NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4502 8.3044 120.3268 55.5085 33.3710 174.0622 2 E 4.4639 8.1243 121.5123 53.1365 32.5990 173.4526 3 K 4.3737 9.0091 122.2758 56.1152 35.3933 175.4424 4 K 4.3580 8.7295 118.3382 57.1441 34.3961 176.8261 5 T 4.9829 8.3893 116.5753 62.8186 71.3419 173.3433 6 I 4.8327 8.2725 118.6254 59.0808 41.4654 174.5489 7 V 5.0210 8.4232 121.8952 61.8123 35.5950 173.1772 8 L 4.9780 8.6330 123.6451 54.4351 43.5741 176.7059 9 G 3.8433 8.7643 112.0365 46.4898 0.0000 176.5460 10 V 3.4959 9.2205 123.2833 62.7022 31.1316 174.4366 11 I 4.6457 5.7836 112.0592 60.0030 41.5406 174.1087 12 G 3.7709 9.0452 116.0177 45.8302 0.0000 174.9822 13 S 4.5261 8.9076 109.6554 57.7546 65.5173 173.2103 14 D 4.5513 8.3055 124.6636 53.4471 42.3531 175.3681 15 C 4.5573 8.4806 120.4521 57.3773 28.6568 172.1191 16 H 4.6827 8.5860 123.9482 57.8258 31.8790 175.0451 17 A 4.8094 7.7877 120.0449 51.6866 19.3558 176.4191 18 V 4.0034 7.8009 118.8665 65.3718 33.9772 171.9635 19 G 3.8016 8.7901 117.7825 45.2994 0.0000 171.6027 20 N 4.8343 8.1577 123.2507 51.8429 42.0193 174.7420 21 K 4.5651 8.5004 117.5638 55.2073 32.7856 175.0570 22 I 4.4271 8.1468 113.3656 61.5012 41.2823 176.7404 23 L 4.7738 7.8118 120.6362 53.1296 40.7479 175.2163 24 D 4.6811 8.1037 121.1021 56.3364 42.2968 177.0753 25 H 4.7408 8.1883 112.8254 56.8897 34.4076 172.3404 26 A 4.8535 8.6088 118.5388 50.4225 22.4174 173.4805 27 F 4.7630 8.5195 124.4921 58.7708 36.4906 175.0654 28 T 4.4697 7.5546 112.9050 64.0705 73.8416 174.3477 29 N 4.4619 8.2253 118.2258 54.1890 39.3771 175.0642 30 A 3.9841 7.7835 119.3078 56.4830 19.4153 177.6334 31 G 3.3584 7.7134 102.1413 45.0983 0.0000 173.7193 32 F 4.4499 7.1880 118.9169 57.3776 39.6423 175.5967 33 N 4.6680 8.6284 120.6476 52.5510 37.4473 172.3979 34 V 5.2578 7.6703 121.0127 60.0906 33.5467 174.5952 35 V 4.4445 8.3315 126.4003 61.1786 35.0040 173.6793 36 N 5.4074 8.6425 124.3702 50.6507 39.6491 172.6771 37 I 4.1235 8.2180 125.6278 59.7438 39.6786 175.7973 38 G 4.0772 8.4787 115.2331 45.0254 0.0000 172.5560 39 V 3.9841 8.5063 113.3217 61.0000 32.4074 176.6426 40 L 4.4555 8.5118 122.4720 56.0880 40.9558 176.6203 41 S 4.6357 8.2988 114.9945 55.4971 66.2281 171.9013 42 P 4.3970 0.0000 0.0000 63.4486 32.6395 177.3847 43 Q 4.3154 8.7296 119.8059 58.3024 28.4451 178.2527 44 E 4.1400 8.1840 119.2433 58.2088 29.8019 178.1722 45 V 3.9412 7.6111 117.3414 64.3470 31.7230 176.8560 46 F 4.3962 8.0184 118.7604 59.7792 39.6691 177.1368 47 I 4.0147 7.5471 119.8416 64.5519 37.0865 178.2998 48 K 4.0595 7.8621 117.9618 59.1395 31.8514 178.7874 49 A 4.2353 8.0393 119.5422 53.5229 18.3197 178.5564 50 A 4.4476 8.0132 120.3007 52.7134 18.9248 179.6837 51 I 3.7077 7.2949 118.1069 64.2465 37.2552 177.9993 52 E 4.1199 8.0254 116.7228 59.1833 30.8286 177.9771 53 T 4.3683 8.0221 118.6116 62.1588 67.6601 174.8481 54 K 4.3998 7.8075 114.9357 55.5478 33.0533 175.9584 55 A 4.1333 7.8793 121.1576 51.5897 18.8845 178.9072 56 D 4.6447 8.7796 123.0905 55.1806 40.4985 176.0130 57 A 4.6981 7.7468 120.0353 50.5219 22.4198 175.7257 58 I 4.9857 7.9467 120.0421 60.2028 39.9427 172.3018 59 L 4.4196 9.1384 126.5762 54.2061 42.8071 175.3209 60 L 4.4618 8.8751 128.2720 53.8618 41.6779 176.0063 61 S 4.8034 8.7891 121.1934 57.4135 62.0226 172.2110 62 S 4.5783 8.4904 122.1891 56.9569 64.3141 174.0654 63 L 4.0575 7.8198 126.3150 53.8707 41.0262 175.3855 64 Y 3.5722 7.2459 120.4162 58.1222 35.0991 169.8112 65 G 3.9756 8.3301 110.8430 46.3685 0.0000 171.8286 66 Q 3.9517 8.4016 120.9729 54.7540 28.7830 171.6484 67 G 3.8608 8.5606 107.8612 46.4653 0.0000 173.2809 68 E 3.7900 9.6661 129.8680 57.0041 27.6601 175.0668 69 I 3.9142 7.4145 117.4063 62.4218 35.3231 174.5814 70 D 4.9920 8.4140 121.6055 55.8515 40.9625 177.9395 71 C 4.2935 7.6355 118.8992 61.8134 32.1977 174.0893 72 K 4.0823 8.1077 119.9537 59.7266 32.1357 178.4075 73 G 3.9534 8.5254 108.6452 46.5364 0.0000 175.1326 74 L 4.1527 7.5657 120.9447 56.1968 42.3142 179.3341 75 R 3.9707 7.7726 118.6910 59.2278 30.0057 178.4510 76 Q 4.2223 7.6313 118.0162 58.1057 28.0527 178.8784 77 K 4.0148 7.5698 118.9401 59.6359 32.1032 179.0717 78 C 4.1578 8.2419 117.1810 62.8560 27.8547 176.1207 79 D 4.4331 8.4500 121.0346 56.9669 40.2499 177.8202 80 E 4.4832 7.8875 115.4191 56.8373 30.5298 176.1898 81 A 4.5518 7.8079 119.1912 51.9886 21.2140 179.1781 82 G 4.8719 8.7458 116.0698 45.0346 0.0000 172.3856 83 L 3.6945 7.9689 119.2354 56.4241 40.7160 175.4190 84 E 4.0664 8.6992 117.6923 58.7664 28.4978 178.6221 85 G 3.6916 9.0517 118.1784 48.1765 0.0000 173.7741 86 I 3.8014 7.6180 120.1192 61.7941 37.3890 175.1801 87 L 4.0274 8.2300 128.4100 53.5666 42.8673 175.0928 88 L 4.6381 7.4513 124.6994 53.6343 44.2269 174.5428 89 Y 5.3506 8.5550 122.1944 56.3665 42.3031 174.3917 90 V 5.1344 7.9329 119.6770 60.3050 35.5718 174.7657 91 G 4.3982 8.5321 107.9302 47.0830 0.0000 174.2917 92 G 3.6664 9.2896 114.8326 45.5798 0.0000 177.9726 93 N 3.7674 6.7333 124.4341 51.9823 39.3651 172.9308 94 I 4.4887 8.8457 117.8707 62.5520 37.7918 178.4732 95 V 4.1186 9.0367 125.7617 61.5507 32.0149 176.9640 96 V 4.4344 7.6544 123.8930 60.2091 30.2346 176.4964 97 G 4.3622 9.5516 120.0760 46.7219 0.0000 174.2945 98 K 4.4368 7.3346 120.2853 54.0433 30.5006 176.9351 99 Q 4.5470 7.6027 118.2915 55.6625 30.4147 174.5728 100 H 4.7771 7.6830 111.8144 53.2545 30.3666 171.7372 101 W 4.0940 8.1114 135.0000 57.7652 36.4289 171.4332 102 P 4.3236 0.0000 0.0000 63.0024 30.3626 176.2402 103 D 4.5144 8.6967 122.3728 55.0023 41.3179 178.6324 104 V 3.4952 7.4765 120.6133 64.1363 32.2265 177.8063 105 E 3.6157 7.6153 119.8751 58.4270 29.1961 178.4175 106 K 4.0400 7.8718 117.7668 58.3433 31.9795 179.3895 107 R 3.7629 7.1295 119.7764 59.2150 29.7421 177.5642 108 F 4.7032 7.1768 114.9643 57.8431 38.5143 177.2138 109 K 4.4962 7.8221 122.1645 58.2235 32.3330 177.9000 110 D 4.5608 7.5714 115.7744 55.1588 39.8975 177.0365 111 M 4.2995 7.8918 118.7505 56.3793 32.9092 176.5738 112 G 3.6050 7.4191 104.9776 45.1616 0.0000 171.8071 113 Y 5.0627 5.6039 119.1832 57.5575 45.9314 175.1126 114 D 5.4403 8.5560 120.6392 54.3353 41.1343 175.6863 115 R 4.9578 8.1440 123.7480 54.1301 33.7366 174.8487 116 V 4.6954 6.9604 118.1262 60.7241 34.4383 174.0912 117 Y 4.4857 8.9181 120.4801 56.5160 41.3625 173.9625 118 A 4.9835 8.0192 122.7526 48.8037 23.0076 173.0932 119 P 4.1513 0.0000 0.0000 64.0222 31.2528 175.4378 120 G 3.6905 8.5814 119.7078 45.8100 0.0000 173.0270 121 T 4.2541 7.1061 111.5218 59.8003 69.7075 172.2599 122 P 4.3909 0.0000 0.0000 62.1521 31.3222 175.3053 123 P 4.2189 0.0000 0.0000 64.8181 31.6320 176.4094 124 E 4.7858 7.5193 118.1632 53.9951 30.8216 175.7751 125 V 4.0061 7.2860 115.3375 62.0404 31.8233 179.1675 126 G 3.5120 8.8085 116.2988 47.0713 0.0000 174.7839 127 I 3.8792 7.4985 121.4754 63.4168 37.2423 177.7281 128 A 4.1162 7.6163 120.2722 54.1760 18.6289 179.1741 129 D 4.4494 7.7742 117.8296 57.1829 40.7104 178.6354 130 L 2.8139 7.4969 119.7021 57.9303 40.1957 178.9247 131 K 3.9030 7.5139 120.5674 58.6139 31.8802 178.9610 132 K 3.9457 7.9876 119.2368 59.6144 31.8130 178.6770 133 D 4.6237 7.6298 117.0374 55.7091 40.6044 177.9619 134 L 4.1136 7.1428 120.0163 56.8216 42.3639 176.8726 135 N 4.7462 7.7145 114.4449 53.3914 39.8285 174.9746 136 I 4.6940 7.2674 119.7153 60.6459 38.2087 174.7878 137 E 4.5812 8.0514 122.8337 55.8105 29.8072 176.3126 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 4.45 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.60 0.00 2 E 8.12 4.46 0.00 1.97 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 3 K 9.01 4.37 0.00 2.06 1.88 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.56 7.81 4 K 8.73 4.36 0.00 1.35 1.57 0.00 0.61 0.00 0.00 1.42 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.57 7.81 5 T 8.39 4.98 4.21 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 1.26 0.00 0.00 6 I 8.27 4.83 1.77 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.84 0.67 0.00 0.00 7 V 8.42 5.02 2.22 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 1.09 0.00 0.00 1.01 0.00 0.00 8 L 8.63 4.98 0.00 1.89 1.83 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.76 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 10 V 9.22 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 1.01 0.00 0.00 1.06 0.00 0.00 11 I 5.78 4.65 1.89 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 1.25 0.56 0.94 0.00 0.00 12 G 9.05 3.77 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 13 S 8.91 4.53 0.00 3.80 3.68 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 0.00 0.00 0.00 0.00 14 D 8.31 4.55 0.00 2.70 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.48 4.56 0.00 3.14 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 16 H 8.59 4.68 0.00 3.07 3.32 0.00 5.88 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 17 A 7.79 4.81 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 18 V 7.80 4.00 2.33 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 0.97 0.00 0.00 0.98 0.00 0.00 19 G 8.79 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.16 4.83 0.00 2.66 2.73 0.00 0.00 6.96 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 21 K 8.50 4.57 0.00 1.69 1.97 0.00 1.84 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.33 7.81 22 I 8.15 4.43 1.72 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.77 0.80 0.00 0.00 23 L 7.81 4.77 0.00 1.71 1.71 0.99 1.11 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 24 D 8.10 4.68 0.00 2.83 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 25 H 8.19 4.74 0.00 3.08 3.41 0.00 5.67 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 26 A 8.61 4.85 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.52 4.76 0.00 3.07 3.47 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 28 T 7.55 4.47 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 1.01 0.00 0.00 29 N 8.23 4.46 0.00 2.68 2.84 0.00 0.00 6.96 7.98 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 30 A 7.78 3.98 0.56 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 0.00 0.00 31 G 7.71 3.36 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 0.00 32 F 7.19 4.45 0.00 2.93 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 33 N 8.63 4.67 0.00 2.77 2.81 0.00 0.00 7.15 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 34 V 7.67 5.26 1.85 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 0.59 0.00 0.00 0.90 0.00 0.00 35 V 8.33 4.44 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 0.90 0.00 0.00 0.94 0.00 0.00 36 N 8.64 5.41 0.00 2.78 2.72 0.00 0.00 7.58 8.06 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 37 I 8.22 4.12 1.93 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.12 1.16 0.00 0.00 38 G 8.48 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 0.00 0.00 0.00 39 V 8.51 3.98 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 0.84 0.00 0.00 0.93 0.00 0.00 40 L 8.51 4.46 0.00 1.89 2.00 0.98 0.57 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 41 S 8.30 4.64 0.00 3.88 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.40 0.00 2.20 2.04 0.00 3.58 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 2.12 2.20 0.00 43 Q 8.73 4.32 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.54 2.65 0.00 44 E 8.18 4.14 0.00 2.00 2.01 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 2.41 2.32 0.00 45 V 7.61 3.94 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 1.06 0.00 0.00 0.93 0.00 0.00 46 F 8.02 4.40 0.00 3.32 2.94 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 0.00 0.00 0.00 47 I 7.55 4.01 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.05 0.96 0.00 0.00 48 K 7.86 4.06 0.00 2.00 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.63 7.81 49 A 8.04 4.24 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 50 A 8.01 4.45 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 51 I 7.29 3.71 2.09 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.46 0.92 0.00 0.00 52 E 8.03 4.12 0.00 2.13 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 2.42 2.56 0.00 53 T 8.02 4.37 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 1.27 0.00 0.00 54 K 7.81 4.40 0.00 2.02 1.77 0.00 1.60 0.00 0.00 0.61 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.38 7.81 55 A 7.88 4.13 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 56 D 8.78 4.64 0.00 2.86 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 57 A 7.75 4.70 1.04 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 0.00 0.00 58 I 7.95 4.99 1.78 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 1.07 0.92 0.85 0.00 0.00 59 L 9.14 4.42 0.00 1.85 1.66 1.12 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.88 4.46 0.00 1.68 1.72 0.82 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 61 S 8.79 4.80 0.00 4.01 4.03 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 0.00 0.00 0.00 62 S 8.49 4.58 0.00 4.03 3.72 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 63 L 7.82 4.06 0.00 1.56 1.50 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.25 3.57 0.00 3.21 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 65 G 8.33 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 0.00 0.00 0.00 0.00 66 Q 8.40 3.95 0.00 2.26 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.29 7.23 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 67 G 8.56 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 68 E 9.67 3.79 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 69 I 7.41 3.91 1.93 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 1.53 1.56 0.93 0.00 0.00 70 D 8.41 4.99 0.00 2.71 2.49 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 0.00 0.00 0.00 0.00 71 C 7.64 4.29 0.00 3.34 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 72 K 8.11 4.08 0.00 1.96 1.82 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.34 7.81 73 G 8.53 3.95 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 0.00 0.00 0.00 74 L 7.57 4.15 0.00 1.75 1.52 -0.27 0.70 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 75 R 7.77 3.97 0.00 2.17 2.03 0.00 2.90 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 76 Q 7.63 4.22 0.00 2.37 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.54 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 77 K 7.57 4.01 0.00 2.02 1.85 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.79 7.81 78 C 8.24 4.16 0.00 3.16 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 79 D 8.45 4.43 0.00 2.85 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 80 E 7.89 4.48 0.00 2.13 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 2.56 2.32 0.00 81 A 7.81 4.55 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 82 G 8.75 4.87 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 83 L 7.97 3.69 0.00 2.06 2.10 1.10 0.72 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 84 E 8.70 4.07 0.00 1.96 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 2.31 2.31 0.00 85 G 9.05 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 86 I 7.62 3.80 1.76 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.52 0.70 0.00 0.00 87 L 8.23 4.03 0.00 1.68 1.61 0.17 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.45 4.64 0.00 1.57 1.82 0.92 1.03 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 89 Y 8.56 5.35 0.00 2.95 2.89 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 90 V 7.93 5.13 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 1.31 0.00 0.00 1.08 0.00 0.00 91 G 8.53 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 0.00 0.00 0.00 0.00 92 G 9.29 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 93 N 6.73 3.77 0.00 2.77 2.83 0.00 0.00 6.07 7.18 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 94 I 8.85 4.49 2.12 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 1.36 0.48 0.98 0.00 0.00 95 V 9.04 4.12 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 0.91 0.00 0.00 96 V 7.65 4.43 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 0.95 0.00 0.00 1.01 0.00 0.00 97 G 9.55 4.36 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 0.00 98 K 7.33 4.44 0.00 1.73 1.75 0.00 1.62 0.00 0.00 1.50 0.00 0.00 2.69 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.35 7.81 99 Q 7.60 4.55 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.43 0.00 0.00 0.00 0.00 0.00 2.18 2.33 0.00 100 H 7.68 4.78 0.00 3.10 3.23 0.00 5.82 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 W 8.11 4.09 0.00 3.41 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 0.00 102 P 0.00 4.32 0.00 2.20 2.06 0.00 3.78 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 103 D 8.70 4.51 0.00 2.63 2.60 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 0.00 104 V 7.48 3.50 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 0.88 0.00 0.00 0.77 0.00 0.00 105 E 7.62 3.62 0.00 2.04 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 2.36 2.53 0.00 106 K 7.87 4.04 0.00 1.89 1.72 0.00 1.50 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.37 7.81 107 R 7.13 3.76 0.00 1.81 1.36 0.00 3.08 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 108 F 7.18 4.70 0.00 3.19 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 0.00 109 K 7.82 4.50 0.00 2.05 1.86 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.38 7.81 110 D 7.57 4.56 0.00 2.82 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 0.00 111 M 7.89 4.30 0.00 2.07 2.35 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 2.65 2.71 0.00 112 G 7.42 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Y 5.60 5.06 0.00 3.22 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 0.00 114 D 8.56 5.44 0.00 2.96 2.93 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 0.00 115 R 8.14 4.96 0.00 0.69 1.42 0.00 3.20 0.00 0.00 3.39 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.96 0.00 116 V 6.96 4.70 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 0.56 0.00 0.00 0.86 0.00 0.00 117 Y 8.92 4.49 0.00 2.98 2.91 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 0.00 0.00 0.00 118 A 8.02 4.98 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 0.00 119 P 0.00 4.15 0.00 2.06 2.09 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 120 G 8.58 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 0.00 121 T 7.11 4.25 4.46 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 1.28 0.00 0.00 122 P 0.00 4.39 0.00 2.25 2.29 0.00 3.81 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 123 P 0.00 4.22 0.00 2.21 2.23 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 124 E 7.52 4.79 0.00 2.10 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 2.34 2.26 0.00 125 V 7.29 4.01 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 0.82 0.00 0.00 0.81 0.00 0.00 126 G 8.81 3.51 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 0.00 127 I 7.50 3.88 1.81 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 1.08 0.41 1.09 0.00 0.00 128 A 7.62 4.12 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 0.00 129 D 7.77 4.45 0.00 2.19 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 0.00 0.00 0.00 130 L 7.50 2.81 0.00 1.45 1.66 0.68 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 131 K 7.51 3.90 0.00 1.76 1.87 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.35 1.59 7.81 132 K 7.99 3.95 0.00 2.09 1.94 0.00 1.78 0.00 0.00 1.85 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.51 7.81 133 D 7.63 4.62 0.00 2.70 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 7.14 4.11 0.00 1.63 1.72 0.88 0.81 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 0.00 135 N 7.71 4.75 0.00 2.82 2.92 0.00 0.00 7.00 8.11 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 0.00 136 I 7.27 4.69 1.98 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 1.38 0.79 0.96 0.00 0.00 137 E 8.05 4.58 0.00 2.12 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 0.00 2.34 2.25 0.00