NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2239 8.4449 116.7527 55.6338 30.4087 175.0188 3 L 4.2864 8.0753 126.6604 52.5877 42.4608 174.3944 4 I 4.5904 8.4170 125.7308 60.4631 38.8016 175.4006 5 V 4.3746 8.9981 127.0164 61.1155 34.4619 173.8773 6 N 5.0661 8.8814 125.7850 52.1091 40.1141 174.2498 7 V 4.6538 8.6737 125.8551 61.6935 33.2479 174.6352 8 I 4.9579 9.0848 129.4053 59.6014 40.3941 174.1809 9 N 5.3617 9.2541 125.1627 51.6636 40.6476 175.6620 10 G 4.2258 9.3793 115.1595 44.0949 0.0000 170.6493 11 P 4.4232 0.0000 0.0000 64.5327 31.4574 176.4783 12 N 4.4076 9.1661 117.5201 53.8088 36.7587 175.8202 13 L 4.3311 7.5458 117.3854 55.8547 42.2076 178.7016 14 G 3.6471 7.9418 106.4168 47.2557 0.0000 174.4688 15 R 4.2337 7.3472 117.2602 56.0056 30.8094 176.5435 16 L 3.8384 7.3689 120.7463 57.0715 42.2763 177.4560 17 G 4.0899 9.5712 114.2681 45.8926 0.0000 173.3587 18 R 4.5620 7.6199 116.3775 55.3449 31.4660 175.5437 *25 G 3.7095 8.2193 105.6153 45.6614 0.0000 173.6813 26 G 3.9995 8.5246 110.9089 45.1940 0.0000 173.1361 27 T 4.1432 7.8076 117.6930 63.3701 68.8354 175.1750 28 T 4.9737 8.6077 119.3323 60.8286 71.1002 175.1454 29 H 4.0814 8.6405 120.6021 59.4248 30.0171 176.9206 30 D 4.3224 8.1032 120.2581 57.5965 40.7780 178.5922 31 E 3.9828 7.8593 117.7989 59.1163 29.3973 179.1951 32 L 3.8347 7.8287 120.6494 57.7874 42.1025 179.1310 33 V 3.3488 7.7700 118.0905 65.9999 31.5369 177.8867 34 A 4.1938 7.6935 121.3954 54.5327 18.2960 179.3660 35 L 3.9048 7.8239 118.7244 58.1860 42.1509 179.3743 36 I 3.6830 7.6334 119.7243 64.4194 37.1960 178.1414 37 E 3.9383 8.1012 119.4067 59.3634 29.3894 179.3774 38 R 3.9579 7.9741 118.5694 59.5481 29.7215 178.2313 39 E 3.9310 8.1156 118.5217 59.0659 29.5847 178.5712 40 A 4.0581 8.5526 121.0435 55.2312 18.3443 179.5189 41 A 4.0498 8.2162 119.3801 55.0579 18.1819 178.7403 42 E 4.4289 7.8136 114.0131 56.7161 29.6658 177.0744 43 L 4.6453 6.9979 117.5537 53.6514 43.3217 176.5269 44 G 3.8499 7.9017 106.5327 46.6774 0.0000 173.5885 45 L 4.9794 8.1990 117.8633 52.3286 45.8858 176.2516 46 K 4.4963 8.8573 123.0774 54.8707 33.9919 174.6514 47 A 5.0716 8.5798 129.4575 50.3403 20.9118 175.8025 48 V 4.0782 8.7112 123.7728 61.3024 33.3585 174.5217 49 V 4.7229 8.1914 128.3887 61.2220 33.0978 174.9487 50 R 4.5832 8.6859 125.8961 54.3769 34.5671 173.9028 51 Q 5.1990 8.6295 122.1389 54.6543 32.0291 174.2443 52 S 4.8025 9.1119 119.4320 57.3717 65.4592 173.6357 53 D 4.5401 8.9019 124.5208 55.0921 41.5911 176.8205 54 S 4.4548 7.7542 115.3068 56.7510 63.3049 173.7385 55 E 3.8453 8.7562 129.9526 59.3897 29.5261 178.3166 56 A 3.8892 7.9026 120.1831 55.3506 18.5140 179.2604 57 Q 3.4571 7.5580 117.8846 59.0429 29.0995 178.4278 58 L 3.9736 7.6510 120.0557 57.6311 41.6220 179.4259 59 L 3.8670 8.1083 119.3959 57.6502 41.5148 179.0097 60 D 4.3135 7.7718 117.7748 57.2706 41.2783 178.4371 61 W 4.5075 7.8295 119.1257 59.9115 28.9930 178.6559 62 I 3.8772 7.9078 119.7513 64.4968 36.4386 178.1754 63 H 4.3090 8.3042 117.2429 59.0628 28.5450 177.8680 64 Q 4.0331 8.2609 119.6372 58.9893 28.5363 178.7532 65 A 4.0945 8.1659 121.2300 54.7020 18.2164 179.6778 66 A 3.9622 8.0193 119.7732 55.5744 18.3144 179.6661 67 D 4.3255 8.3170 116.0870 56.6389 40.9619 177.8156 68 A 4.4351 7.9191 118.3930 50.6346 19.5820 176.4085 69 A 3.7359 7.4251 119.2128 53.0719 16.8809 177.0445 70 E 4.7628 8.0588 118.5005 55.5343 31.3255 175.3330 71 P 4.6400 0.0000 0.0000 63.0334 33.1187 175.0633 72 V 4.9161 8.4431 120.4885 61.3116 34.8712 174.0700 73 I 4.7950 9.0158 129.1535 59.7208 39.0922 174.2962 74 L 5.1599 9.0257 129.8184 53.1825 45.1065 174.5264 75 N 5.2167 9.4133 125.1523 51.0748 40.1144 174.6184 76 A 4.1802 8.7033 129.1313 52.1162 20.1570 178.3393 77 G 4.0063 7.9713 105.4375 46.5205 0.0000 178.3624 78 G 3.7380 8.7294 113.5210 47.8984 0.0000 174.8988 79 L 4.2703 7.6682 121.2429 56.6103 41.4534 179.1274 80 T 3.9091 7.5894 116.3648 66.5667 68.2059 175.0077 81 H 5.1589 7.9731 116.2278 55.3785 29.5451 175.6512 82 T 4.6249 7.7639 108.8177 60.7477 70.3989 173.0169 83 S 4.5856 8.1121 117.6200 56.5648 62.6333 174.5340 84 V 3.3578 7.9184 128.4086 65.5362 31.4393 177.4159 85 A 3.9389 7.8433 120.2513 55.1250 18.2220 179.2390 86 L 3.8902 7.9419 118.7519 58.0877 42.1097 178.9585 87 R 3.9202 7.5754 117.3520 59.7741 29.7830 178.2477 88 D 4.3696 8.0596 117.0325 57.2099 40.9648 178.3395 89 A 4.1930 7.9472 121.0168 55.4665 18.3286 179.4865 90 C 4.2451 8.3133 114.4542 62.2598 27.9262 175.9256 91 A 4.1180 7.5648 121.4270 54.5985 18.0091 178.4899 92 E 4.0638 7.8708 116.1024 58.6232 29.8568 177.5406 93 L 4.1390 7.5352 120.1630 54.8265 41.8707 177.0682 94 S 4.3734 8.6910 118.2799 60.0299 64.0471 174.6389 95 A 4.3921 7.7000 121.1549 50.4551 19.5782 175.7296 96 P 4.3725 0.0000 0.0000 63.0777 32.9359 175.0757 97 L 5.1965 8.7868 124.9615 53.3846 44.8908 174.8838 98 I 4.8097 8.5935 127.3531 59.4442 39.8350 174.4073 99 E 4.6915 8.9677 129.0718 55.5604 31.1413 175.2174 100 V 4.7596 8.6385 126.0718 61.3375 35.1241 173.7193 101 H 4.7661 9.0338 124.2716 54.1913 31.9024 174.2738 102 I 3.9861 8.7092 124.7334 64.5536 37.7261 177.0884 103 S 4.5732 7.9396 114.2838 57.3292 64.2179 173.3895 104 N 4.5833 8.3614 119.4043 52.4919 37.6992 175.8665 105 V 3.6317 8.1232 120.0362 64.1069 31.8027 177.3859 106 H 4.3460 8.0649 114.6025 56.7555 28.8134 175.6161 107 A 4.6314 7.8030 121.4862 51.7656 19.8527 177.5594 108 R 4.7043 7.2048 116.1745 55.8552 31.7248 175.6558 109 E 3.9578 8.2001 122.1425 57.0049 30.4125 177.5933 110 E 3.9078 8.5335 122.2299 59.0871 29.6968 179.1499 111 F 4.3775 7.7348 114.1600 59.4011 37.8678 176.9475 112 R 3.7350 6.8281 116.7205 57.4522 30.0270 177.1966 113 R 4.0453 7.4462 116.2819 56.6111 30.5967 175.4692 114 H 4.8006 7.8235 118.2020 54.0440 31.4410 172.8708 115 S 4.7992 8.0425 120.5702 56.5408 64.5362 173.4665 116 Y 4.2122 8.5778 125.3281 60.3172 38.4460 177.1290 117 L 4.2803 7.9836 119.8411 57.3726 42.2556 178.8377 118 S 4.1996 8.1379 114.8451 61.3381 62.9274 175.2391 119 P 4.2675 0.0000 0.0000 64.9123 31.1268 177.1717 120 I 4.1218 7.5048 108.6001 60.8111 38.2906 175.7453 121 A 4.4160 7.2818 123.8775 51.8600 19.5426 177.8538 122 T 4.0705 8.7637 117.4796 66.3482 68.7912 175.1904 123 G 4.1468 7.6920 105.9950 44.7054 0.0000 171.0127 124 V 4.8792 8.0741 118.7325 61.0111 34.5410 174.3219 125 I 4.5169 9.0256 128.6733 59.4757 39.7566 174.7757 126 V 4.6715 8.2264 126.1172 62.3794 34.0355 175.6624 127 G 3.9864 9.3001 116.1434 45.6130 0.0000 173.2362 128 L 4.4623 7.6873 118.4173 54.4004 42.6209 178.7559 129 G 3.7916 7.7912 108.1065 46.3370 0.0000 175.7624 130 I 3.9796 8.2652 117.3498 63.8904 38.0291 178.2726 131 Q 4.2119 8.2407 119.9069 58.3031 29.0181 177.7336 132 G 3.6249 7.9011 107.1425 48.2693 0.0000 175.2110 133 Y 4.0711 7.7258 118.2789 61.0387 38.0644 178.7633 134 L 4.1080 7.9303 119.3753 57.7074 41.7684 179.3841 135 L 4.0939 8.3840 119.1435 57.4838 41.5203 179.3465 136 A 4.0486 7.9905 120.6193 54.9621 18.2925 179.5503 137 L 3.9873 8.1409 117.6246 58.1391 41.3565 179.8245 138 R 3.9347 8.0039 118.1189 59.3470 30.0734 177.9134 139 Y 4.0894 7.9617 119.1415 60.8148 38.6189 178.1905 140 L 3.9993 7.8003 117.9285 57.6171 41.7844 179.1042 141 A 4.0871 8.1029 119.9473 54.3774 18.3343 178.3936 142 E 4.2102 7.5401 115.8672 57.0744 30.1343 175.5891 143 H 4.2916 7.5865 119.7647 55.8161 29.2298 173.4442 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 E 8.44 4.22 0.00 2.01 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 2.13 1.91 0.00 3 L 8.08 4.29 0.00 1.67 1.65 0.91 0.54 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 4 I 8.42 4.59 1.98 0.00 0.00 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 1.22 0.65 0.89 0.00 0.00 5 V 9.00 4.37 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 1.10 0.00 0.00 0.95 0.00 0.00 6 N 8.88 5.07 0.00 2.80 2.69 0.00 0.00 6.20 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 7 V 8.67 4.65 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 1.01 0.00 0.00 0.96 0.00 0.00 8 I 9.08 4.96 1.96 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.54 1.18 0.00 0.00 9 N 9.25 5.36 0.00 2.70 2.80 0.00 0.00 6.47 8.40 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 10 G 9.38 4.23 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 0.00 11 P 0.00 4.42 0.00 2.08 2.04 0.00 4.06 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.30 0.00 12 N 9.17 4.41 0.00 2.99 3.00 0.00 0.00 6.88 6.89 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 13 L 7.55 4.33 0.00 1.95 1.78 1.11 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14 G 7.94 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 7.35 4.23 0.00 2.05 2.00 0.00 3.37 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 16 L 7.37 3.84 0.00 2.04 1.61 0.97 1.12 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 17 G 9.57 4.09 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 0.00 18 R 7.62 4.56 0.00 1.74 1.89 0.00 3.30 0.00 0.00 3.40 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 *25 G 8.22 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 26 G 8.52 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.81 4.14 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 1.19 0.00 0.00 28 T 8.61 4.97 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 29 H 8.64 4.08 0.00 3.20 3.33 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.10 4.32 0.00 2.72 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 31 E 7.86 3.98 0.00 2.20 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 2.31 2.30 0.00 32 L 7.83 3.83 0.00 1.62 1.56 0.50 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.77 3.35 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 0.87 0.00 0.00 0.79 0.00 0.00 34 A 7.69 4.19 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 35 L 7.82 3.90 0.00 1.96 1.75 0.91 0.98 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 36 I 7.63 3.68 1.89 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.31 0.88 0.00 0.00 37 E 8.10 3.94 0.00 2.13 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 2.35 0.00 38 R 7.97 3.96 0.00 2.06 2.05 0.00 3.09 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 39 E 8.12 3.93 0.00 2.24 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 0.00 2.33 2.38 0.00 40 A 8.55 4.06 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 41 A 8.22 4.05 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 42 E 7.81 4.43 0.00 2.18 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 2.42 0.00 43 L 7.00 4.65 0.00 1.89 1.64 0.96 0.87 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 44 G 7.90 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 45 L 8.20 4.98 0.00 1.56 1.53 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.86 4.50 0.00 1.81 1.65 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.35 7.81 47 A 8.58 5.07 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 48 V 8.71 4.08 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 0.84 0.00 0.00 0.87 0.00 0.00 49 V 8.19 4.72 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 0.71 0.00 0.00 0.83 0.00 0.00 50 R 8.69 4.58 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.65 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.10 0.00 51 Q 8.63 5.20 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.12 0.00 52 S 9.11 4.80 0.00 3.91 3.59 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 0.00 0.00 0.00 0.00 53 D 8.90 4.54 0.00 2.70 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 54 S 7.75 4.45 0.00 3.84 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.76 3.85 0.00 2.03 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 2.33 2.35 0.00 56 A 7.90 3.89 1.24 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 0.00 0.00 0.00 57 Q 7.56 3.46 0.00 1.80 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 1.65 1.16 0.00 58 L 7.65 3.97 0.00 1.85 1.73 0.95 0.83 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 59 L 8.11 3.87 0.00 1.72 1.56 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 60 D 7.77 4.31 0.00 2.79 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.83 4.51 0.00 3.64 3.05 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 62 I 7.91 3.88 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.76 0.96 0.00 0.00 63 H 8.30 4.31 0.00 3.39 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.26 4.03 0.00 2.39 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.67 0.00 65 A 8.17 4.09 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 66 A 8.02 3.96 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 67 D 8.32 4.33 0.00 2.83 2.77 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 0.00 0.00 0.00 0.00 68 A 7.92 4.44 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 69 A 7.43 3.74 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 70 E 8.06 4.76 0.00 1.88 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 2.29 2.44 0.00 71 P 0.00 4.64 0.00 2.15 2.22 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 72 V 8.44 4.92 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 1.13 0.00 0.00 0.97 0.00 0.00 73 I 9.02 4.79 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 1.14 0.49 0.94 0.00 0.00 74 L 9.03 5.16 0.00 1.73 1.48 1.06 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 75 N 9.41 5.22 0.00 2.77 3.01 0.00 0.00 6.97 7.68 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 76 A 8.70 4.18 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 77 G 7.97 4.01 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 0.00 0.00 0.00 78 G 8.73 3.74 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 0.00 0.00 0.00 79 L 7.67 4.27 0.00 1.81 1.74 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 80 T 7.59 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 1.24 0.00 0.00 81 H 7.97 5.16 0.00 3.26 3.48 0.00 5.56 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.76 4.62 4.28 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 1.34 0.00 0.00 83 S 8.11 4.59 0.00 3.86 3.87 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 0.00 0.00 0.00 84 V 7.92 3.36 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 0.89 0.00 0.00 0.40 0.00 0.00 85 A 7.84 3.94 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 86 L 7.94 3.89 0.00 1.77 1.67 0.91 0.80 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 87 R 7.58 3.92 0.00 2.01 2.11 0.00 3.47 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 88 D 8.06 4.37 0.00 2.83 2.72 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 89 A 7.95 4.19 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 90 C 8.31 4.25 0.00 3.16 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 91 A 7.56 4.12 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 92 E 7.87 4.06 0.00 2.18 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 2.36 2.30 0.00 93 L 7.54 4.14 0.00 1.69 1.79 0.99 1.04 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 94 S 8.69 4.37 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.70 4.39 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 96 P 0.00 4.37 0.00 2.21 2.15 0.00 3.58 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.17 0.00 97 L 8.79 5.20 0.00 1.77 1.50 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.59 4.81 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.64 0.79 0.00 0.00 99 E 8.97 4.69 0.00 2.01 1.76 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 0.00 2.21 2.20 0.00 100 V 8.64 4.76 1.64 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 0.11 0.00 0.00 0.69 0.00 0.00 101 H 9.03 4.77 0.00 3.01 3.21 0.00 5.67 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.71 3.99 1.93 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.20 0.97 0.00 0.00 103 S 7.94 4.57 0.00 3.98 3.89 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 0.00 0.00 0.00 104 N 8.36 4.58 0.00 2.74 2.76 0.00 0.00 6.88 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 0.00 105 V 8.12 3.63 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 0.59 0.00 0.00 0.63 0.00 0.00 106 H 8.06 4.35 0.00 3.26 3.30 0.00 5.64 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.80 4.63 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 0.00 0.00 108 R 7.20 4.70 0.00 1.60 1.58 0.00 3.18 0.00 0.00 3.15 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.68 0.00 109 E 8.20 3.96 0.00 1.16 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 2.40 2.25 0.00 110 E 8.53 3.91 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 2.36 2.33 0.00 111 F 7.73 4.38 0.00 3.29 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 0.00 112 R 6.83 3.73 0.00 1.62 1.76 0.00 2.91 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.67 0.00 113 R 7.45 4.05 0.00 1.92 1.96 0.00 3.08 0.00 0.00 3.12 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.43 0.00 114 H 7.82 4.80 0.00 3.12 3.11 0.00 5.52 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.04 4.80 0.00 3.78 3.62 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 0.00 116 Y 8.58 4.21 0.00 3.05 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 0.00 117 L 7.98 4.28 0.00 1.73 1.72 0.93 0.81 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 0.00 118 S 8.14 4.20 0.00 3.88 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 0.00 119 P 0.00 4.27 0.00 2.06 2.13 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 120 I 7.50 4.12 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.64 0.94 0.00 0.00 121 A 7.28 4.42 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 0.00 122 T 8.76 4.07 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 1.25 0.00 0.00 123 G 7.69 4.15 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 0.00 0.00 0.00 124 V 8.07 4.88 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 0.89 0.00 0.00 0.92 0.00 0.00 125 I 9.03 4.52 1.76 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 1.03 0.57 0.85 0.00 0.00 126 V 8.23 4.67 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 0.82 0.00 0.00 0.94 0.00 0.00 127 G 9.30 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 0.00 0.00 0.00 128 L 7.69 4.46 0.00 1.63 1.68 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 129 G 7.79 3.79 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 0.00 0.00 0.00 130 I 8.27 3.98 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 1.27 0.95 0.00 0.00 131 Q 8.24 4.21 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.62 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 132 G 7.90 3.62 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 0.00 0.00 0.00 133 Y 7.73 4.07 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.93 4.11 0.00 1.84 1.75 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.38 4.09 0.00 1.68 1.73 0.92 1.20 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 0.00 136 A 7.99 4.05 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 0.00 137 L 8.14 3.99 0.00 1.97 1.77 0.95 0.71 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 0.00 138 R 8.00 3.93 0.00 2.07 2.12 0.00 3.13 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 139 Y 7.96 4.09 0.00 3.09 3.13 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 0.00 140 L 7.80 4.00 0.00 1.86 1.75 0.98 1.22 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 0.00 141 A 8.10 4.09 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 0.00 142 E 7.54 4.21 0.00 2.12 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 2.23 2.29 0.00 143 H 7.59 4.29 0.00 2.76 2.96 0.00 5.93 0.00 0.00 0.00 0.00 6.91 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.