NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 Q 4.3545 8.1876 119.1187 55.2389 30.7175 175.6258 29 S 4.3183 8.2784 113.1322 59.0629 63.9344 175.0511 30 R 3.9347 8.3908 126.4968 62.4013 29.5148 185.0000 31 T 4.0665 7.8096 116.0091 66.2960 68.4802 176.4421 32 L 3.9759 7.8899 121.7595 58.1947 42.0760 178.8345 33 L 3.9822 8.3773 119.1549 57.5800 41.4621 179.3368 34 A 4.0693 8.4486 121.3651 55.1938 18.3823 179.9030 35 G 3.5756 8.1684 104.2040 47.9621 0.0000 176.0029 36 I 3.7330 8.1540 122.4837 64.2094 37.2702 178.7011 37 V 3.5938 7.9841 119.2476 66.0403 31.3564 177.9010 38 Q 3.9848 8.3178 119.5061 59.1041 28.8076 177.8521 39 Q 4.0464 8.2499 120.5932 58.8426 28.9434 178.1211 40 Q 3.9652 8.1342 119.5919 58.8601 28.6529 178.1936 41 Q 3.9436 8.0048 120.2880 59.2687 29.0566 178.4587 42 Q 3.9797 8.0862 119.0654 58.9218 28.7802 178.6820 43 L 3.9936 8.2122 120.3201 57.7222 41.6185 179.3112 44 L 3.9771 8.2078 120.4935 58.2749 41.9804 178.8262 45 D 4.3305 8.4451 119.2225 57.1215 40.6526 178.8169 46 V 3.5521 7.8793 118.7632 66.3013 31.5044 178.6514 47 V 3.6717 7.8764 111.9550 64.0786 31.2844 178.8025 48 K 3.9574 8.2474 118.5793 59.5774 31.9197 179.6035 49 R 3.9486 7.9783 118.3160 59.3642 29.9882 179.1942 50 Q 4.0287 8.5098 118.3414 58.8519 28.5643 178.5504 51 Q 4.0309 8.4694 121.1363 59.1382 29.0901 178.0751 52 E 3.9571 8.1921 119.7511 59.2301 29.4898 179.1315 53 L 3.9717 8.1010 120.3984 58.1724 42.1188 179.0070 54 L 4.0743 8.4814 119.3508 57.8951 41.4399 179.7417 55 R 4.1518 8.4211 118.4210 59.2934 30.0020 179.1232 56 L 4.1398 8.0380 118.8383 58.1270 41.5293 179.7272 57 T 4.0817 8.1420 115.8781 66.4897 68.3288 177.0988 58 V 3.8472 8.3639 120.7271 65.6489 31.5160 177.7532 59 W 4.2804 8.7392 128.5759 60.6814 30.4975 178.2150 60 G 3.4233 8.5918 105.4984 47.8936 0.0000 175.7626 61 T 3.8140 8.2215 118.1135 66.3671 68.5218 176.8380 62 K 3.7708 8.1885 120.4088 59.3539 32.1010 178.8488 63 N 3.8938 7.6264 117.5326 56.5382 38.7335 176.8463 64 L 3.7745 7.7656 120.5733 57.6478 41.6299 179.1458 65 Q 3.3607 7.8087 119.7362 59.3338 28.7901 178.6754 66 T 3.6637 7.5578 116.4719 66.7238 68.4455 176.9418 67 R 3.8629 7.7288 119.9354 59.0668 29.9307 179.3561 68 V 3.5069 8.1535 118.5556 66.0220 31.4275 178.0339 69 T 3.9785 8.0913 116.7633 65.9342 68.2090 176.1680 70 A 3.9602 7.9328 122.3344 55.2954 18.3080 179.7793 71 I 3.6819 7.8653 118.2448 64.5490 36.7670 178.5005 72 E 3.9509 8.4031 119.6683 59.3151 29.2445 179.4002 73 K 3.9972 8.3039 119.8009 59.5126 32.1759 178.2322 74 Y 4.0258 8.3328 120.0947 60.8142 38.6719 178.0857 75 L 3.8473 8.2960 120.1477 57.4600 41.5969 179.4986 76 K 3.8610 8.1159 119.6223 59.4349 32.2095 178.1764 77 D 4.2429 8.0843 118.3859 57.6171 40.9966 178.4062 78 Q 3.7771 7.9959 118.3349 58.6869 28.5702 178.5120 79 A 3.9501 8.1236 122.0417 55.4509 18.5751 179.6821 80 Q 3.9691 8.2219 116.5763 58.9144 28.2182 178.9530 81 L 3.9323 7.9490 121.2423 58.3593 41.9855 178.7491 82 N 4.3834 8.1856 114.9833 56.4002 38.5459 177.0401 83 A 4.1667 8.1524 121.2553 54.5153 18.5056 179.1772 84 W 4.2132 7.9921 126.5395 60.4346 30.8934 178.0582 85 G 3.6901 7.8179 103.1522 47.2456 0.0000 174.7258 *104 T 4.4408 7.7124 117.1658 63.2843 70.7390 174.4092 105 P 4.3199 0.0000 0.0000 66.1572 31.4360 179.0052 106 K 3.9300 8.3446 124.3857 60.5916 31.3662 181.1053 *107 W 4.2947 7.9841 122.7237 61.4489 28.2875 179.8042 108 N 4.6046 8.1421 118.0646 56.6217 38.3479 176.3629 109 N 4.3909 8.5837 118.7229 56.8928 39.0430 176.7080 110 E 4.0397 8.4098 119.9627 59.6274 29.5616 179.4110 111 T 3.8772 8.2615 116.0548 66.5495 68.4476 176.7953 112 W 4.1123 8.5738 120.6730 59.3562 29.0390 178.7377 113 Q 4.1419 8.5004 118.7777 58.9286 28.1560 178.2841 114 E 3.9643 8.2600 120.3038 59.0500 29.5976 178.6516 115 W 4.0222 8.2807 128.3859 60.3981 30.6509 177.4897 116 E 3.9314 8.9493 119.5681 59.3656 29.0583 178.8947 117 R 3.9374 8.0857 118.0212 59.2192 30.0720 179.1098 118 K 3.9467 7.8950 118.0244 59.5568 32.0208 179.5133 119 V 3.2786 7.5348 118.4891 66.0638 31.3788 177.8041 120 D 4.2734 8.2462 118.9026 57.1075 40.5397 178.4529 121 F 4.1863 8.4161 121.3300 61.4588 39.3691 177.2378 122 L 3.3799 8.0720 118.7082 57.4272 41.3221 179.3083 123 E 3.8338 8.2306 118.8131 59.3863 29.4405 179.0100 124 E 3.8251 7.8525 118.9918 59.2836 29.6240 178.3858 125 N 4.1139 7.8915 117.2485 56.7189 38.8667 176.9974 126 I 3.6876 7.9460 121.6483 64.3983 37.1120 178.5110 127 T 3.7920 7.8463 116.5663 66.5733 68.2760 176.5028 128 A 3.9736 7.9130 122.6041 55.1517 18.4057 179.6447 129 L 3.9393 8.2473 117.9089 57.9188 41.6427 179.8328 130 L 3.9836 8.1487 119.1909 57.6809 41.5614 179.1447 131 E 3.9485 8.2285 119.3760 59.2509 29.5912 178.6646 132 E 3.9652 8.3880 118.5240 59.3831 29.4957 179.2038 133 A 4.0188 8.0902 120.8547 55.0999 18.3781 179.5296 134 Q 3.9082 8.0748 118.2222 59.3242 29.1653 178.3989 135 I 3.9843 7.7828 122.2906 63.9387 37.0506 178.2437 136 Q 4.0105 8.2394 120.3984 58.7938 28.8283 177.8899 137 Q 3.9396 8.2153 120.9930 59.2237 29.2182 178.1711 138 E 3.9814 8.1865 119.5621 59.3123 29.4670 179.4699 139 K 4.0757 8.0620 118.4958 59.6307 32.1445 179.1778 140 N 4.3558 8.5006 117.0154 56.5201 38.4285 177.3298 141 M 4.1369 8.3403 122.6268 59.3114 32.0337 179.1059 *142 Y 4.1702 7.8931 120.8688 61.9289 36.8186 179.8932 143 E 4.1727 8.1659 120.2401 59.0305 30.1268 178.4038 144 L 4.0926 8.1239 120.5480 57.9698 41.8505 178.9125 145 Q 4.0183 7.7907 117.5763 58.9779 28.7500 178.7568 146 K 4.1114 7.8252 118.1880 58.9812 32.0850 177.6370 147 L 4.3173 7.5074 122.7882 54.9327 41.7958 176.5235 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 28 Q 8.19 4.35 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.96 0.00 0.00 0.00 0.00 0.00 2.26 1.93 0.00 29 S 8.28 4.32 0.00 4.12 4.13 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 0.00 0.00 0.00 0.00 30 R 8.39 3.93 0.00 1.97 2.01 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 31 T 7.81 4.07 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 32 L 7.89 3.98 0.00 1.75 1.83 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.38 3.98 0.00 1.86 1.70 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.45 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.17 3.58 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 0.00 36 I 8.15 3.73 1.99 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 1.41 0.90 0.91 0.00 0.00 37 V 7.98 3.59 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 0.99 0.00 0.00 0.97 0.00 0.00 38 Q 8.32 3.98 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 39 Q 8.25 4.05 0.00 2.30 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 40 Q 8.13 3.97 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.57 0.00 0.00 0.00 0.00 0.00 2.64 2.48 0.00 41 Q 8.00 3.94 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 42 Q 8.09 3.98 0.00 2.41 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 43 L 8.21 3.99 0.00 1.81 1.71 0.92 0.72 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 44 L 8.21 3.98 0.00 1.81 1.83 0.91 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.45 4.33 0.00 2.93 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 46 V 7.88 3.55 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 1.11 0.00 0.00 1.00 0.00 0.00 47 V 7.88 3.67 2.07 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 0.76 0.00 0.00 1.00 0.00 0.00 48 K 8.25 3.96 0.00 1.94 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.68 7.81 49 R 7.98 3.95 0.00 1.99 1.97 0.00 3.37 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 50 Q 8.51 4.03 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 51 Q 8.47 4.03 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 52 E 8.19 3.96 0.00 2.22 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 2.47 0.00 53 L 8.10 3.97 0.00 1.78 1.85 0.95 0.55 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 54 L 8.48 4.07 0.00 1.96 1.72 0.92 1.00 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 55 R 8.42 4.15 0.00 2.03 2.02 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 56 L 8.04 4.14 0.00 1.96 1.80 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.14 4.08 4.46 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 1.31 0.00 0.00 58 V 8.36 3.85 2.41 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 1.22 0.00 0.00 1.07 0.00 0.00 59 W 8.74 4.28 0.00 3.52 3.49 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 60 G 8.59 3.42 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 61 T 8.22 3.81 4.66 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 1.22 0.00 0.00 62 K 8.19 3.77 0.00 1.78 1.78 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.29 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.88 2.01 7.81 63 N 7.63 3.89 0.00 1.44 2.01 0.00 0.00 7.28 6.21 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 64 L 7.77 3.77 0.00 1.66 1.53 0.89 0.84 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 65 Q 7.81 3.36 0.00 1.21 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 66 T 7.56 3.66 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 1.12 0.00 0.00 67 R 7.73 3.86 0.00 1.86 1.88 0.00 3.04 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 68 V 8.15 3.51 1.93 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 1.02 0.00 0.00 0.86 0.00 0.00 69 T 8.09 3.98 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 1.13 0.00 0.00 70 A 7.93 3.96 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 71 I 7.87 3.68 1.97 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.69 0.93 0.00 0.00 72 E 8.40 3.95 0.00 2.14 1.99 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 2.32 2.39 0.00 73 K 8.30 4.00 0.00 1.81 2.08 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.44 7.81 74 Y 8.33 4.03 0.00 3.12 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 75 L 8.30 3.85 0.00 1.73 1.70 0.96 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.12 3.86 0.00 1.89 1.92 0.00 1.64 0.00 0.00 1.56 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.43 7.81 77 D 8.08 4.24 0.00 2.83 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 78 Q 8.00 3.78 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 1.68 1.27 0.00 79 A 8.12 3.95 1.33 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 0.00 0.00 0.00 80 Q 8.22 3.97 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 81 L 7.95 3.93 0.00 1.78 1.80 0.87 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.19 4.38 0.00 2.93 2.88 0.00 0.00 7.09 8.17 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 83 A 8.15 4.17 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 84 W 7.99 4.21 0.00 3.62 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 85 G 7.82 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 0.00 0.00 0.00 *104 T 7.71 4.44 4.25 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 1.22 0.00 0.00 105 P 0.00 4.32 0.00 2.16 2.09 0.00 3.63 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 2.11 2.14 0.00 106 K 8.34 3.93 0.00 1.76 1.82 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.10 7.81 *107 W 7.98 4.29 0.00 2.49 2.34 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 0.00 108 N 8.14 4.60 0.00 2.84 3.06 0.00 0.00 6.95 6.80 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 0.00 109 N 8.58 4.39 0.00 3.02 2.99 0.00 0.00 7.30 7.21 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 0.00 110 E 8.41 4.04 0.00 2.22 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 2.49 2.52 0.00 111 T 8.26 3.88 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 1.06 0.00 0.00 112 W 8.57 4.11 0.00 3.50 3.28 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 0.00 113 Q 8.50 4.14 0.00 2.38 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 114 E 8.26 3.96 0.00 2.09 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 0.00 2.32 2.32 0.00 115 W 8.28 4.02 0.00 3.11 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 0.00 116 E 8.95 3.93 0.00 2.58 2.39 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 2.44 2.58 0.00 117 R 8.09 3.94 0.00 2.09 1.97 0.00 3.20 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 118 K 7.90 3.95 0.00 1.82 1.78 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.54 7.81 119 V 7.53 3.28 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 0.78 0.00 0.00 -0.21 0.00 0.00 120 D 8.25 4.27 0.00 2.94 2.71 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 0.00 121 F 8.42 4.19 0.00 3.05 3.27 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 0.00 122 L 8.07 3.38 0.00 1.72 1.55 0.89 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.23 3.83 0.00 2.07 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 2.27 2.43 0.00 124 E 7.85 3.83 0.00 2.02 1.97 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 2.27 2.28 0.00 125 N 7.89 4.11 0.00 2.06 2.33 0.00 0.00 7.27 8.59 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 0.00 126 I 7.95 3.69 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.37 0.86 0.00 0.00 127 T 7.85 3.79 4.37 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 1.18 0.00 0.00 128 A 7.91 3.97 1.33 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 0.00 0.00 0.00 129 L 8.25 3.94 0.00 1.77 1.71 0.88 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.15 3.98 0.00 1.82 1.69 0.90 0.86 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 0.00 131 E 8.23 3.95 0.00 2.08 1.93 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 2.29 2.38 0.00 132 E 8.39 3.97 0.00 2.35 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 2.32 0.00 133 A 8.09 4.02 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 0.00 134 Q 8.07 3.91 0.00 2.29 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.66 0.00 135 I 7.78 3.98 1.98 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 1.38 1.32 0.91 0.00 0.00 136 Q 8.24 4.01 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 137 Q 8.22 3.94 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.58 0.00 0.00 0.00 0.00 0.00 2.57 2.44 0.00 138 E 8.19 3.98 0.00 2.21 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 2.40 0.00 139 K 8.06 4.08 0.00 1.97 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.73 7.81 140 N 8.50 4.36 0.00 2.71 2.86 0.00 0.00 7.06 8.10 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 0.00 141 M 8.34 4.14 0.00 2.07 2.23 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 2.85 2.56 0.00 *142 Y 7.89 4.17 0.00 2.34 2.30 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 0.00 143 E 8.17 4.17 0.00 2.12 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 0.00 2.32 2.35 0.00 144 L 8.12 4.09 0.00 1.81 1.90 0.92 0.46 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 0.00 145 Q 7.79 4.02 0.00 2.36 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 146 K 7.83 4.11 0.00 1.95 1.88 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.60 7.81 147 L 7.51 4.32 0.00 1.84 1.57 0.92 0.68 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 * Residues marked with a * may have inaccurate shift predictions.