NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 W 4.7774 8.2749 130.5347 56.5628 31.8680 173.6487 *4 P 3.0940 0.0000 0.0000 61.1887 31.5866 175.5618 5 P 4.3060 0.0000 0.0000 62.2715 33.0459 175.8015 6 R 4.5839 8.3388 121.0879 55.2949 31.0578 175.7986 7 P 4.1253 0.0000 0.0000 66.0513 31.3718 178.8151 8 E 4.2796 8.3152 116.5519 59.1471 29.4284 178.8513 9 E 3.9712 8.0938 119.3771 58.9808 29.7317 178.5409 10 V 3.8716 8.0473 118.1954 66.2357 31.5001 177.9076 11 A 3.6962 8.3932 120.5923 55.0117 18.2181 179.5238 12 R 3.8172 8.1302 117.2241 59.5402 30.0204 178.9527 13 K 3.8956 8.0271 118.2383 59.3135 31.9872 179.2784 14 L 3.9326 8.0745 119.5625 57.9989 41.5086 179.8934 15 R 4.5621 8.1431 119.3701 58.6963 29.7119 179.0889 16 R 4.0139 7.7894 118.2529 58.8389 30.2288 177.2395 17 L 4.2123 7.5392 116.4690 55.3733 41.8929 177.5498 18 G 4.1092 7.9944 106.6329 44.8349 0.0000 174.0497 19 F 4.5007 8.6242 119.0956 57.4068 40.3624 174.6042 20 V 4.8022 9.1606 121.3921 60.9187 35.1015 174.1757 21 E 3.7690 9.0168 128.1380 55.8379 29.9675 176.4230 22 R 4.2634 8.7338 124.9905 56.0243 30.8645 175.4483 *24 A 4.2135 7.8331 120.5041 52.2566 19.2287 176.6435 25 K 4.3321 9.0173 121.6429 57.0998 35.5336 175.5927 26 G 3.6667 9.6455 112.1789 46.6812 0.0000 174.6478 27 G 4.0436 8.4581 105.8892 45.4454 0.0000 173.1006 28 H 5.6475 8.3017 116.1484 53.9603 32.8459 172.9412 29 R 5.0272 9.4440 118.6415 54.4120 34.7013 173.9647 30 L 5.2233 8.3431 123.1511 53.5586 45.0039 174.4644 31 Y 5.3838 9.4115 123.7887 56.4307 41.4177 174.7785 32 T 5.3647 9.1698 112.7025 60.3002 72.6077 172.1601 33 H 4.7258 8.5756 121.9440 53.4688 32.3032 173.3838 34 P 4.1290 0.0000 0.0000 65.3778 31.2544 177.0693 35 D 4.5221 8.1440 115.1655 53.5129 39.6761 177.0219 36 G 4.0251 8.2124 109.1095 45.0598 0.0000 174.4588 37 R 4.2779 8.2317 119.3226 56.6340 31.4330 175.8661 38 I 5.3255 8.3246 121.6435 59.8397 41.1537 174.9095 39 V 4.4744 9.2537 126.2832 61.2433 34.8693 173.8805 40 V 4.9254 8.5774 127.5062 61.3859 33.3324 174.8320 41 V 4.4861 8.9829 127.4533 60.3768 34.5449 172.3254 42 P 4.5571 0.0000 0.0000 62.0232 32.1179 175.6279 43 F 4.8588 9.2111 121.0087 57.4592 40.1390 177.0277 44 H 4.4403 8.1567 115.5993 57.3840 28.8351 175.3490 45 S 4.8826 7.1245 115.6241 56.4099 65.4005 174.4089 46 G 3.8604 8.5482 110.1876 47.0879 0.0000 173.4535 47 E 4.8792 7.6241 116.3423 54.8563 32.6479 174.6328 48 L 4.6399 8.3100 121.4175 52.9878 43.3942 175.1314 49 P 4.5426 0.0000 0.0000 62.4055 32.4454 177.4536 50 K 3.5232 8.9571 122.8408 59.6881 31.9208 179.3783 51 G 3.5220 7.9091 105.3520 48.1400 0.0000 175.6108 52 T 3.8760 7.8386 117.5446 66.1830 68.4589 176.4397 53 F 4.2172 8.3472 122.6691 61.4123 39.4479 177.4677 54 K 3.6027 8.2658 118.2670 59.0375 31.6484 179.4047 55 R 3.7942 8.1117 119.4372 59.3598 29.9468 178.6544 56 I 3.6000 7.8692 119.8893 64.2739 37.0542 178.3770 57 L 3.7337 7.5141 119.8725 57.5276 41.4507 179.4015 58 R 3.8058 7.8619 118.5707 59.8328 29.8292 178.4372 59 D 4.4164 8.1874 117.0612 56.8994 40.9074 177.8841 60 A 4.4395 8.2836 119.6463 51.8649 18.6976 177.3361 61 G 3.8594 7.8304 104.9565 46.6308 0.0000 173.8113 62 L 4.9428 7.8870 118.2910 52.7541 44.4597 177.1543 63 T 4.4701 8.3181 112.2142 60.3880 71.8896 175.9738 64 E 4.0555 8.5262 120.1735 59.4492 29.5386 179.0321 65 E 4.0328 8.3064 118.8538 59.5956 29.4923 178.6741 66 E 4.0233 8.0020 117.0383 59.2007 29.8060 178.7236 67 F 4.2234 8.4595 120.7551 61.8993 39.3125 177.0615 68 H 4.2158 8.5179 114.2838 58.5172 28.5629 176.7739 69 N 4.5981 7.8093 115.5645 54.0151 38.7002 175.1434 70 L 4.1452 7.3695 125.3104 54.8599 41.8122 176.4837 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 2 W 8.27 4.78 0.00 3.29 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 *4 P 0.00 3.09 0.00 1.77 2.13 0.00 3.31 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 5 P 0.00 4.31 0.00 1.78 1.86 0.00 3.08 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.37 0.00 6 R 8.34 4.58 0.00 1.77 1.86 0.00 3.14 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.61 0.00 7 P 0.00 4.13 0.00 2.16 1.63 0.00 3.68 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 2.25 2.04 0.00 8 E 8.32 4.28 0.00 2.07 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 2.65 2.40 0.00 9 E 8.09 3.97 0.00 2.09 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 0.00 2.37 2.40 0.00 10 V 8.05 3.87 2.31 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 1.10 0.00 0.00 1.18 0.00 0.00 11 A 8.39 3.70 1.58 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 0.00 0.00 12 R 8.13 3.82 0.00 1.91 2.06 0.00 3.08 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 13 K 8.03 3.90 0.00 1.90 1.60 0.00 1.31 0.00 0.00 0.61 0.00 0.00 2.84 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.17 1.34 7.81 14 L 8.07 3.93 0.00 1.33 1.14 0.41 0.35 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 15 R 8.14 4.56 0.00 2.00 2.06 0.00 3.26 0.00 0.00 3.42 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.72 0.00 16 R 7.79 4.01 0.00 1.89 2.11 0.00 3.24 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 17 L 7.54 4.21 0.00 2.14 1.88 1.08 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 18 G 7.99 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.62 4.50 0.00 3.10 3.23 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 20 V 9.16 4.80 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 0.98 0.00 0.00 1.03 0.00 0.00 21 E 9.02 3.77 0.00 1.75 1.75 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 2.04 1.88 0.00 22 R 8.73 4.26 0.00 1.73 1.87 0.00 3.41 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 *24 A 7.83 4.21 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 25 K 9.02 4.33 0.00 1.78 1.62 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.36 7.81 26 G 9.65 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 27 G 8.46 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 28 H 8.30 5.65 0.00 3.33 3.29 0.00 5.76 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 29 R 9.44 5.03 0.00 2.02 1.54 0.00 2.97 0.00 0.00 2.81 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.43 0.00 30 L 8.34 5.22 0.00 1.72 1.47 0.96 0.88 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 31 Y 9.41 5.38 0.00 3.10 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 0.00 32 T 9.17 5.36 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 1.29 0.00 0.00 33 H 8.58 4.73 0.00 1.58 2.87 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.13 0.00 1.95 2.03 0.00 2.69 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.94 0.00 35 D 8.14 4.52 0.00 2.75 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 36 G 8.21 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 37 R 8.23 4.28 0.00 1.83 2.21 0.00 3.36 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 38 I 8.32 5.33 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.54 1.00 0.00 0.00 39 V 9.25 4.47 2.04 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 0.85 0.00 0.00 0.86 0.00 0.00 40 V 8.58 4.93 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 0.92 0.00 0.00 0.99 0.00 0.00 41 V 8.98 4.49 2.12 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 0.34 0.00 0.00 0.92 0.00 0.00 42 P 0.00 4.56 0.00 1.77 1.95 0.00 3.56 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 1.75 1.91 0.00 43 F 9.21 4.86 0.00 3.03 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 44 H 8.16 4.44 0.00 3.24 3.49 0.00 5.67 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 7.12 4.88 0.00 3.98 3.81 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 46 G 8.55 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 0.00 0.00 0.00 47 E 7.62 4.88 0.00 1.84 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 0.00 2.16 2.34 0.00 48 L 8.31 4.64 0.00 1.61 1.72 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.54 0.00 2.10 2.00 0.00 3.64 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 2.14 2.13 0.00 50 K 8.96 3.52 0.00 0.79 1.31 0.00 1.29 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 0.21 7.81 51 G 7.91 3.52 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 0.00 52 T 7.84 3.88 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 1.20 0.00 0.00 53 F 8.35 4.22 0.00 3.14 3.32 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 54 K 8.27 3.60 0.00 1.80 1.69 0.00 1.61 0.00 0.00 1.40 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.51 1.42 7.81 55 R 8.11 3.79 0.00 1.89 2.05 0.00 3.08 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 56 I 7.87 3.60 1.87 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 1.45 0.51 0.78 0.00 0.00 57 L 7.51 3.73 0.00 1.30 1.62 0.27 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.86 3.81 0.00 1.91 2.05 0.00 3.06 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 59 D 8.19 4.42 0.00 2.64 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 60 A 8.28 4.44 1.15 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 61 G 7.83 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 0.00 0.00 0.00 62 L 7.89 4.94 0.00 1.60 1.63 1.03 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.32 4.47 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 1.23 0.00 0.00 64 E 8.53 4.06 0.00 2.11 2.25 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 2.44 2.41 0.00 65 E 8.31 4.03 0.00 2.09 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 2.43 2.47 0.00 66 E 8.00 4.02 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 2.38 2.36 0.00 67 F 8.46 4.22 0.00 3.19 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 68 H 8.52 4.22 0.00 3.27 3.38 0.00 5.70 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.81 4.60 0.00 2.72 2.85 0.00 0.00 7.02 7.80 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 70 L 7.37 4.15 0.00 1.40 1.47 0.88 1.06 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 * Residues marked with a * may have inaccurate shift predictions.