NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 98 V 4.0296 8.0544 114.0483 60.9288 33.1492 175.3073 99 R 3.6293 8.4640 121.6278 58.5496 30.0356 174.9754 100 Y 5.0597 7.5430 113.2205 56.3130 41.8287 174.9351 101 R 4.0010 8.8162 123.5879 58.1045 30.6654 177.2666 102 F 4.9816 7.7314 111.7293 56.8363 41.3368 175.2058 103 L 3.9168 8.1868 122.2236 55.9929 41.9582 176.3904 104 R 4.3616 8.2584 122.9925 55.6478 31.6148 175.7752 105 L 4.7615 7.8067 119.8984 55.0653 42.3072 176.4253 106 A 4.9411 9.0707 124.5018 49.5693 21.6371 173.6417 107 P 4.1775 0.0000 0.0000 62.6635 32.2472 177.2480 108 D 4.5756 8.7075 122.4996 55.5050 41.4933 176.9421 109 E 3.1714 7.2817 113.2100 57.0053 28.4373 174.1107 *116 A 4.3520 8.4570 126.0161 52.4940 20.0525 175.8880 117 E 4.6539 9.2228 121.0468 54.7300 32.6732 171.7240 118 S 5.1319 8.6321 119.4100 55.7309 64.3453 172.9379 119 R 4.5647 9.0801 127.4764 54.4909 32.5991 174.2655 120 I 4.2224 8.3607 127.6698 61.0038 37.1884 175.7201 121 L 4.4028 8.7131 128.5727 57.0908 42.5575 177.1535 122 E 4.7254 7.7939 113.7801 55.7146 32.8208 174.6004 123 C 4.7558 8.3506 121.7204 58.7794 34.0633 172.8381 124 R 4.7151 9.0521 126.4211 54.9202 33.7711 173.6167 125 R 5.1723 8.5183 123.4777 55.0350 31.8755 175.4366 126 L 4.7173 8.9317 124.9083 54.8365 44.7029 175.5743 127 R 4.5417 8.5241 119.8906 56.4908 30.0353 175.8073 128 A 4.1132 8.9549 126.9157 50.5996 18.8836 176.0379 129 P 4.2414 0.0000 0.0000 62.4832 32.5387 177.2342 130 A 4.0122 8.7442 124.6981 56.2587 18.1748 180.7898 131 E 3.9514 7.9167 116.0735 60.8686 29.8933 181.4800 132 I 3.6494 7.2624 118.9013 64.4055 37.3089 178.1769 133 A 3.9915 8.0235 121.6633 54.8296 18.0772 179.6994 134 R 3.7476 7.8602 116.8744 59.6618 30.0037 178.6998 135 A 4.0023 7.6993 119.1197 54.6149 18.4788 178.6867 136 L 4.2290 7.8617 114.4902 53.7055 43.0058 176.2265 137 E 3.7723 7.5935 117.4133 57.3828 27.3506 174.1564 138 L 4.7053 8.0946 119.7411 53.3802 44.2069 178.3286 139 R 4.0733 8.5686 119.0444 55.9436 29.9580 177.3044 140 A 4.1603 8.3040 122.2252 53.7616 18.8552 178.3531 141 G 3.8994 8.8806 109.9722 45.3583 0.0000 173.2061 142 E 4.0730 7.6935 121.0120 56.4767 31.0019 176.4323 143 T 4.5628 8.5878 122.6023 63.9956 69.6583 173.6925 144 V 4.9181 9.1010 119.1900 59.5389 36.1387 174.5210 145 V 4.5748 8.5280 123.1630 61.7816 33.2875 174.4721 146 T 4.7625 9.0913 122.5242 60.1771 70.3499 172.5489 147 I 4.8544 8.1153 128.1663 59.3773 40.9280 174.2108 148 R 5.0597 8.4212 126.6961 54.5348 32.5552 174.8006 149 R 5.0714 9.0311 121.5794 54.8427 33.8510 173.2498 150 Q 5.0196 9.0018 121.3285 54.3260 31.9990 173.9323 151 L 5.0939 8.7198 126.3581 53.4936 44.2820 176.0120 152 S 4.7106 8.7487 120.1724 56.0475 66.7843 173.6157 *154 N 4.2487 8.3889 115.6761 54.5978 40.1005 173.8356 155 H 3.8306 7.9892 110.2183 55.2248 24.9629 172.8397 *157 P 4.4575 0.0000 0.0000 62.9976 32.9549 177.2141 158 T 4.5087 9.0843 117.4573 63.6841 72.0578 174.1298 159 V 4.6787 7.4601 119.5478 60.8453 35.4791 174.3105 160 I 4.7973 8.6602 127.9331 59.6785 39.8804 174.0960 161 D 5.4244 9.1410 127.4906 52.5179 43.8339 174.9655 162 D 4.9324 9.0142 122.6651 52.3687 43.9400 175.1960 163 L 5.2106 8.3771 122.3531 52.6422 46.1567 175.5410 164 W 5.3505 9.3958 121.6503 54.9976 32.9358 174.4297 165 L 5.1099 8.9064 123.8429 51.8299 45.4794 174.3869 166 P 4.6148 0.0000 0.0000 62.4410 32.3358 177.8107 167 G 3.6687 8.8681 109.7613 47.9450 0.0000 175.9877 168 T 3.8762 7.9048 110.8970 64.5448 68.7994 175.1501 169 H 4.6347 7.6156 115.5907 55.3864 29.5432 175.1601 170 F 4.2864 7.6350 119.8917 56.6320 40.0844 174.9045 171 R 4.2278 8.1829 120.1822 57.8847 30.1228 177.3577 172 G 4.0335 9.1165 111.4706 45.0549 0.0000 173.6149 173 L 4.4637 7.7511 121.8814 54.5738 40.7189 176.0217 174 T 4.7574 7.9498 115.2918 58.6778 73.4725 174.1988 175 L 4.0272 8.5132 124.4166 58.9121 41.9217 179.3432 176 E 4.0065 8.1298 117.8052 60.9369 29.7673 181.0207 177 L 4.1704 8.0570 121.6025 58.1482 42.0252 179.2198 178 L 4.1046 7.9536 117.5954 57.3848 41.5510 178.7928 179 T 4.2624 7.6173 107.8366 63.3796 69.4679 176.6426 180 A 4.0976 8.1042 123.3514 53.1374 18.8130 177.4893 181 S 4.6859 7.3911 113.9092 57.2125 64.7705 175.5847 182 K 4.0783 8.5222 123.6902 56.7555 31.9511 176.7115 183 A 4.2320 7.3058 119.2806 51.3515 19.0750 176.0258 184 P 4.1957 0.0000 0.0000 62.9497 33.1704 177.6299 185 L 3.4645 8.1977 121.5247 58.0918 41.7309 179.5023 186 Y 4.0897 7.4222 116.1074 60.9795 37.7869 178.9097 187 G 3.6407 7.9451 106.2706 47.3961 0.0000 175.5105 188 L 4.0318 8.0089 122.7012 58.2284 42.1802 179.0487 189 F 5.1230 8.3912 118.1291 60.9173 38.8815 177.6617 190 E 4.2599 8.4777 117.8618 59.5242 29.2193 179.1644 191 S 4.3473 8.1987 113.4480 60.3256 63.3269 175.4782 192 E 4.1404 8.5256 120.9491 56.7082 29.9472 176.3401 193 F 4.5895 7.9776 114.0065 55.9877 40.9796 175.4820 194 G 4.0811 8.3562 107.8376 45.3951 0.0000 173.6102 195 V 4.2837 8.1249 120.2905 61.1663 31.9333 174.5941 196 S 4.9773 8.3613 126.9386 57.4759 63.6954 174.4312 *198 V 4.1546 8.2634 108.8782 61.2035 33.7541 176.0164 199 R 4.9319 8.1641 118.9634 54.6720 33.9019 173.8203 200 A 5.1648 8.4884 124.8677 50.2016 22.2961 174.8283 201 D 4.9985 9.4390 121.3870 52.5821 43.4439 175.4276 202 E 5.3349 8.8095 121.6947 54.4360 33.6085 175.3108 203 K 4.5847 9.1283 121.1901 54.6486 35.5945 175.1505 204 L 5.1337 8.4986 124.4666 53.0718 44.0893 176.0659 205 R 4.7252 8.7853 120.5435 54.5062 35.1658 173.6901 206 A 5.0045 8.4733 123.1540 51.0339 20.2566 177.0113 207 V 4.6087 8.7216 114.8398 59.2642 36.6623 174.5926 208 A 4.7268 8.5272 123.8909 51.0903 19.6178 177.3589 209 A 4.1316 9.0638 125.3404 52.2047 19.4107 177.7965 210 S 4.5783 8.7474 117.2860 57.1373 64.2641 173.2952 211 P 4.1905 0.0000 0.0000 66.0428 30.9881 178.2933 212 E 4.0720 8.0314 116.6015 59.3287 30.0417 178.3014 213 I 3.9943 7.7904 119.2507 63.4892 37.2996 177.9128 214 A 4.0103 8.2116 122.1576 55.0677 18.0988 178.0487 215 P 4.2056 0.0000 0.0000 65.4944 31.2001 178.5471 216 L 4.1228 7.8827 116.3863 56.4075 41.7559 177.5051 217 L 4.4752 7.7754 116.3966 53.7992 42.3031 176.2542 218 G 3.8532 7.8334 106.7941 46.6945 0.0000 173.8673 219 V 4.5777 7.7952 111.2812 58.6090 36.0035 175.2696 220 E 4.2160 8.4505 118.9332 55.0266 30.3599 174.5272 221 P 4.5050 0.0000 0.0000 64.6437 31.8057 175.6692 222 G 4.0839 9.1262 111.2217 45.4060 0.0000 174.2825 223 R 3.9509 7.9270 120.2556 56.2590 31.0663 174.2835 224 P 4.8815 0.0000 0.0000 62.9504 31.9131 175.6532 225 L 5.0114 8.8891 123.8720 52.7043 46.1048 175.4028 226 L 4.6110 8.8364 124.7597 54.3612 43.4324 175.0374 227 Q 4.8936 9.3610 129.2119 54.7759 30.8912 174.2507 228 V 4.5610 8.9120 127.6053 61.4377 33.8345 173.9946 229 D 5.3626 9.0141 129.7323 52.8592 42.5435 175.6428 230 R 5.1277 9.1476 124.8485 54.4251 33.4772 174.2447 231 I 4.8529 8.7874 126.6252 59.6888 39.8431 174.5894 232 S 5.1679 8.8105 123.4187 57.0656 65.3579 172.8571 233 Y 4.9165 9.3108 121.0427 56.7497 41.7935 175.3461 234 T 4.8935 8.6326 118.0499 59.5424 70.8608 172.5728 235 Y 3.8502 8.4560 118.8679 60.4618 37.9766 176.8784 236 G 4.0067 8.9479 112.8160 45.0186 0.0000 172.5043 237 D 4.3545 7.9425 115.8140 54.8443 38.6800 174.1547 238 R 4.4262 7.6049 117.0772 54.3078 30.6924 175.4050 239 P 4.6342 0.0000 0.0000 61.8188 32.2584 174.9683 *241 E 4.2971 8.3234 118.4937 56.1261 31.1576 174.0975 242 V 4.8518 8.5842 126.0256 61.1739 34.3159 174.2324 243 R 5.1377 9.3112 127.8100 54.7017 33.6301 173.3519 244 R 5.0371 9.7683 127.4952 54.7497 32.3312 174.4384 245 G 4.6605 9.4228 114.7315 44.1208 0.0000 171.5681 246 L 5.4824 9.2223 124.3734 53.0756 44.5561 174.9352 247 Y 5.1033 9.2694 122.1373 56.0152 40.8674 174.7095 248 L 4.6221 9.0627 127.8522 53.8562 42.5746 177.4691 249 T 4.9869 8.1021 119.9120 60.4068 68.8920 174.7827 250 D 4.5665 8.0426 121.5747 57.1111 42.0382 177.4244 251 H 4.9998 8.2057 112.7011 55.4631 31.0785 173.0440 252 Y 5.2605 7.9435 115.5872 56.5258 42.7196 173.5279 253 H 5.0533 9.2352 116.8877 54.1847 33.0859 171.3026 254 Y 5.0699 8.6624 120.2694 56.1984 39.3702 174.7999 255 R 4.5512 8.6883 125.0032 55.5588 30.9418 175.8711 256 N 4.9391 8.6870 120.2991 52.1384 42.0987 173.2289 257 S 4.8484 8.6576 119.8979 56.3997 65.1721 173.2065 258 L 4.7727 8.2874 122.8685 53.0406 44.1094 176.2396 259 N 4.5420 8.6911 118.6322 53.5688 38.6574 175.0881 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 98 V 8.05 4.03 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 0.83 0.00 0.00 0.89 0.00 0.00 99 R 8.46 3.63 0.00 1.50 1.36 0.00 2.99 0.00 0.00 2.99 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.50 0.00 100 Y 7.54 5.06 0.00 3.00 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 0.00 101 R 8.82 4.00 0.00 1.46 1.39 0.00 2.76 0.00 0.00 2.84 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 102 F 7.73 4.98 0.00 3.02 2.87 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 0.00 0.00 0.00 103 L 8.19 3.92 0.00 1.40 0.95 0.89 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 104 R 8.26 4.36 0.00 0.67 1.24 0.00 3.26 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.71 0.00 105 L 7.81 4.76 0.00 1.46 1.55 0.66 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 106 A 9.07 4.94 1.13 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 0.00 107 P 0.00 4.18 0.00 1.99 1.96 0.00 3.77 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 108 D 8.71 4.58 0.00 2.53 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 0.00 109 E 7.28 3.17 0.00 2.08 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 2.22 2.19 0.00 *116 A 8.46 4.35 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 0.00 117 E 9.22 4.65 0.00 1.60 1.81 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 2.14 2.09 0.00 118 S 8.63 5.13 0.00 3.82 3.73 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 0.00 119 R 9.08 4.56 0.00 1.81 1.69 0.00 3.11 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 1.47 1.54 0.00 120 I 8.36 4.22 1.84 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 1.30 0.90 0.87 0.00 0.00 121 L 8.71 4.40 0.00 1.65 1.67 0.88 0.68 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 0.00 122 E 7.79 4.73 0.00 1.95 1.94 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 2.25 2.20 0.00 123 C 8.35 4.76 0.00 2.91 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 0.00 124 R 9.05 4.72 0.00 1.83 1.63 0.00 3.12 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 125 R 8.52 5.17 0.00 1.73 1.84 0.00 3.27 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 126 L 8.93 4.72 0.00 1.69 1.75 1.03 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 127 R 8.52 4.54 0.00 1.62 1.77 0.00 3.27 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.21 0.00 128 A 8.95 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.24 0.00 1.99 1.92 0.00 3.48 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.10 0.00 130 A 8.74 4.01 1.27 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 0.00 0.00 0.00 131 E 7.92 3.95 0.00 1.99 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 1.96 0.00 132 I 7.26 3.65 1.74 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 -0.22 0.74 0.00 0.00 133 A 8.02 3.99 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 0.00 134 R 7.86 3.75 0.00 1.89 2.13 0.00 3.06 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 135 A 7.70 4.00 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 0.00 136 L 7.86 4.23 0.00 1.70 1.72 0.95 0.72 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 0.00 137 E 7.59 3.77 0.00 2.11 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 2.28 2.29 0.00 138 L 8.09 4.71 0.00 1.57 1.71 0.94 0.93 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 0.00 139 R 8.57 4.07 0.00 1.75 1.81 0.00 3.27 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.46 0.00 140 A 8.30 4.16 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 0.00 141 G 8.88 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 0.00 0.00 0.00 142 E 7.69 4.07 0.00 2.27 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 0.00 2.32 2.31 0.00 143 T 8.59 4.56 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 1.23 0.00 0.00 144 V 9.10 4.92 2.26 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 0.76 0.00 0.00 1.11 0.00 0.00 145 V 8.53 4.57 1.92 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 0.89 0.00 0.00 0.91 0.00 0.00 146 T 9.09 4.76 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 1.16 0.00 0.00 147 I 8.12 4.85 1.70 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 1.02 0.37 0.86 0.00 0.00 148 R 8.42 5.06 0.00 1.87 1.64 0.00 3.00 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.58 0.00 149 R 9.03 5.07 0.00 1.98 1.86 0.00 2.71 0.00 0.00 3.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 150 Q 9.00 5.02 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 151 L 8.72 5.09 0.00 1.42 1.40 0.74 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.75 4.71 0.00 3.66 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.39 4.25 0.00 2.77 2.89 0.00 0.00 6.93 7.89 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 0.00 155 H 7.99 3.83 0.00 3.39 3.38 0.00 5.78 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *157 P 0.00 4.46 0.00 2.24 2.08 0.00 3.06 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 1.88 2.06 0.00 158 T 9.08 4.51 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 1.03 0.00 0.00 159 V 7.46 4.68 1.72 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 0.33 0.00 0.00 0.21 0.00 0.00 160 I 8.66 4.80 1.84 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 1.19 0.75 0.91 0.00 0.00 161 D 9.14 5.42 0.00 2.42 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 0.00 162 D 9.01 4.93 0.00 2.44 1.67 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 0.00 163 L 8.38 5.21 0.00 1.28 1.35 0.83 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 164 W 9.40 5.35 0.00 3.14 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 0.00 165 L 8.91 5.11 0.00 0.99 0.59 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 166 P 0.00 4.61 0.00 2.33 2.26 0.00 3.82 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.09 0.00 167 G 8.87 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 0.00 168 T 7.90 3.88 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 1.17 0.00 0.00 169 H 7.62 4.63 0.00 2.83 2.87 0.00 5.79 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 F 7.63 4.29 0.00 2.97 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 0.00 171 R 8.18 4.23 0.00 1.86 1.94 0.00 3.18 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 172 G 9.12 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 173 L 7.75 4.46 0.00 1.43 1.70 1.11 0.50 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 0.00 174 T 7.95 4.76 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 1.26 0.00 0.00 175 L 8.51 4.03 0.00 1.77 1.71 0.90 0.90 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 0.00 176 E 8.13 4.01 0.00 2.01 1.94 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 2.31 1.94 0.00 177 L 8.06 4.17 0.00 1.85 1.97 0.96 0.83 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 0.00 178 L 7.95 4.10 0.00 1.81 1.72 0.92 0.73 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 0.00 179 T 7.62 4.26 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 1.28 0.00 0.00 180 A 8.10 4.10 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 0.00 181 S 7.39 4.69 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 0.00 182 K 8.52 4.08 0.00 1.80 1.77 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.00 7.81 183 A 7.31 4.23 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 0.00 184 P 0.00 4.20 0.00 2.13 2.02 0.00 3.57 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 2.08 2.17 0.00 185 L 8.20 3.46 0.00 1.07 0.66 0.73 0.74 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 0.00 186 Y 7.42 4.09 0.00 2.97 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 0.00 187 G 7.95 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 0.00 188 L 8.01 4.03 0.00 1.85 1.79 1.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 189 F 8.39 5.12 0.00 3.43 3.38 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 0.00 190 E 8.48 4.26 0.00 2.33 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 2.60 2.76 0.00 191 S 8.20 4.35 0.00 3.90 3.92 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 0.00 192 E 8.53 4.14 0.00 1.75 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 0.00 1.68 1.47 0.00 193 F 7.98 4.59 0.00 3.37 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.36 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 V 8.12 4.28 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 0.97 0.00 0.00 0.79 0.00 0.00 196 S 8.36 4.98 0.00 4.04 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 *198 V 8.26 4.15 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 -0.33 0.00 0.00 0.82 0.00 0.00 199 R 8.16 4.93 0.00 1.78 1.73 0.00 3.07 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 200 A 8.49 5.16 0.17 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 0.00 0.00 201 D 9.44 5.00 0.00 2.67 2.60 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 0.00 202 E 8.81 5.33 0.00 1.79 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 0.00 2.17 2.23 0.00 203 K 9.13 4.58 0.00 1.59 1.63 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.36 7.81 204 L 8.50 5.13 0.00 1.27 1.31 0.69 -0.25 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 0.00 205 R 8.79 4.73 0.00 1.67 1.71 0.00 3.09 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 206 A 8.47 5.00 1.19 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 0.00 0.00 207 V 8.72 4.61 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 0.74 0.00 0.00 1.00 0.00 0.00 208 A 8.53 4.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 A 9.06 4.13 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 0.00 210 S 8.75 4.58 0.00 4.03 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 0.00 211 P 0.00 4.19 0.00 2.04 2.19 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.17 0.00 212 E 8.03 4.07 0.00 1.97 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 2.30 2.40 0.00 213 I 7.79 3.99 1.89 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 1.47 0.99 0.92 0.00 0.00 214 A 8.21 4.01 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 0.00 215 P 0.00 4.21 0.00 2.17 2.11 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 216 L 7.88 4.12 0.00 1.74 1.70 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.78 4.48 0.00 1.61 1.68 0.93 0.89 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 0.00 218 G 7.83 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 0.00 219 V 7.80 4.58 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 0.78 0.00 0.00 0.98 0.00 0.00 220 E 8.45 4.22 0.00 2.12 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 0.00 2.36 2.28 0.00 221 P 0.00 4.51 0.00 2.06 2.07 0.00 3.65 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 222 G 9.13 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 R 7.93 3.95 0.00 2.20 1.93 0.00 3.16 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 224 P 0.00 4.88 0.00 1.98 1.99 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 225 L 8.89 5.01 0.00 1.58 1.66 0.95 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 226 L 8.84 4.61 0.00 1.73 1.53 0.76 0.71 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 0.00 227 Q 9.36 4.89 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.52 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 228 V 8.91 4.56 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 0.99 0.00 0.00 0.37 0.00 0.00 229 D 9.01 5.36 0.00 2.61 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 0.00 230 R 9.15 5.13 0.00 1.84 1.93 0.00 3.17 0.00 0.00 2.95 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 231 I 8.79 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 1.16 0.52 0.43 0.00 0.00 232 S 8.81 5.17 0.00 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 0.00 233 Y 9.31 4.92 0.00 2.87 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 0.00 234 T 8.63 4.89 4.35 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 1.35 0.00 0.00 235 Y 8.46 3.85 0.00 3.11 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 0.00 236 G 8.95 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 0.00 237 D 7.94 4.35 0.00 2.78 2.67 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 0.00 238 R 7.60 4.43 0.00 2.01 1.93 0.00 3.50 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.83 0.00 239 P 0.00 4.63 0.00 2.00 1.70 0.00 3.50 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.03 0.00 *241 E 8.32 4.30 0.00 2.13 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 2.35 2.30 0.00 242 V 8.58 4.85 2.29 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 0.99 0.00 0.00 0.88 0.00 0.00 243 R 9.31 5.14 0.00 1.97 1.82 0.00 3.26 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 244 R 9.77 5.04 0.00 2.10 2.01 0.00 3.30 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 245 G 9.42 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 0.00 246 L 9.22 5.48 0.00 1.57 1.63 0.96 0.82 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 0.00 247 Y 9.27 5.10 0.00 2.90 2.86 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 0.00 248 L 9.06 4.62 0.00 1.63 1.63 0.95 0.93 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 0.00 249 T 8.10 4.99 4.46 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 1.33 0.00 0.00 250 D 8.04 4.57 0.00 2.61 2.60 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 0.00 251 H 8.21 5.00 0.00 3.16 3.07 0.00 5.56 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 Y 7.94 5.26 0.00 2.89 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 0.00 253 H 9.24 5.05 0.00 3.21 3.44 0.00 5.25 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 Y 8.66 5.07 0.00 2.89 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 0.00 255 R 8.69 4.55 0.00 1.87 1.97 0.00 3.11 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.50 0.00 256 N 8.69 4.94 0.00 2.90 2.80 0.00 0.00 6.97 7.63 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 0.00 257 S 8.66 4.85 0.00 4.01 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 0.00 258 L 8.29 4.77 0.00 1.63 1.60 0.93 1.07 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 0.00 259 N 8.69 4.54 0.00 2.71 2.73 0.00 0.00 6.85 7.56 0.00 0.00 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.