NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 I 4.1455 8.1245 118.5501 59.8758 38.1289 177.1729 33 Q 4.2060 7.8310 118.3021 55.0794 28.7031 175.7110 34 L 4.4943 7.7576 115.7356 55.2667 43.6918 174.7079 35 G 3.7116 8.9416 105.4108 44.1485 0.0000 174.0368 36 V 3.5579 8.8750 117.4325 66.7708 31.1897 178.7377 37 T 3.7210 7.8445 114.4140 66.7666 68.4007 176.4042 38 R 3.8052 7.4053 118.1304 59.2984 30.0931 178.0253 39 N 4.2049 7.7982 116.2585 56.6973 38.9918 176.9755 40 K 4.0044 7.9069 119.7347 59.5504 32.1402 179.5038 41 I 3.3457 7.3542 119.9107 64.5252 36.8943 178.4733 42 M 3.9962 8.0841 119.5903 58.5440 31.7114 179.0243 43 T 3.8231 8.0383 115.8262 66.4459 68.6268 176.6814 44 A 3.9969 7.9601 122.7224 55.0471 18.3732 179.4890 45 Q 2.0000 7.5081 117.9555 58.5027 29.0197 177.6919 46 Y 3.9853 7.8623 120.7050 60.8348 38.8243 177.8230 47 E 3.7812 8.1747 120.1137 59.1129 29.6298 177.9618 48 C 4.0992 7.8540 118.5138 60.0122 43.8205 175.3123 49 Y 4.0527 7.6690 118.3504 60.9234 37.2412 178.5746 50 Q 3.8256 7.9159 119.2141 58.8477 27.9248 179.0061 51 K 3.9683 7.9202 119.4496 59.4813 31.8602 179.5416 52 I 3.9942 7.7276 119.1880 64.5386 37.0938 177.9230 53 M 4.2381 8.1522 118.3377 58.5404 32.1748 177.4082 54 Q 4.4349 8.0302 115.7963 54.2597 29.0958 174.8246 55 D 4.1926 6.8476 120.0951 53.1881 42.1758 175.5270 *60 A 3.9104 8.4585 123.9314 52.5971 19.3930 176.9400 *61 E 4.2757 8.5563 118.9267 58.2699 29.7285 171.9957 62 G 3.8405 8.5642 111.6413 43.1084 0.0000 171.0594 63 V 4.3272 8.3541 118.6759 61.9760 32.9197 175.5785 64 Y 5.0694 8.4595 124.1557 56.3693 42.2214 175.4192 65 C 4.6385 8.8964 120.1937 55.7072 41.4825 173.3925 66 N 5.1484 8.7584 120.4771 52.5174 39.4877 174.8963 67 R 4.4894 8.9416 121.2305 57.8505 30.6366 175.4523 68 T 4.8612 9.3237 119.3299 60.3483 71.8232 171.9570 69 W 5.1590 8.7266 135.0000 55.8370 31.4887 175.3554 70 D 4.3488 8.4285 126.9814 53.1040 39.5092 177.0351 71 G 3.3587 5.6165 107.3727 45.0706 0.0000 174.6204 72 W 4.7842 7.1922 115.4622 57.2860 32.4895 175.2840 73 L 5.0171 8.8162 116.5999 52.8729 44.8415 174.2547 74 C 5.3438 8.5587 120.7456 55.3437 46.0482 172.7266 75 W 4.9595 8.9721 124.9575 54.8167 32.0238 175.1544 76 N 5.1314 9.1394 121.7750 52.7574 39.2618 174.5987 77 D 5.1194 8.8169 120.5401 55.1272 41.7210 176.4883 78 V 4.8157 8.8814 120.3971 59.7430 35.0983 174.3927 79 A 3.5585 8.4257 123.4808 51.2859 19.5008 177.0187 80 A 3.7763 7.9235 124.2325 53.9506 18.8377 178.3108 81 G 3.8503 8.5729 110.1051 45.6897 0.0000 173.1799 82 T 4.6036 7.2485 108.3295 59.5656 71.9253 173.0070 83 E 4.9235 8.5766 124.0130 54.8300 30.9954 175.6663 84 S 4.8172 9.1306 124.1054 58.6369 64.8234 173.1080 85 M 5.6315 8.5992 120.1455 54.7566 35.3216 173.6866 86 Q 4.6198 8.9978 122.4308 54.4929 34.1388 173.8512 87 L 4.7143 8.2500 120.2341 54.3807 42.5051 177.9569 88 C 4.5362 9.1424 120.1681 56.5826 41.1518 172.2197 89 P 4.2206 0.0000 0.0000 62.7445 31.5251 175.1868 90 D 4.8055 7.9710 118.0661 53.8031 39.8047 177.4006 91 Y 4.1857 7.2940 120.0850 60.8117 38.1899 176.6261 92 F 5.0026 6.9810 116.9814 55.1026 41.9321 175.9979 93 Q 4.0413 8.9140 125.2387 59.0474 28.6862 176.7367 94 D 4.7825 8.2459 115.3690 53.4014 39.9802 175.2928 95 F 5.0159 8.1654 119.2421 56.4260 40.4743 175.0857 96 D 4.7232 8.6370 125.2270 51.9065 40.6820 175.2818 97 P 4.6129 0.0000 0.0000 64.1117 31.4597 177.3735 98 S 4.3894 8.4706 113.4318 59.5334 63.9038 174.4015 99 E 4.2784 8.1592 121.7390 56.2537 30.5810 175.8046 100 K 4.9599 8.4085 120.5214 54.9340 34.6609 175.9002 101 V 4.5509 9.1201 123.9327 61.3093 34.1897 174.5488 102 T 5.2938 8.1817 116.0652 59.9631 72.5751 172.7138 103 K 4.4095 8.4280 123.3627 55.0394 35.9533 174.6212 104 I 4.7414 8.4958 128.0224 60.2522 39.4401 174.9160 105 C 4.7769 8.9026 128.0212 54.6883 45.3980 173.3316 106 D 4.8306 8.9919 127.1474 52.6310 40.0902 177.1535 107 Q 3.9524 8.5711 117.6610 59.2364 28.5609 177.8632 108 D 4.4645 8.1804 114.6573 54.4108 41.1664 176.2674 109 G 3.7185 8.1661 108.0224 46.6286 0.0000 172.5990 110 N 5.0814 8.1736 116.1229 50.2806 41.9328 174.5715 111 W 4.6795 8.7436 123.1031 56.5430 30.0395 175.7961 112 F 4.2823 9.7220 126.8669 59.2078 39.9692 173.9698 113 R 4.8962 7.3261 123.4530 53.9673 33.0120 174.9760 114 H 3.8577 9.0724 124.3686 55.8497 30.1244 174.4177 115 P 3.8272 0.0000 0.0000 65.6557 31.5436 177.6160 116 A 4.1555 8.2768 121.2611 54.3739 18.6479 178.0495 117 S 4.3904 8.0529 108.1588 58.1063 64.3872 174.5278 118 N 4.3962 8.9263 117.7294 53.5402 37.8019 173.0820 119 R 4.4852 7.7058 116.9207 54.8468 31.7863 175.7950 120 T 4.3792 8.6945 122.3854 64.1885 69.0791 172.9711 121 W 4.8128 9.3048 135.0000 55.9489 32.7372 174.6637 122 T 3.9858 7.9258 123.4323 61.7220 70.4500 174.5648 123 N 3.3701 8.3330 124.9357 52.5088 38.8661 174.2823 124 Y 4.5463 7.6623 121.8614 57.4778 38.6651 178.0140 125 T 3.8772 7.7241 113.1260 64.9081 68.6325 175.3031 126 Q 4.1883 7.8211 118.0615 56.9370 29.5318 177.6456 127 C 3.9961 7.8580 116.9688 59.2881 39.6404 174.0144 128 N 4.6088 7.1797 117.0999 52.0498 39.8846 175.9220 *129 V 3.2905 7.6934 117.1391 61.9828 29.1160 174.5666 *130 N 4.3136 8.6298 123.1737 52.8329 37.8217 176.7634 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 32 I 8.12 4.15 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 1.27 1.21 0.91 0.00 0.00 33 Q 7.83 4.21 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.29 6.94 0.00 0.00 0.00 0.00 0.00 2.33 2.01 0.00 34 L 7.76 4.49 0.00 1.62 1.60 0.91 0.94 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 35 G 8.94 3.71 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 0.00 36 V 8.88 3.56 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 1.06 0.00 0.00 0.93 0.00 0.00 37 T 7.84 3.72 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 1.14 0.00 0.00 38 R 7.41 3.81 0.00 2.19 1.89 0.00 3.09 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 39 N 7.80 4.20 0.00 2.85 2.96 0.00 0.00 7.21 6.45 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 40 K 7.91 4.00 0.00 2.00 2.05 0.00 1.81 0.00 0.00 1.91 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.77 7.81 41 I 7.35 3.35 1.62 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.06 0.76 0.00 0.00 42 M 8.08 4.00 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.79 0.00 43 T 8.04 3.82 4.40 0.00 0.00 0.00 0.00 0.00 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 44 A 7.96 4.00 1.70 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 45 Q 7.51 2.00 0.00 1.23 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.73 0.00 0.00 0.00 0.00 0.00 2.00 1.16 0.00 46 Y 7.86 3.99 0.00 3.03 3.03 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 47 E 8.17 3.78 0.00 2.18 2.00 0.00 0.00 0.00 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 2.28 0.00 48 C 7.85 4.10 0.00 3.01 2.61 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 0.00 0.00 0.00 0.00 49 Y 7.67 4.05 0.00 2.90 2.81 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 50 Q 7.92 3.83 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 1.58 1.93 0.00 51 K 7.92 3.97 0.00 1.99 1.85 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.59 7.81 52 I 7.73 3.99 2.02 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.62 1.04 0.00 0.00 53 M 8.15 4.24 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 54 Q 8.03 4.43 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 55 D 6.85 4.19 0.00 2.95 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 *60 A 8.46 3.91 1.28 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 0.00 0.00 *61 E 8.56 4.28 0.00 2.00 1.79 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 2.18 1.86 0.00 62 G 8.56 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 0.00 0.00 0.00 0.00 63 V 8.35 4.33 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 0.97 0.00 0.00 0.92 0.00 0.00 64 Y 8.46 5.07 0.00 2.72 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 65 C 8.90 4.64 0.00 1.69 1.28 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 66 N 8.76 5.15 0.00 2.78 2.89 0.00 0.00 6.96 7.66 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 67 R 8.94 4.49 0.00 1.96 1.98 0.00 3.24 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.03 0.00 68 T 9.32 4.86 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 69 W 8.73 5.16 0.00 2.80 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 70 D 8.43 4.35 0.00 2.74 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 71 G 5.62 3.36 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 0.00 72 W 7.19 4.78 0.00 3.33 3.46 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 73 L 8.82 5.02 0.00 1.53 1.09 0.89 0.98 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 74 C 8.56 5.34 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 75 W 8.97 4.96 0.00 2.95 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 76 N 9.14 5.13 0.00 2.77 2.89 0.00 0.00 7.12 8.06 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 77 D 8.82 5.12 0.00 2.68 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 78 V 8.88 4.82 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 0.66 0.00 0.00 1.01 0.00 0.00 79 A 8.43 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 7.92 3.78 1.21 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 0.00 0.00 81 G 8.57 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.25 4.60 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 1.21 0.00 0.00 83 E 8.58 4.92 0.00 1.96 1.89 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 2.20 2.28 0.00 84 S 9.13 4.82 0.00 4.07 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 0.00 85 M 8.60 5.63 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 86 Q 9.00 4.62 0.00 1.71 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 1.96 1.67 0.00 87 L 8.25 4.71 0.00 1.48 1.73 0.93 0.94 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 88 C 9.14 4.54 0.00 2.96 2.98 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 0.00 0.00 0.00 89 P 0.00 4.22 0.00 0.49 1.52 0.00 3.96 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 1.97 1.97 0.00 90 D 7.97 4.81 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 7.29 4.19 0.00 1.43 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 0.00 0.00 0.00 92 F 6.98 5.00 0.00 2.56 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 93 Q 8.91 4.04 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.15 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 94 D 8.25 4.78 0.00 2.98 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 95 F 8.17 5.02 0.00 3.18 3.01 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 96 D 8.64 4.72 0.00 2.69 2.52 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 97 P 0.00 4.61 0.00 2.21 2.17 0.00 3.44 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 98 S 8.47 4.39 0.00 3.96 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 99 E 8.16 4.28 0.00 2.08 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 0.00 2.43 2.61 0.00 100 K 8.41 4.96 0.00 1.60 1.70 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.39 7.81 101 V 9.12 4.55 2.16 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 0.49 0.00 0.00 0.90 0.00 0.00 102 T 8.18 5.29 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 1.20 0.00 0.00 103 K 8.43 4.41 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.80 0.70 7.81 104 I 8.50 4.74 1.83 0.00 0.00 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 1.19 0.36 0.91 0.00 0.00 105 C 8.90 4.78 0.00 2.13 2.81 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 0.00 106 D 8.99 4.83 0.00 2.91 2.92 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 0.00 107 Q 8.57 3.95 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.09 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 108 D 8.18 4.46 0.00 2.79 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 0.00 109 G 8.17 3.72 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 0.00 0.00 0.00 110 N 8.17 5.08 0.00 2.95 2.70 0.00 0.00 7.07 7.23 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 0.00 111 W 8.74 4.68 0.00 3.20 3.10 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 0.00 0.00 0.00 0.00 112 F 9.72 4.28 0.00 3.26 3.15 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 0.00 113 R 7.33 4.90 0.00 1.46 1.63 0.00 3.25 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 114 H 9.07 3.86 0.00 3.16 3.13 0.00 5.59 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 0.00 115 P 0.00 3.83 0.00 2.17 2.12 0.00 3.34 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.92 0.00 116 A 8.28 4.16 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 0.00 117 S 8.05 4.39 0.00 3.97 3.93 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 0.00 118 N 8.93 4.40 0.00 2.81 3.01 0.00 0.00 7.13 5.76 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 0.00 119 R 7.71 4.49 0.00 2.03 1.86 0.00 3.28 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 120 T 8.69 4.38 4.29 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 1.28 0.00 0.00 121 W 9.30 4.81 0.00 3.50 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.93 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 0.53 0.00 0.00 123 N 8.33 3.37 0.00 2.53 2.62 0.00 0.00 7.03 7.59 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 0.00 124 Y 7.66 4.55 0.00 2.92 2.68 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 0.00 125 T 7.72 3.88 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 1.44 0.00 0.00 126 Q 7.82 4.19 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.10 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 127 C 7.86 4.00 0.00 1.98 1.29 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 0.00 128 N 7.18 4.61 0.00 2.69 2.70 0.00 0.00 7.28 7.71 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 *129 V 7.69 3.29 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 0.72 0.00 0.00 0.93 0.00 0.00 *130 N 8.63 4.31 0.00 2.82 2.87 0.00 0.00 6.76 7.56 0.00 0.00 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.