NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4647 8.3044 118.7881 54.3180 33.0263 178.0211 2 Q 4.6037 8.9680 115.8391 54.7661 31.5755 173.1198 3 D 4.6151 8.3227 124.2681 52.6987 40.6579 173.5499 4 Y 5.0976 7.1731 120.0493 55.1472 41.8759 175.8890 5 T 4.8301 8.8088 115.3442 61.7578 72.3656 173.6656 6 V 4.5528 9.0694 126.7151 62.2484 33.0722 174.2398 7 H 5.2017 9.5398 126.5645 54.8606 30.5440 174.2682 8 I 4.8414 8.8994 124.9108 59.5426 39.1950 174.8087 9 V 4.7009 8.0126 126.6319 61.2007 34.3374 173.7553 10 D 4.6112 8.3453 123.6663 53.6163 42.9867 175.4651 11 D 4.5518 8.7364 124.9517 55.7753 40.1938 175.5555 12 E 4.3256 9.1157 120.8892 54.9776 29.7670 176.3505 13 E 3.9218 8.8063 125.8142 59.1503 29.6488 176.9210 14 P 4.2284 0.0000 0.0000 65.5365 31.4650 178.8154 15 V 3.5730 7.6715 116.6629 65.7355 31.5816 177.8057 16 R 3.8715 8.0300 118.4880 59.5452 29.8737 178.6294 17 K 4.0028 8.3969 118.5719 59.3656 32.0509 179.1851 18 S 4.1014 8.0035 113.4332 61.4600 62.3384 176.1261 19 L 4.0017 7.9217 122.5470 58.0089 41.7803 178.7087 20 A 4.0000 8.1354 120.8445 54.9862 18.2669 179.3335 21 F 4.0705 8.6391 119.5646 61.6389 39.6125 176.9303 22 M 3.8773 8.0055 117.2075 58.7266 32.0042 178.1452 23 L 4.0239 7.8936 119.0062 58.1654 41.8617 179.6567 24 T 4.0360 8.0897 115.7592 66.9899 68.1700 176.5895 25 M 4.0728 7.8864 119.2757 57.1989 31.8439 177.3447 26 N 4.9508 7.6545 115.2476 52.7574 39.6035 175.8560 27 G 3.7854 7.7192 107.1546 45.6648 0.0000 174.4408 28 F 4.2968 8.2199 117.8561 56.5709 40.3342 175.1848 29 A 4.3352 8.3521 123.6650 51.6537 19.5145 176.6945 30 V 4.9208 8.3027 121.6683 61.1975 35.4760 174.7162 31 K 4.5331 8.6342 125.7295 55.5708 35.6431 174.9370 32 M 4.9709 8.6049 126.7451 54.6809 33.0691 175.1644 33 H 4.8676 8.7498 117.4540 54.0843 32.3409 175.1097 34 Q 4.1774 9.0468 121.9825 58.8009 29.1138 176.6676 35 S 4.6233 7.4890 108.2016 56.0829 67.4013 175.3114 36 A 4.1134 8.5179 123.5878 55.2567 18.1378 179.5360 37 E 3.9356 8.3170 116.4645 59.5528 29.4457 179.2995 38 A 4.0022 8.4390 120.9767 55.3104 18.4686 179.4703 39 F 4.0337 8.4037 119.1604 61.2336 39.1822 176.9830 40 L 3.7700 8.3624 119.3943 58.1472 41.9835 178.6847 41 A 4.0717 7.8244 119.3974 54.5081 18.5765 178.6410 42 F 4.3133 7.8300 118.3185 59.7178 39.6425 177.2804 43 A 3.4418 7.4017 121.0158 54.9870 17.7481 177.7442 44 P 4.1180 0.0000 0.0000 65.4415 31.4787 177.6511 45 D 4.3942 7.4297 115.0242 53.6116 41.3212 176.9390 46 V 3.6864 6.7461 120.7782 62.6386 32.0841 175.3535 47 R 4.5194 8.0975 124.9862 55.6233 33.8259 175.1415 48 N 4.2363 8.9424 120.1761 54.9292 36.0149 173.2579 49 G 4.7667 7.8568 102.7156 44.4528 0.0000 173.0439 50 V 4.7173 8.9341 120.6877 60.7544 34.8273 173.9240 51 L 4.7157 9.0036 130.5436 53.7715 43.9830 175.2046 52 V 4.4140 8.6014 126.0472 61.6345 33.5960 172.9560 53 T 5.0976 8.3518 128.3767 60.6792 70.6220 173.8070 *55 L 4.1392 8.6838 117.5163 55.3021 44.0812 178.5842 56 R 4.7304 7.9804 122.0504 55.1705 28.4260 173.8127 57 M 4.9272 8.0556 119.7253 51.0847 34.9674 174.0710 58 P 4.3698 0.0000 0.0000 65.9177 31.4317 176.6432 59 D 4.6478 8.1324 116.4025 54.9634 41.9180 176.6345 60 M 4.8383 7.6520 116.9072 52.7512 35.1294 175.3577 61 S 4.7326 9.4881 122.0560 57.6767 65.5496 175.5574 62 G 3.6888 8.6056 109.0827 48.1926 0.0000 176.5116 63 V 3.7804 7.7955 114.3209 63.9354 31.6250 178.2979 64 E 3.9969 8.7843 118.8525 59.3208 29.2379 179.1316 65 L 3.9948 8.4460 120.6495 58.1614 42.1467 178.9470 66 L 4.0237 7.9988 118.8589 57.8870 41.4921 179.6965 67 R 3.9299 8.4843 118.2248 59.5062 29.8420 178.8224 68 N 4.3304 8.2355 115.0260 56.3991 38.9214 177.1785 69 L 4.2593 8.3843 120.7381 57.5136 41.6462 179.6521 70 G 3.6670 8.1913 105.7835 48.1496 0.0000 175.4682 71 D 4.4214 8.1603 120.3451 56.3764 40.8672 178.0143 72 L 4.3012 7.5117 116.6514 53.5669 42.3308 176.3662 73 K 3.9228 8.4160 117.8803 57.6306 30.2465 177.1792 74 I 3.7584 8.2058 122.2222 64.4719 37.6317 175.6066 75 N 4.1505 8.1340 121.3895 52.0637 33.6362 173.3221 76 I 4.6053 7.7225 121.7779 57.9674 40.5086 173.8236 77 P 4.3115 0.0000 0.0000 63.6081 32.2145 175.5366 78 S 5.2970 8.7419 118.9935 56.7354 67.3752 172.8896 79 I 4.8955 9.0870 123.9065 59.5704 40.6200 174.4701 80 V 4.7118 8.6506 127.5723 61.3539 33.0881 174.5721 81 I 4.8738 7.9977 121.0061 59.6971 40.1402 174.4301 82 T 4.3156 8.3763 117.0299 61.5047 71.2357 173.6540 83 G 4.1695 8.5551 111.5801 45.4706 0.0000 172.8940 84 H 4.9600 8.1914 116.5002 55.0337 29.9581 173.6958 85 G 4.3671 8.1681 107.1852 44.6562 0.0000 173.3297 86 D 4.8150 8.1752 118.6865 50.4154 43.8467 176.3558 87 V 3.4655 8.3675 118.5073 65.9225 31.2662 175.9986 88 P 4.1919 0.0000 0.0000 65.9192 31.2099 178.5640 89 M 4.0070 8.8358 117.6314 58.2472 31.9051 178.6484 90 A 2.0000 7.8220 121.2978 54.2310 18.2510 179.9883 91 V 3.3867 7.7754 117.1252 66.1594 31.6935 178.0122 92 E 3.8882 8.3989 118.5433 59.3179 29.3820 179.1467 93 A 4.0376 8.2623 120.9623 55.7734 18.6134 179.7617 94 M 4.0906 8.0283 116.8822 58.2960 31.7142 179.2538 95 K 4.0022 8.1926 118.3959 59.1790 32.3479 178.6638 96 A 4.2384 7.8859 118.8069 52.7082 18.3979 177.9748 97 G 3.9712 7.8490 104.6052 44.5906 0.0000 174.3098 98 A 4.1596 7.5640 122.4551 52.6071 18.7800 178.3930 99 V 3.7903 8.6357 123.0205 65.9511 32.3231 175.3422 100 D 4.6055 7.6355 117.2438 53.4428 44.7557 174.3900 101 F 5.1313 8.7905 123.7136 56.7723 42.0026 173.4711 102 I 4.5518 8.6409 127.7942 59.4003 39.9135 175.1180 103 E 4.8786 8.8275 126.0383 55.8450 30.5399 176.1837 104 K 4.5753 9.3820 124.1352 54.5957 33.6657 175.1201 105 P 4.3103 0.0000 0.0000 62.4283 32.4823 175.0902 106 F 4.9462 7.1692 111.9792 55.5403 40.5690 173.9061 107 E 4.3270 8.7471 121.3282 56.1019 30.4088 177.6391 108 D 4.5433 9.0409 122.1032 58.3174 40.8919 179.3291 109 T 3.8814 8.1308 115.3565 66.8750 68.4863 176.4438 110 V 3.5001 7.8312 119.7430 66.0823 31.5485 178.0365 111 I 3.3646 7.4286 117.8457 63.7476 37.7765 177.5926 112 I 3.5110 7.8676 120.9319 64.4946 36.8945 178.2796 113 E 3.9757 8.3215 119.0954 59.2448 29.2713 179.2253 114 A 3.9597 7.8355 120.6197 55.0782 18.4059 179.8305 115 I 3.5870 7.8937 118.3996 64.5742 36.9986 178.3767 116 E 4.1057 8.2076 118.1757 59.4469 29.6862 179.1060 117 R 4.1509 8.3583 118.6964 59.6123 30.1086 178.4220 118 A 4.0914 8.4473 121.0711 55.1057 18.2897 179.6199 119 S 3.6955 8.4345 112.8352 61.0805 62.5113 176.3403 120 E 4.0437 7.6495 121.1012 58.6636 29.2162 177.6088 121 H 4.6231 7.8127 114.9394 55.8601 29.0000 175.1980 122 L 4.2055 7.5121 126.6620 55.0040 41.5516 176.6083 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 1 M 8.30 4.46 0.00 2.05 1.08 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 Q 8.97 4.60 0.00 2.17 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 7.29 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 3 D 8.32 4.62 0.00 2.66 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 4 Y 7.17 5.10 0.00 3.25 2.99 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 5 T 8.81 4.83 4.35 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 1.19 0.00 0.00 6 V 9.07 4.55 2.10 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 0.91 0.00 0.00 1.10 0.00 0.00 7 H 9.54 5.20 0.00 2.96 3.16 0.00 5.64 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.90 4.84 1.87 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 1.08 0.70 0.90 0.00 0.00 9 V 8.01 4.70 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 0.96 0.00 0.00 0.73 0.00 0.00 10 D 8.35 4.61 0.00 2.66 2.46 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 11 D 8.74 4.55 0.00 2.95 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 12 E 9.12 4.33 0.00 2.07 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 2.30 2.31 0.00 13 E 8.81 3.92 0.00 2.02 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 2.37 2.42 0.00 14 P 0.00 4.23 0.00 2.17 2.05 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 15 V 7.67 3.57 2.18 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 1.04 0.00 0.00 0.91 0.00 0.00 16 R 8.03 3.87 0.00 2.04 2.13 0.00 3.15 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 17 K 8.40 4.00 0.00 1.97 1.84 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.55 7.81 18 S 8.00 4.10 0.00 3.88 4.04 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 19 L 7.92 4.00 0.00 1.86 1.66 0.97 1.12 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 20 A 8.14 4.00 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 21 F 8.64 4.07 0.00 3.16 3.28 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 22 M 8.01 3.88 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.75 0.00 23 L 7.89 4.02 0.00 1.77 1.61 0.77 0.34 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 24 T 8.09 4.04 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 1.16 0.00 0.00 25 M 7.89 4.07 0.00 1.75 1.96 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 26 N 7.65 4.95 0.00 2.91 3.03 0.00 0.00 7.03 7.41 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 27 G 7.72 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 28 F 8.22 4.30 0.00 3.01 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 29 A 8.35 4.34 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 30 V 8.30 4.92 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 0.81 0.00 0.00 0.97 0.00 0.00 31 K 8.63 4.53 0.00 1.82 1.52 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.13 0.00 0.00 2.27 0.00 0.00 0.00 0.00 1.10 1.30 7.81 32 M 8.60 4.97 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 33 H 8.75 4.87 0.00 3.20 3.25 0.00 5.62 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 9.05 4.18 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 35 S 7.49 4.62 0.00 4.19 3.96 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 36 A 8.52 4.11 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 37 E 8.32 3.94 0.00 2.10 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 2.43 2.48 0.00 38 A 8.44 4.00 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 39 F 8.40 4.03 0.00 3.12 3.25 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 40 L 8.36 3.77 0.00 1.75 1.86 0.92 1.12 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 41 A 7.82 4.07 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 42 F 7.83 4.31 0.00 3.04 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 43 A 7.40 3.44 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.12 0.00 1.89 2.04 0.00 3.62 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.07 0.00 45 D 7.43 4.39 0.00 1.96 2.36 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 46 V 6.75 3.69 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 0.87 0.00 0.00 0.86 0.00 0.00 47 R 8.10 4.52 0.00 1.82 1.80 0.00 3.57 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.55 0.00 48 N 8.94 4.24 0.00 2.99 2.98 0.00 0.00 6.80 7.60 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 49 G 7.86 4.77 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 0.00 0.00 0.00 50 V 8.93 4.72 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 0.98 0.00 0.00 0.81 0.00 0.00 51 L 9.00 4.72 0.00 1.59 1.45 0.30 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.60 4.41 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 0.84 0.00 0.00 0.85 0.00 0.00 53 T 8.35 5.10 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 1.24 0.00 0.00 *55 L 8.68 4.14 0.00 1.85 1.69 1.06 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 56 R 7.98 4.73 0.00 1.85 1.88 0.00 3.02 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 57 M 8.06 4.93 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.66 0.00 58 P 0.00 4.37 0.00 2.17 2.23 0.00 3.86 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 59 D 8.13 4.65 0.00 2.70 2.76 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 0.00 0.00 0.00 60 M 7.65 4.84 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 61 S 9.49 4.73 0.00 4.18 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 62 G 8.61 3.69 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 0.00 0.00 0.00 63 V 7.80 3.78 2.12 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 0.90 0.00 0.00 0.98 0.00 0.00 64 E 8.78 4.00 0.00 2.16 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 2.35 2.34 0.00 65 L 8.45 3.99 0.00 1.83 1.99 1.15 0.73 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 66 L 8.00 4.02 0.00 1.94 1.74 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.48 3.93 0.00 2.07 1.99 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 68 N 8.24 4.33 0.00 2.88 2.91 0.00 0.00 7.14 8.29 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 69 L 8.38 4.26 0.00 1.92 1.77 1.16 1.19 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 70 G 8.19 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 71 D 8.16 4.42 0.00 2.80 2.76 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 0.00 0.00 0.00 72 L 7.51 4.30 0.00 1.78 1.68 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.42 3.92 0.00 1.84 1.88 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.53 7.81 74 I 8.21 3.76 1.99 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.60 0.90 0.00 0.00 75 N 8.13 4.15 0.00 2.91 2.74 0.00 0.00 6.42 7.72 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 76 I 7.72 4.61 1.99 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.14 1.10 0.00 0.00 77 P 0.00 4.31 0.00 2.05 2.08 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 78 S 8.74 5.30 0.00 3.73 3.69 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 79 I 9.09 4.90 1.79 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 1.06 0.68 0.80 0.00 0.00 80 V 8.65 4.71 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 0.71 0.00 0.00 1.02 0.00 0.00 81 I 8.00 4.87 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.86 0.79 0.00 0.00 82 T 8.38 4.32 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 1.03 0.00 0.00 83 G 8.56 4.17 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 0.00 0.00 0.00 84 H 8.19 4.96 0.00 3.15 3.26 0.00 5.65 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 85 G 8.17 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 0.00 0.00 0.00 0.00 86 D 8.18 4.82 0.00 2.91 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 87 V 8.37 3.47 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 1.07 0.00 0.00 0.92 0.00 0.00 88 P 0.00 4.19 0.00 2.26 2.06 0.00 3.82 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 89 M 8.84 4.01 0.00 2.09 2.36 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.81 0.00 90 A 7.82 2.00 0.75 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 0.00 0.00 91 V 7.78 3.39 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 1.06 0.00 0.00 0.88 0.00 0.00 92 E 8.40 3.89 0.00 2.11 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 2.53 0.00 93 A 8.26 4.04 1.47 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 0.00 0.00 94 M 8.03 4.09 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.89 0.00 95 K 8.19 4.00 0.00 1.85 1.86 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.56 7.81 96 A 7.89 4.24 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 97 G 7.85 3.97 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 0.00 0.00 0.00 98 A 7.56 4.16 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 99 V 8.64 3.79 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 0.74 0.00 0.00 0.88 0.00 0.00 100 D 7.64 4.61 0.00 2.73 2.39 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 0.00 101 F 8.79 5.13 0.00 2.98 2.86 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 0.00 102 I 8.64 4.55 1.60 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.86 0.61 0.00 0.00 103 E 8.83 4.88 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 104 K 9.38 4.58 0.00 1.40 1.51 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.46 7.81 105 P 0.00 4.31 0.00 2.06 1.93 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 106 F 7.17 4.95 0.00 3.01 3.16 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 0.00 107 E 8.75 4.33 0.00 2.10 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 2.45 2.31 0.00 108 D 9.04 4.54 0.00 2.73 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 0.00 109 T 8.13 3.88 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 110 V 7.83 3.50 2.18 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 0.77 0.00 0.00 0.95 0.00 0.00 111 I 7.43 3.36 1.20 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.09 0.98 0.00 0.00 112 I 7.87 3.51 2.10 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.50 1.13 0.00 0.00 113 E 8.32 3.98 0.00 2.00 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 2.35 2.52 0.00 114 A 7.84 3.96 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 0.00 115 I 7.89 3.59 1.85 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.37 1.01 0.00 0.00 116 E 8.21 4.11 0.00 2.14 2.10 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 2.56 2.69 0.00 117 R 8.36 4.15 0.00 2.00 2.12 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 118 A 8.45 4.09 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 0.00 119 S 8.43 3.70 0.00 2.72 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 0.00 120 E 7.65 4.04 0.00 2.05 1.91 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 2.29 2.41 0.00 121 H 7.81 4.62 0.00 3.21 3.31 0.00 5.65 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 L 7.51 4.21 0.00 1.65 1.58 0.82 1.31 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 * Residues marked with a * may have inaccurate shift predictions.