NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 100 R 4.4208 8.1133 120.9866 56.5485 30.7906 173.5523 101 I 3.8651 8.0358 125.6385 60.0323 38.0147 170.4177 102 V 4.1738 9.0315 126.9078 61.7087 34.6130 174.9180 103 E 4.3924 8.7814 127.2622 55.9169 29.9222 173.2345 104 I 4.2594 8.2991 128.4033 59.0960 38.2100 173.6040 105 P 5.2365 0.0000 0.0000 62.1123 33.2931 175.3381 106 V 5.2348 8.9611 117.4965 58.1172 35.8361 174.6204 107 C 4.4837 8.3383 125.6626 59.6093 32.6014 171.4796 108 Y 4.9378 8.5261 122.9105 57.3043 40.4681 177.4694 109 G 3.9505 9.7130 113.4391 45.6491 0.0000 173.9969 110 G 3.9042 8.7506 109.1682 46.9239 0.0000 176.1422 111 E 3.9880 8.6186 116.5252 58.6899 30.1140 176.0828 112 F 4.3837 7.9297 116.2723 60.1100 39.7086 176.1952 113 G 4.1743 7.7456 109.8409 42.3911 0.0000 171.5509 114 P 4.2418 0.0000 0.0000 65.5840 32.1865 177.0448 115 D 5.0144 8.3363 117.6992 53.7115 41.7545 178.0543 116 L 4.1277 8.1913 126.4679 58.6283 41.8792 178.8642 117 E 4.0825 8.2519 120.6660 61.5127 29.8037 182.9041 118 E 4.2180 8.0816 119.0401 60.9496 29.5144 180.6257 119 V 3.7328 7.8251 119.4647 65.9705 31.4116 177.9275 120 A 4.0618 8.1441 122.3786 56.1503 18.2975 179.6905 121 K 3.8045 8.7917 122.4974 60.0642 31.3913 180.6923 122 I 3.8554 8.1087 121.2881 64.1578 37.8893 178.3357 123 N 4.6777 7.8617 117.3685 57.4503 39.4491 176.6028 124 Q 3.1861 7.6775 113.8661 56.0472 26.0153 175.4203 125 L 4.9271 8.0832 121.8357 52.7192 46.7050 177.1821 126 S 4.7386 8.1935 114.5839 56.5152 66.1409 173.1003 127 P 4.3629 0.0000 0.0000 67.2493 30.2602 179.1730 128 E 4.1095 8.2548 119.6085 61.0817 29.8126 181.6758 129 E 4.2593 7.7605 119.3180 60.6643 29.8962 182.7499 130 V 3.7998 8.2489 119.8981 66.0765 31.3587 177.9424 131 I 3.1188 7.5450 119.3140 64.2653 37.0840 177.6126 132 D 4.5109 7.5831 117.8534 54.7111 39.3401 178.3910 133 I 3.8267 7.5864 122.1618 64.8753 37.3288 177.3392 134 H 4.4366 8.0363 120.3726 59.2695 29.4931 177.3577 135 T 4.3621 8.2653 118.4125 66.7509 68.3777 176.8306 136 N 4.6760 7.8349 120.5719 55.5333 37.8036 180.3206 137 G 3.6036 7.3379 107.3744 45.5796 0.0000 172.9660 138 E 4.1814 7.3535 119.3502 54.8537 31.6116 173.6660 139 Y 4.9829 8.5323 125.8190 56.1470 40.7538 175.3405 140 V 4.4085 8.5717 125.4455 62.1410 33.1265 175.2517 141 V 4.5016 8.7372 129.2966 63.1743 32.9096 174.4646 142 Y 5.3283 9.3421 125.1682 56.1471 42.1903 173.2112 143 M 5.6135 8.7164 117.7134 54.2743 36.5163 174.6014 144 L 4.5645 8.5763 118.5979 55.5537 43.4672 175.8945 145 G 4.0381 8.8338 114.6814 46.6785 0.0000 172.9943 *148 P 4.2367 0.0000 0.0000 58.4464 33.5792 177.0335 149 G 3.9803 8.4788 106.7103 45.5075 0.0000 172.0874 150 F 4.5273 7.9021 120.7229 55.5182 39.4689 174.2772 151 P 4.4084 0.0000 0.0000 61.0057 30.8840 174.2811 152 F 4.2491 8.5404 126.7521 58.1468 40.3891 174.1271 153 L 5.1959 8.7944 122.0456 52.9756 44.1666 176.1404 154 G 4.1531 9.7845 113.0176 46.6476 0.0000 172.7466 155 G 3.9146 9.4627 109.9687 45.1226 0.0000 174.1968 156 M 4.4545 8.3492 122.7906 55.9671 33.1065 176.4693 157 S 4.2998 8.8725 124.1579 58.4481 63.3139 175.4977 158 K 4.1023 8.9750 129.4874 57.2364 31.6376 176.8556 159 R 4.1828 8.0377 114.4373 58.5927 29.4630 181.4441 160 I 4.4285 7.5801 114.6511 61.2528 37.7856 175.4182 161 A 4.3882 7.3385 122.3616 53.0669 18.9972 177.4875 162 A 4.5805 8.8203 118.6007 50.3371 23.0574 174.5891 163 P 4.5737 0.0000 0.0000 62.6961 32.7810 177.0614 164 R 4.1692 8.3810 119.6708 55.5262 30.0826 177.6911 165 K 3.8862 8.7552 121.8715 56.4581 32.6748 176.8172 166 S 4.2175 9.0219 121.3811 61.5549 62.7260 175.6032 167 S 4.8167 7.6857 115.7146 54.6269 64.6025 173.7700 168 P 4.5815 0.0000 0.0000 61.5469 31.9489 176.6729 169 R 4.1581 8.2384 120.8295 55.3347 30.6772 176.2816 170 P 4.2253 0.0000 0.0000 65.4572 31.6290 176.4171 171 S 4.4255 7.4103 109.7449 57.5456 64.9195 174.7513 172 I 4.1171 8.7685 130.6337 59.8297 38.5129 174.1116 173 P 4.6143 0.0000 0.0000 62.1739 32.6238 175.7480 174 A 4.1418 8.4879 124.8432 54.1363 18.8202 178.2517 175 G 3.9634 9.8442 111.2684 45.0392 0.0000 173.7257 176 S 4.7414 7.6916 115.7649 58.9882 64.5893 173.6936 177 V 4.7838 8.6437 120.4564 61.4666 34.1778 174.5716 178 G 5.0057 9.6045 114.6786 44.5495 0.0000 170.9735 179 I 4.9278 8.6213 119.6119 59.1690 40.9092 174.7963 180 A 4.0310 8.0117 129.1204 50.8464 21.4417 177.2879 181 G 3.8435 10.1506 119.4095 47.6806 0.0000 174.8555 182 L 4.9808 8.8453 118.8723 53.7471 42.4858 176.9504 183 Q 4.7355 7.9563 118.9408 55.1402 31.4058 175.7667 184 T 5.0679 8.6901 116.7007 59.3736 69.8976 172.7995 185 G 4.6278 7.8373 112.5056 44.7565 0.0000 171.6040 186 V 4.5719 6.6201 118.9736 61.0602 33.5021 175.2294 187 Y 4.3888 8.3266 123.1699 55.7985 38.2100 175.1142 188 P 4.3675 0.0000 0.0000 64.9237 31.6732 176.7839 189 I 4.5845 7.3148 108.7018 58.5579 40.7005 175.5794 190 S 4.8091 8.8233 120.3155 59.6134 61.2953 174.0096 191 T 4.6810 8.0898 120.9019 58.8091 71.3359 170.2106 192 P 4.7693 0.0000 0.0000 62.5241 32.7004 175.8975 193 G 4.4207 7.3328 115.1199 45.6752 0.0000 172.4681 194 G 4.2247 7.8714 107.6263 45.8161 0.0000 173.6319 195 W 4.8915 8.3407 119.1551 56.0221 30.8454 177.5435 196 Q 4.4085 8.8238 123.1628 55.7641 29.1021 175.4461 197 L 4.6362 8.9444 126.4199 54.4747 42.3461 177.7166 198 I 4.2790 8.6919 117.6936 61.1168 40.0644 175.3297 199 G 3.5866 7.4292 107.8582 47.0382 0.0000 171.6791 200 K 5.0596 7.8157 118.9488 55.6997 36.1010 175.9431 201 T 5.0442 9.0145 117.2299 58.4731 71.8086 171.3013 202 P 4.7885 0.0000 0.0000 62.0381 32.9948 176.4819 203 L 4.3718 7.7172 115.0484 54.1272 42.8614 172.7408 204 A 4.2009 8.1634 130.8238 51.6703 19.8443 178.0363 *214 T 4.0810 8.0667 110.6286 60.5599 69.8435 173.7372 215 L 4.0806 8.6544 129.0480 56.9809 42.4593 176.9004 216 L 4.3004 7.7700 119.9100 54.4708 42.6128 177.0531 217 R 4.6477 7.9072 120.6625 53.9170 33.1809 171.0716 218 A 4.2265 8.1708 121.0614 53.1186 18.5541 178.2687 219 G 3.9749 9.3092 113.1572 45.0446 0.0000 173.0380 220 D 4.7135 7.9990 119.8819 54.3015 42.6901 175.0689 221 I 5.0674 8.1562 119.6478 59.6497 40.6258 175.0179 222 V 4.6181 8.9976 127.0557 60.9346 34.3424 174.4051 223 K 4.6866 8.1528 125.2267 54.5011 35.0604 175.6420 224 F 5.0671 8.9860 126.7599 58.0453 40.1983 176.2795 225 V 4.7120 9.5316 124.0390 60.0813 35.4197 175.6337 226 R 5.2614 9.1462 125.3301 56.0521 30.2282 173.1681 227 I 4.7415 8.0682 113.9138 60.5368 41.1313 175.4683 228 S 4.4179 8.4475 121.6245 58.1428 62.8924 176.8176 229 E 4.0214 8.8231 118.0012 60.5472 29.4879 179.7075 230 K 4.1040 8.0452 120.1617 57.1358 32.0152 179.9482 *231 D 4.5051 7.6017 121.4725 54.3666 40.4244 180.6813 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 100 R 8.11 4.42 0.00 1.52 1.93 0.00 3.22 0.00 0.00 3.33 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.24 0.00 101 I 8.04 3.87 1.85 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 1.21 1.04 0.89 0.00 0.00 102 V 9.03 4.17 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 0.89 0.00 0.00 0.96 0.00 0.00 103 E 8.78 4.39 0.00 1.80 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.91 0.00 104 I 8.30 4.26 1.89 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 1.29 0.65 1.19 0.00 0.00 105 P 0.00 5.24 0.00 2.10 2.20 0.00 3.65 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 2.02 1.99 0.00 106 V 8.96 5.23 1.76 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 0.65 0.00 0.00 -0.30 0.00 0.00 107 C 8.34 4.48 0.00 2.30 1.76 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 0.00 108 Y 8.53 4.94 0.00 2.85 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 0.00 109 G 9.71 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 0.00 110 G 8.75 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 0.00 111 E 8.62 3.99 0.00 2.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.90 0.00 112 F 7.93 4.38 0.00 3.18 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 0.00 113 G 7.75 4.17 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 0.00 114 P 0.00 4.24 0.00 2.05 2.17 0.00 3.67 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 2.02 2.12 0.00 115 D 8.34 5.01 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.19 4.13 0.00 1.95 1.70 1.00 1.06 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 0.00 117 E 8.25 4.08 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 0.00 118 E 8.08 4.22 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 2.31 1.93 0.00 119 V 7.83 3.73 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 0.95 0.00 0.00 1.03 0.00 0.00 120 A 8.14 4.06 1.52 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 0.00 0.00 121 K 8.79 3.80 0.00 1.73 1.80 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.38 7.81 122 I 8.11 3.86 1.93 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 1.52 1.09 0.91 0.00 0.00 123 N 7.86 4.68 0.00 2.71 2.87 0.00 0.00 7.24 7.57 0.00 0.00 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 Q 7.68 3.19 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.19 0.00 125 L 8.08 4.93 0.00 1.72 1.55 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 126 S 8.19 4.74 0.00 4.04 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 0.00 127 P 0.00 4.36 0.00 2.29 2.39 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.06 0.00 128 E 8.25 4.11 0.00 2.00 2.00 0.00 0.00 0.00 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 0.00 129 E 7.76 4.26 0.00 1.94 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 2.24 2.04 0.00 130 V 8.25 3.80 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 0.95 0.00 0.00 1.02 0.00 0.00 131 I 7.54 3.12 1.67 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 1.25 0.69 0.17 0.00 0.00 132 D 7.58 4.51 0.00 2.68 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 0.00 133 I 7.59 3.83 2.03 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 1.71 1.35 0.96 0.00 0.00 134 H 8.04 4.44 0.00 3.32 3.43 0.00 5.63 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 T 8.27 4.36 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 1.37 0.00 0.00 136 N 7.83 4.68 0.00 2.77 2.73 0.00 0.00 6.99 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 G 7.34 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 0.00 0.00 0.00 138 E 7.35 4.18 0.00 1.75 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 139 Y 8.53 4.98 0.00 2.87 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 0.00 140 V 8.57 4.41 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 0.94 0.00 0.00 0.96 0.00 0.00 141 V 8.74 4.50 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 0.82 0.00 0.00 0.91 0.00 0.00 142 Y 9.34 5.33 0.00 3.08 3.03 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 0.00 143 M 8.72 5.61 0.00 1.99 2.05 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 2.58 2.69 0.00 144 L 8.58 4.56 0.00 1.71 1.62 0.92 -0.12 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 0.00 145 G 8.83 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 *148 P 0.00 4.24 0.00 2.27 2.09 0.00 3.88 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.16 0.00 149 G 8.48 3.98 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 0.00 0.00 0.00 150 F 7.90 4.53 0.00 2.71 2.65 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 0.00 151 P 0.00 4.41 0.00 1.82 1.91 0.00 2.20 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.56 0.00 152 F 8.54 4.25 0.00 2.03 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 0.00 0.00 0.00 0.00 153 L 8.79 5.20 0.00 1.74 1.64 0.91 0.84 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 0.00 154 G 9.78 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 9.46 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 0.00 156 M 8.35 4.45 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.65 0.00 157 S 8.87 4.30 0.00 3.69 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 0.00 158 K 8.97 4.10 0.00 1.67 1.86 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.02 7.81 159 R 8.04 4.18 0.00 1.82 1.88 0.00 3.18 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.22 0.00 160 I 7.58 4.43 1.94 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 1.27 1.39 0.94 0.00 0.00 161 A 7.34 4.39 1.30 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 0.00 0.00 0.00 162 A 8.82 4.58 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 0.00 163 P 0.00 4.57 0.00 2.08 2.04 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 164 R 8.38 4.17 0.00 1.85 1.76 0.00 3.30 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.22 0.00 165 K 8.76 3.89 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.56 7.81 166 S 9.02 4.22 0.00 3.98 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 0.00 167 S 7.69 4.82 0.00 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 0.00 168 P 0.00 4.58 0.00 2.04 2.03 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 169 R 8.24 4.16 0.00 1.94 1.79 0.00 3.07 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 170 P 0.00 4.23 0.00 2.14 2.16 0.00 3.77 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 171 S 7.41 4.43 0.00 3.79 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 I 8.77 4.12 1.23 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.65 0.44 0.00 0.00 173 P 0.00 4.61 0.00 2.09 2.13 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 174 A 8.49 4.14 1.30 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 0.00 0.00 0.00 175 G 9.84 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 0.00 176 S 7.69 4.74 0.00 3.86 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 V 8.64 4.78 1.83 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 0.63 0.00 0.00 0.76 0.00 0.00 178 G 9.60 5.01 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 0.00 179 I 8.62 4.93 1.84 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 1.17 0.66 0.88 0.00 0.00 180 A 8.01 4.03 -0.18 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 0.00 181 G 10.15 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 0.00 182 L 8.85 4.98 0.00 1.63 1.49 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 183 Q 7.96 4.74 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.52 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 184 T 8.69 5.07 4.33 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 1.07 0.00 0.00 185 G 7.84 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 V 6.62 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 0.85 0.00 0.00 1.07 0.00 0.00 187 Y 8.33 4.39 0.00 3.04 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 0.00 188 P 0.00 4.37 0.00 2.03 2.06 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.87 0.00 189 I 7.31 4.58 1.88 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 1.27 0.69 0.92 0.00 0.00 190 S 8.82 4.81 0.00 3.92 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 0.00 191 T 8.09 4.68 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 1.21 0.00 0.00 192 P 0.00 4.77 0.00 2.05 2.13 0.00 3.85 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.93 0.00 193 G 7.33 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 0.00 0.00 0.00 0.00 194 G 7.87 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 0.00 0.00 0.00 0.00 195 W 8.34 4.89 0.00 3.25 3.29 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 0.00 196 Q 8.82 4.41 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 197 L 8.94 4.64 0.00 1.67 1.63 0.86 0.50 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 0.00 198 I 8.69 4.28 1.96 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.44 0.99 0.00 0.00 199 G 7.43 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 0.00 200 K 7.82 5.06 0.00 1.90 1.54 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.41 7.81 201 T 9.01 5.04 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 1.28 0.00 0.00 202 P 0.00 4.79 0.00 2.17 2.06 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 1.88 1.90 0.00 203 L 7.72 4.37 0.00 1.62 1.45 0.92 0.76 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 0.00 204 A 8.16 4.20 1.20 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 *214 T 8.07 4.08 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 1.21 0.00 0.00 215 L 8.65 4.08 0.00 1.56 1.67 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 216 L 7.77 4.30 0.00 1.57 1.52 0.80 0.70 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 0.00 217 R 7.91 4.65 0.00 1.68 1.73 0.00 3.28 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.15 0.00 218 A 8.17 4.23 1.30 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 0.00 0.00 0.00 219 G 9.31 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 0.00 220 D 8.00 4.71 0.00 2.78 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 0.00 221 I 8.16 5.07 1.86 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 1.11 0.75 0.88 0.00 0.00 222 V 9.00 4.62 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 0.17 0.00 0.00 0.81 0.00 0.00 223 K 8.15 4.69 0.00 1.67 1.67 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.50 7.81 224 F 8.99 5.07 0.00 3.17 3.12 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 0.00 225 V 9.53 4.71 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 0.72 0.00 0.00 0.93 0.00 0.00 226 R 9.15 5.26 0.00 1.59 1.75 0.00 3.11 0.00 0.00 3.93 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.04 0.00 227 I 8.07 4.74 1.83 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 1.15 0.87 0.91 0.00 0.00 228 S 8.45 4.42 0.00 3.80 3.79 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 0.00 229 E 8.82 4.02 0.00 1.98 1.90 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 2.23 1.88 0.00 230 K 8.05 4.10 0.00 1.77 1.75 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.36 1.00 7.81 *231 D 7.60 4.51 0.00 2.41 2.49 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 * Residues marked with a * may have inaccurate shift predictions.