NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 E 4.2957 8.4293 120.2265 56.5675 31.0749 175.0182 9 T 4.2788 7.8587 110.3860 60.1878 71.5750 173.9333 10 L 4.0536 9.1931 122.6728 58.1719 41.9943 180.9450 11 E 4.2865 8.2140 117.5439 59.4398 29.6015 178.6960 12 A 4.0296 8.0320 120.6714 55.6443 18.3733 179.9942 13 R 3.9094 8.3889 116.5722 59.4076 30.0629 179.1684 14 I 3.2973 8.8435 119.6771 64.0530 37.7353 177.6807 15 N 4.2957 8.4214 116.7769 56.1772 38.0606 177.1267 16 R 3.9771 8.0008 120.0103 59.3527 30.0342 178.4563 17 A 4.0490 7.7001 119.4117 54.0063 18.1219 178.0240 18 T 4.0836 7.2059 105.4595 60.6142 69.2754 173.0208 19 N 4.1850 7.5914 119.9226 54.1171 39.0429 173.7358 20 P 4.6149 0.0000 0.0000 64.4456 31.7864 177.3943 21 L 4.2603 8.5952 118.7085 56.7911 41.9447 177.4172 22 N 4.2563 7.5895 114.4204 54.2736 38.7762 174.8516 23 K 4.3035 8.6342 120.7245 56.4091 32.6936 175.5611 24 E 4.8198 7.6648 115.4303 55.1555 31.7412 174.9891 25 L 3.7302 8.6569 119.3307 55.2900 42.0123 177.9181 26 D 4.7076 7.9453 122.2706 52.6195 40.9857 176.5783 27 W 4.3789 8.4816 126.2786 58.7765 29.4183 177.4696 28 A 4.0829 8.3439 120.7127 55.6913 17.6974 179.7759 29 S 4.0561 8.0995 112.2258 61.9341 63.0878 176.5835 30 I 3.6557 7.6140 122.3234 64.9252 36.8046 177.9126 31 N 4.5044 8.8731 116.9966 56.5661 38.5727 177.6969 32 G 3.7486 8.2022 107.0225 47.7992 0.0000 175.3128 33 F 4.0546 8.4095 122.6180 61.5280 39.1591 176.6590 34 C 4.1056 8.2417 115.9340 59.9195 39.7242 176.0456 35 E 3.8114 8.2328 119.7038 59.4487 28.3663 179.0178 36 Q 3.9793 8.0890 119.4258 58.1989 29.0590 178.0442 37 L 4.0231 7.1817 121.2405 58.3448 40.7191 178.0034 38 N 4.8089 7.1570 114.0243 53.2024 38.7407 175.5588 39 E 4.0526 7.5658 116.2088 57.5192 30.6606 176.3793 40 D 4.7754 7.2254 118.7045 52.3997 43.0493 176.7501 41 F 5.4409 8.3560 118.6185 57.9007 40.0380 176.8973 42 E 4.1981 8.1745 120.7155 58.1785 30.0489 179.2778 43 G 3.6098 8.0528 106.6600 47.3266 0.0000 173.9786 44 P 4.4112 0.0000 0.0000 64.8811 31.3669 176.9851 45 P 4.3596 0.0000 0.0000 65.3575 31.1589 178.4813 46 L 4.0100 7.6926 117.9183 57.8291 41.9605 178.6755 47 A 4.3027 8.2510 121.1672 55.5085 18.2801 179.6641 48 T 3.6462 7.7912 107.9367 64.9802 68.5766 176.5095 49 R 4.0414 7.8445 120.8938 59.1753 30.0626 178.9361 50 L 4.0921 8.3883 118.7146 57.8857 41.6037 179.7422 51 L 4.0592 8.4386 118.7975 57.4659 41.5336 179.0386 52 A 4.0196 8.6982 121.2265 55.6241 18.3663 178.6939 53 H 3.9874 8.0172 116.3686 59.9076 29.9706 177.3591 54 K 3.8931 7.9246 119.6035 59.4882 31.6106 179.5031 55 I 3.8414 7.7811 119.3580 63.8195 37.0632 177.4214 56 Q 4.2883 7.4557 116.7001 54.8937 29.1438 176.0150 57 S 4.1269 6.6560 113.0652 58.2108 62.7577 172.6925 58 P 4.3388 0.0000 0.0000 63.9437 31.5411 176.3358 59 Q 4.3866 7.7290 119.1993 54.3252 28.7136 175.6492 60 E 3.9475 9.0231 124.3905 59.4254 29.5378 178.2578 61 W 4.7864 8.4440 127.4091 60.8421 30.5938 177.0780 62 E 3.8263 8.3373 120.0331 58.6198 29.1780 178.2912 63 A 4.4619 7.9400 121.4141 54.8546 18.3157 179.5776 64 I 3.7051 8.1521 118.2813 64.4637 37.0734 178.7758 65 Q 3.4915 7.6867 118.6436 58.7129 28.4765 178.3645 66 A 3.8347 7.6985 121.7133 55.4547 18.3172 179.7184 67 L 4.2368 7.8675 116.9562 57.8487 41.7430 179.6948 68 T 3.8903 7.8335 115.9200 66.6919 68.4074 176.3382 69 V 3.5509 8.0287 120.3081 66.5339 31.6088 177.3154 70 L 4.0039 8.6033 119.1655 58.5410 41.7479 178.3161 71 E 4.2879 9.0712 119.7771 60.1578 29.8653 179.1699 72 T 4.1934 8.6992 115.5518 67.1449 68.3099 176.0803 73 C 4.3168 9.0522 118.3970 59.8881 39.9119 175.7776 74 M 4.2710 8.1206 119.0642 57.6064 31.7545 178.3046 75 K 4.3264 7.9029 118.1038 57.8879 32.4973 177.2080 76 S 4.6268 7.4443 112.8589 57.7704 64.4615 174.7477 77 C 4.6583 8.0631 114.2749 56.4560 29.8151 172.0476 78 G 3.0017 8.0927 124.8178 46.0686 0.0000 173.7371 79 K 3.8530 8.2249 122.8930 59.1211 32.6847 177.1889 80 R 3.7408 7.9856 117.9115 59.5166 29.9836 178.4557 81 F 4.0085 8.1661 119.3869 61.5111 39.5432 176.4690 82 H 3.8802 7.8398 115.4542 59.1459 28.2981 177.5229 83 D 4.3513 8.0018 119.5053 57.2389 40.6275 178.4480 84 E 3.9155 7.5314 118.4582 59.2289 29.7812 179.1775 85 V 3.2690 7.1288 118.4253 64.8654 31.4425 176.4864 86 G 4.0070 7.4007 104.2736 44.3160 0.0000 173.5447 87 K 4.4238 7.3061 119.0915 53.5484 35.7321 177.8505 88 F 4.3294 8.8245 121.5456 62.0433 38.6719 179.7612 89 R 3.4608 6.8445 115.2936 57.9426 31.5285 176.7952 90 F 4.6465 8.0662 118.4351 59.6683 40.0678 177.5900 91 L 4.1089 7.9682 118.9682 57.5593 41.4018 178.7607 92 N 4.3003 8.7647 117.0068 56.4894 38.1938 177.2213 93 E 3.9002 7.3939 118.0453 59.1024 29.6408 178.9324 94 L 4.0733 7.4823 118.6354 57.4439 41.7193 179.2599 95 I 3.7273 7.6633 120.0023 64.1190 36.9496 178.3216 96 K 3.7798 8.2274 119.8581 59.7145 31.6548 179.4508 97 V 3.7393 7.6123 118.1552 65.1225 31.2406 177.5471 98 V 4.1103 7.2788 109.5606 61.1910 32.2590 175.6105 99 S 4.6260 7.7400 115.8791 56.3607 63.2811 172.9911 100 P 4.3399 0.0000 0.0000 65.3183 31.5084 177.3934 101 K 3.8951 8.2116 118.3593 59.1095 33.7190 176.7385 102 Y 4.0548 7.7491 111.5512 58.5354 36.2763 176.9756 103 L 4.4126 6.5689 135.0000 56.2286 42.7971 178.1271 104 G 3.9667 9.1367 107.4967 46.9777 0.0000 174.7350 105 S 4.4300 7.9671 115.9401 59.7579 63.3959 174.8979 106 R 4.6925 7.7023 115.7788 55.9935 29.5626 175.6351 107 T 4.6948 7.6677 113.4506 62.4072 72.1890 174.1703 108 S 4.4684 8.2717 118.4709 57.6808 64.3535 174.9118 109 E 3.9550 8.6507 121.3757 59.3741 29.3141 178.1475 110 K 4.0168 8.1374 119.3159 59.3842 32.2826 178.2118 111 V 3.5796 7.8151 117.8419 66.3631 31.5512 178.5684 112 K 4.0103 8.1538 117.6976 59.6175 31.8177 179.1909 113 N 4.3724 8.9949 117.8097 56.0765 38.3222 177.4508 114 K 4.0517 8.1219 121.1838 59.3349 32.2499 178.6823 115 I 3.6799 7.5899 119.7284 64.6022 37.1088 178.2706 116 L 4.0663 7.8594 119.2633 57.8646 41.4661 179.0402 117 E 3.9314 8.4210 118.8627 59.7801 29.3388 179.5235 118 L 3.3449 7.9762 118.5934 57.5384 41.6198 179.4910 119 L 3.8754 7.6310 118.6787 58.0547 41.5911 178.9073 120 Y 3.2244 7.7953 119.2936 60.5777 38.6102 178.3767 121 S 3.9782 7.8436 114.9135 61.1694 62.7209 176.4907 122 W 4.3013 7.5470 122.6708 59.4639 28.7331 178.4572 123 T 3.5365 7.5773 109.0719 64.4731 67.8455 176.0231 124 V 3.8345 6.8980 119.4962 65.0579 32.0024 177.8682 125 G 3.8802 8.4196 104.6189 46.6673 0.0000 173.9914 126 L 4.7517 8.4806 121.6590 52.1424 42.0508 175.2441 127 P 4.4967 0.0000 0.0000 63.8332 32.2346 178.1281 128 E 4.1350 7.9095 117.9264 58.3619 30.4175 177.2738 129 E 4.2775 7.8151 121.1656 55.4089 27.3784 177.8839 130 V 3.7922 7.4845 114.1304 63.4147 32.0858 177.8079 131 K 4.1702 7.7949 118.0247 58.5283 32.1354 178.9728 132 I 3.7890 7.7104 120.2531 64.4128 37.0447 178.1237 133 A 4.1199 8.1086 121.0722 55.2098 17.6951 179.1914 134 E 3.9877 8.0223 116.9084 59.1989 29.8857 178.6431 135 A 4.1499 8.6118 121.3336 55.5934 18.3693 179.0562 136 Y 3.9974 8.3133 118.1861 60.8201 38.9012 178.0720 137 Q 4.0774 8.5670 118.7703 59.3352 28.4275 177.9729 138 M 4.1113 7.6162 118.5504 57.8369 32.0220 177.7774 139 L 4.0305 8.0462 119.4919 57.4736 41.8750 179.4609 140 K 4.2918 7.5705 119.3701 59.3120 32.3037 177.7632 141 K 4.2383 7.9013 116.8421 57.7465 32.1834 176.7339 142 Q 4.4428 9.0396 115.8853 55.4958 30.2439 175.7838 143 G 3.8823 7.8670 105.7692 46.6735 0.0000 175.3825 144 I 3.8849 7.7904 122.5196 63.1521 37.7191 176.4069 145 V 3.7297 7.4987 123.2385 62.9232 31.3388 175.3114 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 8 E 8.43 4.30 0.00 1.97 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 2.22 2.38 0.00 9 T 7.86 4.28 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 1.22 0.00 0.00 10 L 9.19 4.05 0.00 1.75 1.89 0.64 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.21 4.29 0.00 2.09 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 2.43 2.50 0.00 12 A 8.03 4.03 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 13 R 8.39 3.91 0.00 2.29 2.30 0.00 3.30 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.82 0.00 14 I 8.84 3.30 1.80 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.98 0.99 0.00 0.00 15 N 8.42 4.30 0.00 2.87 2.85 0.00 0.00 7.02 7.69 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 16 R 8.00 3.98 0.00 2.07 1.89 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 17 A 7.70 4.05 1.21 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 0.00 0.00 18 T 7.21 4.08 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 0.97 0.00 0.00 19 N 7.59 4.19 0.00 2.97 2.91 0.00 0.00 7.22 7.59 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 20 P 0.00 4.61 0.00 2.15 2.18 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.21 0.00 21 L 8.60 4.26 0.00 1.81 1.77 0.94 0.90 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 22 N 7.59 4.26 0.00 3.06 3.17 0.00 0.00 6.99 7.49 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 23 K 8.63 4.30 0.00 1.76 1.84 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.41 7.81 24 E 7.66 4.82 0.00 2.09 1.93 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 2.18 2.33 0.00 25 L 8.66 3.73 0.00 1.23 0.70 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 26 D 7.95 4.71 0.00 2.71 2.42 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 27 W 8.48 4.38 0.00 3.45 3.14 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 28 A 8.34 4.08 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 29 S 8.10 4.06 0.00 4.06 3.90 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 0.00 0.00 0.00 30 I 7.61 3.66 2.13 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 1.28 0.86 1.08 0.00 0.00 31 N 8.87 4.50 0.00 2.95 2.93 0.00 0.00 7.01 7.96 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 32 G 8.20 3.75 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 0.00 33 F 8.41 4.05 0.00 3.15 3.26 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 34 C 8.24 4.11 0.00 3.21 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 35 E 8.23 3.81 0.00 1.85 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 2.49 2.44 0.00 36 Q 8.09 3.98 0.00 2.28 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.30 0.00 37 L 7.18 4.02 0.00 1.60 1.25 0.65 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.16 4.81 0.00 2.52 2.83 0.00 0.00 7.06 7.54 0.00 0.00 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 E 7.57 4.05 0.00 1.99 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 2.33 2.14 0.00 40 D 7.23 4.78 0.00 2.92 2.53 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 0.00 0.00 0.00 0.00 41 F 8.36 5.44 0.00 2.95 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 42 E 8.17 4.20 0.00 2.09 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 2.38 0.00 43 G 8.05 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 44 P 0.00 4.41 0.00 2.20 2.28 0.00 3.75 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 45 P 0.00 4.36 0.00 2.16 2.08 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 46 L 7.69 4.01 0.00 1.95 1.90 0.96 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.25 4.30 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 48 T 7.79 3.65 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 0.83 0.00 0.00 49 R 7.84 4.04 0.00 2.15 2.11 0.00 3.17 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.93 0.00 50 L 8.39 4.09 0.00 1.97 1.79 1.11 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.44 4.06 0.00 2.15 1.96 1.21 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.70 4.02 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 53 H 8.02 3.99 0.00 3.20 3.54 0.00 5.60 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 54 K 7.92 3.89 0.00 1.71 1.77 0.00 1.64 0.00 0.00 1.59 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.62 1.56 7.81 55 I 7.78 3.84 2.01 0.00 0.00 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 1.56 0.68 0.91 0.00 0.00 56 Q 7.46 4.29 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 57 S 6.66 4.13 0.00 3.96 3.75 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 58 P 0.00 4.34 0.00 2.09 2.09 0.00 3.71 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 2.03 2.10 0.00 59 Q 7.73 4.39 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 60 E 9.02 3.95 0.00 2.07 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 0.00 2.49 2.46 0.00 61 W 8.44 4.79 0.00 3.29 3.09 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 62 E 8.34 3.83 0.00 1.98 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 2.22 2.25 0.00 63 A 7.94 4.46 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 64 I 8.15 3.71 2.05 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 1.77 0.95 1.09 0.00 0.00 65 Q 7.69 3.49 0.00 1.68 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 66 A 7.70 3.83 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 67 L 7.87 4.24 0.00 1.92 1.78 0.95 0.79 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 68 T 7.83 3.89 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 1.04 0.00 0.00 69 V 8.03 3.55 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 0.84 0.00 0.00 0.76 0.00 0.00 70 L 8.60 4.00 0.00 2.05 2.06 1.20 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 71 E 9.07 4.29 0.00 2.13 2.38 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 2.52 2.54 0.00 72 T 8.70 4.19 4.57 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 1.43 0.00 0.00 73 C 9.05 4.32 0.00 3.02 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 74 M 8.12 4.27 0.00 2.13 2.66 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.93 0.00 75 K 7.90 4.33 0.00 1.98 1.95 0.00 1.80 0.00 0.00 1.83 0.00 0.00 3.17 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.62 1.90 7.81 76 S 7.44 4.63 0.00 4.01 3.90 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 0.00 0.00 0.00 77 C 8.06 4.66 0.00 3.09 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 78 G 8.09 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 0.00 0.00 0.00 79 K 8.22 3.85 0.00 1.84 1.79 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.28 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.51 7.81 80 R 7.99 3.74 0.00 1.87 1.83 0.00 2.95 0.00 0.00 2.46 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.50 0.00 81 F 8.17 4.01 0.00 3.05 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 82 H 7.84 3.88 0.00 3.30 3.29 0.00 5.69 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 83 D 8.00 4.35 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 84 E 7.53 3.92 0.00 1.72 1.68 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 2.37 2.48 0.00 85 V 7.13 3.27 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 0.56 0.00 0.00 -0.28 0.00 0.00 86 G 7.40 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 0.00 0.00 0.00 87 K 7.31 4.42 0.00 1.91 1.61 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.22 1.38 7.81 88 F 8.82 4.33 0.00 3.10 3.18 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 89 R 6.84 3.46 0.00 1.89 2.02 0.00 3.24 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 90 F 8.07 4.65 0.00 3.10 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 91 L 7.97 4.11 0.00 2.04 1.86 1.17 0.63 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 92 N 8.76 4.30 0.00 2.71 2.78 0.00 0.00 6.97 7.64 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 93 E 7.39 3.90 0.00 1.85 1.83 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 2.46 2.46 0.00 94 L 7.48 4.07 0.00 1.77 1.67 1.10 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.66 3.73 1.95 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 1.53 1.57 0.85 0.00 0.00 96 K 8.23 3.78 0.00 1.85 1.85 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.76 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.95 1.14 7.81 97 V 7.61 3.74 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 1.03 0.00 0.00 0.93 0.00 0.00 98 V 7.28 4.11 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 0.71 0.00 0.00 1.07 0.00 0.00 99 S 7.74 4.63 0.00 4.01 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 0.00 100 P 0.00 4.34 0.00 2.07 2.09 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 101 K 8.21 3.90 0.00 1.64 1.82 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.75 1.19 7.81 102 Y 7.75 4.05 0.00 3.17 2.51 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 0.00 103 L 6.57 4.41 0.00 1.84 1.72 0.94 0.93 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 0.00 104 G 9.14 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 0.00 105 S 7.97 4.43 0.00 3.86 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 0.00 106 R 7.70 4.69 0.00 1.88 1.97 0.00 3.01 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 107 T 7.67 4.69 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 1.22 0.00 0.00 108 S 8.27 4.47 0.00 4.02 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 0.00 109 E 8.65 3.96 0.00 2.10 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 2.37 2.58 0.00 110 K 8.14 4.02 0.00 1.88 1.92 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.54 7.81 111 V 7.82 3.58 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 0.99 0.00 0.00 0.97 0.00 0.00 112 K 8.15 4.01 0.00 1.86 1.85 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.27 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.76 7.81 113 N 8.99 4.37 0.00 2.77 2.99 0.00 0.00 6.68 7.56 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 0.00 114 K 8.12 4.05 0.00 1.91 2.06 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.55 7.81 115 I 7.59 3.68 2.07 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 1.55 0.64 0.93 0.00 0.00 116 L 7.86 4.07 0.00 1.90 1.79 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.42 3.93 0.00 2.14 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 2.33 2.43 0.00 118 L 7.98 3.34 0.00 1.41 0.51 0.97 0.62 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 0.00 119 L 7.63 3.88 0.00 2.09 2.02 1.09 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 7.80 3.22 0.00 2.81 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 0.00 121 S 7.84 3.98 0.00 4.03 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 0.00 122 W 7.55 4.30 0.00 3.46 3.06 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 0.00 123 T 7.58 3.54 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 0.98 0.00 0.00 124 V 6.90 3.83 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 0.74 0.00 0.00 0.21 0.00 0.00 125 G 8.42 3.88 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 0.00 0.00 0.00 126 L 8.48 4.75 0.00 1.54 1.43 0.60 0.62 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 0.00 127 P 0.00 4.50 0.00 2.15 2.24 0.00 3.73 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 1.96 1.95 0.00 128 E 7.91 4.14 0.00 1.94 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 2.28 2.30 0.00 129 E 7.82 4.28 0.00 2.12 1.80 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 2.20 2.23 0.00 130 V 7.48 3.79 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 1.06 0.00 0.00 0.90 0.00 0.00 131 K 7.79 4.17 0.00 1.55 0.96 0.00 1.46 0.00 0.00 0.91 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.16 1.34 7.81 132 I 7.71 3.79 2.05 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 1.51 0.83 1.19 0.00 0.00 133 A 8.11 4.12 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 0.00 134 E 8.02 3.99 0.00 2.46 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 0.00 2.41 2.44 0.00 135 A 8.61 4.15 1.56 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 0.00 136 Y 8.31 4.00 0.00 3.30 3.18 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 0.00 137 Q 8.57 4.08 0.00 2.43 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.55 0.00 0.00 0.00 0.00 0.00 2.55 2.67 0.00 138 M 7.62 4.11 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.70 0.00 139 L 8.05 4.03 0.00 1.71 1.53 0.90 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.57 4.29 0.00 1.58 1.95 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.45 7.81 141 K 7.90 4.24 0.00 2.01 1.80 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.48 7.81 142 Q 9.04 4.44 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.32 0.00 0.00 0.00 0.00 0.00 2.26 2.54 0.00 143 G 7.87 3.88 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 0.00 0.00 0.00 144 I 7.79 3.88 1.81 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 1.29 0.56 0.87 0.00 0.00 145 V 7.50 3.73 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 0.62 0.00 0.00 0.43 0.00 0.00