NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 84 D 4.7063 8.3649 120.5206 54.5157 42.5173 174.2848 85 T 4.3854 8.2039 116.2648 61.0666 69.7819 173.5898 86 S 4.7691 9.2913 119.4954 58.2267 65.5920 173.0533 87 I 4.5823 8.4724 121.5763 59.2750 40.0072 176.0543 88 D 4.9874 8.5398 127.7773 52.6189 42.1664 176.6449 89 I 3.7678 8.1508 117.8162 64.3580 38.0524 177.6291 90 E 4.0007 8.2230 119.1335 59.3907 29.2332 178.8421 91 D 4.4039 8.8423 119.4195 57.1127 40.7987 178.6467 92 I 3.7966 8.1654 120.9041 64.5862 36.9412 178.6457 93 K 4.0634 8.0119 117.7878 59.0919 31.9127 179.2905 94 K 4.1576 7.7968 117.5599 58.4565 31.9512 178.7634 95 I 4.0615 7.0765 118.0561 62.0717 38.1353 175.9215 96 L 4.8353 7.5069 118.5410 52.4783 43.2216 175.1122 97 P 4.5070 0.0000 0.0000 64.3713 32.0362 176.4984 98 H 4.3207 8.1373 116.7997 56.1039 29.3495 174.3671 99 R 4.8055 8.2085 120.5846 54.0731 34.2891 173.6706 100 Y 4.4440 8.7055 119.7613 57.9798 38.9562 174.1910 101 P 4.0289 0.0000 0.0000 62.6383 31.9608 175.1794 102 F 4.5979 8.6423 118.0811 58.7813 40.2666 173.2450 103 L 4.7742 8.1592 120.7108 53.1293 42.8210 175.6095 104 L 4.7814 9.2736 125.4932 54.0689 43.1401 176.0558 105 V 4.3984 7.8359 118.1628 61.2983 33.4520 174.7997 106 D 4.7542 8.8056 127.0163 55.8925 42.1385 176.7858 107 K 4.5197 7.5841 115.9824 55.4846 35.7343 173.8755 108 V 4.7407 8.3171 126.4708 61.2870 33.1564 175.7860 109 I 4.3255 8.7691 121.0161 61.6904 39.7930 175.2951 110 Y 4.9043 7.7614 122.4699 56.3631 42.3572 173.3396 111 M 4.8444 7.5409 123.7249 54.1703 35.9909 173.6444 112 Q 4.2139 8.8423 126.4099 53.3681 31.1418 172.6522 113 P 4.1887 0.0000 0.0000 64.5135 31.8114 176.5270 114 N 4.0982 8.9344 117.7100 53.8510 35.7320 174.5369 115 K 4.5693 7.0370 114.6940 56.8047 34.8895 175.4785 116 T 5.1987 7.8283 110.6610 61.0344 72.2573 172.4031 117 I 5.1439 8.9425 124.7423 59.4279 42.1289 173.6971 118 I 5.0324 9.2809 128.9884 59.8891 40.5757 175.0584 119 G 4.6638 8.9718 113.2530 45.6123 0.0000 170.8569 120 L 5.3017 8.9951 118.5362 54.2895 44.4014 174.6376 121 K 4.9408 9.0044 122.2756 54.8290 34.7801 174.7671 122 Q 4.5988 9.5121 127.4621 55.2711 29.9759 175.4040 123 V 4.6185 8.8040 124.5881 61.6027 33.0306 174.4259 124 S 5.0141 9.3310 122.9120 56.4358 64.9185 174.1136 125 T 3.5508 8.5125 119.3069 64.8259 67.3828 173.8944 126 N 4.5980 7.7858 119.3455 54.0699 39.2015 174.1526 127 E 4.6978 7.9311 116.3268 53.2486 30.6514 176.0037 128 P 4.2523 0.0000 0.0000 65.8196 31.2696 178.7609 129 F 4.4537 7.3713 113.8376 59.4755 37.6900 177.3978 130 F 4.4628 7.2070 118.8055 60.5369 38.3782 177.1420 131 N 4.5227 7.7776 115.1786 55.4624 38.3710 176.5431 132 G 4.0890 7.8995 104.9169 44.7081 0.0000 173.7367 133 H 3.8716 7.7291 120.2708 54.2770 30.5801 171.6976 134 F 5.1091 8.8160 120.5840 54.7070 43.7244 174.3157 135 P 4.2689 0.0000 0.0000 65.9880 31.0683 177.6386 136 Q 4.3304 8.0080 112.8820 56.0839 29.6013 175.7961 137 K 4.2573 8.0775 120.2149 55.4373 34.4238 174.3157 138 Q 4.8553 8.6904 126.9014 55.5893 29.1889 175.7798 139 I 4.8547 8.7392 125.0872 59.4599 40.9211 175.1384 140 M 4.0131 9.3730 128.3822 54.5615 32.8830 174.3267 141 P 3.7097 0.0000 0.0000 62.8248 32.2922 177.1505 142 G 2.8262 8.3444 109.4351 47.9980 0.0000 176.2077 143 V 3.9185 7.4088 113.8458 63.8406 31.4854 178.1242 144 L 3.9747 7.5367 118.1930 56.7345 41.6110 179.2447 145 Q 3.9973 7.9547 118.1949 58.7805 28.6806 178.1054 146 I 3.7876 7.9629 120.9191 64.5332 37.2013 177.8135 147 E 4.0590 8.3895 119.5853 59.4740 29.4649 178.5735 148 A 3.9574 8.1487 120.7882 55.4149 18.3343 179.6837 149 L 4.0164 7.9990 116.7675 57.7409 41.7053 179.5666 150 A 4.1525 8.4358 121.2213 55.1873 18.3286 179.6956 151 Q 3.9614 8.4463 116.9649 59.0817 28.7382 178.6205 152 L 3.9194 7.9884 121.0390 58.3244 42.0415 178.9627 153 A 4.1061 8.3572 120.8468 54.9546 18.2313 179.8246 154 G 2.6135 7.8334 104.2538 47.5348 0.0000 175.8222 155 I 3.5825 7.5914 122.2942 64.0995 37.0557 178.1498 156 L 3.8702 7.5567 120.6363 58.3959 41.6382 178.8554 157 C 3.9805 7.6461 115.5406 62.7650 28.1224 175.2677 158 L 4.0608 7.6637 119.5555 57.5225 41.3631 178.6134 159 K 4.1642 8.1981 116.9353 58.1711 32.1142 177.6962 160 S 4.3073 7.3473 112.1763 57.8963 63.5897 173.8850 *166 N 4.4428 8.1199 119.5486 54.3126 38.1482 173.4200 167 N 4.6248 8.5086 120.8015 53.2112 38.2074 175.5370 168 L 4.3355 7.8265 120.9916 54.3376 41.8377 176.0765 169 F 5.2285 8.3829 118.3844 54.9994 40.8902 174.1281 170 L 4.7829 9.3939 121.4727 52.5964 45.4024 175.3383 171 F 4.8322 8.9340 123.5433 58.6435 39.2810 174.6230 172 A 4.5906 9.5102 128.6480 53.6059 20.5273 176.7125 173 G 4.2008 7.8708 99.9758 45.8501 0.0000 172.9774 174 V 5.0416 8.0220 119.0503 60.2791 34.4061 173.7455 175 D 4.7372 9.1268 123.7693 52.3364 45.0312 175.5377 176 G 4.0704 8.0435 107.0044 45.4368 0.0000 173.2450 177 V 4.2819 7.1536 116.0876 61.6562 33.1995 176.1091 178 R 4.4515 8.5197 126.8285 54.1025 33.4924 174.4057 179 W 4.9990 8.9008 124.2832 55.7333 29.4606 176.3219 180 K 4.4067 9.4878 125.8763 57.7978 32.7203 177.4638 181 K 4.5344 7.7764 118.2065 54.2808 35.0050 173.1163 182 P 4.5179 0.0000 0.0000 62.7352 32.3868 175.6152 183 V 4.5574 8.4355 122.6688 61.3860 33.6765 174.4777 184 L 5.2833 9.5316 127.1589 51.8089 45.8499 174.3308 185 P 4.5332 0.0000 0.0000 64.7091 31.5859 176.7894 186 G 4.0396 9.0470 111.2480 45.2919 0.0000 173.6839 187 D 4.7276 8.0718 119.2990 54.3607 42.5660 175.5662 188 T 4.8026 8.3424 117.5982 61.9289 70.3607 173.9902 189 L 4.5811 8.9485 130.2623 54.6752 43.2130 175.3183 190 T 4.9862 8.9322 124.3648 62.6441 70.5638 174.0586 191 M 5.3969 9.2588 125.2507 53.6089 36.3590 174.1965 192 Q 5.2437 9.3319 123.0834 54.2887 32.8100 173.7448 193 A 5.3033 9.1386 126.9089 50.2260 22.8022 174.5145 194 N 5.3679 8.9498 118.1452 51.0779 42.3506 173.6336 195 L 4.3596 9.0399 127.1365 55.6101 42.1320 176.4806 196 I 4.2512 9.0817 128.6197 63.6074 37.8290 176.1455 197 S 4.7545 7.8264 113.8762 57.9712 66.1032 172.8221 198 F 5.0803 8.4906 120.8955 57.4899 41.4930 171.6861 199 K 4.6642 7.6243 127.8042 57.4028 40.3500 175.6988 *203 G 3.7673 7.5467 104.3751 46.4891 0.0000 171.9286 204 I 5.0110 7.8136 119.6977 59.2601 40.9925 176.2874 205 A 5.1964 8.6331 129.0849 49.8733 22.0534 174.8018 206 K 5.0111 9.3269 121.7167 54.6047 35.1893 175.4785 207 L 5.3982 8.8983 123.8045 53.2396 46.6887 175.7435 208 S 5.0616 8.8374 116.4074 57.2303 65.9962 173.0352 209 G 4.5960 9.0758 106.8946 44.9635 0.0000 171.8147 210 V 4.8470 8.9345 120.4896 60.9237 35.4700 174.0042 211 G 4.4662 9.0386 114.5691 44.6436 0.0000 171.6083 212 Y 5.4668 9.7144 121.3398 55.9689 42.5598 174.8536 213 V 4.6648 8.6266 121.2695 61.7064 34.9414 175.2911 214 N 4.0913 10.1623 125.7902 54.3857 35.9877 175.4151 215 G 3.9658 8.7099 105.8409 45.0786 0.0000 174.0879 216 K 4.7114 7.7433 119.5136 54.0743 34.2836 175.9095 217 V 3.8019 8.4262 122.7697 63.2191 32.0446 175.8175 218 V 4.4203 8.7508 119.9822 61.8546 34.6799 175.5494 219 I 4.9807 7.4205 119.4206 59.3946 41.6532 173.3188 220 N 5.3162 8.9341 125.8417 51.4383 42.0484 173.6986 221 I 4.7070 8.6381 123.6923 59.3911 39.7570 176.2845 222 S 4.1554 9.1184 124.3122 61.2336 64.1560 174.4178 223 E 4.9423 8.2638 119.9655 55.1196 33.5998 173.7703 224 M 5.1028 9.6249 127.7211 53.8441 35.0172 174.7786 225 T 4.8323 8.6323 120.0518 61.6405 71.6098 173.2386 226 F 5.5623 8.9434 124.4321 55.6478 42.8061 173.8837 227 A 5.0441 9.1495 125.2092 50.5169 20.7856 177.0894 228 L 4.5310 8.7579 122.6107 54.9132 41.7092 176.6719 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 84 D 8.36 4.71 0.00 2.27 2.53 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 0.00 85 T 8.20 4.39 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 1.21 0.00 0.00 86 S 9.29 4.77 0.00 3.93 3.88 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 87 I 8.47 4.58 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.07 0.90 0.00 0.00 88 D 8.54 4.99 0.00 2.95 2.84 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 89 I 8.15 3.77 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 1.67 1.45 0.93 0.00 0.00 90 E 8.22 4.00 0.00 2.02 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 2.41 2.35 0.00 91 D 8.84 4.40 0.00 2.90 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 92 I 8.17 3.80 2.05 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 1.53 0.80 0.93 0.00 0.00 93 K 8.01 4.06 0.00 1.97 1.90 0.00 1.74 0.00 0.00 1.86 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.56 7.81 94 K 7.80 4.16 0.00 1.94 1.88 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.67 7.81 95 I 7.08 4.06 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 1.50 0.62 0.88 0.00 0.00 96 L 7.51 4.84 0.00 1.68 1.75 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.51 0.00 2.14 2.33 0.00 3.97 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.13 0.00 98 H 8.14 4.32 0.00 3.19 3.56 0.00 5.84 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 99 R 8.21 4.81 0.00 1.85 1.89 0.00 3.36 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.57 0.00 100 Y 8.71 4.44 0.00 2.93 2.90 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 0.00 101 P 0.00 4.03 0.00 1.86 0.95 0.00 3.72 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.76 0.00 102 F 8.64 4.60 0.00 2.79 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 0.00 103 L 8.16 4.77 0.00 1.71 1.63 1.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 104 L 9.27 4.78 0.00 1.44 1.48 0.34 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.84 4.40 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 0.86 0.00 0.00 0.92 0.00 0.00 106 D 8.81 4.75 0.00 2.78 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 0.00 107 K 7.58 4.52 0.00 1.80 1.60 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.38 7.81 108 V 8.32 4.74 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 1.08 0.00 0.00 0.93 0.00 0.00 109 I 8.77 4.33 1.92 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 1.35 0.89 0.94 0.00 0.00 110 Y 7.76 4.90 0.00 3.04 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 M 7.54 4.84 0.00 1.82 1.72 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 112 Q 8.84 4.21 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.64 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 113 P 0.00 4.19 0.00 2.14 1.91 0.00 3.67 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 2.04 2.05 0.00 114 N 8.93 4.10 0.00 2.81 2.89 0.00 0.00 6.71 7.61 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 0.00 115 K 7.04 4.57 0.00 1.82 1.71 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.46 7.81 116 T 7.83 5.20 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 1.44 0.00 0.00 117 I 8.94 5.14 1.85 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 1.25 1.65 1.04 0.00 0.00 118 I 9.28 5.03 2.03 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.75 1.00 0.00 0.00 119 G 8.97 4.66 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 0.00 120 L 9.00 5.30 0.00 1.85 1.76 0.95 0.60 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 0.00 121 K 9.00 4.94 0.00 1.92 1.71 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.36 1.69 7.81 122 Q 9.51 4.60 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.46 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 123 V 8.80 4.62 2.33 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 1.43 0.00 0.00 1.09 0.00 0.00 124 S 9.33 5.01 0.00 3.90 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 0.00 125 T 8.51 3.55 4.02 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 1.15 0.00 0.00 126 N 7.79 4.60 0.00 2.74 2.79 0.00 0.00 7.05 6.98 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 0.00 127 E 7.93 4.70 0.00 1.56 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 2.19 2.32 0.00 128 P 0.00 4.25 0.00 2.24 2.36 0.00 3.59 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.84 0.00 129 F 7.37 4.45 0.00 3.08 3.22 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 0.00 130 F 7.21 4.46 0.00 3.01 2.97 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 0.00 131 N 7.78 4.52 0.00 2.79 2.93 0.00 0.00 6.89 7.53 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 0.00 132 G 7.90 4.09 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 0.00 133 H 7.73 3.87 0.00 2.82 2.88 0.00 5.54 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.82 5.11 0.00 3.19 2.84 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 0.00 135 P 0.00 4.27 0.00 2.10 2.21 0.00 3.88 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 2.12 2.37 0.00 136 Q 8.01 4.33 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 137 K 8.08 4.26 0.00 1.82 1.77 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.45 7.81 138 Q 8.69 4.86 0.00 1.72 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.47 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 139 I 8.74 4.85 2.07 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.75 1.01 0.00 0.00 140 M 9.37 4.01 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 141 P 0.00 3.71 0.00 1.67 1.46 0.00 2.51 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.21 0.00 142 G 8.34 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 0.00 0.00 0.00 143 V 7.41 3.92 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 0.86 0.00 0.00 0.81 0.00 0.00 144 L 7.54 3.97 0.00 1.34 1.25 -0.10 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 7.95 4.00 0.00 2.61 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.87 0.00 0.00 0.00 0.00 0.00 2.49 2.57 0.00 146 I 7.96 3.79 2.23 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.28 1.11 0.00 0.00 147 E 8.39 4.06 0.00 2.22 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 0.00 1.76 2.19 0.00 148 A 8.15 3.96 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 0.00 149 L 8.00 4.02 0.00 2.10 1.81 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 150 A 8.44 4.15 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 0.00 151 Q 8.45 3.96 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.71 0.00 0.00 0.00 0.00 0.00 2.02 2.42 0.00 152 L 7.99 3.92 0.00 1.91 1.84 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 153 A 8.36 4.11 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 0.00 154 G 7.83 2.61 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 0.00 155 I 7.59 3.58 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 1.38 0.76 0.86 0.00 0.00 156 L 7.56 3.87 0.00 1.67 1.82 0.89 1.52 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 0.00 157 C 7.65 3.98 0.00 2.91 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 0.00 158 L 7.66 4.06 0.00 1.52 1.65 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.20 4.16 0.00 1.62 1.78 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.45 7.81 160 S 7.35 4.31 0.00 3.77 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 *166 N 8.12 4.44 0.00 2.74 2.90 0.00 0.00 7.20 7.79 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 0.00 167 N 8.51 4.62 0.00 3.07 2.96 0.00 0.00 6.33 7.79 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 0.00 168 L 7.83 4.34 0.00 1.84 1.69 0.92 0.97 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 0.00 169 F 8.38 5.23 0.00 3.10 2.90 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 0.00 170 L 9.39 4.78 0.00 1.59 1.63 0.93 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 171 F 8.93 4.83 0.00 3.19 2.90 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 0.00 172 A 9.51 4.59 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 0.00 173 G 7.87 4.20 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 0.00 174 V 8.02 5.04 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 0.46 0.00 0.00 0.96 0.00 0.00 175 D 9.13 4.74 0.00 2.49 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 0.00 176 G 8.04 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 0.00 177 V 7.15 4.28 1.55 0.00 0.00 0.00 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 0.70 0.00 0.00 178 R 8.52 4.45 0.00 1.62 1.72 0.00 3.12 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.46 0.00 179 W 8.90 5.00 0.00 3.35 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 0.00 180 K 9.49 4.41 0.00 1.75 1.89 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.35 7.81 181 K 7.78 4.53 0.00 1.72 1.68 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.49 7.81 182 P 0.00 4.52 0.00 2.04 2.03 0.00 3.75 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 2.07 2.13 0.00 183 V 8.44 4.56 2.16 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 1.18 0.00 0.00 1.08 0.00 0.00 184 L 9.53 5.28 0.00 1.57 1.51 0.95 1.00 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 0.00 185 P 0.00 4.53 0.00 1.82 1.78 0.00 3.48 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.67 0.00 186 G 9.05 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 0.00 0.00 0.00 0.00 187 D 8.07 4.73 0.00 2.81 2.66 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 0.00 188 T 8.34 4.80 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 1.29 0.00 0.00 189 L 8.95 4.58 0.00 1.83 1.77 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 190 T 8.93 4.99 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 1.24 0.00 0.00 191 M 9.26 5.40 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 192 Q 9.33 5.24 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.56 0.00 193 A 9.14 5.30 1.26 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 0.00 0.00 194 N 8.95 5.37 0.00 2.65 2.72 0.00 0.00 6.52 6.36 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 0.00 195 L 9.04 4.36 0.00 1.62 1.62 1.13 1.08 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 0.00 196 I 9.08 4.25 1.95 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 1.30 0.70 0.92 0.00 0.00 197 S 7.83 4.75 0.00 3.89 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 0.00 198 F 8.49 5.08 0.00 3.00 2.85 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 0.00 199 K 7.62 4.66 0.00 1.85 1.55 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.35 1.44 7.81 *203 G 7.55 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 0.00 204 I 7.81 5.01 1.73 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.90 0.83 0.00 0.00 205 A 8.63 5.20 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 0.00 0.00 0.00 0.00 0.00 206 K 9.33 5.01 0.00 1.63 1.67 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.32 7.81 207 L 8.90 5.40 0.00 1.73 1.67 1.19 0.62 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 0.00 208 S 8.84 5.06 0.00 4.04 4.02 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 0.00 209 G 9.08 4.60 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 0.00 210 V 8.93 4.85 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 0.38 0.00 0.00 0.90 0.00 0.00 211 G 9.04 4.47 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 0.00 0.00 0.00 212 Y 9.71 5.47 0.00 2.84 2.84 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 0.00 213 V 8.63 4.66 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 1.04 0.00 0.00 1.01 0.00 0.00 214 N 10.16 4.09 0.00 2.93 2.90 0.00 0.00 7.31 7.65 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 0.00 215 G 8.71 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 0.00 216 K 7.74 4.71 0.00 2.05 1.76 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.40 7.81 217 V 8.43 3.80 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 0.67 0.00 0.00 0.83 0.00 0.00 218 V 8.75 4.42 2.30 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 0.84 0.00 0.00 1.00 0.00 0.00 219 I 7.42 4.98 1.96 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.74 0.91 0.00 0.00 220 N 8.93 5.32 0.00 2.59 2.54 0.00 0.00 6.58 7.38 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 0.00 221 I 8.64 4.71 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 1.09 0.65 0.89 0.00 0.00 222 S 9.12 4.16 0.00 3.81 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 0.00 223 E 8.26 4.94 0.00 2.04 1.74 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 2.16 2.25 0.00 224 M 9.62 5.10 0.00 1.74 1.81 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.66 0.00 225 T 8.63 4.83 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 1.15 0.00 0.00 226 F 8.94 5.56 0.00 3.00 3.09 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 0.00 227 A 9.15 5.04 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 0.00 228 L 8.76 4.53 0.00 1.54 1.65 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.