NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 190 G 3.9210 8.3544 109.7388 45.4816 0.0000 172.8739 191 Q 3.9942 7.9201 124.1294 53.7899 30.2085 172.5117 192 E 4.0228 9.4402 123.1022 56.8582 31.0547 175.6572 193 M 4.7271 8.1936 120.2776 53.9971 34.2381 174.9641 194 Y 4.5028 8.6193 118.7083 56.0833 40.4541 174.9886 195 A 4.7643 8.3509 125.6116 50.3414 21.1052 175.9642 196 F 4.5439 9.0401 121.7730 55.8436 40.1213 175.6792 197 R 4.5644 8.4531 126.0812 54.0830 30.6943 176.0030 198 S 4.0922 8.8455 119.1939 59.6609 62.8123 174.8052 199 E 4.0824 8.4802 124.3077 56.7278 29.1019 174.1760 200 E 4.7844 7.6743 114.9067 54.8594 29.6075 175.8403 201 R 4.1025 7.8485 118.4630 57.3092 31.6165 177.4884 202 F 4.9261 7.6821 115.5652 56.3751 39.6922 176.1075 203 K 4.0587 8.2892 123.3985 58.9737 32.5028 176.1222 204 S 4.8803 7.5528 111.1165 55.1377 65.8968 171.8061 205 P 4.4029 0.0000 0.0000 62.0585 31.6534 174.7410 206 P 4.3961 0.0000 0.0000 62.6272 31.6649 176.3433 207 I 3.8658 7.9939 113.3292 60.3981 37.6472 174.6878 208 L 3.7252 7.8159 122.7445 57.3647 42.1714 175.0064 209 P 4.2581 0.0000 0.0000 62.7867 30.5867 175.3848 210 P 4.4454 0.0000 0.0000 64.4103 30.4576 177.4402 211 H 3.9227 6.8926 123.9611 57.8801 25.1323 174.7096 212 L 4.3506 7.3835 118.9915 53.3000 41.6889 177.1927 213 L 4.3086 8.3448 124.7715 53.8126 42.4786 178.0370 214 Q 4.1334 8.8742 123.1498 58.2977 28.9474 177.4016 215 V 4.4784 7.2707 112.7577 60.8784 34.3248 174.2759 216 I 4.3145 8.4721 127.2543 59.4468 38.9176 174.8770 217 L 4.3821 8.4566 125.9001 53.3213 41.9143 175.9504 218 N 4.7756 8.6196 122.2941 51.3356 39.5816 173.9856 219 K 4.4650 8.2930 124.5541 54.3105 33.9264 176.3025 220 D 4.6082 8.4902 126.0861 54.0246 39.3042 175.7626 221 T 4.0207 8.4865 121.3095 66.1762 68.7660 175.3826 222 N 4.4764 7.9890 116.3591 53.8668 38.6147 172.7953 *233 P 4.1763 0.0000 0.0000 62.0885 32.4140 174.4718 234 N 4.3840 8.5199 117.3722 53.8527 38.1681 174.0528 235 H 3.9360 8.1421 120.6723 59.3416 29.7902 175.9046 236 V 4.5333 7.1699 119.6468 60.7608 31.4157 175.0373 237 M 4.4658 7.8657 117.3835 55.7735 32.0147 176.8670 238 L 4.2210 7.7236 119.4765 56.9426 42.0553 177.3189 239 N 4.3212 9.0598 119.5363 53.7010 37.2516 174.2502 240 H 4.5592 7.7459 115.4635 54.6649 29.8534 174.5521 241 L 4.5014 8.2420 125.2865 55.1536 42.6690 175.4453 242 Y 4.8637 9.3294 123.2724 56.4617 41.7768 174.3636 243 A 5.6386 8.2401 120.8005 51.0260 22.3325 176.0349 244 L 4.4367 8.3206 119.5694 53.5079 43.2881 177.1668 245 S 4.1409 8.6211 116.5440 58.8687 63.2755 174.8950 246 I 3.9576 8.2764 125.2723 61.4223 37.5484 175.6967 247 K 4.5347 8.1968 123.1325 55.9023 35.1213 176.2278 248 D 4.4539 9.7181 123.2673 55.7161 38.7228 173.9425 249 S 3.8908 8.2148 108.8440 59.2713 60.2421 170.9686 250 V 4.8805 7.7101 120.1703 60.0840 33.8633 174.7650 251 M 4.3010 8.7606 125.4766 54.9334 33.6682 175.7123 252 V 4.1107 8.1681 121.6597 61.2252 34.4437 173.8427 253 L 5.1471 8.4643 128.4545 53.3627 44.2593 175.8683 254 S 5.6557 9.4539 115.9231 56.7756 66.5144 172.3885 255 A 5.0626 8.4710 124.1468 51.4866 22.7565 174.9036 256 T 5.1134 8.4968 116.1851 62.3118 71.0463 173.5535 257 H 5.3415 9.3212 122.7030 53.9647 33.2616 172.4966 258 R 4.7027 8.6431 119.9980 54.5740 31.9147 174.7574 259 Y 4.5610 8.6331 125.8384 56.2646 42.1605 177.1597 260 K 3.5664 8.2853 127.9464 57.7346 31.4186 176.0001 261 K 4.3747 9.0833 121.8323 56.5412 32.9613 175.4997 262 K 4.6684 8.1188 119.5043 54.6330 34.5702 174.5143 263 Y 5.3366 8.5539 119.1539 56.1258 40.8772 175.2830 264 V 4.5090 8.8427 123.3821 60.1919 34.5767 174.6973 265 T 4.9103 8.6757 121.2354 62.6259 69.5948 173.9157 266 T 4.6232 8.7679 124.3040 61.9713 70.7310 173.9728 267 L 5.2299 8.5969 125.4142 52.8435 44.4798 175.3419 268 L 4.7333 9.1419 126.3152 53.5700 44.2701 174.4797 269 Y 4.8327 8.8715 124.5328 56.7996 39.2265 175.1150 270 K 4.6213 8.7540 125.5883 54.0671 35.7414 173.9133 271 P 4.8773 0.0000 0.0000 62.8078 32.3903 176.4420 272 I 4.1007 7.9243 121.5705 61.5689 36.8234 175.8197 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 190 G 8.35 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 0.00 0.00 0.00 191 Q 7.92 3.99 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.89 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 192 E 9.44 4.02 0.00 1.92 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 1.83 2.00 0.00 193 M 8.19 4.73 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.59 0.00 194 Y 8.62 4.50 0.00 2.95 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 0.00 195 A 8.35 4.76 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 0.00 196 F 9.04 4.54 0.00 3.00 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 0.00 197 R 8.45 4.56 0.00 1.80 1.91 0.00 3.25 0.00 0.00 3.29 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 198 S 8.85 4.09 0.00 3.99 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 0.00 199 E 8.48 4.08 0.00 2.37 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 2.21 2.34 0.00 200 E 7.67 4.78 0.00 1.94 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 2.21 2.37 0.00 201 R 7.85 4.10 0.00 1.57 1.43 0.00 3.13 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 202 F 7.68 4.93 0.00 2.99 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 0.00 203 K 8.29 4.06 0.00 1.72 1.85 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 204 S 7.55 4.88 0.00 3.98 3.80 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 0.00 205 P 0.00 4.40 0.00 2.08 2.08 0.00 3.71 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 206 P 0.00 4.40 0.00 2.19 2.09 0.00 3.83 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 2.03 2.03 0.00 207 I 7.99 3.87 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.47 0.91 0.00 0.00 208 L 7.82 3.73 0.00 1.59 1.55 0.89 0.96 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 0.00 209 P 0.00 4.26 0.00 2.25 2.00 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 210 P 0.00 4.45 0.00 2.33 2.26 0.00 3.50 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 211 H 6.89 3.92 0.00 3.23 3.53 0.00 5.69 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 L 7.38 4.35 0.00 1.77 1.56 0.87 0.62 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 0.00 213 L 8.34 4.31 0.00 1.77 1.77 1.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 214 Q 8.87 4.13 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 215 V 7.27 4.48 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 0.82 0.00 0.00 0.95 0.00 0.00 216 I 8.47 4.31 1.66 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 0.51 0.82 0.00 0.00 217 L 8.46 4.38 0.00 1.61 1.61 0.92 1.03 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 0.00 218 N 8.62 4.78 0.00 2.65 2.73 0.00 0.00 6.97 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 0.00 219 K 8.29 4.47 0.00 1.66 1.67 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.48 7.81 220 D 8.49 4.61 0.00 2.71 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 0.00 221 T 8.49 4.02 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 0.00 222 N 7.99 4.48 0.00 2.82 2.93 0.00 0.00 6.00 7.75 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 *233 P 0.00 4.18 0.00 1.94 2.00 0.00 3.59 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.02 0.00 234 N 8.52 4.38 0.00 2.64 2.72 0.00 0.00 6.74 8.16 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 0.00 235 H 8.14 3.94 0.00 3.15 3.25 0.00 5.65 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 0.00 236 V 7.17 4.53 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 0.83 0.00 0.00 1.00 0.00 0.00 237 M 7.87 4.47 0.00 2.37 2.54 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.57 0.00 238 L 7.72 4.22 0.00 1.74 1.75 1.14 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 239 N 9.06 4.32 0.00 2.85 3.00 0.00 0.00 7.03 7.70 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 0.00 240 H 7.75 4.56 0.00 3.35 3.07 0.00 5.65 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 0.00 241 L 8.24 4.50 0.00 1.62 1.50 0.94 0.81 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 0.00 242 Y 9.33 4.86 0.00 2.94 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 0.00 243 A 8.24 5.64 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 0.00 244 L 8.32 4.44 0.00 1.49 1.59 0.89 0.89 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 0.00 245 S 8.62 4.14 0.00 3.85 3.82 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 0.00 246 I 8.28 3.96 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 1.40 0.45 0.91 0.00 0.00 247 K 8.20 4.53 0.00 1.82 1.68 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.38 7.81 248 D 9.72 4.45 0.00 2.80 2.72 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 0.00 249 S 8.21 3.89 0.00 4.07 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 0.00 250 V 7.71 4.88 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 0.97 0.00 0.00 1.01 0.00 0.00 251 M 8.76 4.30 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.46 0.00 252 V 8.17 4.11 1.82 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 0.39 0.00 0.00 0.18 0.00 0.00 253 L 8.46 5.15 0.00 1.64 1.54 0.91 0.42 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 0.00 254 S 9.45 5.66 0.00 3.84 3.70 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 A 8.47 5.06 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 T 8.50 5.11 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 1.37 0.00 0.00 257 H 9.32 5.34 0.00 3.15 3.21 0.00 5.77 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 R 8.64 4.70 0.00 1.77 1.76 0.00 3.16 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.67 0.00 259 Y 8.63 4.56 0.00 2.95 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 0.00 260 K 8.29 3.57 0.00 1.62 1.00 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.91 0.25 7.81 261 K 9.08 4.37 0.00 1.69 1.80 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.37 7.81 262 K 8.12 4.67 0.00 1.75 1.71 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.60 7.81 263 Y 8.55 5.34 0.00 2.83 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 0.00 264 V 8.84 4.51 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 0.79 0.00 0.00 0.97 0.00 0.00 265 T 8.68 4.91 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 1.21 0.00 0.00 266 T 8.77 4.62 4.31 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 1.25 0.00 0.00 267 L 8.60 5.23 0.00 1.63 1.69 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 268 L 9.14 4.73 0.00 1.73 1.52 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 269 Y 8.87 4.83 0.00 2.86 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 0.00 270 K 8.75 4.62 0.00 1.82 1.59 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.43 7.81 271 P 0.00 4.88 0.00 1.99 1.99 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 272 I 7.92 4.10 1.87 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 1.08 0.71 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.