NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 94 K 4.3498 8.3149 119.9978 56.6918 33.9445 174.9070 95 I 4.6218 8.1013 121.6092 59.2309 41.5621 173.7107 96 L 4.6962 8.8252 125.7882 53.0666 44.5276 172.8503 97 P 4.4197 0.0000 0.0000 63.7915 31.0567 173.5997 *98 H 4.3374 8.8781 115.2054 54.5276 28.2708 171.1734 99 R 4.2114 8.7080 125.4774 57.7366 30.5138 177.0662 100 Y 4.2837 7.9058 118.9812 56.3966 39.3590 173.6637 101 P 3.9670 0.0000 0.0000 64.6740 31.4671 176.3969 102 F 4.8626 6.1857 117.1089 55.1065 40.3963 174.9363 103 L 4.4243 8.6625 128.0882 55.0679 42.5386 176.8783 104 L 4.7758 10.4997 128.1803 54.2397 42.0973 177.7750 105 V 4.2835 7.5203 118.5430 61.4241 32.9087 173.8979 106 D 4.5934 8.7155 128.3958 56.7774 41.6045 177.1630 107 K 4.2021 7.6923 116.1490 55.5054 35.7327 174.1743 108 V 4.2813 8.6180 128.4140 61.8612 31.1095 175.2191 109 I 4.1815 8.4774 122.4579 63.0066 38.7406 175.4864 110 Y 4.8801 8.0924 122.9350 56.8062 42.5556 173.0515 111 M 4.8023 7.5454 124.7777 54.0995 35.9268 173.4640 112 Q 4.2625 8.8723 126.7884 53.4624 31.8771 172.5567 113 P 4.2825 0.0000 0.0000 64.2956 31.9461 175.2201 114 N 4.2378 9.0536 118.7376 54.6712 36.6494 174.7371 115 K 4.5834 8.0008 119.5499 56.1889 34.5475 179.8151 116 T 5.1508 7.5382 112.7860 61.0213 71.4765 171.4136 117 I 4.9850 8.4317 123.3890 59.7321 42.2301 173.3741 118 I 5.1829 9.7131 130.0995 59.9510 40.9802 174.9707 119 G 4.7235 9.3654 112.8024 45.7219 0.0000 170.7644 120 L 5.2598 8.5325 118.2675 54.9024 44.5691 174.6931 121 K 4.8320 9.2662 121.0142 54.9862 35.4676 175.1517 122 Q 4.4775 9.4640 128.4091 55.4293 29.2340 176.7858 123 V 4.0094 9.0833 126.7291 62.5325 31.6821 176.1190 124 S 4.8151 9.0035 125.0352 57.9463 63.6168 174.8920 125 T 4.3935 8.3164 110.0694 62.4813 69.1806 174.3929 126 N 4.9775 7.6851 120.5316 52.9778 39.6360 173.7003 127 E 3.8270 7.7732 118.1540 54.4099 30.7868 174.9135 128 P 3.8411 0.0000 0.0000 65.4714 31.2298 177.1935 129 F 4.7474 7.0127 110.3873 56.8909 37.7470 174.7103 130 F 5.2447 7.4843 119.1297 56.1737 41.5144 174.9132 *138 Q 3.8257 8.3115 121.8871 56.0605 29.1165 174.3285 139 I 4.9515 7.9396 124.7900 59.8508 41.6122 174.5892 140 M 4.4397 8.9552 126.8977 54.3903 32.5749 174.2280 141 P 4.1156 0.0000 0.0000 62.5542 32.3056 177.7035 142 G 2.6138 8.4276 110.4618 47.3562 0.0000 175.8502 143 V 3.7885 7.1359 120.6499 64.3154 31.6295 177.5317 144 L 4.0040 8.2436 118.6460 55.7207 41.5888 178.7268 145 Q 4.0749 7.6628 118.5211 58.4699 28.9920 177.8083 146 I 3.7571 7.7896 120.4620 64.5405 37.2130 177.5109 147 E 3.8242 7.8418 119.6901 59.5677 29.3044 178.5344 148 A 4.0055 7.9709 120.1564 55.5986 18.5164 179.6861 149 L 3.9332 8.1865 116.9266 57.7161 41.6256 179.7307 150 A 3.9240 8.4733 121.1738 55.0942 18.2520 179.6693 151 Q 3.8249 8.3799 116.9364 58.9930 28.7627 178.3923 152 L 3.8133 7.9197 121.0087 58.4445 42.0686 178.6036 153 A 3.8892 7.9624 120.3608 55.4448 18.1740 179.9250 154 G 3.0733 7.6543 103.7221 47.6163 0.0000 175.6968 155 I 3.5370 7.8047 121.5894 64.2598 37.2403 177.5015 156 L 3.9105 7.6541 119.7452 58.9645 41.9135 178.4854 157 C 4.0093 7.6120 115.2534 61.7446 28.3629 175.0855 158 L 3.9277 7.0188 120.0997 54.5556 41.7974 176.1608 *168 L 4.2976 8.1679 124.1409 55.1444 43.8028 174.8408 169 F 5.2765 8.7269 118.8592 55.6275 42.6522 174.7359 170 L 4.9768 9.3036 121.2058 52.8671 45.9780 175.9670 171 F 4.1992 9.2110 125.0558 58.3289 38.2786 174.3735 172 A 4.1203 9.0090 129.4656 52.6675 18.9105 177.5200 173 G 4.0372 6.7269 104.7469 46.1166 0.0000 172.2996 174 V 4.8371 7.8533 119.6527 59.7867 34.7738 174.3190 175 D 4.4781 8.8404 121.6589 52.8715 45.0147 174.5094 176 G 4.0143 8.2787 110.3632 46.3241 0.0000 173.2308 177 V 5.0021 7.0738 116.2945 60.3853 33.8029 175.8629 178 R 4.1762 7.9746 126.2337 54.2773 33.3122 174.8248 179 W 5.0844 8.5528 125.2016 55.4039 27.7979 176.3110 180 K 4.2760 8.5415 124.2510 58.5605 32.3373 176.8116 181 K 4.6864 7.9618 118.9156 54.2081 35.7654 174.0203 182 P 4.5364 0.0000 0.0000 62.0096 32.0774 176.1274 183 V 3.9516 8.4920 125.8731 62.5360 32.7312 175.0961 184 L 5.1546 9.3457 127.6268 51.9113 44.5274 174.1144 185 P 4.7602 0.0000 0.0000 63.3483 31.5435 176.2848 186 G 3.9623 8.5434 111.9350 45.4772 0.0000 173.4905 187 D 4.8622 8.6144 121.1800 53.5154 42.9422 175.7897 188 T 4.9843 8.3717 119.0067 61.7007 70.4991 173.8303 189 L 4.4572 9.1884 130.7516 55.1056 43.3622 175.5180 190 T 5.0640 8.9430 123.8603 62.5647 70.6917 173.9218 191 M 5.4694 9.6041 125.0471 53.7685 36.9152 174.1435 192 Q 5.7282 9.3367 122.2428 53.6030 33.1812 173.3720 193 A 5.4017 8.7361 126.8624 50.3044 22.7225 174.1911 194 N 5.3988 9.2048 118.6208 51.0824 42.1719 173.6614 195 L 4.3223 8.4486 126.3032 55.4937 42.0625 176.4088 196 I 4.3048 9.0787 128.5751 63.5928 38.0370 176.3554 197 S 4.8354 7.8061 114.1654 57.3354 66.4153 172.5968 198 F 5.3007 8.6187 121.9356 56.9455 42.7557 173.9737 199 K 4.6566 9.3043 124.3798 54.3457 35.1818 176.6481 200 S 5.0795 8.6267 123.8062 56.0474 63.0720 172.5273 201 S 4.5065 8.1847 127.9149 60.2109 69.5936 177.0820 202 L 4.2946 9.4790 117.0010 56.7513 41.2794 180.4793 203 G 4.7314 8.5581 106.8126 47.4612 0.0000 174.4893 204 I 4.8376 7.7407 123.9746 59.3111 39.6562 174.8613 205 A 5.2638 8.8732 126.9233 49.9897 22.7237 175.1073 206 K 5.7372 8.9763 119.9317 54.3446 36.2095 175.4506 207 L 5.4877 8.7628 122.5952 53.1050 46.5009 175.1011 208 S 5.0946 9.1110 114.8891 56.7994 66.2942 173.3307 209 G 4.5052 8.7721 107.0319 44.8213 0.0000 171.6685 210 V 4.8224 8.7238 120.8251 60.8713 35.4577 174.0507 211 G 4.4137 8.7966 114.4083 44.6220 0.0000 171.3635 212 Y 5.4859 9.4344 120.5091 56.1186 43.0027 174.7744 213 V 4.5172 8.8017 119.8797 61.5884 34.7232 175.1501 214 N 3.9200 9.7528 126.6898 54.6394 35.7704 175.2237 215 G 3.8398 8.5242 102.5818 45.7470 0.0000 173.8205 216 K 4.6540 7.7362 119.2037 53.7190 34.5936 175.8482 217 V 3.9115 8.6928 123.2583 63.6524 31.9385 175.5806 218 V 4.3734 8.8737 120.8057 61.9127 34.0863 175.6966 219 I 5.0224 7.3714 119.5974 59.4894 41.7020 173.2544 220 N 5.1618 8.8220 125.2420 51.4821 42.7239 173.6381 221 I 4.6827 8.5161 122.8656 59.8199 40.4507 176.0768 222 S 4.2491 8.9546 124.9949 61.0886 63.7212 174.7708 223 E 4.9423 8.4330 116.0551 55.5629 33.3074 173.6102 224 M 5.0700 9.4619 124.0676 54.0331 34.5817 174.8078 225 T 5.0747 9.6528 121.8776 62.0855 71.0633 173.9452 226 F 5.4974 9.5512 123.9622 55.6624 43.2074 173.9261 227 A 5.1253 9.4376 123.7351 49.7237 22.2443 175.8557 228 L 3.8058 7.7697 118.8454 55.4987 42.6026 177.8880 229 S 3.9646 9.0205 118.3968 59.2481 63.5847 172.3916 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 94 K 8.31 4.35 0.00 1.88 1.88 0.00 1.50 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.41 7.81 95 I 8.10 4.62 1.88 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 1.43 0.79 0.92 0.00 0.00 96 L 8.83 4.70 0.00 1.57 1.44 0.92 1.05 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 97 P 0.00 4.42 0.00 2.07 2.13 0.00 3.66 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 2.09 2.16 0.00 *98 H 8.88 4.34 0.00 3.00 3.17 0.00 7.20 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 8.71 4.21 0.00 1.90 2.07 0.00 3.27 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 100 Y 7.91 4.28 0.00 2.87 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 0.00 101 P 0.00 3.97 0.00 1.06 1.57 0.00 2.34 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.81 0.00 102 F 6.19 4.86 0.00 3.17 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 0.00 103 L 8.66 4.42 0.00 1.64 1.65 1.00 1.02 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 0.00 104 L 10.50 4.78 0.00 1.76 1.75 1.02 1.16 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 0.00 105 V 7.52 4.28 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 0.84 0.00 0.00 0.95 0.00 0.00 106 D 8.72 4.59 0.00 2.76 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 7.69 4.20 0.00 1.79 1.61 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.37 7.81 108 V 8.62 4.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.92 0.00 0.00 109 I 8.48 4.18 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.83 0.94 0.00 0.00 110 Y 8.09 4.88 0.00 3.08 2.81 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 0.00 111 M 7.55 4.80 0.00 1.83 1.72 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 112 Q 8.87 4.26 0.00 1.84 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 113 P 0.00 4.28 0.00 2.02 1.97 0.00 3.80 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 114 N 9.05 4.24 0.00 2.77 2.84 0.00 0.00 6.61 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 8.00 4.58 0.00 1.40 1.69 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 1.23 7.81 116 T 7.54 5.15 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 1.35 0.00 0.00 117 I 8.43 4.99 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.41 0.88 0.00 0.00 118 I 9.71 5.18 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.31 1.06 0.00 0.00 119 G 9.37 4.72 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 0.00 120 L 8.53 5.26 0.00 1.84 1.77 0.95 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 121 K 9.27 4.83 0.00 1.94 1.70 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.75 7.81 122 Q 9.46 4.48 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.88 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 123 V 9.08 4.01 2.41 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 1.31 0.00 0.00 1.08 0.00 0.00 124 S 9.00 4.82 0.00 3.93 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 0.00 125 T 8.32 4.39 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 126 N 7.69 4.98 0.00 2.62 2.73 0.00 0.00 7.01 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 0.00 127 E 7.77 3.83 0.00 1.16 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 1.47 1.47 0.00 128 P 0.00 3.84 0.00 0.49 0.49 0.00 3.05 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.51 0.00 129 F 7.01 4.75 0.00 3.10 3.28 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 0.00 130 F 7.48 5.24 0.00 3.06 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 *138 Q 8.31 3.83 0.00 1.71 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 139 I 7.94 4.95 1.90 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 1.25 0.66 1.00 0.00 0.00 140 M 8.96 4.44 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 141 P 0.00 4.12 0.00 1.90 2.02 0.00 3.35 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 1.72 1.80 0.00 142 G 8.43 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 0.00 143 V 7.14 3.79 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 0.74 0.00 0.00 0.91 0.00 0.00 144 L 8.24 4.00 0.00 1.31 1.25 0.09 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 7.66 4.07 0.00 2.52 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.89 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 146 I 7.79 3.76 2.20 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.29 1.17 0.00 0.00 147 E 7.84 3.82 0.00 1.83 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.35 0.00 148 A 7.97 4.01 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 0.00 149 L 8.19 3.93 0.00 1.99 1.73 0.88 0.71 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 0.00 150 A 8.47 3.92 0.95 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 0.00 151 Q 8.38 3.82 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.59 0.00 152 L 7.92 3.81 0.00 1.92 1.63 0.95 0.88 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 0.00 153 A 7.96 3.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 G 7.65 3.07 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 0.00 155 I 7.80 3.54 1.90 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 1.53 0.80 0.86 0.00 0.00 156 L 7.65 3.91 0.00 1.68 1.69 0.85 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 157 C 7.61 4.01 0.00 2.45 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 0.00 0.00 0.00 0.00 158 L 7.02 3.93 0.00 1.76 1.59 0.96 0.98 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 *168 L 8.17 4.30 0.00 1.73 1.47 1.01 0.99 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 0.00 169 F 8.73 5.28 0.00 2.89 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 0.00 170 L 9.30 4.98 0.00 1.57 1.59 0.94 1.07 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 0.00 171 F 9.21 4.20 0.00 2.97 2.89 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 0.00 172 A 9.01 4.12 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 0.00 173 G 6.73 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 0.00 174 V 7.85 4.84 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 0.65 0.00 0.00 1.02 0.00 0.00 175 D 8.84 4.48 0.00 2.71 2.43 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 0.00 176 G 8.28 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 0.00 177 V 7.07 5.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.76 0.00 0.00 178 R 7.97 4.18 0.00 1.58 1.68 0.00 3.26 0.00 0.00 3.22 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 179 W 8.55 5.08 0.00 3.40 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.54 4.28 0.00 1.66 1.90 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.42 7.81 181 K 7.96 4.69 0.00 1.80 1.67 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.46 7.81 182 P 0.00 4.54 0.00 2.00 2.00 0.00 3.76 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 2.10 0.00 183 V 8.49 3.95 2.14 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 1.06 0.00 0.00 0.99 0.00 0.00 184 L 9.35 5.15 0.00 1.79 1.55 0.94 0.94 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 0.00 185 P 0.00 4.76 0.00 2.07 2.30 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.41 0.00 186 G 8.54 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 0.00 187 D 8.61 4.86 0.00 2.90 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 0.00 188 T 8.37 4.98 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 1.25 0.00 0.00 189 L 9.19 4.46 0.00 1.79 1.61 0.98 0.69 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 0.00 190 T 8.94 5.06 4.42 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 1.29 0.00 0.00 191 M 9.60 5.47 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.49 0.00 192 Q 9.34 5.73 0.00 2.23 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 2.35 0.00 193 A 8.74 5.40 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 0.00 194 N 9.20 5.40 0.00 2.62 2.71 0.00 0.00 6.53 6.77 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 0.00 195 L 8.45 4.32 0.00 1.68 1.62 1.05 1.28 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 0.00 196 I 9.08 4.30 2.11 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 1.31 0.88 0.94 0.00 0.00 197 S 7.81 4.84 0.00 3.91 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 8.62 5.30 0.00 3.10 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 K 9.30 4.66 0.00 1.80 1.77 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.67 7.81 200 S 8.63 5.08 0.00 4.02 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 0.00 201 S 8.18 4.51 0.00 3.86 3.58 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 0.00 202 L 9.48 4.29 0.00 1.61 1.62 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.56 4.73 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 0.00 204 I 7.74 4.84 1.98 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 1.16 0.78 0.93 0.00 0.00 205 A 8.87 5.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 K 8.98 5.74 0.00 1.85 1.93 0.00 1.55 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.28 7.81 207 L 8.76 5.49 0.00 1.64 1.66 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 208 S 9.11 5.09 0.00 3.96 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 0.00 209 G 8.77 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 0.00 210 V 8.72 4.82 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.88 0.00 0.00 211 G 8.80 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 Y 9.43 5.49 0.00 2.83 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 0.00 213 V 8.80 4.52 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 1.03 0.00 0.00 1.00 0.00 0.00 214 N 9.75 3.92 0.00 2.94 2.91 0.00 0.00 7.18 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 8.52 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 0.00 216 K 7.74 4.65 0.00 2.06 1.75 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.37 7.81 217 V 8.69 3.91 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 0.72 0.00 0.00 0.93 0.00 0.00 218 V 8.87 4.37 2.32 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 0.89 0.00 0.00 1.02 0.00 0.00 219 I 7.37 5.02 2.17 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.35 0.96 0.00 0.00 220 N 8.82 5.16 0.00 2.52 2.52 0.00 0.00 6.61 7.29 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 0.00 221 I 8.52 4.68 1.92 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 1.10 0.75 0.90 0.00 0.00 222 S 8.95 4.25 0.00 3.94 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 0.00 223 E 8.43 4.94 0.00 2.03 2.01 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 2.19 2.29 0.00 224 M 9.46 5.07 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.61 0.00 225 T 9.65 5.07 4.18 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 1.23 0.00 0.00 226 F 9.55 5.50 0.00 3.11 3.28 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 0.00 227 A 9.44 5.13 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 0.00 228 L 7.77 3.81 0.00 1.50 1.45 -0.01 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 229 S 9.02 3.96 0.00 3.84 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 * Residues marked with a * may have inaccurate shift predictions.