 8.08 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 0.00 177 V 7.81 3.91 2.21 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 1.07 0.00 0.00 0.95 0.00 0.00 178 A 7.97 5.28 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 H 8.87 4.90 0.00 3.01 3.10 0.00 5.62 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 0.00 180 A 8.39 3.65 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 0.00 181 T 8.06 4.56 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 1.05 0.00 0.00 182 P 0.00 4.84 0.00 2.05 2.02 0.00 3.54 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 2.05 0.00 183 A 8.11 4.10 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 * Residues marked with a * may have inaccurate shift predictions.