NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4403 8.1585 118.2007 55.3972 32.9851 176.4751 2 A 3.9166 7.8273 124.6153 55.7700 19.1366 176.0887 3 E 3.9226 8.5335 118.2360 59.6252 30.0414 177.5050 4 A 4.2639 8.2726 120.2306 55.3545 18.1866 179.6945 5 L 4.0647 7.7587 116.7256 57.9698 41.6613 179.1519 6 F 3.4568 7.8833 119.1141 61.0310 39.3485 176.9975 7 K 3.7588 8.8193 118.7499 59.6799 32.2398 178.4633 8 E 3.8784 8.0170 119.8864 59.2869 29.6482 178.1501 9 I 3.8398 8.0683 117.7231 63.7032 39.3276 176.8317 10 D 5.2167 7.0401 120.5274 52.5400 37.5140 175.2100 11 V 3.6754 7.6950 122.3928 65.7527 32.1770 176.6410 12 N 4.2003 8.2920 115.7933 54.8215 38.9666 174.5553 13 G 3.7290 8.6630 104.7451 46.5222 0.0000 172.2818 14 D 4.6946 9.2682 118.6980 55.2747 41.6808 178.2212 15 G 4.3841 8.6987 107.9888 44.7459 0.0000 172.8432 16 A 4.9985 8.2627 118.8983 50.6010 22.8354 176.6627 17 V 5.0946 9.4492 119.5127 60.3190 35.6701 174.1669 18 S 5.1180 8.2885 117.1113 56.1892 66.5485 174.0229 19 Y 3.5981 8.3177 119.1599 60.6484 38.1643 177.5307 20 E 3.6008 7.9841 119.8509 59.0163 30.0195 178.3486 21 E 3.9679 8.1187 118.9468 59.3644 29.4545 179.7818 22 V 3.7625 8.0921 119.4590 64.7539 31.3998 178.4038 23 K 3.7913 7.9556 119.0614 59.1652 31.7651 179.1442 24 A 3.9458 8.1854 120.9731 55.0308 18.0736 178.9904 25 F 3.9373 8.2483 118.5512 61.7936 39.6557 177.4515 26 V 3.8709 8.5275 118.6632 64.9122 31.0094 177.8526 27 S 4.4789 8.0410 114.4777 60.5906 62.1831 175.9213 28 K 3.9057 8.0208 120.1447 60.1753 31.8005 177.7090 29 K 4.1295 8.6865 120.2079 57.7381 32.4506 179.0243 30 R 4.6663 7.7909 117.0243 54.9558 35.0335 174.3745 31 A 5.0336 8.1815 117.3374 51.7229 19.2612 177.0913 32 I 4.2174 7.4766 113.7207 60.2836 38.0704 175.9848 33 K 3.9024 7.8611 112.6442 58.6391 29.4792 178.7273 34 N 4.3954 8.2584 118.7777 55.7530 37.2248 175.4262 35 E 3.8920 8.2113 119.7072 59.7714 29.4209 178.7868 36 Q 3.9715 8.0977 120.7710 58.0513 29.3778 177.1113 37 L 3.8970 8.0974 121.3487 58.3940 42.0436 178.7172 38 L 4.0886 8.5142 120.0608 58.5978 42.1244 178.5957 39 Q 3.9762 8.4080 119.3032 59.4443 28.7147 179.0396 40 L 3.9801 8.0000 120.1705 58.3842 42.5519 178.3933 41 I 3.7634 7.9526 119.5989 64.5774 36.5512 177.6680 42 F 4.0792 9.3372 121.5295 61.9102 39.0142 177.3705 43 K 4.3074 8.3844 117.8516 59.5316 31.9315 178.5241 44 S 4.2158 8.2687 113.1831 61.3559 62.5006 175.6908 45 I 4.0322 7.5848 119.4391 62.9295 38.2599 175.0065 46 D 4.4968 9.3363 120.9076 53.6787 40.6802 176.2153 47 A 4.0812 8.5282 130.7382 54.7949 19.0816 178.1724 48 D 4.3724 7.8541 114.2820 56.2792 39.6471 178.7160 49 G 4.6913 9.0518 110.3152 44.9366 0.0000 174.8286 50 N 4.1956 8.7059 117.0727 53.3903 37.8216 176.0371 51 G 4.1357 8.5298 108.0208 45.2767 0.0000 172.6743 52 E 5.2359 8.0558 118.0373 54.6221 33.4871 174.8425 53 I 4.9529 9.1497 115.4455 59.4661 42.1106 172.6049 54 D 5.4609 7.9282 119.9224 51.1488 42.4669 176.6835 55 Q 2.5931 8.4702 115.6132 59.2396 27.9220 178.1539 56 N 4.2009 7.9255 117.6970 56.3342 38.4998 177.0301 57 E 3.9693 9.3993 120.2801 59.3454 29.4293 179.4439 58 F 3.9371 8.7401 121.1107 60.9438 39.1787 177.1695 59 A 4.1475 8.4831 120.8757 55.3575 17.9953 179.8922 60 K 3.8727 8.3319 117.0315 59.3331 31.8338 179.4935 61 F 4.0228 8.1893 120.9015 61.0955 39.2970 176.0603 62 Y 4.0979 8.3691 119.1279 61.4814 38.5941 177.7422 63 G 3.7347 7.9524 105.8487 45.3107 0.0000 173.5658 64 S 4.3665 7.6255 126.2597 57.7470 69.0922 178.0508 65 I 4.5217 6.8769 120.9932 61.7216 42.4179 175.8272 66 Q 4.4762 7.6831 123.4117 52.3166 29.6760 173.8171 67 G 4.7163 7.3468 117.2320 45.2266 0.0000 170.1659 68 Q 4.3496 8.0865 123.2447 55.5099 30.8107 173.4291 69 D 4.3972 8.6654 123.4684 55.3632 41.9730 177.2410 70 L 4.3549 7.2024 123.1366 52.9514 43.7076 175.5698 71 S 4.2144 8.5340 121.3450 61.4740 62.9067 175.6841 72 D 4.4259 8.1914 120.2794 57.3885 40.9257 177.6834 73 D 4.4416 8.1947 118.6204 56.7769 41.1165 178.4503 74 K 4.1059 7.8819 118.8667 59.5778 32.3455 178.8936 75 I 3.8515 8.3344 119.3871 64.2243 37.7905 178.1644 76 G 3.6923 8.4670 106.5962 47.3866 0.0000 175.9266 77 L 4.2007 8.0945 121.6314 57.6997 41.6799 179.6538 78 K 3.8962 8.4143 118.9849 59.7689 32.4279 179.3003 79 V 3.5082 7.9686 119.4344 65.7790 31.5168 177.7667 80 L 3.9339 8.2230 118.8782 58.2319 41.6048 178.8071 81 Y 4.2874 8.3196 119.5078 60.8825 38.2929 178.3934 82 K 3.4515 7.8086 119.9655 58.6516 32.2811 178.5020 83 L 3.9825 7.6144 120.2559 58.3792 42.1634 178.4124 84 M 4.1728 8.0312 117.4385 57.5043 32.4504 176.3391 85 D 4.3513 7.6820 125.3536 54.8560 40.1591 176.2671 86 V 4.1885 7.8698 123.1901 61.0456 32.4900 177.1066 87 D 4.3051 8.0510 120.5366 54.4365 40.1129 175.1714 88 G 3.5683 8.6047 108.0284 45.8237 0.0000 171.8915 89 D 4.6630 8.7256 121.1288 54.5107 43.3893 179.1769 90 G 4.0525 8.5344 106.8781 44.7804 0.0000 172.6211 91 K 5.0606 7.3847 116.1199 54.5895 35.9737 175.1193 92 L 5.0501 9.1741 121.3750 54.8322 44.6413 174.6508 93 T 4.8157 8.1350 109.1301 59.1643 72.1272 174.8329 94 K 3.9488 7.9511 119.6960 59.8533 32.4725 178.8864 95 E 3.9127 7.8492 120.2455 58.8617 29.6214 178.1570 96 E 3.9708 8.2376 119.8215 58.9685 29.6751 179.1133 97 V 3.6206 7.9713 119.4561 65.2706 31.5514 178.3857 98 T 4.0792 8.2169 114.0690 64.4283 66.9006 176.3158 99 S 4.1159 7.8915 114.8638 61.1902 62.7588 175.6782 100 F 4.4824 8.4047 123.3482 61.4286 39.1109 177.2556 101 F 3.7332 8.2182 117.8168 60.2858 38.7125 177.2316 102 K 3.4418 8.4687 119.7005 59.7332 31.5418 178.1364 103 K 3.9658 7.6737 118.8639 59.9615 32.0308 178.2211 104 H 4.4803 8.7635 116.5569 60.1469 28.9145 175.9281 105 G 3.6983 6.9199 104.0083 45.3841 0.0000 174.6970 106 I 4.1400 7.5831 122.9845 59.8740 35.8026 175.8481 107 E 4.0245 8.3531 124.9817 58.5734 29.8507 178.6399 108 K 3.6750 8.1890 119.8723 60.1844 32.0671 178.8796 109 V 3.4999 7.3521 119.1753 64.7146 30.9048 178.2964 110 A 4.0775 9.0625 122.2049 54.6323 18.1374 179.3312 111 E 3.8341 7.8787 117.8069 59.4838 29.8904 178.8971 112 Q 3.9913 8.5325 118.1394 59.1260 28.6970 178.5444 113 V 3.4842 8.1148 120.7894 65.8572 31.3270 177.7513 114 M 4.0217 7.9914 117.5696 58.4133 32.1414 178.0737 115 K 4.1165 8.0731 117.8504 59.0147 32.3017 178.9337 116 A 4.2610 7.8701 120.6385 54.1494 19.3546 178.2654 117 D 4.4266 7.5669 117.5965 52.9343 40.2658 176.0162 118 A 4.5144 7.9115 133.3974 51.9995 19.2783 177.4637 119 N 4.7112 8.5562 119.3338 55.5213 40.9002 177.2209 120 G 4.0978 8.5521 103.4809 45.1397 0.0000 174.2166 121 D 4.4378 8.0186 118.9679 56.1642 39.7440 178.1677 122 G 3.8736 9.8787 107.4106 44.7666 0.0000 171.6922 123 Y 5.1016 7.9689 114.2247 56.6958 42.5585 174.0331 124 I 4.9304 9.2273 114.2956 60.3751 41.8924 173.1894 125 T 4.8984 7.9312 109.6000 59.4098 72.0225 174.8094 126 L 4.1671 8.4248 120.7949 58.3761 41.9056 178.6555 127 E 4.0521 8.2110 118.2155 59.4684 29.4970 178.7669 128 E 4.0754 8.4507 119.4032 58.9865 29.4644 178.5698 129 F 4.1516 8.4256 120.8073 60.9441 39.6750 176.7740 130 L 4.3364 8.5693 120.1749 58.3684 42.2278 178.4197 131 E 3.9444 8.5060 119.2780 59.3114 29.2137 178.5244 132 F 4.3044 8.2699 120.1782 61.3785 39.4217 176.7476 133 S 3.6349 7.8281 111.9629 60.5827 62.2215 173.7649 134 L 4.1023 7.4115 125.0218 54.8763 41.3866 176.5209 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 8.16 4.44 0.00 2.22 2.38 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 2 A 7.83 3.92 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 3 E 8.53 3.92 0.00 2.08 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 2.31 2.26 0.00 4 A 8.27 4.26 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 5 L 7.76 4.06 0.00 2.45 2.40 1.06 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 6 F 7.88 3.46 0.00 2.02 2.98 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 7 K 8.82 3.76 0.00 2.03 2.23 0.00 1.28 0.00 0.00 1.59 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.76 7.81 8 E 8.02 3.88 0.00 2.05 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 0.00 2.34 2.33 0.00 9 I 8.07 3.84 2.27 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 1.48 1.50 0.96 0.00 0.00 10 D 7.04 5.22 0.00 2.17 2.37 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 11 V 7.69 3.68 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 0.79 0.00 0.00 0.98 0.00 0.00 12 N 8.29 4.20 0.00 3.06 2.86 0.00 0.00 6.86 7.63 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 13 G 8.66 3.73 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 0.00 0.00 0.00 14 D 9.27 4.69 0.00 2.69 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 15 G 8.70 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 0.00 0.00 0.00 0.00 16 A 8.26 5.00 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 17 V 9.45 5.09 2.35 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 1.38 0.00 0.00 0.25 0.00 0.00 18 S 8.29 5.12 0.00 3.96 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 19 Y 8.32 3.60 0.00 2.37 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 20 E 7.98 3.60 0.00 2.03 1.86 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 2.27 2.26 0.00 21 E 8.12 3.97 0.00 2.13 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 2.31 2.30 0.00 22 V 8.09 3.76 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 0.86 0.00 0.00 0.22 0.00 0.00 23 K 7.96 3.79 0.00 1.69 1.69 0.00 1.40 0.00 0.00 1.19 0.00 0.00 2.18 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 0.83 7.81 24 A 8.19 3.95 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 25 F 8.25 3.94 0.00 3.33 3.38 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 26 V 8.53 3.87 2.26 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 0.97 0.00 0.00 0.99 0.00 0.00 27 S 8.04 4.48 0.00 4.01 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 28 K 8.02 3.91 0.00 1.92 1.76 0.00 1.67 0.00 0.00 1.44 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.41 7.81 29 K 8.69 4.13 0.00 1.79 1.65 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.48 7.81 30 R 7.79 4.67 0.00 1.86 1.79 0.00 3.13 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 31 A 8.18 5.03 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 32 I 7.48 4.22 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 1.43 0.71 0.92 0.00 0.00 33 K 7.86 3.90 0.00 2.04 2.00 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.43 7.81 34 N 8.26 4.40 0.00 3.03 3.10 0.00 0.00 5.85 7.65 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 35 E 8.21 3.89 0.00 2.26 2.26 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 2.39 2.42 0.00 36 Q 8.10 3.97 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 37 L 8.10 3.90 0.00 1.97 1.73 0.91 0.45 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 38 L 8.51 4.09 0.00 1.90 1.93 1.09 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 8.41 3.98 0.00 2.54 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.58 0.00 0.00 0.00 0.00 0.00 2.20 2.47 0.00 40 L 8.00 3.98 0.00 1.69 1.97 0.94 1.37 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 41 I 7.95 3.76 1.98 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.41 0.35 0.00 0.00 42 F 9.34 4.08 0.00 3.36 3.34 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 43 K 8.38 4.31 0.00 2.15 1.92 0.00 1.88 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.52 7.81 44 S 8.27 4.22 0.00 4.11 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 45 I 7.58 4.03 1.91 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 1.71 0.77 0.80 0.00 0.00 46 D 9.34 4.50 0.00 2.59 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 47 A 8.53 4.08 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 48 D 7.85 4.37 0.00 2.79 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 49 G 9.05 4.69 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 50 N 8.71 4.20 0.00 2.90 2.99 0.00 0.00 6.44 7.13 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 51 G 8.53 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.06 5.24 0.00 1.87 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 2.38 0.00 53 I 9.15 4.95 1.81 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.14 0.52 0.00 0.00 54 D 7.93 5.46 0.00 2.80 2.88 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 0.00 0.00 0.00 55 Q 8.47 2.59 0.00 1.27 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.87 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 56 N 7.93 4.20 0.00 2.89 2.87 0.00 0.00 7.12 7.62 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 57 E 9.40 3.97 0.00 2.15 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 2.28 2.29 0.00 58 F 8.74 3.94 0.00 3.22 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 59 A 8.48 4.15 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 60 K 8.33 3.87 0.00 1.95 1.88 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.44 7.81 61 F 8.19 4.02 0.00 2.98 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 62 Y 8.37 4.10 0.00 3.28 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 63 G 7.95 3.73 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 0.00 0.00 0.00 64 S 7.63 4.37 0.00 3.75 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 65 I 6.88 4.52 1.84 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 1.25 0.76 0.89 0.00 0.00 66 Q 7.68 4.48 0.00 1.93 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.11 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 67 G 7.35 4.72 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 0.00 0.00 0.00 68 Q 8.09 4.35 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.94 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 69 D 8.67 4.40 0.00 2.60 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 70 L 7.20 4.35 0.00 1.71 1.56 0.92 0.90 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 71 S 8.53 4.21 0.00 3.98 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 72 D 8.19 4.43 0.00 2.75 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 73 D 8.19 4.44 0.00 2.93 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 74 K 7.88 4.11 0.00 2.15 1.95 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.54 1.60 7.81 75 I 8.33 3.85 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 1.06 0.00 0.00 76 G 8.47 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 77 L 8.09 4.20 0.00 2.31 2.19 1.19 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.41 3.90 0.00 1.96 2.11 0.00 1.39 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.71 1.51 7.81 79 V 7.97 3.51 2.31 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 1.23 0.00 0.00 0.94 0.00 0.00 80 L 8.22 3.93 0.00 1.99 1.79 1.05 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 81 Y 8.32 4.29 0.00 2.77 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 82 K 7.81 3.45 0.00 1.45 1.89 0.00 1.94 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.24 1.43 7.81 83 L 7.61 3.98 0.00 1.74 1.74 0.89 1.02 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 84 M 8.03 4.17 0.00 1.54 1.75 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 2.35 0.00 85 D 7.68 4.35 0.00 2.62 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 86 V 7.87 4.19 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 0.74 0.00 0.00 0.88 0.00 0.00 87 D 8.05 4.31 0.00 2.78 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.60 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 89 D 8.73 4.66 0.00 2.72 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 90 G 8.53 4.05 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 0.00 0.00 0.00 91 K 7.38 5.06 0.00 1.72 1.97 0.00 1.74 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.45 7.81 92 L 9.17 5.05 0.00 1.69 1.53 0.84 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 93 T 8.14 4.82 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 1.24 0.00 0.00 94 K 7.95 3.95 0.00 2.07 2.00 0.00 1.23 0.00 0.00 1.45 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.23 1.35 7.81 95 E 7.85 3.91 0.00 2.00 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 2.35 2.40 0.00 96 E 8.24 3.97 0.00 2.08 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 2.30 2.32 0.00 97 V 7.97 3.62 2.31 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 1.08 0.00 0.00 1.10 0.00 0.00 98 T 8.22 4.08 4.42 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 1.28 0.00 0.00 99 S 7.89 4.12 0.00 3.93 4.08 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 0.00 0.00 0.00 100 F 8.40 4.48 0.00 2.96 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 0.00 101 F 8.22 3.73 0.00 3.12 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.47 3.44 0.00 1.85 2.07 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.64 7.81 103 K 7.67 3.97 0.00 1.90 1.92 0.00 1.93 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.72 7.81 104 H 8.76 4.48 0.00 3.20 3.32 0.00 5.71 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 0.00 105 G 6.92 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.58 4.14 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.96 0.71 0.00 0.00 107 E 8.35 4.02 0.00 2.17 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 0.00 2.33 2.33 0.00 108 K 8.19 3.68 0.00 1.94 2.10 0.00 1.46 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.41 7.81 109 V 7.35 3.50 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 0.66 0.00 0.00 -0.05 0.00 0.00 110 A 9.06 4.08 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 0.00 111 E 7.88 3.83 0.00 2.06 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 2.40 0.00 112 Q 8.53 3.99 0.00 2.26 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.49 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 113 V 8.11 3.48 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 0.89 0.00 0.00 0.94 0.00 0.00 114 M 7.99 4.02 0.00 2.12 2.18 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 2.58 2.68 0.00 115 K 8.07 4.12 0.00 1.94 1.85 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.58 7.81 116 A 7.87 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 7.57 4.43 0.00 2.56 2.52 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 0.00 118 A 7.91 4.51 1.26 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 0.00 0.00 0.00 119 N 8.56 4.71 0.00 3.06 2.84 0.00 0.00 7.10 7.36 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 0.00 120 G 8.55 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 0.00 0.00 0.00 121 D 8.02 4.44 0.00 2.91 2.87 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 0.00 122 G 9.88 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 0.00 123 Y 7.97 5.10 0.00 2.91 2.84 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 0.00 124 I 9.23 4.93 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.13 0.87 0.00 0.00 125 T 7.93 4.90 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 1.28 0.00 0.00 126 L 8.42 4.17 0.00 2.14 1.78 0.86 1.10 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 0.00 127 E 8.21 4.05 0.00 2.12 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 2.45 2.42 0.00 128 E 8.45 4.08 0.00 2.12 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 2.37 0.00 129 F 8.43 4.15 0.00 3.25 3.21 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 0.00 0.00 0.00 0.00 130 L 8.57 4.34 0.00 2.09 1.79 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.51 3.94 0.00 2.31 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 0.00 2.34 2.51 0.00 132 F 8.27 4.30 0.00 2.99 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 0.00 133 S 7.83 3.63 0.00 3.64 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 7.41 4.10 0.00 1.80 1.53 0.95 0.66 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