NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.1503 8.0214 115.2432 62.0359 69.1521 175.6150 *5 G 3.8871 8.1103 110.7427 45.5932 0.0000 175.4193 6 N 4.3227 8.1147 117.7534 55.7985 38.5045 177.1119 7 L 3.9525 8.2707 122.0418 58.1945 42.2388 178.6699 8 Q 3.9757 8.1018 119.0070 59.5733 28.7034 178.2128 9 T 3.8645 7.7761 115.5372 66.7516 68.6683 176.0506 10 A 4.1902 7.7562 121.7938 55.0995 18.3041 179.7547 11 I 3.6513 7.8392 118.3755 64.6178 37.0175 178.2155 12 N 4.5252 8.1524 115.2779 55.0103 38.7039 175.7940 13 D 4.6889 7.6930 119.1996 54.0607 41.2832 177.5595 14 K 4.5001 8.0233 122.3661 59.7572 32.1427 178.8489 15 S 4.1556 8.0664 114.2415 61.5039 62.7803 176.5089 16 G 3.5741 7.9585 107.9300 47.5807 0.0000 175.3664 17 T 3.9388 7.9311 118.0030 66.4894 68.2683 176.7883 18 L 3.0482 7.8296 119.1286 56.4291 41.6566 178.2951 19 A 4.4110 7.4206 119.1605 51.3479 19.6146 177.0692 20 S 4.6070 7.4958 113.3715 56.7821 64.9139 175.3409 21 Q 3.9393 8.6459 122.9199 59.4802 28.6293 178.3275 22 N 4.3897 8.1312 117.7348 56.3006 39.0009 176.5321 23 F 3.9909 8.0088 122.3391 61.2401 39.4167 177.2414 24 L 3.9343 8.1470 117.4791 57.5639 41.8477 178.0068 25 D 4.6011 8.1641 115.7606 53.6985 41.2801 176.3856 26 A 4.3406 7.3236 122.7767 51.7552 19.0845 178.0201 27 D 4.4223 8.5834 120.1209 54.6762 42.7331 178.0724 28 E 3.8454 8.7422 123.2001 59.5170 29.6158 179.3361 29 Q 3.9842 7.9943 117.1825 59.2403 28.6497 178.6253 30 K 4.0172 7.9281 119.9463 59.0325 32.1238 179.3026 31 R 3.8973 8.0659 118.5493 59.3638 29.9591 178.7537 32 N 4.3586 8.4829 116.1625 56.3221 38.5754 177.1201 33 A 4.0307 8.2471 122.2320 55.4207 18.5575 179.0914 34 Y 4.0245 8.1509 117.7619 61.0089 38.9659 177.8769 35 N 4.1803 8.5826 117.5667 56.5226 38.6474 177.4825 36 Q 3.9759 8.6105 119.5811 58.7427 28.7593 178.6468 37 A 3.9269 7.9758 121.9179 55.0964 18.3342 179.8396 38 V 3.3699 7.5725 116.8088 66.1780 31.4632 178.4667 39 S 4.1876 8.0146 114.6886 61.5115 62.5181 176.4800 40 A 3.9358 8.1585 123.3166 55.1172 18.0119 179.5949 41 A 3.9331 8.0298 119.2864 55.3001 18.2174 179.7416 42 E 3.8932 8.2297 116.5224 59.6934 29.5616 179.2856 43 T 4.0089 7.8608 115.0771 66.6900 68.6076 176.3977 44 I 3.8460 7.2201 120.1705 64.0420 38.4324 178.6297 45 L 4.1799 7.8188 118.7274 53.6358 38.5424 177.0472 *54 A 4.0954 7.2907 124.3927 52.2040 20.6402 178.6676 55 K 3.9343 8.7498 126.4693 60.2662 31.6503 178.9272 56 T 4.0748 7.9906 110.3705 64.8158 68.4685 176.1812 57 A 3.9714 7.9000 123.0758 54.6452 18.5295 179.6525 58 V 3.5122 7.7460 116.6886 66.1629 31.6336 178.0758 59 E 4.0408 8.7613 121.2176 60.2019 29.2297 180.1069 60 Q 4.0063 8.3072 120.4586 60.0668 28.2078 180.1166 61 A 4.1586 7.9966 123.0275 54.8573 18.3446 179.5229 62 L 3.8858 7.9969 118.6965 58.3970 42.1363 178.7123 63 N 4.3092 8.2336 116.4191 56.7130 38.5157 177.1446 64 N 4.3466 8.4288 117.8268 56.1109 38.5331 177.7624 65 V 3.5727 7.9237 119.6282 66.1456 31.7189 177.8195 66 N 4.3899 8.5199 116.6022 56.5063 38.3829 177.2065 67 N 4.3801 8.5651 117.8684 56.2997 38.4202 177.3874 68 A 4.1064 7.9234 121.2141 54.9338 18.7380 179.3645 69 K 3.9764 8.5097 118.3605 60.0128 32.1458 178.6825 70 H 4.1587 8.2861 117.0039 59.0141 29.8247 176.7098 71 A 4.1394 7.8535 121.5103 53.1519 18.6504 177.8968 72 L 4.0762 7.1546 117.5895 55.3646 42.2343 176.7976 73 N 5.0549 8.4625 119.2471 51.7099 38.3359 176.6987 74 G 3.6662 8.5546 108.6670 48.9419 0.0000 175.9338 75 T 3.9450 8.0526 117.9635 66.5170 68.4563 176.2886 76 Q 3.9543 8.0560 120.7217 59.4636 29.0068 178.0615 77 N 4.2828 8.3833 117.5209 56.0591 38.4550 177.0572 78 L 3.9141 8.2223 122.0082 58.4083 42.2428 178.8141 79 N 4.3295 8.2404 116.3001 56.3360 38.3781 177.1320 80 N 4.2831 8.4990 117.9124 56.2993 38.6408 177.2644 81 A 3.9728 8.1467 122.1051 55.0555 18.4567 179.7213 82 K 3.8623 8.3635 117.3831 59.8514 32.0872 179.3969 83 Q 3.9733 8.1772 119.4410 58.8405 28.9160 177.9336 84 A 3.9511 8.3111 122.0620 54.8166 18.3315 179.3834 85 A 3.9067 8.1542 119.3480 55.4879 18.4956 179.8942 86 I 3.6396 7.8563 118.2500 64.8270 37.1468 178.8219 87 T 3.8431 8.2266 116.5317 66.6361 68.0780 176.5284 88 A 4.0058 7.7534 121.4044 55.1767 18.6423 179.5041 89 I 3.8160 7.9052 118.4212 64.6484 36.9854 178.4284 90 N 4.4982 8.4663 116.7415 56.0013 38.4076 176.7928 91 G 4.1464 7.9798 104.0417 44.1392 0.0000 174.5651 92 A 4.4589 7.7075 125.2179 50.3525 18.2782 178.4123 93 S 4.1001 8.3613 118.0629 61.4991 63.5903 175.8231 94 D 4.5650 8.3069 119.4053 55.1228 41.0806 176.6435 95 L 4.3932 7.3325 120.1872 54.1168 42.4303 177.1033 96 N 4.7435 8.9285 121.0653 51.8489 40.0375 176.1954 97 Q 3.9156 8.4564 120.4748 59.0877 28.9889 177.9993 98 K 3.9043 8.0470 120.1126 59.5647 32.3829 178.6616 99 Q 3.9316 8.5872 118.3544 58.9259 28.6243 178.5615 100 K 3.8590 8.2052 119.7496 59.9101 32.1807 178.8871 101 D 4.3477 8.3192 118.5964 57.3582 40.7204 178.8701 102 A 3.9993 8.0151 121.1460 55.2419 18.3791 179.7624 103 L 3.9848 8.0323 117.5171 57.7509 41.5670 179.8892 104 K 3.9453 8.5055 118.7635 59.2183 32.0042 179.0486 105 A 3.9826 8.0788 121.0353 55.3910 18.0834 179.5688 106 Q 3.9123 7.8257 114.7609 59.0687 29.2396 178.8576 107 A 4.1389 8.1240 121.5630 55.4811 18.2970 179.5881 108 N 4.4658 8.3839 113.7663 55.7921 38.6646 177.0341 109 G 3.8720 7.8210 104.5466 43.7755 0.0000 173.8975 110 A 4.0413 7.1660 124.3671 52.9557 18.6855 177.6225 111 Q 4.4087 8.7361 120.9509 56.3984 30.2133 176.0174 112 R 4.8362 7.9311 116.1941 53.1778 34.2711 176.0918 113 V 3.6059 8.8518 120.5769 66.5654 31.3398 178.8904 114 S 4.1091 8.0084 113.1388 61.3779 62.8543 176.1512 115 N 4.3282 8.0409 119.7301 56.0490 38.3033 177.2498 116 A 4.0219 7.9108 121.7633 55.2495 18.5788 179.5015 117 Q 3.9884 8.4181 116.8895 59.1614 28.6650 178.8550 118 D 4.3633 8.3157 120.0360 57.2352 40.7808 178.8308 119 V 3.5709 7.8284 118.7623 66.0241 31.5030 177.6819 120 Q 3.9279 8.0568 119.1792 59.5062 28.8847 177.7863 121 H 4.0334 8.2747 118.9904 59.5111 29.8249 176.8817 122 N 4.3429 8.6009 118.3169 56.2147 38.2644 177.2051 123 A 3.9730 8.2419 122.3305 55.5063 18.5838 179.9268 124 T 3.7755 7.8465 114.1677 66.6265 68.3319 176.5736 125 E 3.8579 8.2095 120.3533 59.2839 29.7177 178.3267 126 L 4.0673 7.9200 119.2404 58.1847 42.2282 178.0689 127 N 4.4180 8.3677 116.5883 56.0065 38.9378 175.1365 128 T 4.2966 7.5890 114.3346 61.7985 69.2591 174.1304 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 3 T 8.02 4.15 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 *5 G 8.11 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 0.00 0.00 0.00 6 N 8.11 4.32 0.00 2.94 2.89 0.00 0.00 6.71 6.74 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 7 L 8.27 3.95 0.00 1.83 1.65 0.91 0.67 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 8 Q 8.10 3.98 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.64 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 9 T 7.78 3.86 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 10 A 7.76 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 11 I 7.84 3.65 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.08 0.88 0.00 0.00 12 N 8.15 4.53 0.00 2.78 2.88 0.00 0.00 6.98 7.46 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 13 D 7.69 4.69 0.00 2.89 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 14 K 8.02 4.50 0.00 1.81 2.00 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.29 7.81 15 S 8.07 4.16 0.00 4.06 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 16 G 7.96 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.93 3.94 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 0.57 0.00 0.00 18 L 7.83 3.05 0.00 1.58 1.46 0.81 0.11 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 19 A 7.42 4.41 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 20 S 7.50 4.61 0.00 4.02 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Q 8.65 3.94 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 22 N 8.13 4.39 0.00 2.86 2.79 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 23 F 8.01 3.99 0.00 3.04 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 24 L 8.15 3.93 0.00 1.70 1.76 1.02 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 25 D 8.16 4.60 0.00 2.82 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 26 A 7.32 4.34 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.58 4.42 0.00 2.68 2.59 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 28 E 8.74 3.85 0.00 1.99 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 2.36 2.35 0.00 29 Q 7.99 3.98 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 30 K 7.93 4.02 0.00 1.92 1.89 0.00 1.76 0.00 0.00 2.03 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.52 7.81 31 R 8.07 3.90 0.00 1.87 1.74 0.00 2.21 0.00 0.00 2.73 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.63 0.00 32 N 8.48 4.36 0.00 2.90 2.90 0.00 0.00 6.95 8.49 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 33 A 8.25 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 34 Y 8.15 4.02 0.00 3.25 3.40 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 35 N 8.58 4.18 0.00 3.02 2.87 0.00 0.00 7.11 8.02 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 36 Q 8.61 3.98 0.00 2.05 2.14 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 2.38 2.47 0.00 37 A 7.98 3.93 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 38 V 7.57 3.37 1.73 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 0.98 0.00 0.00 0.20 0.00 0.00 39 S 8.01 4.19 0.00 4.01 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.16 3.94 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 41 A 8.03 3.93 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 42 E 8.23 3.89 0.00 2.05 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 2.31 2.43 0.00 43 T 7.86 4.01 4.41 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 1.20 0.00 0.00 44 I 7.22 3.85 2.01 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 1.51 0.55 0.90 0.00 0.00 45 L 7.82 4.18 0.00 1.73 1.65 0.93 0.81 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 *54 A 7.29 4.10 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 55 K 8.75 3.93 0.00 1.77 1.85 0.00 1.81 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.08 7.81 56 T 7.99 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 57 A 7.90 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 58 V 7.75 3.51 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 1.02 0.00 0.00 1.00 0.00 0.00 59 E 8.76 4.04 0.00 2.26 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 2.33 0.00 60 Q 8.31 4.01 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 61 A 8.00 4.16 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 62 L 8.00 3.89 0.00 1.86 1.88 0.93 0.46 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 63 N 8.23 4.31 0.00 3.11 2.87 0.00 0.00 7.10 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.43 4.35 0.00 2.92 2.87 0.00 0.00 6.71 8.48 0.00 0.00 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 V 7.92 3.57 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 1.18 0.00 0.00 0.98 0.00 0.00 66 N 8.52 4.39 0.00 2.77 2.88 0.00 0.00 7.11 6.49 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 67 N 8.57 4.38 0.00 2.80 2.90 0.00 0.00 6.94 8.58 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 68 A 7.92 4.11 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.51 3.98 0.00 2.12 1.89 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.16 7.81 70 H 8.29 4.16 0.00 3.29 3.36 0.00 6.00 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.85 4.14 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 72 L 7.15 4.08 0.00 1.67 1.76 0.78 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 73 N 8.46 5.05 0.00 2.77 2.91 0.00 0.00 6.11 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 74 G 8.55 3.67 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 0.00 0.00 0.00 75 T 8.05 3.94 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 1.20 0.00 0.00 76 Q 8.06 3.95 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 77 N 8.38 4.28 0.00 2.89 2.83 0.00 0.00 6.68 7.17 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 78 L 8.22 3.91 0.00 1.81 1.87 0.98 0.68 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 79 N 8.24 4.33 0.00 2.77 2.85 0.00 0.00 7.12 6.53 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 80 N 8.50 4.28 0.00 2.86 2.86 0.00 0.00 6.90 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.15 3.97 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 82 K 8.36 3.86 0.00 1.96 1.87 0.00 1.66 0.00 0.00 1.57 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.68 1.64 7.81 83 Q 8.18 3.97 0.00 2.18 2.08 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 2.35 2.41 0.00 84 A 8.31 3.95 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 85 A 8.15 3.91 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 86 I 7.86 3.64 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 1.52 0.68 0.91 0.00 0.00 87 T 8.23 3.84 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 1.21 0.00 0.00 88 A 7.75 4.01 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 89 I 7.91 3.82 2.02 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 1.52 0.63 0.94 0.00 0.00 90 N 8.47 4.50 0.00 2.86 2.88 0.00 0.00 7.06 7.42 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 91 G 7.98 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 92 A 7.71 4.46 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 93 S 8.36 4.10 0.00 3.99 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 94 D 8.31 4.57 0.00 2.97 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 95 L 7.33 4.39 0.00 1.59 1.58 0.91 1.00 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 96 N 8.93 4.74 0.00 2.99 2.96 0.00 0.00 6.53 7.46 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 97 Q 8.46 3.92 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 98 K 8.05 3.90 0.00 1.86 1.98 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.53 7.81 99 Q 8.59 3.93 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.50 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 100 K 8.21 3.86 0.00 1.99 1.88 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.60 7.81 101 D 8.32 4.35 0.00 2.89 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 0.00 102 A 8.02 4.00 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 0.00 103 L 8.03 3.98 0.00 1.84 1.73 0.92 0.77 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 0.00 104 K 8.51 3.95 0.00 1.91 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.66 7.81 105 A 8.08 3.98 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 0.00 106 Q 7.83 3.91 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 107 A 8.12 4.14 1.39 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 0.00 0.00 0.00 108 N 8.38 4.47 0.00 2.78 2.90 0.00 0.00 7.06 7.87 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 0.00 109 G 7.82 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 0.00 0.00 0.00 110 A 7.17 4.04 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 0.00 111 Q 8.74 4.41 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.52 0.00 112 R 7.93 4.84 0.00 1.95 1.75 0.00 3.31 0.00 0.00 3.10 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 113 V 8.85 3.61 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 1.12 0.00 0.00 0.98 0.00 0.00 114 S 8.01 4.11 0.00 4.08 4.10 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 0.00 115 N 8.04 4.33 0.00 2.93 2.90 0.00 0.00 6.79 6.66 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 0.00 116 A 7.91 4.02 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 0.00 117 Q 8.42 3.99 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 118 D 8.32 4.36 0.00 2.87 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 0.00 119 V 7.83 3.57 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 1.12 0.00 0.00 1.06 0.00 0.00 120 Q 8.06 3.93 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.56 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 121 H 8.27 4.03 0.00 3.31 3.47 0.00 5.84 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 0.00 122 N 8.60 4.34 0.00 2.79 2.86 0.00 0.00 6.97 7.20 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 0.00 123 A 8.24 3.97 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 0.00 124 T 7.85 3.78 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 1.18 0.00 0.00 125 E 8.21 3.86 0.00 1.83 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 0.00 2.31 2.34 0.00 126 L 7.92 4.07 0.00 1.75 1.86 0.92 1.25 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 0.00 127 N 8.37 4.42 0.00 2.85 2.97 0.00 0.00 7.17 8.18 0.00 0.00 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 T 7.59 4.30 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 1.22 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.