NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7397 8.2833 118.1262 52.6890 40.6712 176.4562 3 D 4.2361 8.5023 119.9722 57.2054 40.9246 176.8811 4 K 3.9630 8.7655 119.6166 59.3985 32.5446 178.8773 5 K 3.8662 8.0620 118.1154 59.8003 31.9551 179.1761 6 I 3.7117 7.8095 119.7028 64.4040 37.0065 178.1530 7 E 3.9360 8.3588 120.1585 59.1756 29.3986 178.6971 8 L 4.0368 8.4840 120.8272 58.1249 42.1716 178.9343 9 L 4.0876 8.3532 119.4181 57.9531 41.6450 179.6348 10 T 3.9235 8.2877 115.9943 67.1702 68.2597 176.9962 11 T 3.9864 7.6070 115.7244 66.6182 68.5763 175.9617 12 Y 4.1733 8.4224 121.8116 60.7575 38.9123 178.0260 13 L 4.3713 8.4937 119.8663 57.1850 41.5809 178.9709 14 S 4.4462 7.8030 112.7166 60.1876 63.3539 175.5695 15 L 4.1369 7.7831 122.7623 55.5263 41.5530 175.5353 16 Y 5.2987 7.2027 116.0941 56.2287 40.5024 175.0463 17 I 4.4073 8.4773 121.5984 58.7482 41.6738 174.2130 18 D 4.6984 8.5021 128.5210 54.4808 41.8527 176.7198 19 H 4.1694 8.8403 121.7776 59.0027 28.4832 177.2221 20 H 4.0425 7.7484 120.8873 59.2996 29.5890 177.1990 21 T 3.8824 7.8421 116.8934 66.7940 68.1040 176.4173 22 V 3.5807 7.2217 117.9626 66.0182 31.7412 177.5314 23 L 4.0236 7.9992 119.1106 57.9731 41.8553 178.7532 24 A 4.0166 7.8900 120.4843 56.8120 18.9449 178.9949 25 D 4.6127 8.2996 114.8224 54.1430 42.6017 175.5865 *32 K 4.1846 8.4799 113.6043 56.3778 34.2061 175.3897 33 Y 5.7610 7.6813 115.6039 55.7509 40.7954 176.0792 34 V 4.2094 7.8751 121.1405 60.3603 33.1867 174.3812 35 V 4.1516 8.2755 126.3244 63.2009 32.9532 174.7487 36 L 5.3116 9.0733 125.3194 51.8263 45.0269 175.1922 37 D 3.9073 8.8253 124.3180 54.2058 41.1824 175.3380 38 V 4.1830 7.3607 117.8580 61.1673 32.2939 176.8421 39 R 4.0212 8.1469 121.1661 56.3003 30.3522 176.6047 40 N 4.4607 8.6569 119.2257 54.7295 39.4185 175.4844 41 A 4.0309 7.8868 119.8826 51.0273 18.9943 175.1359 42 P 4.1722 0.0000 0.0000 62.5563 31.6856 176.8092 43 A 3.9431 8.5050 126.1165 52.5870 18.8678 176.6391 *50 I 3.8565 7.9466 120.9776 60.6382 38.5646 175.9451 51 K 4.0588 8.3271 124.3244 57.1455 32.6676 178.2063 52 G 3.9228 8.7813 108.8518 46.0190 0.0000 173.6627 53 A 4.2302 7.8227 122.4277 51.9802 19.1800 177.3480 54 I 4.1452 8.4236 124.3084 60.5081 38.3381 176.1328 55 A 4.3445 8.6404 128.8270 51.6114 19.4974 174.7728 *57 P 4.0603 0.0000 0.0000 62.0772 32.4710 178.0073 58 A 3.9447 8.4896 124.7103 55.1900 18.1604 180.3949 59 K 3.7126 8.2542 114.9573 59.0813 32.9869 177.6600 60 D 4.8136 7.3145 118.2105 53.8751 41.9567 177.6191 61 L 3.8588 7.7868 122.0393 58.1006 41.8888 178.5456 62 A 4.1165 7.9334 119.5313 54.4557 18.5682 177.8716 63 T 4.3947 7.5577 111.0909 64.0409 69.5943 175.4960 64 R 4.6629 7.4852 120.9927 55.7268 31.0902 177.9270 65 I 3.7563 7.9248 120.6997 63.6662 38.4126 177.8455 66 G 3.7431 8.1095 108.2800 48.3314 0.0000 174.4827 67 E 4.1056 7.7326 118.4919 59.1735 29.6141 178.0003 68 L 3.9918 7.2569 117.9928 54.8801 42.1329 176.1540 69 D 4.8516 9.1241 122.9037 52.4522 41.6811 175.0473 70 P 4.3875 0.0000 0.0000 65.9613 31.3738 177.5215 71 A 4.1968 8.5573 118.7821 53.6366 18.4055 177.2856 72 K 4.5326 8.0590 115.4541 55.4631 34.3031 176.2868 73 T 4.8812 8.2476 118.6706 62.3645 70.7966 173.3334 74 Y 4.8675 8.5967 123.9086 56.7273 40.3450 174.8220 75 V 4.9427 8.2145 121.5922 61.2573 34.6319 174.5146 76 V 5.0689 8.8109 121.1709 59.7187 34.9626 174.4914 77 Y 4.9478 8.0524 122.1671 55.5663 41.1394 174.4387 *83 T 4.2302 8.4964 114.0971 61.2305 70.3400 175.0456 84 T 3.9150 8.4494 115.2661 64.8523 68.8180 176.6088 85 L 4.0233 8.0596 121.5423 57.6232 41.6532 179.6250 86 G 3.8570 7.4433 106.1444 47.3405 0.0000 175.9770 87 K 3.9500 7.6451 120.5843 59.1376 31.9351 179.5231 88 T 3.7971 8.5478 116.2016 66.6877 68.3819 176.2580 89 A 3.9131 8.0872 122.5759 55.0402 18.2745 179.3095 90 L 3.7740 7.9324 118.6693 58.2380 42.1643 178.7585 91 L 3.8586 8.3984 120.4950 58.2038 41.9370 178.8588 92 V 3.5526 7.9671 118.2044 66.1573 31.5440 177.6142 93 L 3.9820 7.9625 118.4198 58.2019 41.4361 179.7035 94 L 4.2035 8.1901 118.7329 58.0362 41.2914 179.9466 95 S 4.1152 8.1262 114.2247 61.4496 62.8484 176.3221 96 A 4.1577 7.9218 122.6712 53.5491 18.1995 177.9962 97 G 3.8406 7.3407 103.2350 45.2206 0.0000 174.0929 98 F 4.4165 7.8911 118.3752 57.2605 39.9554 175.2619 99 E 4.4773 9.0562 121.3533 54.8532 29.9581 174.1909 100 A 5.0587 8.1048 126.9372 50.2659 22.6592 174.0211 101 Y 4.7978 8.7883 115.3891 56.6743 43.3709 173.7448 102 E 4.9339 9.0178 122.1850 54.2095 32.0694 174.7621 103 L 4.3617 9.1357 129.2779 54.8945 42.6922 176.5872 104 A 4.3118 8.6221 127.8871 52.3898 17.9219 176.9134 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 N 8.28 4.74 0.00 2.77 2.90 0.00 0.00 6.99 7.19 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 3 D 8.50 4.24 0.00 2.77 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 4 K 8.77 3.96 0.00 1.80 1.86 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.54 7.81 5 K 8.06 3.87 0.00 1.80 1.87 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.53 1.55 7.81 6 I 7.81 3.71 1.97 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 1.42 0.78 0.93 0.00 0.00 7 E 8.36 3.94 0.00 2.32 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 0.00 2.32 2.39 0.00 8 L 8.48 4.04 0.00 1.77 1.89 0.98 0.66 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 9 L 8.35 4.09 0.00 1.75 1.75 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 T 8.29 3.92 4.30 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 1.25 0.00 0.00 11 T 7.61 3.99 4.32 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 1.25 0.00 0.00 12 Y 8.42 4.17 0.00 3.28 3.19 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 13 L 8.49 4.37 0.00 1.91 1.81 0.99 0.79 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 14 S 7.80 4.45 0.00 4.15 4.19 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 15 L 7.78 4.14 0.00 1.08 1.31 0.55 0.63 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 16 Y 7.20 5.30 0.00 2.81 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.48 4.41 1.52 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.12 0.90 0.00 0.00 18 D 8.50 4.70 0.00 2.68 2.43 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 19 H 8.84 4.17 0.00 3.40 3.54 0.00 5.72 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 H 7.75 4.04 0.00 3.12 3.24 0.00 5.79 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 21 T 7.84 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 1.31 0.00 0.00 22 V 7.22 3.58 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 0.76 0.00 0.00 0.66 0.00 0.00 23 L 8.00 4.02 0.00 1.84 1.66 0.87 1.22 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 A 7.89 4.02 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 25 D 8.30 4.61 0.00 2.78 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 *32 K 8.48 4.18 0.00 1.15 1.19 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.39 7.81 33 Y 7.68 5.76 0.00 2.86 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 34 V 7.88 4.21 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 0.00 0.00 0.98 0.00 0.00 0.69 0.00 0.00 35 V 8.28 4.15 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 1.10 0.00 0.00 0.96 0.00 0.00 36 L 9.07 5.31 0.00 1.62 1.54 0.82 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 37 D 8.83 3.91 0.00 2.72 2.57 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 38 V 7.36 4.18 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 0.74 0.00 0.00 0.86 0.00 0.00 39 R 8.15 4.02 0.00 1.81 1.80 0.00 2.86 0.00 0.00 3.53 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.40 0.00 40 N 8.66 4.46 0.00 2.68 2.84 0.00 0.00 6.97 7.35 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 41 A 7.89 4.03 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 42 P 0.00 4.17 0.00 2.05 2.03 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 43 A 8.51 3.94 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 *50 I 7.95 3.86 1.71 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.16 0.78 0.00 0.00 51 K 8.33 4.06 0.00 1.82 1.67 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.50 7.81 52 G 8.78 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 0.00 0.00 0.00 53 A 7.82 4.23 1.46 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 0.00 0.00 54 I 8.42 4.15 1.94 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.19 0.95 0.00 0.00 55 A 8.64 4.34 1.22 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 0.00 0.00 0.00 *57 P 0.00 4.06 0.00 2.36 2.10 0.00 3.57 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 1.98 2.05 0.00 58 A 8.49 3.94 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 59 K 8.25 3.71 0.00 1.90 1.94 0.00 1.52 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.58 1.51 7.81 60 D 7.31 4.81 0.00 2.49 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 61 L 7.79 3.86 0.00 1.84 1.76 0.74 1.16 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 62 A 7.93 4.12 1.27 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 0.00 0.00 0.00 63 T 7.56 4.39 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 64 R 7.49 4.66 0.00 1.79 2.12 0.00 3.10 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 65 I 7.92 3.76 1.88 0.00 0.00 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 1.58 1.47 0.94 0.00 0.00 66 G 8.11 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 67 E 7.73 4.11 0.00 2.20 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 2.28 0.00 68 L 7.26 3.99 0.00 1.12 0.65 -0.10 0.56 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 69 D 9.12 4.85 0.00 2.82 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 70 P 0.00 4.39 0.00 2.08 1.98 0.00 3.83 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 71 A 8.56 4.20 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 72 K 8.06 4.53 0.00 1.77 1.45 0.00 1.78 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.47 7.81 73 T 8.25 4.88 4.62 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 1.81 0.00 0.00 74 Y 8.60 4.87 0.00 2.88 2.85 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 75 V 8.21 4.94 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 1.07 0.00 0.00 0.78 0.00 0.00 76 V 8.81 5.07 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 0.76 0.00 0.00 0.96 0.00 0.00 77 Y 8.05 4.95 0.00 3.11 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 *83 T 8.50 4.23 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 84 T 8.45 3.92 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 1.23 0.00 0.00 85 L 8.06 4.02 0.00 1.69 1.73 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.44 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 0.00 0.00 0.00 87 K 7.65 3.95 0.00 2.06 1.83 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.34 1.45 7.81 88 T 8.55 3.80 4.34 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 1.19 0.00 0.00 89 A 8.09 3.91 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 90 L 7.93 3.77 0.00 1.79 1.80 0.80 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.40 3.86 0.00 1.71 1.89 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 92 V 7.97 3.55 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 0.95 0.00 0.00 0.94 0.00 0.00 93 L 7.96 3.98 0.00 1.84 1.68 0.86 -0.07 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 94 L 8.19 4.20 0.00 1.63 1.68 0.82 1.19 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 95 S 8.13 4.12 0.00 3.97 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 96 A 7.92 4.16 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.34 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 7.89 4.42 0.00 3.11 3.01 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 99 E 9.06 4.48 0.00 2.09 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 2.23 2.28 0.00 100 A 8.10 5.06 1.20 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 0.00 0.00 101 Y 8.79 4.80 0.00 2.82 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 0.00 102 E 9.02 4.93 0.00 1.74 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 2.35 2.46 0.00 103 L 9.14 4.36 0.00 1.75 1.84 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.62 4.31 1.25 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.