NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.3358 8.0276 120.6284 55.0235 44.0807 178.7814 32 E 3.7382 8.0340 116.1870 58.5841 29.9674 175.8818 33 E 4.2693 8.2420 116.5644 55.7782 29.7528 177.5858 34 Q 4.3707 8.2514 117.7031 56.7281 32.5405 176.3361 35 L 4.0774 8.6308 118.3427 56.7822 41.6670 178.4990 36 N 4.5457 7.5564 117.8455 54.9440 38.9242 176.3792 37 K 3.6067 8.0024 119.1290 60.2570 32.4204 178.5827 38 S 4.0917 8.0432 112.8012 60.8029 62.4615 175.3633 39 L 3.8828 8.0156 122.4025 59.0519 42.1025 178.4475 40 K 3.6608 9.1350 119.1438 60.8998 31.2287 178.0332 41 T 3.9527 8.3242 110.3069 64.7090 68.7999 176.6509 42 I 3.7594 7.7092 122.9768 64.3340 37.1528 178.0428 43 A 4.1258 7.9338 120.9495 54.5499 18.0683 178.8930 44 S 4.2874 7.6847 108.7748 59.7444 62.4739 174.5748 45 Q 4.4630 7.2833 116.0210 57.8278 30.4746 177.2380 46 K 3.8233 7.9968 120.1864 59.7294 32.2402 178.0908 47 A 4.1182 8.7191 120.7053 55.5505 18.0537 179.2476 48 A 3.8848 7.8490 117.2217 55.6612 18.8912 179.5272 49 I 3.8716 8.1183 117.9285 64.2320 37.1527 177.9951 50 E 3.9372 8.7674 120.6663 59.8416 29.5081 178.9788 51 N 4.3591 8.8076 115.9511 55.9134 38.4667 176.8586 52 Y 4.2166 8.3950 121.9232 60.5617 38.7432 177.0425 53 N 4.2031 8.1903 116.8653 56.5493 38.6850 177.1148 54 Q 3.6166 8.3722 119.6485 58.9072 28.7914 179.1373 55 L 4.1483 7.3350 119.5734 57.2749 42.4178 178.3492 56 K 4.0106 8.0869 119.4751 58.3863 32.0326 178.5629 57 E 3.8914 9.0707 121.1425 59.6627 29.4567 178.4592 58 D 4.4517 7.7727 117.1039 56.8182 40.5196 178.1704 59 Y 4.2375 7.9463 120.6506 60.8685 38.8233 177.6934 60 N 4.0840 8.2877 116.8583 55.7673 38.4047 177.4057 61 T 3.9680 7.7891 116.9531 65.5008 68.3144 176.3684 62 L 3.9126 7.3505 120.0676 57.3336 41.9792 178.7856 63 K 3.6990 7.1989 118.0015 59.7890 31.7295 179.2523 64 R 3.8832 7.5863 116.8087 59.3798 29.9370 178.6772 65 E 4.1525 7.5554 116.5877 58.4684 29.3990 178.1152 66 L 4.2506 8.0426 122.2376 57.3427 42.0151 178.5929 67 S 4.6383 8.0827 117.0200 58.9120 63.4191 175.2919 68 D 4.7199 8.0017 120.3518 55.7350 42.8358 176.3667 69 R 4.3858 7.4956 116.0576 57.4823 30.6385 177.8925 70 D 4.4447 8.7594 118.0252 56.3669 41.3597 177.4042 71 D 4.5788 7.8036 118.6679 57.1706 41.7953 178.1026 72 E 4.1606 7.5197 118.5119 58.4763 29.2821 179.3569 73 V 3.6825 7.5360 119.0469 65.7473 31.6363 178.0794 74 K 3.9905 7.8963 116.9892 59.6896 32.1432 178.4664 75 R 3.9997 8.6377 120.2895 58.9848 29.8097 177.7258 76 L 4.4142 7.8649 120.8232 55.9861 41.9753 178.9931 77 R 4.2003 7.7444 119.1384 58.5490 30.1905 178.3823 78 E 4.0659 8.4370 118.9122 58.9800 29.0996 178.2312 79 D 4.5397 8.0381 117.1691 55.7303 40.8430 177.3618 80 I 4.1653 7.3001 119.4996 61.9265 37.9767 176.3695 81 A 4.5981 8.0806 121.2497 52.2332 19.6932 178.5048 82 K 3.9586 7.7412 118.3349 59.6155 32.5415 178.2780 83 E 4.2262 8.0492 117.4163 57.8809 28.6551 178.3243 84 N 4.4482 8.0202 116.4993 55.1610 39.1489 176.1584 85 E 4.2590 7.8276 119.1104 57.5872 29.6237 177.8157 86 L 4.3408 7.3625 117.9396 56.9613 42.1916 178.3255 87 R 4.2014 8.0689 115.4612 57.6988 30.1071 177.9479 88 T 4.3027 7.2389 113.3795 65.6058 69.3339 177.0929 89 K 4.1930 7.9131 119.9834 58.2963 31.8990 179.4456 90 A 3.9736 7.6944 121.4849 55.1159 18.3168 179.0668 91 E 4.2103 7.5416 112.9690 58.2288 29.1529 177.4187 92 E 4.5037 7.8837 117.1518 57.8767 31.1368 177.6000 93 E 3.9864 8.5189 117.5722 59.2913 29.5022 178.7181 94 A 3.9101 7.9854 120.3392 54.0457 19.1519 178.4443 95 D 4.3633 8.2229 118.0755 57.0089 41.3733 178.1516 96 K 3.9057 8.0519 118.9898 59.9767 31.9315 178.5819 97 L 3.9072 7.4431 121.1065 58.1612 41.9185 178.2601 98 N 4.3890 7.7882 112.7425 54.5596 38.8918 176.7888 99 K 4.2403 7.7186 120.1042 58.6460 32.8640 178.1229 100 E 4.2567 8.1844 117.6907 57.9303 29.2599 178.3805 101 V 3.9700 6.9539 117.1651 64.3934 31.8568 176.2892 102 E 3.9968 8.6363 120.5977 57.5121 29.0959 177.4969 103 D 4.4511 8.3786 118.1075 56.9782 39.6305 178.8774 104 L 4.0422 7.4361 118.8712 57.0205 42.2464 177.1853 105 T 4.4061 9.6288 113.1341 65.1310 70.9929 176.0268 106 A 4.0719 7.9616 122.4867 55.1670 18.0900 179.3923 107 S 4.1595 8.3303 111.5740 61.1261 62.4848 175.9577 108 L 4.0142 7.9206 121.0583 57.7561 41.9496 177.5126 109 F 4.5606 8.2765 120.8517 60.5092 39.5680 176.7916 110 D 4.2000 8.5285 118.6134 57.4425 40.8441 179.1582 111 E 3.8411 8.4281 119.6569 59.2062 29.6982 178.6066 112 A 3.9517 7.9714 120.9433 55.2183 18.3935 179.2394 113 N 4.0744 7.6796 114.2927 56.5682 38.2544 177.0480 114 N 4.5368 8.1506 116.7122 54.9631 38.3642 176.2939 115 L 4.4368 7.6531 121.1998 55.9746 42.7882 177.6452 116 V 3.9423 7.5182 117.1505 64.2151 31.7221 177.6488 117 A 4.0199 8.3393 120.8576 54.9299 18.3496 178.8007 118 D 4.4565 7.4746 115.9011 55.2871 39.7689 178.3722 119 A 4.1952 7.2467 123.1240 55.0376 18.2109 180.0597 120 R 4.1453 7.4696 112.4248 57.3438 29.9097 177.1745 *122 E 4.3622 8.1434 116.5124 55.4448 31.6812 178.0983 123 K 3.9642 7.8869 119.2923 59.3668 32.1614 178.3509 124 Y 5.1336 8.6221 117.7651 61.1847 37.7950 178.4746 125 A 4.1570 8.1625 120.9663 55.3195 18.3655 179.5807 126 I 3.9779 7.7042 117.4632 63.8905 37.2742 178.7462 127 E 4.0506 9.2185 120.1791 59.2154 29.3545 179.3330 128 I 3.7587 7.5139 120.5605 63.9987 37.2753 178.2215 129 L 3.5540 8.1824 118.3561 57.1644 41.8393 177.9388 130 N 4.7446 7.7300 113.8109 54.2148 40.1056 177.1736 131 K 3.9775 8.0353 119.2586 59.2360 32.0618 178.1587 132 R 4.5512 8.7112 117.1485 56.5056 29.8439 177.6277 133 L 4.1406 8.0122 122.0992 57.9086 42.6879 178.6660 134 T 3.3084 7.8369 114.8856 66.3870 68.3273 176.1224 135 E 4.0920 8.0410 120.7686 58.7099 29.5766 177.8878 136 Q 4.2723 7.5428 116.7117 57.0204 29.5672 176.3302 137 L 4.3781 8.8454 121.8681 56.9096 42.5630 177.5815 138 R 4.3578 7.6522 114.3482 57.4808 30.1187 177.7552 139 E 4.1909 8.5263 118.4262 57.7073 29.7270 177.6637 140 K 4.4350 7.9442 116.3561 56.3081 33.6495 175.6592 141 D 4.5275 7.4602 122.1504 54.2931 40.9682 176.0933 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 31 L 8.03 4.34 0.00 1.72 1.78 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.03 3.74 0.00 2.23 2.19 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 2.36 2.36 0.00 33 E 8.24 4.27 0.00 1.93 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 2.29 2.36 0.00 34 Q 8.25 4.37 0.00 2.04 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.58 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 35 L 8.63 4.08 0.00 1.84 1.71 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.56 4.55 0.00 2.96 2.69 0.00 0.00 7.04 6.07 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 37 K 8.00 3.61 0.00 1.83 1.88 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.54 7.81 38 S 8.04 4.09 0.00 3.88 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 39 L 8.02 3.88 0.00 2.02 1.80 0.92 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 40 K 9.13 3.66 0.00 1.72 1.93 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.48 7.81 41 T 8.32 3.95 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 1.24 0.00 0.00 42 I 7.71 3.76 2.11 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 1.45 1.10 0.91 0.00 0.00 43 A 7.93 4.13 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 44 S 7.68 4.29 0.00 3.92 4.07 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 45 Q 7.28 4.46 0.00 2.27 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.54 0.00 0.00 0.00 0.00 0.00 2.25 2.57 0.00 46 K 8.00 3.82 0.00 1.84 1.94 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.48 7.81 47 A 8.72 4.12 1.41 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 48 A 7.85 3.88 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 49 I 8.12 3.87 1.90 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 1.39 0.72 0.95 0.00 0.00 50 E 8.77 3.94 0.00 2.07 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 2.34 2.40 0.00 51 N 8.81 4.36 0.00 2.92 2.89 0.00 0.00 6.76 7.38 0.00 0.00 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 Y 8.40 4.22 0.00 3.00 3.17 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 0.00 0.00 0.00 53 N 8.19 4.20 0.00 2.93 2.86 0.00 0.00 7.08 7.74 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 54 Q 8.37 3.62 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 55 L 7.34 4.15 0.00 1.85 1.65 0.91 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.09 4.01 0.00 1.18 1.52 0.00 1.50 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 57 E 9.07 3.89 0.00 2.03 2.06 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 2.29 2.34 0.00 58 D 7.77 4.45 0.00 2.79 2.70 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 59 Y 7.95 4.24 0.00 3.02 3.02 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 60 N 8.29 4.08 0.00 2.75 2.75 0.00 0.00 7.08 6.39 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 61 T 7.79 3.97 4.36 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 1.18 0.00 0.00 62 L 7.35 3.91 0.00 1.79 1.61 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.20 3.70 0.00 1.74 1.75 0.00 1.63 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.20 0.85 7.81 64 R 7.59 3.88 0.00 1.75 1.95 0.00 3.28 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.78 0.00 65 E 7.56 4.15 0.00 1.92 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 2.30 2.37 0.00 66 L 8.04 4.25 0.00 1.70 1.69 0.90 0.79 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 67 S 8.08 4.64 0.00 3.80 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 68 D 8.00 4.72 0.00 3.04 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 69 R 7.50 4.39 0.00 1.91 1.93 0.00 3.17 0.00 0.00 3.08 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 70 D 8.76 4.44 0.00 2.73 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 71 D 7.80 4.58 0.00 2.87 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 72 E 7.52 4.16 0.00 2.10 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 2.51 2.47 0.00 73 V 7.54 3.68 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 1.03 0.00 0.00 1.00 0.00 0.00 74 K 7.90 3.99 0.00 1.76 1.86 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.49 7.81 75 R 8.64 4.00 0.00 1.86 1.92 0.00 3.14 0.00 0.00 3.22 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 76 L 7.86 4.41 0.00 1.77 1.70 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 77 R 7.74 4.20 0.00 1.99 1.96 0.00 3.12 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 78 E 8.44 4.07 0.00 2.07 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 2.66 2.49 0.00 79 D 8.04 4.54 0.00 2.68 2.70 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 80 I 7.30 4.17 2.14 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 1.45 0.68 0.91 0.00 0.00 81 A 8.08 4.60 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 82 K 7.74 3.96 0.00 1.83 1.96 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.52 7.81 83 E 8.05 4.23 0.00 2.00 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 2.31 2.34 0.00 84 N 8.02 4.45 0.00 3.00 2.85 0.00 0.00 6.75 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 85 E 7.83 4.26 0.00 2.30 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 2.34 0.00 86 L 7.36 4.34 0.00 1.75 1.68 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.07 4.20 0.00 1.80 1.97 0.00 3.31 0.00 0.00 3.22 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.74 0.00 88 T 7.24 4.30 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 1.21 0.00 0.00 89 K 7.91 4.19 0.00 1.88 1.99 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.56 7.81 90 A 7.69 3.97 1.30 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 0.00 0.00 91 E 7.54 4.21 0.00 2.06 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 2.34 2.54 0.00 92 E 7.88 4.50 0.00 2.11 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 2.29 2.60 0.00 93 E 8.52 3.99 0.00 2.21 2.21 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 2.55 2.33 0.00 94 A 7.99 3.91 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 95 D 8.22 4.36 0.00 2.86 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 96 K 8.05 3.91 0.00 2.02 2.08 0.00 1.56 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.62 1.51 7.81 97 L 7.44 3.91 0.00 1.72 1.81 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 98 N 7.79 4.39 0.00 2.74 2.84 0.00 0.00 7.11 8.20 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 99 K 7.72 4.24 0.00 1.95 1.84 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.49 1.67 7.81 100 E 8.18 4.26 0.00 2.03 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 2.33 2.45 0.00 101 V 6.95 3.97 2.26 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 0.79 0.00 0.00 0.97 0.00 0.00 102 E 8.64 4.00 0.00 2.05 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 2.30 2.31 0.00 103 D 8.38 4.45 0.00 2.91 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 0.00 104 L 7.44 4.04 0.00 1.80 1.77 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 105 T 9.63 4.41 4.39 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 0.00 0.00 1.19 0.00 0.00 106 A 7.96 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 0.00 107 S 8.33 4.16 0.00 3.90 4.05 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 0.00 108 L 7.92 4.01 0.00 1.78 1.93 0.95 0.70 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 0.00 109 F 8.28 4.56 0.00 3.24 3.20 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 0.00 110 D 8.53 4.20 0.00 2.79 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 0.00 111 E 8.43 3.84 0.00 2.06 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 2.30 2.35 0.00 112 A 7.97 3.95 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 0.00 113 N 7.68 4.07 0.00 2.68 2.72 0.00 0.00 7.13 6.92 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 0.00 114 N 8.15 4.54 0.00 2.71 2.83 0.00 0.00 6.70 6.77 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 0.00 115 L 7.65 4.44 0.00 1.98 1.84 0.91 0.81 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 0.00 116 V 7.52 3.94 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 0.96 0.00 0.00 0.92 0.00 0.00 117 A 8.34 4.02 1.31 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 0.00 0.00 0.00 118 D 7.47 4.46 0.00 3.01 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 0.00 119 A 7.25 4.20 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 7.47 4.15 0.00 1.88 1.99 0.00 3.38 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.95 0.00 *122 E 8.14 4.36 0.00 2.09 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 0.00 2.59 2.29 0.00 123 K 7.89 3.96 0.00 1.95 1.81 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.78 1.61 7.81 124 Y 8.62 5.13 0.00 2.98 3.06 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 0.00 125 A 8.16 4.16 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 0.00 126 I 7.70 3.98 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.41 0.94 0.00 0.00 127 E 9.22 4.05 0.00 2.01 2.23 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 2.50 2.30 0.00 128 I 7.51 3.76 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 1.52 1.01 0.92 0.00 0.00 129 L 8.18 3.55 0.00 1.59 1.76 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 130 N 7.73 4.74 0.00 2.95 2.83 0.00 0.00 6.46 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 0.00 131 K 8.04 3.98 0.00 2.00 1.92 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.47 7.81 132 R 8.71 4.55 0.00 1.92 1.93 0.00 3.17 0.00 0.00 3.10 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 133 L 8.01 4.14 0.00 1.73 1.82 0.92 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 0.00 134 T 7.84 3.31 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 0.00 135 E 8.04 4.09 0.00 1.99 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 2.31 2.54 0.00 136 Q 7.54 4.27 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 137 L 8.85 4.38 0.00 1.80 1.67 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 138 R 7.65 4.36 0.00 2.01 2.15 0.00 3.11 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 139 E 8.53 4.19 0.00 1.96 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 0.00 2.34 2.55 0.00 140 K 7.94 4.44 0.00 1.70 1.83 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.60 7.81 141 D 7.46 4.53 0.00 2.76 2.56 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.