NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1493 7.9133 120.6256 62.5162 33.4190 174.5183 3 W 4.5554 8.8867 128.8243 55.0427 28.2661 173.5956 4 L 4.8536 9.6657 128.3998 54.1427 42.9506 175.8529 5 N 4.6491 10.3012 125.3093 54.4300 36.8457 175.1226 6 G 4.1876 8.8505 106.7419 45.2918 0.0000 174.2996 7 E 4.6543 8.2900 120.2301 53.7427 30.7689 173.7622 8 P 3.9133 0.0000 0.0000 62.4423 31.8941 175.9498 9 R 4.5275 8.2184 120.7284 53.9967 34.6179 174.1638 10 P 4.5239 0.0000 0.0000 61.8140 30.2296 176.1128 11 L 4.3756 7.3660 118.9781 55.2249 43.0969 177.0144 12 E 4.1209 7.9504 117.9984 58.3529 29.6921 177.6549 13 G 3.9541 9.2818 111.3559 45.1872 0.0000 173.3398 14 K 4.5906 7.7821 119.1969 54.8437 34.6518 175.6503 15 T 4.6103 8.2615 111.8161 60.3978 71.9837 176.0437 16 L 4.0297 8.2594 121.5707 57.9196 41.5807 179.9590 17 K 4.0515 7.9682 118.0823 59.4412 32.1465 179.0939 18 E 3.9999 8.0464 118.7095 59.1834 29.1790 179.5041 19 V 3.6046 7.9618 117.9557 66.0333 31.8134 177.8627 20 L 4.1517 8.4253 119.2253 57.3313 41.2172 178.6062 21 E 4.0320 8.1113 119.1561 59.2852 29.8657 180.8151 22 E 4.2047 7.9047 118.2596 56.0276 28.5782 177.5926 *24 G 3.8090 7.9258 103.4665 45.4989 0.0000 173.5761 25 V 4.3198 7.1665 117.3264 58.9705 33.4174 175.0279 26 E 4.1102 8.6030 124.7134 55.7194 30.2136 177.3255 27 L 4.0582 8.6759 127.0314 57.5980 42.0469 179.5755 28 K 4.0565 8.1082 117.0145 59.4209 32.7412 178.2784 29 G 3.6786 7.7512 107.7140 47.1204 0.0000 173.6144 30 V 4.5824 7.5261 112.7143 59.8921 34.9891 174.4796 31 A 5.1138 8.9954 122.1695 50.6923 22.7616 175.3483 32 V 4.6755 8.8451 122.6937 60.9566 33.9990 174.5075 33 L 4.4437 9.0564 131.5521 54.8446 42.8776 175.2815 34 L 4.4967 8.9446 130.9616 53.4154 42.2158 174.8860 35 N 4.3013 9.0474 125.5458 54.0852 36.0471 175.2489 36 E 3.8227 8.1329 113.5745 56.2805 28.2905 174.5077 37 E 4.4243 7.6685 119.1691 54.3364 31.7179 174.7479 38 A 4.7378 8.1204 126.9825 50.6620 20.2210 176.1057 39 F 5.1622 9.1798 121.1810 55.3830 43.1702 174.9936 40 L 4.4614 8.6554 120.3071 54.2892 42.4851 178.2560 41 G 4.4051 8.5620 111.0276 48.2956 0.0000 174.7798 42 L 4.2660 7.8605 116.4549 55.5842 42.0231 177.0297 43 E 4.6071 8.4618 117.9868 55.8969 30.0320 176.6525 44 V 3.4115 7.5393 111.9268 60.2668 32.2031 174.4662 45 P 4.2800 0.0000 0.0000 62.7884 31.7384 176.4124 46 D 4.4604 8.2939 119.1022 55.9976 41.3933 177.3735 47 R 3.9356 7.9200 119.4443 56.1924 30.1406 174.7540 48 P 4.6397 0.0000 0.0000 62.5830 32.4467 176.1300 49 L 4.3373 9.4910 123.5063 54.9487 42.9931 176.4470 50 R 4.9542 9.6294 121.0129 53.7659 34.4670 174.6606 51 D 4.5217 8.7649 120.5404 56.0915 41.4130 175.9552 52 G 4.2602 9.2242 114.6912 45.9197 0.0000 173.8999 53 D 4.4715 8.4292 120.4092 54.5950 42.0810 176.0809 54 V 4.4530 9.3228 123.8606 61.4672 33.1201 174.0275 55 V 4.6528 8.8625 128.8585 61.4555 33.8139 174.5650 56 E 5.0146 9.3477 126.3911 54.7747 33.0036 174.9112 57 V 4.6044 9.1298 126.6369 61.7195 32.3020 175.3907 58 V 4.7238 8.9402 120.8758 59.7873 36.0671 174.2880 59 A 4.8797 8.1733 122.2962 50.9771 22.4976 175.4701 60 L 4.2887 8.3311 118.3085 53.8208 42.9566 176.8072 *62 Q 4.0472 8.3409 118.3798 56.2665 29.4879 174.6074 63 G 4.0566 8.0816 108.6377 45.2393 0.0000 173.3813 64 G 3.7041 8.3900 107.3227 45.6557 0.0000 172.5875 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 V 7.91 4.15 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 1.06 0.00 0.00 0.99 0.00 0.00 3 W 8.89 4.56 0.00 3.46 3.21 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 0.00 0.00 0.00 0.00 4 L 9.67 4.85 0.00 1.73 1.56 0.96 0.49 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 5 N 10.30 4.65 0.00 2.87 2.88 0.00 0.00 7.35 7.22 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 6 G 8.85 4.19 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 0.00 7 E 8.29 4.65 0.00 2.16 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 2.31 2.40 0.00 8 P 0.00 3.91 0.00 1.45 0.49 0.00 3.65 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 1.69 1.62 0.00 9 R 8.22 4.53 0.00 1.74 1.73 0.00 3.28 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 10 P 0.00 4.52 0.00 2.13 2.03 0.00 3.68 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 1.93 1.93 0.00 11 L 7.37 4.38 0.00 1.70 1.72 0.91 0.88 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 12 E 7.95 4.12 0.00 1.93 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 0.00 2.30 2.32 0.00 13 G 9.28 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 14 K 7.78 4.59 0.00 2.07 1.70 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.33 7.81 15 T 8.26 4.61 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 1.28 0.00 0.00 16 L 8.26 4.03 0.00 1.70 1.78 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.97 4.05 0.00 1.82 1.85 0.00 1.52 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.58 7.81 18 E 8.05 4.00 0.00 2.27 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 2.32 2.30 0.00 19 V 7.96 3.60 2.22 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 0.84 0.00 0.00 1.01 0.00 0.00 20 L 8.43 4.15 0.00 1.74 1.70 0.94 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 21 E 8.11 4.03 0.00 2.15 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 0.00 2.33 2.37 0.00 22 E 7.90 4.20 0.00 2.04 1.96 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 2.34 2.39 0.00 *24 G 7.93 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 0.00 0.00 0.00 25 V 7.17 4.32 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 0.73 0.00 0.00 0.94 0.00 0.00 26 E 8.60 4.11 0.00 2.03 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 2.38 2.33 0.00 27 L 8.68 4.06 0.00 1.75 1.72 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.11 4.06 0.00 1.87 1.95 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.44 7.81 29 G 7.75 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.53 4.58 2.20 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 0.84 0.00 0.00 1.04 0.00 0.00 31 A 9.00 5.11 1.23 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 0.00 0.00 32 V 8.85 4.68 2.24 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 1.02 0.00 0.00 0.99 0.00 0.00 33 L 9.06 4.44 0.00 1.78 1.56 0.87 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.94 4.50 0.00 1.97 1.80 0.99 0.55 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 35 N 9.05 4.30 0.00 2.88 2.85 0.00 0.00 7.04 7.77 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 36 E 8.13 3.82 0.00 2.12 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 0.00 2.16 2.30 0.00 37 E 7.67 4.42 0.00 1.94 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 2.20 2.38 0.00 38 A 8.12 4.74 1.09 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 0.00 0.00 39 F 9.18 5.16 0.00 3.00 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 40 L 8.66 4.46 0.00 1.86 1.62 1.01 0.95 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 41 G 8.56 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 0.00 0.00 0.00 0.00 42 L 7.86 4.27 0.00 1.66 1.72 0.93 0.83 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 43 E 8.46 4.61 0.00 1.95 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 2.26 0.00 44 V 7.54 3.41 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 0.82 0.00 0.00 0.95 0.00 0.00 45 P 0.00 4.28 0.00 1.94 1.85 0.00 3.45 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.46 0.00 46 D 8.29 4.46 0.00 2.63 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 0.00 47 R 7.92 3.94 0.00 1.81 1.86 0.00 3.42 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 48 P 0.00 4.64 0.00 1.97 1.97 0.00 3.72 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 2.02 2.11 0.00 49 L 9.49 4.34 0.00 1.64 1.59 0.93 0.97 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 50 R 9.63 4.95 0.00 1.69 1.78 0.00 3.17 0.00 0.00 3.11 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 51 D 8.76 4.52 0.00 2.82 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 52 G 9.22 4.26 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 0.00 53 D 8.43 4.47 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 54 V 9.32 4.45 2.24 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 0.95 0.00 0.00 1.00 0.00 0.00 55 V 8.86 4.65 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 1.01 0.00 0.00 0.99 0.00 0.00 56 E 9.35 5.01 0.00 1.86 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 2.24 2.37 0.00 57 V 9.13 4.60 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 0.78 0.00 0.00 0.96 0.00 0.00 58 V 8.94 4.72 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 0.70 0.00 0.00 1.00 0.00 0.00 59 A 8.17 4.88 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 60 L 8.33 4.29 0.00 1.65 1.60 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 *62 Q 8.34 4.05 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 63 G 8.08 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 0.00 0.00 0.00 64 G 8.39 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.