NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 105 M 4.5004 8.2893 120.3348 53.7543 33.5905 175.7816 106 P 3.8254 0.0000 0.0000 61.5237 31.4867 173.8999 107 K 4.5218 8.8402 123.0381 53.9006 35.9401 177.1305 108 W 4.2004 8.5700 120.7292 57.8472 29.3615 176.2762 109 R 4.5437 8.7742 121.0211 56.2647 29.7218 175.8970 110 K 4.7895 8.0459 117.8870 55.1103 35.2281 175.3382 111 T 4.5571 8.2618 112.4822 63.3863 71.4006 173.3756 112 H 5.0723 8.1846 121.0406 54.0345 32.1139 173.0720 113 L 4.8504 7.8224 125.0327 53.1290 45.3803 175.9420 114 T 5.6654 9.2572 113.8112 60.0751 71.4553 173.0804 115 Y 5.3815 8.0093 119.4631 55.4408 42.4483 174.0266 116 R 4.6032 9.2068 120.2525 55.1095 33.5899 174.2952 117 I 4.4799 8.2856 128.1874 59.9625 35.5299 175.4053 118 V 3.8759 8.5038 127.3705 65.2121 32.1126 175.1243 119 N 5.0758 7.8841 114.6443 51.3356 40.4671 172.6189 120 Y 4.7215 8.1724 115.5782 55.9757 40.7339 175.9611 121 T 3.7104 7.1915 119.0536 60.9283 67.9192 172.6291 122 P 4.3431 0.0000 0.0000 65.5605 31.6193 177.8975 123 D 4.5199 7.7629 118.6580 57.1307 40.9166 176.6977 124 L 4.7559 7.2131 114.7715 52.0253 46.1095 173.8686 125 P 4.3504 0.0000 0.0000 62.9135 32.1972 178.0917 126 R 3.3865 8.0887 121.4768 58.6888 29.8235 177.5105 127 D 4.7235 7.8268 115.9934 53.5869 39.8359 177.8458 128 A 4.0827 8.2077 124.4008 55.0384 18.8730 180.0301 129 V 3.5691 7.6797 116.1977 66.4690 31.7850 177.7067 130 D 4.5548 8.5821 118.9799 57.5623 40.7288 179.0546 131 S 4.0768 7.7430 113.1737 61.3226 62.0045 176.0028 132 A 4.1069 8.3401 123.8018 55.1638 18.0993 179.6458 133 I 3.8352 7.7501 117.6892 64.3732 37.4769 177.8202 134 E 3.8566 8.8875 119.5956 59.7841 29.4595 179.8848 135 K 4.1522 8.1357 117.5464 59.5058 32.3521 178.7148 136 A 3.9518 7.7101 119.8726 55.2272 18.0085 179.7060 137 L 3.7200 7.8419 117.4278 57.6414 41.5633 179.7685 138 K 4.0531 7.9082 118.3367 59.3895 31.7592 179.0381 139 V 4.2304 7.2149 118.3853 65.4229 31.5610 177.9470 140 W 4.7575 7.8027 116.9394 60.9216 29.1555 178.6278 141 E 3.9862 9.5406 118.3263 59.4635 28.9142 179.1200 142 E 4.2605 8.6033 113.5448 57.7681 29.2940 178.1458 143 V 4.5140 8.0040 109.6782 61.2404 34.0769 174.7394 144 T 4.8472 8.1419 109.6939 59.3693 71.6215 171.3424 145 P 4.7465 0.0000 0.0000 62.9082 31.5938 175.5050 146 L 4.5388 8.0400 119.2740 54.8718 42.6121 176.2159 147 T 4.8544 8.1476 111.8450 59.8952 72.6806 172.6101 148 F 5.9404 8.9556 119.8617 54.7836 42.6547 174.6804 149 S 4.8928 8.7013 116.4667 56.6213 66.6705 172.5386 150 R 3.7659 8.3468 121.7216 54.7561 31.1812 175.2310 151 L 4.6629 8.5432 126.2487 53.4707 43.5506 176.1556 152 Y 4.6618 8.2225 117.1791 57.5029 39.7468 175.7078 153 E 4.6094 8.0687 114.6801 56.5827 32.0050 174.3616 154 G 3.6627 8.8176 106.9989 44.1144 0.0000 171.5340 155 E 4.4112 8.5434 120.2669 54.2147 30.6910 176.3290 156 A 4.4193 8.2821 129.1163 51.2344 20.0442 176.4977 157 D 4.4993 8.3210 119.8991 57.2440 41.4643 177.5821 158 I 4.4356 7.9632 122.1664 59.4412 38.9120 173.8658 159 M 4.7440 8.6552 126.3005 55.0625 33.0847 175.0248 160 I 4.9654 8.8008 126.1739 59.7723 39.8665 175.2829 161 S 4.8373 8.5074 119.1579 57.8721 66.6161 173.5624 162 F 5.3819 9.8409 119.6221 56.4533 40.9251 175.0724 163 A 4.7647 8.7000 122.1741 51.3223 23.3059 175.1223 164 V 4.6860 8.1374 117.9686 61.5333 34.6541 176.4180 165 K 3.9888 9.2076 125.5588 55.9443 31.6424 176.1233 166 E 4.3922 8.9210 128.8452 57.8604 29.6177 176.0522 167 H 4.8763 8.7450 118.8882 55.7370 29.9010 173.8891 168 G 3.9933 8.7529 107.1566 45.4926 0.0000 172.6125 169 D 5.0309 7.4511 117.9479 51.6529 42.7250 175.2749 170 N 4.8887 8.6036 114.4749 52.1721 38.1046 177.3796 171 Y 4.6402 7.1231 113.3536 57.4238 40.8101 175.2295 172 S 4.4373 7.8290 117.4625 57.5734 64.1140 175.0361 173 F 4.7675 8.6035 121.3041 57.4438 39.5648 175.6654 174 D 4.8805 8.5245 117.5927 52.7690 39.8815 177.3601 175 G 4.3814 8.3009 109.7395 44.2432 0.0000 171.3534 176 P 4.0928 0.0000 0.0000 64.3663 31.8335 177.6861 177 G 3.6188 8.3285 111.9684 46.2837 0.0000 174.4964 178 H 3.7005 8.9476 117.1274 57.0259 28.6455 175.9380 179 S 4.6095 6.2556 116.3713 58.3301 64.0177 172.6134 180 L 4.4660 8.4192 126.3156 56.5115 43.3601 175.9379 181 A 5.0789 7.7084 116.9128 51.8776 21.9181 174.9877 182 H 5.1056 8.6594 113.7336 54.4731 32.6236 172.2484 183 A 4.7593 7.7855 118.5248 51.2057 21.8688 175.7487 184 Y 4.3214 8.8903 119.8528 56.4980 40.1013 173.7596 185 P 4.9310 0.0000 0.0000 61.5459 33.0712 174.0557 186 P 3.4498 0.0000 0.0000 62.0215 31.7153 177.3828 187 G 3.3141 6.2429 109.1726 44.3184 0.0000 170.1316 188 P 4.6235 0.0000 0.0000 63.3824 33.0558 176.7377 189 G 4.0474 8.4811 105.9632 45.5362 0.0000 174.8176 190 L 4.0005 8.3435 120.3299 57.2405 42.0752 177.4552 191 Y 4.4578 7.0371 115.2212 59.3478 38.1931 177.5520 192 G 4.4928 8.9428 110.0679 46.5273 0.0000 174.0759 193 D 4.8682 7.9630 119.5922 54.4966 42.6086 175.5244 194 I 4.8190 8.4682 120.3469 60.0596 41.4827 174.1032 195 H 5.3894 9.0779 123.9525 53.9241 32.2099 172.8387 196 F 5.0920 8.2105 120.7820 55.3321 41.8223 174.3059 197 D 3.5975 8.8995 124.2570 54.1113 41.5653 175.3203 198 D 5.1706 9.1048 126.2816 54.6923 41.7056 176.5488 199 D 4.6156 8.6858 116.4633 55.0163 41.1903 175.9141 200 E 4.3620 7.5559 118.9214 54.5191 31.2899 175.4533 201 K 4.3663 7.7693 122.4568 55.0668 33.4074 175.3208 202 W 5.0726 9.7738 129.9714 56.3270 29.6925 176.2441 203 T 4.9412 9.1571 115.1155 59.7823 71.6548 174.6094 204 E 4.4702 9.0186 119.5746 57.0036 30.8457 175.9110 205 D 5.0224 7.6685 119.5044 52.7704 41.2797 175.6054 206 A 4.7224 8.5761 123.1874 52.9018 19.3143 178.8363 207 S 4.4846 8.3409 117.2318 61.6739 64.5274 174.6241 208 G 4.0364 7.7442 111.0311 45.8863 0.0000 173.7997 209 T 4.1417 8.8623 122.8018 62.5606 69.9691 173.6982 210 N 5.0426 10.9700 126.3166 53.4119 39.1497 175.0784 211 L 4.1006 8.9399 129.6819 58.3776 42.0834 178.1771 212 F 4.2865 8.4052 119.7963 61.7322 39.1422 176.8152 213 L 3.1339 7.8905 118.7329 57.2138 41.9079 178.9947 214 V 3.7351 7.8964 118.1565 65.7551 31.6007 177.3396 215 A 4.1336 8.6121 120.7414 55.5314 18.3036 179.1522 216 A 3.8447 8.2360 119.2647 55.8709 18.0523 179.4131 217 H 4.3569 8.0921 116.2978 59.3711 29.9763 177.2982 218 E 4.0494 8.8524 120.9353 59.3825 29.2566 179.3322 219 L 4.0110 8.6690 119.6499 57.5305 41.6007 179.3996 220 G 3.2527 7.9554 105.2817 48.2096 0.0000 175.3724 221 H 4.3724 7.8748 119.9080 58.0332 28.5592 178.1006 222 S 5.1056 7.8786 116.0123 60.6803 62.7732 175.6887 223 L 4.6649 7.5440 120.1867 54.1615 41.8265 176.9371 224 G 3.7499 7.1273 105.9023 45.0520 0.0000 174.3870 225 L 3.8655 7.8848 120.7903 54.0495 42.3060 175.9995 226 F 4.9970 7.9089 119.0018 55.4496 42.2267 174.8210 227 H 4.7506 8.8043 118.3478 56.3014 29.0079 175.0211 228 S 4.8814 8.1868 114.8446 56.4041 64.9443 174.2481 229 A 4.3519 8.6155 127.4573 54.4904 18.7073 177.9888 230 N 4.6089 8.2664 114.1165 53.9358 39.5742 174.4890 231 T 3.4000 7.9577 111.4206 62.3809 70.2530 175.7641 232 E 3.9414 8.1701 121.8070 58.5477 30.1562 177.0069 233 A 4.4278 7.6243 120.1246 51.0581 19.1024 177.7617 234 L 4.1474 9.3965 124.4736 58.7466 42.4941 178.3431 235 M 4.3308 8.3636 115.7048 55.7620 32.5512 175.5262 236 Y 4.4612 7.9604 121.4407 57.7342 39.2303 174.6975 237 P 4.3893 0.0000 0.0000 62.6848 31.6463 175.5464 238 L 4.8259 8.0175 119.0375 53.3623 44.7382 175.4100 239 Y 4.4641 8.6334 124.2330 57.3491 39.4639 174.7553 240 N 3.1400 8.5015 123.4083 53.0553 39.3695 175.6713 241 S 3.9922 8.0996 108.8707 58.7845 61.7597 170.8943 *245 L 4.0571 7.6805 117.9310 56.2597 41.4802 178.0020 246 A 4.4205 8.5509 127.3993 49.1896 16.2974 175.6212 247 Q 5.4037 7.2360 131.0140 55.2705 31.9923 172.3224 248 F 4.9792 8.2147 126.3356 56.9546 42.5271 173.2161 249 R 4.1734 7.4191 124.1692 53.5754 33.1674 175.4867 250 L 3.5614 7.8076 122.5741 54.7682 41.8965 177.4554 251 S 4.3953 8.3650 116.7983 57.6856 64.6264 174.6471 252 Q 4.0070 8.5227 119.6800 59.1849 28.7632 177.0701 253 D 3.9674 8.0608 118.5586 57.1643 41.2700 177.9169 254 D 4.4696 8.1049 119.2671 57.2383 41.0436 178.4372 255 V 3.7428 7.5375 118.6938 66.3381 31.5654 177.6507 256 N 4.4809 9.1038 117.2810 56.2886 38.1519 177.6215 257 G 3.5949 7.6639 105.5169 47.9693 0.0000 175.3332 258 I 3.8851 8.0210 121.9396 63.7046 37.9826 177.9750 259 Q 4.9430 8.6340 120.2919 58.1139 28.2645 178.5394 260 S 4.2038 7.9798 114.2961 60.3712 63.2719 175.9253 261 L 4.0563 8.0224 122.7156 56.4615 41.7738 176.9949 262 Y 4.5814 7.4749 111.7703 56.7987 39.6198 175.7384 263 G 4.2166 8.5675 116.1349 45.9817 0.0000 173.8473 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 105 M 8.29 4.50 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.64 0.00 106 P 0.00 3.83 0.00 1.97 1.84 0.00 3.79 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 1.93 1.93 0.00 107 K 8.84 4.52 0.00 1.36 1.26 0.00 1.36 0.00 0.00 1.53 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.14 1.33 7.81 108 W 8.57 4.20 0.00 3.46 3.26 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 0.00 109 R 8.77 4.54 0.00 1.82 1.98 0.00 3.22 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 110 K 8.05 4.79 0.00 1.68 1.74 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.44 1.61 7.81 111 T 8.26 4.56 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 1.22 0.00 0.00 112 H 8.18 5.07 0.00 3.02 3.10 0.00 5.86 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.82 4.85 0.00 1.07 0.94 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 114 T 9.26 5.67 4.14 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 1.16 0.00 0.00 115 Y 8.01 5.38 0.00 3.14 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 0.00 116 R 9.21 4.60 0.00 1.69 1.71 0.00 3.05 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 1.44 1.65 0.00 117 I 8.29 4.48 1.77 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.77 0.58 0.00 0.00 118 V 8.50 3.88 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 0.76 0.00 0.00 0.93 0.00 0.00 119 N 7.88 5.08 0.00 2.85 2.76 0.00 0.00 5.80 7.55 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 0.00 120 Y 8.17 4.72 0.00 2.92 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 0.00 121 T 7.19 3.71 2.69 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 0.61 0.00 0.00 122 P 0.00 4.34 0.00 2.24 2.28 0.00 3.89 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 2.05 1.98 0.00 123 D 7.76 4.52 0.00 2.74 3.08 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 0.00 124 L 7.21 4.76 0.00 1.60 1.50 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.35 0.00 2.17 2.13 0.00 3.72 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 126 R 8.09 3.39 0.00 1.69 1.66 0.00 2.60 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.50 0.00 127 D 7.83 4.72 0.00 2.95 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 0.00 128 A 8.21 4.08 1.39 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 0.00 0.00 0.00 129 V 7.68 3.57 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 1.36 0.00 0.00 1.04 0.00 0.00 130 D 8.58 4.55 0.00 2.93 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 0.00 131 S 7.74 4.08 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.34 4.11 1.46 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 0.00 0.00 133 I 7.75 3.84 1.90 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 1.52 1.11 0.81 0.00 0.00 134 E 8.89 3.86 0.00 1.99 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 2.43 2.86 0.00 135 K 8.14 4.15 0.00 2.08 1.98 0.00 0.79 0.00 0.00 1.27 0.00 0.00 2.63 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.37 1.37 7.81 136 A 7.71 3.95 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 137 L 7.84 3.72 0.00 1.62 1.24 -0.10 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 138 K 7.91 4.05 0.00 2.02 1.89 0.00 1.63 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.54 7.81 139 V 7.21 4.23 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 -0.45 0.00 0.00 0.95 0.00 0.00 140 W 7.80 4.76 0.00 3.59 3.16 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 0.00 141 E 9.54 3.99 0.00 2.20 2.05 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 2.74 2.78 0.00 142 E 8.60 4.26 0.00 2.24 2.23 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 2.46 2.37 0.00 143 V 8.00 4.51 2.23 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 0.80 0.00 0.00 1.30 0.00 0.00 144 T 8.14 4.85 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 1.43 0.00 0.00 145 P 0.00 4.75 0.00 2.20 2.19 0.00 3.54 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 2.11 2.15 0.00 146 L 8.04 4.54 0.00 1.25 1.13 0.62 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 147 T 8.15 4.85 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 1.22 0.00 0.00 148 F 8.96 5.94 0.00 2.84 2.95 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 0.00 149 S 8.70 4.89 0.00 3.88 4.06 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 0.00 150 R 8.35 3.77 0.00 0.67 1.43 0.00 2.66 0.00 0.00 2.86 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.76 0.00 151 L 8.54 4.66 0.00 1.47 1.43 0.93 0.68 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 0.00 152 Y 8.22 4.66 0.00 2.92 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 0.00 153 E 8.07 4.61 0.00 2.04 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 2.20 2.28 0.00 154 G 8.82 3.66 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 0.00 155 E 8.54 4.41 0.00 1.89 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 0.00 2.21 2.35 0.00 156 A 8.28 4.42 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 0.00 157 D 8.32 4.50 0.00 2.27 1.59 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 0.00 158 I 7.96 4.44 1.91 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.01 0.91 0.00 0.00 159 M 8.66 4.74 0.00 1.96 2.17 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 2.71 2.55 0.00 160 I 8.80 4.97 1.87 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 1.17 0.66 0.87 0.00 0.00 161 S 8.51 4.84 0.00 4.01 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 0.00 162 F 9.84 5.38 0.00 3.02 3.08 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 0.00 163 A 8.70 4.76 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 0.00 164 V 8.14 4.69 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 0.93 0.00 0.00 1.01 0.00 0.00 165 K 9.21 3.99 0.00 2.01 1.32 0.00 2.08 0.00 0.00 1.78 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.38 7.81 166 E 8.92 4.39 0.00 1.96 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 2.29 2.25 0.00 167 H 8.75 4.88 0.00 3.29 3.37 0.00 5.54 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 G 8.75 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 D 7.45 5.03 0.00 2.74 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 0.00 170 N 8.60 4.89 0.00 2.61 2.66 0.00 0.00 6.62 7.46 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 0.00 171 Y 7.12 4.64 0.00 2.95 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 0.00 172 S 7.83 4.44 0.00 4.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 F 8.60 4.77 0.00 3.43 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 0.00 174 D 8.52 4.88 0.00 2.82 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 0.00 175 G 8.30 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 P 0.00 4.09 0.00 2.02 1.98 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.23 0.00 177 G 8.33 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 H 8.95 3.70 0.00 3.56 3.11 0.00 5.70 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 S 6.26 4.61 0.00 3.96 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 0.00 180 L 8.42 4.47 0.00 1.69 1.64 0.48 0.67 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 0.00 181 A 7.71 5.08 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 0.00 182 H 8.66 5.11 0.00 2.82 3.27 0.00 5.33 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 0.00 183 A 7.79 4.76 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 0.00 184 Y 8.89 4.32 0.00 3.08 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 0.00 185 P 0.00 4.93 0.00 2.10 1.97 0.00 4.05 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 2.28 2.18 0.00 186 P 0.00 3.45 0.00 1.21 0.49 0.00 3.52 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 187 G 6.24 3.31 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 0.00 188 P 0.00 4.62 0.00 2.31 2.25 0.00 3.72 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 2.16 1.98 0.00 189 G 8.48 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 0.00 0.00 0.00 190 L 8.34 4.00 0.00 1.32 1.03 0.01 0.52 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 0.00 191 Y 7.04 4.46 0.00 3.05 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 0.00 192 G 8.94 4.49 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 0.00 193 D 7.96 4.87 0.00 2.75 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 I 8.47 4.82 1.60 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.13 0.22 0.00 0.00 195 H 9.08 5.39 0.00 3.10 3.27 0.00 5.59 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 F 8.21 5.09 0.00 2.17 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 0.00 0.00 0.00 0.00 197 D 8.90 3.60 0.00 1.58 2.38 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 0.00 198 D 9.10 5.17 0.00 2.94 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 0.00 199 D 8.69 4.62 0.00 2.89 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 0.00 200 E 7.56 4.36 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 2.31 1.88 0.00 201 K 7.77 4.37 0.00 1.67 1.55 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.35 7.81 202 W 9.77 5.07 0.00 3.22 3.08 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 0.00 203 T 9.16 4.94 4.45 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 1.25 0.00 0.00 204 E 9.02 4.47 0.00 2.12 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 2.26 2.30 0.00 205 D 7.67 5.02 0.00 2.75 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 0.00 206 A 8.58 4.72 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 0.00 207 S 8.34 4.48 0.00 4.01 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 0.00 208 G 7.74 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 0.00 209 T 8.86 4.14 3.14 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 0.35 0.00 0.00 210 N 10.97 5.04 0.00 3.14 3.02 0.00 0.00 6.37 6.54 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 0.00 211 L 8.94 4.10 0.00 1.96 1.74 -0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 212 F 8.41 4.29 0.00 3.11 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 L 7.89 3.13 0.00 1.35 1.57 1.00 0.89 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 0.00 214 V 7.90 3.74 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.17 0.00 0.00 215 A 8.61 4.13 1.39 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 0.00 0.00 0.00 216 A 8.24 3.84 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 H 8.09 4.36 0.00 3.28 3.57 0.00 5.61 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 0.00 218 E 8.85 4.05 0.00 2.09 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 2.59 2.31 0.00 219 L 8.67 4.01 0.00 2.09 1.74 0.81 0.58 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 0.00 220 G 7.96 3.25 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 0.00 0.00 0.00 0.00 221 H 7.87 4.37 0.00 3.29 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 S 7.88 5.11 0.00 4.32 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 0.00 223 L 7.54 4.66 0.00 1.51 1.78 0.72 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 224 G 7.13 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 0.00 0.00 0.00 225 L 7.88 3.87 0.00 1.45 1.39 0.75 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 226 F 7.91 5.00 0.00 3.07 2.94 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 0.00 227 H 8.80 4.75 0.00 3.19 3.23 0.00 5.66 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 0.00 228 S 8.19 4.88 0.00 3.95 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 0.00 229 A 8.62 4.35 1.38 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 0.00 0.00 230 N 8.27 4.61 0.00 2.76 2.92 0.00 0.00 7.10 7.30 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 0.00 231 T 7.96 3.40 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 0.55 0.00 0.00 232 E 8.17 3.94 0.00 1.89 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 2.26 2.34 0.00 233 A 7.62 4.43 1.53 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 0.00 0.00 234 L 9.40 4.15 0.00 1.80 2.29 0.99 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 235 M 8.36 4.33 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.00 0.00 236 Y 7.96 4.46 0.00 3.22 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 0.00 237 P 0.00 4.39 0.00 1.95 1.44 0.00 2.20 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 238 L 8.02 4.83 0.00 2.00 1.72 1.14 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 239 Y 8.63 4.46 0.00 2.92 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 N 8.50 3.14 0.00 2.46 2.51 0.00 0.00 7.00 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 0.00 241 S 8.10 3.99 0.00 4.18 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 *245 L 7.68 4.06 0.00 1.98 1.74 0.93 0.57 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 0.00 246 A 8.55 4.42 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 Q 7.24 5.40 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.65 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 248 F 8.21 4.98 0.00 3.32 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 R 7.42 4.17 0.00 1.55 1.53 0.00 3.21 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.50 0.00 250 L 7.81 3.56 0.00 1.40 1.47 0.57 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 251 S 8.36 4.40 0.00 3.98 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 0.00 252 Q 8.52 4.01 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 253 D 8.06 3.97 0.00 2.87 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 0.00 254 D 8.10 4.47 0.00 3.02 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 0.00 255 V 7.54 3.74 2.27 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 1.09 0.00 0.00 1.03 0.00 0.00 256 N 9.10 4.48 0.00 2.75 2.90 0.00 0.00 7.00 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 G 7.66 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 0.00 258 I 8.02 3.89 1.86 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.06 1.26 0.00 0.00 259 Q 8.63 4.94 0.00 2.40 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.60 0.00 0.00 0.00 0.00 0.00 2.68 2.56 0.00 260 S 7.98 4.20 0.00 4.05 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 0.00 261 L 8.02 4.06 0.00 1.53 0.88 0.87 0.60 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 0.00 262 Y 7.47 4.58 0.00 2.96 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 0.00 263 G 8.57 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 * Residues marked with a * may have inaccurate shift predictions.