NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.3383 8.0433 120.6283 54.5766 44.0690 178.5052 32 E 4.2102 8.1574 119.8672 58.4125 29.5510 175.4301 33 E 4.2630 8.8056 120.1237 58.5302 30.5808 177.7005 34 Q 3.9928 7.7988 117.6824 58.8146 28.6340 178.1546 35 L 3.9924 9.3036 121.5072 57.5617 41.9616 178.5910 36 N 4.3347 7.9077 116.9562 56.4233 38.7595 176.6768 37 K 3.9312 7.8165 121.0208 59.5396 32.1354 178.7629 38 S 3.9599 8.6270 112.4439 60.5942 62.4187 175.3232 39 L 4.2219 7.4483 123.1710 57.5271 42.2371 177.9369 40 K 4.2022 8.3024 117.4076 58.2304 31.9870 177.8787 41 T 4.3815 7.4036 114.8769 65.7951 69.4858 176.6509 42 I 3.7068 7.6497 120.9964 63.6334 36.9780 177.9604 43 A 4.1496 7.8807 121.4045 54.5363 18.6294 179.3114 44 S 4.0937 7.6226 110.5394 61.2964 62.5131 176.1654 45 Q 3.9359 8.7054 122.8932 58.8667 28.8246 177.8173 46 K 3.8313 8.3246 120.9340 59.5103 32.2613 178.2280 47 A 3.9411 7.7715 120.4233 55.5441 18.3504 178.8554 48 A 3.9066 8.0276 118.6660 55.8463 18.3585 179.6567 49 I 3.6674 7.7530 116.3789 64.6647 37.2951 178.4129 50 E 4.1593 8.6999 120.0879 59.2315 29.3202 178.5550 51 N 4.4424 8.1904 116.4996 56.1059 38.7797 176.8073 52 Y 4.0394 7.9898 120.5452 60.6003 39.0009 177.5005 53 N 4.4086 8.8331 118.1261 56.2023 38.5558 177.2086 54 Q 3.9715 7.9547 120.9513 58.7520 29.0699 177.8533 55 L 3.8588 7.9095 121.4321 58.1168 42.2307 178.9771 56 K 3.3819 7.6924 119.3239 58.9411 31.9767 178.4524 57 E 3.9041 7.8871 119.5582 59.4850 29.5997 178.4516 58 D 4.3580 8.7704 119.3679 57.4881 40.7620 177.7593 59 Y 4.0834 8.7452 120.7771 61.0065 38.7235 177.7999 60 N 4.2554 8.6307 116.9252 57.0507 38.8834 177.4129 61 T 3.8361 7.8180 116.5263 66.6686 68.1643 176.3001 62 L 4.0112 8.0539 121.8643 57.2943 41.8583 178.6163 63 K 3.7947 7.6914 119.1390 59.0447 32.3299 178.6351 64 R 3.9922 7.9866 118.9439 58.8458 30.0887 178.3249 65 E 3.8875 8.0536 117.6369 59.7782 29.3723 179.6836 66 L 3.8945 7.3193 118.4461 58.0120 42.4388 178.3997 67 S 4.7493 7.8866 114.4422 60.9426 62.2716 175.7915 68 D 4.3704 8.0409 120.6165 57.6026 40.4476 178.6529 69 R 4.1462 8.0406 115.9086 57.7454 29.7557 178.0729 70 D 4.6490 8.0753 120.1529 56.3838 41.2002 178.5331 71 D 4.3292 8.1008 119.4680 57.3703 40.9126 178.1467 72 E 4.0818 8.2073 118.6886 59.7100 29.3760 179.4240 73 V 3.5813 7.2131 117.8542 66.1493 31.5508 178.1257 74 K 3.9254 7.7206 117.7806 59.6450 31.9860 179.2870 75 R 4.0444 8.7016 119.2162 59.8446 29.8741 178.7093 76 L 3.9657 8.6745 118.8331 57.6747 41.4200 179.4646 77 R 3.8941 8.4877 118.2303 59.6875 29.9574 179.0696 78 E 4.0436 8.2696 118.1296 59.2986 29.5424 178.1791 79 D 4.7437 8.0421 116.3573 55.1520 40.7421 177.8131 80 I 4.0325 7.4070 121.4953 63.2644 37.9786 177.4633 81 A 4.1084 7.5782 118.7765 53.4295 18.4067 178.4701 82 K 4.2169 7.5027 116.6887 58.4229 33.0912 177.9824 83 E 4.1214 7.9061 119.2802 58.5323 28.9579 177.4018 84 N 4.7083 8.5536 115.0646 53.2701 39.0959 175.3064 85 E 4.5678 8.1874 120.1318 56.1514 30.4904 176.0313 86 L 4.5901 7.5150 117.5421 56.6656 43.5028 177.8708 87 R 3.9727 7.4885 117.9889 59.4692 29.7946 178.3929 88 T 4.0524 7.6292 114.0534 65.5398 68.7228 176.0454 89 K 4.1221 8.0405 122.7457 58.6620 32.3007 178.2200 90 A 3.9658 7.8126 120.2224 55.2516 18.4125 179.0378 91 E 3.9820 8.0106 116.0148 58.8715 29.7895 178.3365 92 E 4.5164 8.1204 117.7323 57.6848 31.0716 177.1881 93 E 4.1434 8.0492 114.6738 57.2254 29.9333 177.3118 94 A 4.3307 7.9820 120.7334 55.4124 19.3651 179.4532 95 D 4.3206 7.8840 116.8696 57.2043 40.6802 178.5813 96 K 3.9181 7.8510 119.6760 59.1744 32.2717 178.2090 97 L 4.1680 7.6257 120.0860 57.7069 42.3915 178.1640 98 N 4.2887 8.2279 116.0949 56.4622 38.5994 177.4001 99 K 4.3713 8.2895 114.7366 57.7269 32.2170 177.8106 100 E 4.3184 8.2454 120.1893 58.0023 30.0906 177.9039 101 V 3.6270 7.5433 117.9465 65.5690 31.6482 177.4858 102 E 3.9796 8.2397 118.6373 60.3397 29.2570 178.4326 103 D 4.4614 8.3769 118.6620 56.6312 40.8769 178.2862 104 L 3.6499 8.1655 117.8892 59.1400 42.5119 179.3882 105 T 3.8027 8.5785 114.3881 67.0964 68.8030 175.9310 106 A 4.0339 8.3650 121.8021 55.7403 18.5778 179.7111 107 S 4.4659 8.8291 113.5437 60.7697 62.2037 175.9155 108 L 3.9404 8.2955 122.5141 58.3644 42.1530 178.4677 109 F 4.2915 8.4737 120.4536 61.5148 39.1680 176.7960 110 D 4.3119 8.3927 118.4492 57.0935 40.5858 178.2894 111 E 4.1188 8.0979 118.1193 58.2483 29.2725 177.8171 112 A 4.2908 7.1295 118.8115 52.2871 18.5810 177.3161 113 N 4.6421 7.5359 117.1167 55.1321 41.2088 176.4124 114 N 4.4427 7.9818 114.3860 54.8986 38.6948 177.2100 115 L 3.8887 7.8867 122.4130 57.9215 42.5840 178.8496 116 V 3.6139 7.6559 117.3318 65.6975 31.2168 177.1960 117 A 3.9395 7.9692 120.5445 55.6138 18.3043 179.0888 118 D 4.4018 7.6478 115.8258 57.1556 40.8999 178.5912 119 A 4.1679 7.9457 121.0892 54.5962 18.3837 178.0893 120 R 4.2189 7.6274 115.2474 56.7539 31.5249 177.6745 *122 E 4.3392 8.1077 119.5699 56.3074 31.3178 177.6277 123 K 3.8428 7.2608 118.7182 59.8927 31.9172 177.8550 124 Y 3.8755 8.4304 115.4603 61.2883 37.9375 178.9889 125 A 4.0135 8.0502 120.8125 55.2691 18.4356 179.2178 126 I 3.9833 8.2958 117.2621 62.9055 36.6175 177.6481 127 E 4.1672 8.9199 121.5640 58.1281 29.4687 177.4799 128 I 4.1745 7.8157 118.6045 62.1482 37.2230 177.3203 129 L 4.1709 7.5723 119.9623 56.6705 41.5889 178.2289 130 N 4.5800 7.6471 116.5863 54.8018 38.7435 177.3911 131 K 3.9108 7.2664 118.3783 59.5070 32.3907 178.9762 132 R 3.8774 7.6668 118.3095 59.4539 29.5854 179.0775 133 L 4.2793 7.5610 117.3664 58.2298 41.3919 179.6341 134 T 4.0993 7.9837 114.2551 65.5585 68.7603 175.9428 135 E 4.3528 7.9696 119.8087 57.6480 29.8386 177.5331 136 Q 4.3790 8.3782 116.4651 56.4759 29.0769 176.2300 137 L 4.7468 7.2781 117.8410 54.3195 42.1616 177.0400 138 R 4.4915 7.7050 119.1360 56.9266 32.4738 176.9296 139 E 4.3050 8.2025 114.7364 56.7512 29.7797 176.6055 140 K 4.4963 7.9594 118.7678 56.1397 33.0483 175.3573 141 D 4.8277 7.4737 116.4711 54.2573 41.5045 176.8896 *143 L 4.2438 7.8977 115.7224 54.2229 43.5493 177.8278 144 L 4.6994 7.6852 117.7301 54.8898 44.0920 177.4074 145 D 4.5232 7.6949 117.1677 56.8408 41.0199 177.5699 146 T 4.2217 7.7310 112.7419 63.9635 69.1979 174.4050 147 L 4.1804 7.6864 128.0879 55.1125 42.1441 175.9256 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 8.04 4.34 0.00 1.72 1.71 0.92 0.62 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 8.16 4.21 0.00 2.01 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 2.32 2.37 0.00 33 E 8.81 4.26 0.00 2.07 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 2.32 2.44 0.00 34 Q 7.80 3.99 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 35 L 9.30 3.99 0.00 1.76 1.72 0.92 0.53 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 36 N 7.91 4.33 0.00 2.97 2.84 0.00 0.00 6.87 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 37 K 7.82 3.93 0.00 1.81 1.78 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.44 7.81 38 S 8.63 3.96 0.00 3.91 3.92 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 39 L 7.45 4.22 0.00 1.89 1.85 0.92 0.15 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 40 K 8.30 4.20 0.00 1.86 1.77 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.48 7.81 41 T 7.40 4.38 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 42 I 7.65 3.71 2.01 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 1.54 0.93 0.91 0.00 0.00 43 A 7.88 4.15 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 44 S 7.62 4.09 0.00 4.06 3.99 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 0.00 0.00 0.00 45 Q 8.71 3.94 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.54 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 46 K 8.32 3.83 0.00 1.92 1.97 0.00 1.71 0.00 0.00 1.66 0.00 0.00 3.17 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.48 7.81 47 A 7.77 3.94 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 8.03 3.91 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.75 3.67 2.03 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 1.40 0.68 0.98 0.00 0.00 50 E 8.70 4.16 0.00 2.02 2.03 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 2.33 2.38 0.00 51 N 8.19 4.44 0.00 3.00 2.87 0.00 0.00 6.52 7.39 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 52 Y 7.99 4.04 0.00 3.08 2.95 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 53 N 8.83 4.41 0.00 3.03 2.88 0.00 0.00 6.61 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 54 Q 7.95 3.97 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 55 L 7.91 3.86 0.00 1.82 1.42 0.91 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.69 3.38 0.00 1.32 1.63 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.07 7.81 57 E 7.89 3.90 0.00 2.27 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 2.31 2.35 0.00 58 D 8.77 4.36 0.00 2.82 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 59 Y 8.75 4.08 0.00 2.99 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 60 N 8.63 4.26 0.00 3.10 2.91 0.00 0.00 7.15 6.65 0.00 0.00 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 7.82 3.84 4.38 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 0.00 0.00 0.00 1.19 0.00 0.00 62 L 8.05 4.01 0.00 1.81 1.62 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.69 3.79 0.00 1.35 1.79 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.27 7.81 64 R 7.99 3.99 0.00 1.99 1.90 0.00 3.20 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.91 0.00 65 E 8.05 3.89 0.00 1.97 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 2.32 2.57 0.00 66 L 7.32 3.89 0.00 1.55 1.62 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.89 4.75 0.00 3.91 3.98 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 68 D 8.04 4.37 0.00 2.87 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 8.04 4.15 0.00 1.81 1.94 0.00 3.26 0.00 0.00 3.15 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.79 0.00 70 D 8.08 4.65 0.00 2.90 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 71 D 8.10 4.33 0.00 2.92 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 72 E 8.21 4.08 0.00 1.99 2.03 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 2.41 2.40 0.00 73 V 7.21 3.58 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 0.96 0.00 0.00 74 K 7.72 3.93 0.00 1.93 2.02 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.48 7.81 75 R 8.70 4.04 0.00 1.92 2.00 0.00 3.12 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 76 L 8.67 3.97 0.00 1.81 1.67 0.91 1.14 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 77 R 8.49 3.89 0.00 1.83 2.01 0.00 3.11 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 78 E 8.27 4.04 0.00 2.20 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 2.55 0.00 79 D 8.04 4.74 0.00 2.78 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 80 I 7.41 4.03 2.01 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 1.59 1.03 0.91 0.00 0.00 81 A 7.58 4.11 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 82 K 7.50 4.22 0.00 1.93 1.85 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.42 7.81 83 E 7.91 4.12 0.00 2.18 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 2.30 2.40 0.00 84 N 8.55 4.71 0.00 2.91 2.81 0.00 0.00 6.34 8.46 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 85 E 8.19 4.57 0.00 2.22 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 2.23 2.31 0.00 86 L 7.51 4.59 0.00 1.74 1.65 0.92 0.95 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 87 R 7.49 3.97 0.00 1.98 2.07 0.00 3.51 0.00 0.00 3.16 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 88 T 7.63 4.05 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 89 K 8.04 4.12 0.00 2.01 1.93 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.45 7.81 90 A 7.81 3.97 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 91 E 8.01 3.98 0.00 1.90 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 2.35 2.52 0.00 92 E 8.12 4.52 0.00 2.08 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 2.22 2.45 0.00 93 E 8.05 4.14 0.00 1.96 1.95 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 2.29 2.37 0.00 94 A 7.98 4.33 1.42 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 95 D 7.88 4.32 0.00 2.87 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 96 K 7.85 3.92 0.00 1.77 1.96 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.45 7.81 97 L 7.63 4.17 0.00 1.79 1.81 0.92 0.68 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 98 N 8.23 4.29 0.00 2.80 2.85 0.00 0.00 7.16 7.02 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 99 K 8.29 4.37 0.00 1.90 1.86 0.00 1.70 0.00 0.00 2.05 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.52 7.81 100 E 8.25 4.32 0.00 2.25 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 0.00 2.24 2.34 0.00 101 V 7.54 3.63 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 1.01 0.00 0.00 0.99 0.00 0.00 102 E 8.24 3.98 0.00 2.22 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 2.32 2.47 0.00 103 D 8.38 4.46 0.00 2.82 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 3.65 0.00 1.75 1.71 0.93 0.85 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 0.00 105 T 8.58 3.80 4.33 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 1.20 0.00 0.00 106 A 8.37 4.03 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.83 4.47 0.00 3.87 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 0.00 108 L 8.30 3.94 0.00 1.69 2.03 0.94 0.78 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 8.47 4.29 0.00 3.16 3.30 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 0.00 110 D 8.39 4.31 0.00 2.90 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 0.00 111 E 8.10 4.12 0.00 2.11 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 2.46 2.45 0.00 112 A 7.13 4.29 1.16 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 0.00 0.00 113 N 7.54 4.64 0.00 2.67 2.64 0.00 0.00 7.07 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 7.98 4.44 0.00 2.73 2.82 0.00 0.00 6.63 6.09 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 0.00 115 L 7.89 3.89 0.00 2.01 1.58 0.90 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.66 3.61 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 0.97 0.00 0.00 0.96 0.00 0.00 117 A 7.97 3.94 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 0.00 118 D 7.65 4.40 0.00 2.64 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 0.00 119 A 7.95 4.17 1.40 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 0.00 0.00 0.00 120 R 7.63 4.22 0.00 1.81 1.96 0.00 3.48 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.83 0.00 *122 E 8.11 4.34 0.00 2.08 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 2.31 2.52 0.00 123 K 7.26 3.84 0.00 2.12 1.92 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.49 7.81 124 Y 8.43 3.88 0.00 3.01 3.04 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 0.00 125 A 8.05 4.01 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 0.00 126 I 8.30 3.98 1.95 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 1.63 1.12 0.91 0.00 0.00 127 E 8.92 4.17 0.00 1.99 1.95 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 2.17 2.24 0.00 128 I 7.82 4.17 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.95 0.92 0.00 0.00 129 L 7.57 4.17 0.00 1.80 1.71 0.93 0.75 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 0.00 130 N 7.65 4.58 0.00 2.94 2.84 0.00 0.00 6.46 7.54 0.00 0.00 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 7.27 3.91 0.00 1.83 2.00 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.74 1.47 7.81 132 R 7.67 3.88 0.00 1.84 1.96 0.00 3.19 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 133 L 7.56 4.28 0.00 1.72 1.72 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.98 4.10 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 1.20 0.00 0.00 135 E 7.97 4.35 0.00 2.24 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 2.27 2.53 0.00 136 Q 8.38 4.38 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.63 0.00 137 L 7.28 4.75 0.00 1.66 1.63 0.92 0.79 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 0.00 138 R 7.70 4.49 0.00 2.00 1.90 0.00 3.15 0.00 0.00 3.33 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.84 0.00 139 E 8.20 4.31 0.00 1.97 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 2.46 0.00 140 K 7.96 4.50 0.00 1.80 1.81 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.42 7.81 141 D 7.47 4.83 0.00 2.77 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 *143 L 7.90 4.24 0.00 1.66 1.74 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.69 4.70 0.00 1.67 1.66 1.02 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 145 D 7.69 4.52 0.00 2.79 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 0.00 146 T 7.73 4.22 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 0.00 147 L 7.69 4.18 0.00 1.77 1.60 0.92 0.85 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 * Residues marked with a * may have inaccurate shift predictions.