NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 P 4.3730 0.0000 0.0000 62.4858 34.7391 180.0709 13 K 3.4170 8.9440 117.7064 56.9316 31.2843 175.3479 14 G 3.8130 10.1599 119.7913 48.2935 0.0000 173.3005 15 V 4.3709 7.4687 112.6272 59.8314 34.4265 175.6302 16 S 4.3722 8.6279 115.8393 57.0317 65.3062 172.9607 17 V 4.4460 8.5027 128.4596 61.8274 32.2075 174.5371 18 E 4.7178 9.2247 128.8151 54.5973 31.9240 175.2585 19 V 4.7163 8.3996 123.2888 61.0947 33.6352 174.5531 20 A 4.7588 8.5433 129.2066 50.3270 21.6372 174.9220 21 P 3.6718 0.0000 0.0000 61.3372 32.6884 176.6357 22 G 4.2118 7.9564 102.0978 46.0437 0.0000 171.5611 23 R 5.2717 8.2339 118.8921 54.7254 35.7457 174.2519 24 V 4.7762 8.4620 119.0852 61.5235 34.9826 173.9017 25 K 4.5263 9.3314 128.5235 55.1549 33.7160 176.0091 26 V 4.4488 7.9609 125.4890 60.6008 31.4831 174.6060 27 K 4.3867 8.6379 124.6554 56.8838 34.5146 177.0916 28 G 4.3106 8.0748 107.4803 45.4269 0.0000 172.1215 29 P 4.8339 0.0000 0.0000 63.1898 31.1347 177.3218 30 K 4.4293 8.6167 116.8059 54.6166 34.7331 176.3913 31 G 3.9053 7.1242 105.9177 45.5992 0.0000 169.8355 32 E 4.8018 8.1476 119.7793 54.6147 31.4387 175.8776 33 L 4.6527 8.2903 124.7117 52.5240 44.6364 175.5177 34 E 4.2254 8.8219 123.3802 56.5251 30.7030 177.0615 35 V 4.3325 9.0257 124.3378 60.0272 33.9077 172.7844 36 P 4.5357 0.0000 0.0000 63.4329 31.3073 175.7941 37 V 4.5601 8.3672 123.9529 60.2791 34.9273 175.1754 38 S 4.2680 8.6327 118.7677 57.6838 62.0944 172.6226 39 P 4.2697 0.0000 0.0000 65.4884 31.3086 175.9212 40 E 4.3383 8.1298 118.0918 58.5326 28.7078 176.7347 41 M 4.8808 9.7817 134.1023 56.5625 30.5538 177.5894 42 R 3.5302 6.6141 113.7282 57.0363 29.1845 176.5056 43 V 4.0792 7.7221 110.5818 60.2521 32.5556 176.0488 44 V 4.4065 7.9423 130.8849 62.1813 34.6963 175.0492 45 V 4.2345 8.4586 121.9732 61.9872 31.8675 177.1091 46 E 4.4186 8.2236 126.4496 53.7549 29.0811 175.3104 47 E 4.0734 8.3022 123.9993 55.7501 28.6285 177.3907 48 G 3.7056 8.4274 110.1896 46.6145 0.0000 173.1984 49 V 4.4192 7.8076 112.9199 60.0277 36.0652 173.0227 50 V 4.6112 8.1111 120.3565 61.3461 33.0551 174.6730 51 R 4.7713 8.0935 124.8829 54.4909 33.3010 174.3217 52 V 4.5293 8.3396 122.9952 61.0361 34.4890 174.3848 53 E 4.6969 8.6754 126.8136 54.3880 32.3739 174.8395 54 R 4.7276 8.6158 122.3980 53.9771 33.1706 174.5237 55 P 4.1242 0.0000 0.0000 63.6022 29.7382 177.9574 56 S 4.1427 8.7681 107.3617 58.0681 64.2190 174.4852 57 D 4.9788 8.1800 118.4170 54.0738 41.4514 177.4611 58 E 4.3062 7.9456 117.7084 55.5310 31.9445 176.8063 59 R 3.9141 8.5513 121.5308 60.1353 30.1798 179.0358 60 R 3.9333 8.0896 116.8995 59.3540 29.8373 178.4019 61 H 4.3928 7.9022 115.0621 58.2443 29.1285 177.4715 62 K 3.9381 8.6404 119.5327 59.1288 32.1936 179.0135 63 S 4.4217 7.8263 114.8931 61.1402 63.2674 176.0032 64 L 3.9710 7.6230 120.9721 56.9894 41.3805 176.7708 65 H 4.0777 7.4418 116.6523 58.2240 30.6051 173.7220 66 G 4.4133 9.2225 120.3792 46.3709 0.0000 175.0415 67 L 3.9010 7.9630 121.6680 58.0428 42.0041 179.2333 68 T 3.8281 8.6023 115.6036 67.5121 68.4640 177.3195 69 R 3.7051 7.5650 119.1387 59.8296 30.2511 178.2979 70 T 3.9855 8.4149 115.8503 65.9933 68.3204 177.8236 71 L 3.7578 7.9991 121.6974 57.5530 42.0965 179.6913 72 I 3.8189 7.9492 119.7364 64.3787 37.3148 178.0743 73 A 3.9683 7.8040 121.5662 55.7813 17.9795 179.5480 74 N 4.3211 8.9416 114.6365 56.1599 38.4667 177.4907 75 A 4.0199 8.0553 122.3755 55.1758 18.4019 178.9676 76 V 3.5603 7.7960 116.8232 65.7703 31.0966 177.7998 77 K 4.0262 8.4401 118.6504 59.3787 31.8992 179.0598 78 G 3.6149 7.5183 106.1570 47.6258 0.0000 175.5195 79 V 3.8251 8.2103 114.6132 61.1967 33.0285 177.0549 80 S 4.6348 7.2558 115.4522 57.7225 62.3040 174.6543 81 E 3.8188 7.9709 120.3874 56.9076 26.2373 175.4567 82 G 4.4437 7.2633 111.6698 44.0141 0.0000 172.2814 83 Y 5.1785 8.3787 122.6161 55.8711 37.2111 181.0343 84 S 3.9940 9.1435 125.7898 58.2948 61.9903 165.0000 85 K 3.9667 8.7205 126.7281 56.3227 32.8066 175.3873 86 E 5.2779 8.3829 122.7356 54.9048 32.6990 174.4979 87 L 5.3105 10.4608 121.1088 52.6979 45.7886 175.8196 88 L 5.1040 8.3897 122.6172 54.0743 43.2807 175.2967 89 I 4.7335 7.5671 119.4618 63.4494 40.8622 172.7228 90 K 4.8038 9.1300 119.1791 55.6775 34.7026 172.4101 91 G 3.8854 7.2450 112.0912 44.6121 0.0000 177.1911 92 I 4.3602 7.4203 129.4458 60.5006 37.0458 177.4910 93 G 3.9234 8.9961 117.1857 47.9013 0.0000 172.1005 94 Y 5.1661 9.5602 118.7918 57.4372 38.5985 175.7033 95 R 4.6426 7.8361 118.3086 56.2193 32.4274 172.3325 96 A 4.9258 8.8153 120.1709 50.4308 20.4941 176.9706 97 R 4.5019 8.2123 118.5478 53.1547 31.4557 173.1827 98 L 4.0320 7.9984 121.7053 55.1042 43.1680 177.8673 99 V 4.3648 9.1750 125.5386 60.5929 32.4012 176.4377 100 G 3.9620 8.0788 113.6669 45.0834 0.0000 172.9274 101 R 4.0611 8.6428 119.3890 57.7370 30.3997 176.1640 102 A 4.8593 7.5374 120.4540 50.4414 21.2462 176.1574 103 L 4.5274 7.7024 118.4678 53.9835 43.8040 175.2107 104 E 5.3744 8.3112 119.3235 52.9565 30.2452 173.0302 105 L 5.1293 8.2397 123.8899 54.7722 42.6529 176.2327 106 T 4.6431 8.4034 112.9875 59.3706 70.8604 175.2057 107 V 3.1609 7.4419 122.2997 60.0335 32.3941 176.4093 108 G 3.9270 8.0901 106.4921 45.3123 0.0000 173.6442 109 F 4.9861 7.2697 118.4849 56.9409 39.9281 176.0762 110 S 4.4972 8.5690 116.0708 59.5271 62.8165 173.7464 111 H 5.0127 7.7003 119.1125 53.6197 32.9644 170.6875 112 P 4.4099 0.0000 0.0000 62.1101 32.2500 175.6651 113 V 4.0224 8.2720 122.0415 61.8605 32.6880 175.1754 114 V 4.3469 8.3377 129.5437 61.7662 31.3958 174.9955 115 V 3.9439 8.1913 129.5422 61.7198 32.3279 175.3299 116 E 4.3139 8.9708 129.2538 55.8522 30.7559 173.8345 117 P 5.0745 0.0000 0.0000 60.3338 33.0276 173.2185 118 P 4.5388 0.0000 0.0000 61.1182 32.5723 174.9319 119 E 4.0165 8.6336 121.9120 58.4071 30.1070 176.4678 120 G 4.1083 8.9660 113.1399 45.2393 0.0000 172.5013 121 I 5.0379 7.5678 119.0945 59.7337 41.3014 175.0109 122 T 4.5654 8.8607 121.1689 61.8221 72.6918 172.8179 123 F 5.0780 8.7823 124.1666 56.3491 40.6153 174.8553 124 E 4.5717 9.3261 124.0911 54.6744 31.6658 175.6608 125 V 4.8979 8.2563 125.3401 60.1727 30.5023 173.0986 126 P 4.3477 0.0000 0.0000 64.8399 31.7102 177.3026 127 E 4.7279 7.7936 118.2145 52.8990 32.4017 174.7291 128 P 4.6618 0.0000 0.0000 64.0555 31.6362 176.9527 129 T 4.6001 7.7337 107.2650 61.3394 69.8853 173.3845 130 R 4.9472 7.9382 121.2089 55.2424 33.3718 174.3860 131 V 4.9415 9.3800 123.9706 61.5621 35.7229 173.6970 132 R 5.0504 9.0434 121.4631 54.6361 33.1331 173.6956 133 V 4.7110 8.9080 122.3863 61.3548 33.4540 174.8232 134 S 4.9294 8.7941 124.2132 56.8256 65.9452 174.3232 135 G 3.7276 7.8124 109.9187 46.2337 0.0000 171.8205 136 I 4.5616 7.1368 115.9468 58.6801 36.0667 173.5112 137 D 4.5552 7.2158 120.6142 50.6598 47.3800 175.8755 138 K 4.3753 8.4751 122.7737 54.7934 29.9513 178.5868 139 Q 3.7566 7.7360 124.8428 58.9263 30.6236 178.8633 140 K 4.2776 8.2205 117.3336 58.6697 33.1934 177.8486 141 V 3.6216 7.8537 118.0456 66.0644 31.2271 177.7382 142 G 3.9228 8.0961 105.8463 47.8954 0.0000 174.9425 143 Q 4.1230 7.5898 120.3003 59.2172 29.3221 178.1019 144 V 4.6929 8.1768 118.8932 64.6269 31.4988 176.8481 145 A 4.2126 8.3009 120.2677 55.3764 17.9330 179.7089 146 A 3.5984 8.1997 114.4604 54.2749 20.5830 179.9982 147 N 4.1278 8.1395 110.9035 56.0025 38.9058 176.9033 148 I 4.0182 7.3877 120.1111 62.9698 36.5271 178.0685 149 R 3.8177 9.0708 118.0598 59.6454 28.9352 178.6266 150 A 4.0698 8.5571 121.6276 55.1294 18.3894 178.4736 151 I 3.8303 7.3844 116.9072 64.3358 37.3680 175.8307 152 R 4.9548 6.9870 117.1724 54.2984 34.1858 175.0052 153 K 4.6701 7.9689 120.5485 56.2305 33.5607 175.1054 154 P 5.1976 0.0000 0.0000 63.3418 37.5449 174.2364 155 S 4.0528 9.0325 110.2135 58.2349 64.3778 173.4566 156 A 4.3697 10.0401 121.9302 56.0010 16.4068 180.1237 157 Y 4.5417 7.4454 120.6214 60.0961 35.2009 173.8800 158 H 4.2404 7.7850 115.1236 56.2828 28.7996 174.6456 159 E 4.0305 8.6056 123.4809 56.7539 28.7187 174.3877 160 K 4.1093 7.1508 116.7150 56.5788 32.9011 175.6373 161 G 4.0673 8.4747 106.9073 43.4692 0.0000 172.7681 162 I 4.4498 7.7385 113.5428 59.1695 37.8114 175.1084 163 Y 4.1725 8.6433 124.5160 57.5636 38.6959 175.2871 164 Y 4.8324 8.2171 117.4637 57.6576 38.8076 177.3815 165 A 5.4975 7.6930 135.0000 53.3441 19.3115 176.7479 166 G 4.0289 8.0460 104.7990 45.2370 0.0000 172.3431 167 E 4.7027 8.4644 118.3307 53.5974 31.8537 174.4353 168 P 4.7092 0.0000 0.0000 61.6923 31.7779 176.1106 169 V 4.0725 8.2835 123.7586 60.6843 32.6539 176.5668 170 R 3.6088 8.7934 122.2345 59.6944 29.7440 177.1563 *171 L 4.1254 7.7509 122.0051 53.9287 41.6082 177.9631 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 12 P 0.00 4.37 0.00 2.05 2.13 0.00 3.78 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 1.91 2.10 0.00 13 K 8.94 3.42 0.00 1.96 1.58 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.44 7.81 14 G 10.16 3.81 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 0.00 0.00 0.00 15 V 7.47 4.37 2.17 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 0.70 0.00 0.00 0.92 0.00 0.00 16 S 8.63 4.37 0.00 3.85 3.65 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 0.00 0.00 0.00 0.00 17 V 8.50 4.45 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 0.84 0.00 0.00 0.92 0.00 0.00 18 E 9.22 4.72 0.00 1.90 1.81 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 2.23 2.22 0.00 19 V 8.40 4.72 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 0.78 0.00 0.00 0.92 0.00 0.00 20 A 8.54 4.76 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 21 P 0.00 3.67 0.00 2.07 1.94 0.00 3.64 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 2.02 2.14 0.00 22 G 7.96 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 0.00 0.00 0.00 0.00 23 R 8.23 5.27 0.00 1.71 1.87 0.00 3.07 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 24 V 8.46 4.78 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 0.96 0.00 0.00 0.92 0.00 0.00 25 K 9.33 4.53 0.00 1.68 1.88 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.36 7.81 26 V 7.96 4.45 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 1.03 0.00 0.00 0.91 0.00 0.00 27 K 8.64 4.39 0.00 1.84 1.90 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.47 7.81 28 G 8.07 4.31 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 0.00 29 P 0.00 4.83 0.00 2.05 2.09 0.00 3.95 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 2.01 2.09 0.00 30 K 8.62 4.43 0.00 1.52 1.65 0.00 1.87 0.00 0.00 1.72 0.00 0.00 2.78 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.37 1.38 7.81 31 G 7.12 3.91 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 0.00 0.00 0.00 32 E 8.15 4.80 0.00 1.96 1.81 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 2.19 2.38 0.00 33 L 8.29 4.65 0.00 1.50 1.51 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.82 4.23 0.00 1.84 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 2.30 2.31 0.00 35 V 9.03 4.33 2.14 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 0.99 0.00 0.00 0.97 0.00 0.00 36 P 0.00 4.54 0.00 2.10 2.07 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 37 V 8.37 4.56 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 0.76 0.00 0.00 1.03 0.00 0.00 38 S 8.63 4.27 0.00 3.87 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 39 P 0.00 4.27 0.00 2.22 2.08 0.00 3.65 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 2.11 2.11 0.00 40 E 8.13 4.34 0.00 2.01 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 2.37 2.49 0.00 41 M 9.78 4.88 0.00 2.10 2.21 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 2.67 2.31 0.00 42 R 6.61 3.53 0.00 1.83 1.92 0.00 3.25 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 43 V 7.72 4.08 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 0.81 0.00 0.00 0.92 0.00 0.00 44 V 7.94 4.41 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 0.92 0.00 0.00 0.96 0.00 0.00 45 V 8.46 4.23 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 0.91 0.00 0.00 0.96 0.00 0.00 46 E 8.22 4.42 0.00 2.06 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 2.28 2.38 0.00 47 E 8.30 4.07 0.00 2.10 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 2.23 2.21 0.00 48 G 8.43 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 0.00 0.00 0.00 49 V 7.81 4.42 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 0.97 0.00 0.00 50 V 8.11 4.61 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 0.76 0.00 0.00 0.92 0.00 0.00 51 R 8.09 4.77 0.00 1.87 1.72 0.00 3.26 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 52 V 8.34 4.53 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 0.77 0.00 0.00 0.89 0.00 0.00 53 E 8.68 4.70 0.00 1.92 1.77 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 2.20 2.22 0.00 54 R 8.62 4.73 0.00 1.98 2.01 0.00 3.35 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.54 0.00 55 P 0.00 4.12 0.00 2.12 1.87 0.00 3.71 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 1.78 1.90 0.00 56 S 8.77 4.14 0.00 3.96 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 57 D 8.18 4.98 0.00 2.65 2.68 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 58 E 7.95 4.31 0.00 2.13 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 2.42 2.39 0.00 59 R 8.55 3.91 0.00 1.87 1.94 0.00 3.20 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 60 R 8.09 3.93 0.00 1.77 1.91 0.00 3.15 0.00 0.00 3.32 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 61 H 7.90 4.39 0.00 3.39 3.34 0.00 5.84 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 62 K 8.64 3.94 0.00 1.83 1.91 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.50 7.81 63 S 7.83 4.42 0.00 4.02 3.89 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 64 L 7.62 3.97 0.00 1.71 1.72 0.89 1.07 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 65 H 7.44 4.08 0.00 3.12 3.36 0.00 5.72 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 66 G 9.22 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 0.00 0.00 0.00 0.00 67 L 7.96 3.90 0.00 1.89 1.94 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.60 3.83 4.20 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 1.18 0.00 0.00 69 R 7.57 3.71 0.00 1.94 1.93 0.00 3.16 0.00 0.00 3.38 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 70 T 8.41 3.99 4.23 0.00 0.00 0.00 0.00 0.00 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 71 L 8.00 3.76 0.00 1.75 1.68 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.95 3.82 1.85 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 1.44 1.00 0.89 0.00 0.00 73 A 7.80 3.97 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 74 N 8.94 4.32 0.00 2.86 2.85 0.00 0.00 6.96 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 75 A 8.06 4.02 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 76 V 7.80 3.56 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 1.05 0.00 0.00 0.95 0.00 0.00 77 K 8.44 4.03 0.00 1.85 1.85 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.74 7.81 78 G 7.52 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 79 V 8.21 3.83 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 0.83 0.00 0.00 1.01 0.00 0.00 80 S 7.26 4.63 0.00 3.92 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 81 E 7.97 3.82 0.00 2.15 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 0.00 2.29 2.31 0.00 82 G 7.26 4.44 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 0.00 83 Y 8.38 5.18 0.00 2.86 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 0.00 0.00 0.00 0.00 84 S 9.14 3.99 0.00 4.13 4.24 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 85 K 8.72 3.97 0.00 2.00 1.90 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.29 1.26 7.81 86 E 8.38 5.28 0.00 1.99 1.87 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 2.21 2.31 0.00 87 L 10.46 5.31 0.00 1.68 1.78 1.06 0.90 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 88 L 8.39 5.10 0.00 1.65 1.36 0.99 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.57 4.73 2.00 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 1.48 1.42 1.00 0.00 0.00 90 K 9.13 4.80 0.00 2.01 1.82 0.00 1.58 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.17 0.90 7.81 91 G 7.25 3.89 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 0.00 0.00 0.00 92 I 7.42 4.36 1.84 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 1.24 0.70 0.89 0.00 0.00 93 G 9.00 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 94 Y 9.56 5.17 0.00 2.55 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 95 R 7.84 4.64 0.00 1.92 2.05 0.00 2.91 0.00 0.00 3.36 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.46 0.00 96 A 8.82 4.93 1.18 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 0.00 0.00 97 R 8.21 4.50 0.00 1.73 1.79 0.00 3.16 0.00 0.00 3.08 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 98 L 8.00 4.03 0.00 1.59 1.60 1.14 1.06 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 99 V 9.18 4.36 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 0.84 0.00 0.00 0.95 0.00 0.00 100 G 8.08 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 0.00 0.00 0.00 101 R 8.64 4.06 0.00 1.88 2.10 0.00 3.23 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 102 A 7.54 4.86 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 0.00 103 L 7.70 4.53 0.00 1.59 1.42 0.73 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.31 5.37 0.00 1.97 1.87 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 2.12 2.01 0.00 105 L 8.24 5.13 0.00 1.60 1.80 0.80 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.40 4.64 4.18 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 1.16 0.00 0.00 107 V 7.44 3.16 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 0.26 0.00 0.00 0.26 0.00 0.00 108 G 8.09 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 0.00 0.00 0.00 109 F 7.27 4.99 0.00 3.20 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 0.00 110 S 8.57 4.50 0.00 3.88 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 0.00 111 H 7.70 5.01 0.00 3.13 3.15 0.00 5.94 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.41 0.00 2.12 1.95 0.00 3.17 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 113 V 8.27 4.02 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 0.93 0.00 0.00 1.12 0.00 0.00 114 V 8.34 4.35 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 0.78 0.00 0.00 0.90 0.00 0.00 115 V 8.19 3.94 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 0.84 0.00 0.00 0.87 0.00 0.00 116 E 8.97 4.31 0.00 2.06 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 2.38 2.38 0.00 117 P 0.00 5.07 0.00 2.28 2.45 0.00 3.89 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 118 P 0.00 4.54 0.00 2.24 2.23 0.00 3.64 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 119 E 8.63 4.02 0.00 1.95 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 2.29 2.32 0.00 120 G 8.97 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 7.57 5.04 1.83 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 1.15 0.64 0.58 0.00 0.00 122 T 8.86 4.57 4.22 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 1.22 0.00 0.00 123 F 8.78 5.08 0.00 2.96 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 0.00 124 E 9.33 4.57 0.00 1.94 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 0.00 2.23 2.32 0.00 125 V 8.26 4.90 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 0.95 0.00 0.00 0.95 0.00 0.00 126 P 0.00 4.35 0.00 2.22 2.17 0.00 3.88 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 2.00 2.01 0.00 127 E 7.79 4.73 0.00 2.00 1.87 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 2.30 2.20 0.00 128 P 0.00 4.66 0.00 2.22 2.28 0.00 3.64 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 129 T 7.73 4.60 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 1.23 0.00 0.00 130 R 7.94 4.95 0.00 1.75 1.79 0.00 3.25 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 131 V 9.38 4.94 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 1.08 0.00 0.00 0.96 0.00 0.00 132 R 9.04 5.05 0.00 2.03 1.97 0.00 2.73 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 133 V 8.91 4.71 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 0.59 0.00 0.00 1.14 0.00 0.00 134 S 8.79 4.93 0.00 3.87 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 0.00 135 G 7.81 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 0.00 136 I 7.14 4.56 1.77 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 0.95 0.57 0.79 0.00 0.00 137 D 7.22 4.56 0.00 2.54 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 0.00 138 K 8.48 4.38 0.00 1.88 2.05 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.30 7.81 139 Q 7.74 3.76 0.00 1.98 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 140 K 8.22 4.28 0.00 2.09 1.73 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.46 7.81 141 V 7.85 3.62 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 1.02 0.00 0.00 0.91 0.00 0.00 142 G 8.10 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 0.00 143 Q 7.59 4.12 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 144 V 8.18 4.69 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 1.27 0.00 0.00 1.06 0.00 0.00 145 A 8.30 4.21 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 8.20 3.60 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 0.00 147 N 8.14 4.13 0.00 3.04 2.94 0.00 0.00 6.91 7.37 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 0.00 148 I 7.39 4.02 2.05 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 2.16 1.07 0.93 0.00 0.00 149 R 9.07 3.82 0.00 1.89 2.11 0.00 2.44 0.00 0.00 2.47 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 150 A 8.56 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 0.00 151 I 7.38 3.83 1.79 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.81 0.93 0.00 0.00 152 R 6.99 4.95 0.00 1.77 1.81 0.00 2.98 0.00 0.00 2.73 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.48 0.00 153 K 7.97 4.67 0.00 1.71 0.85 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.27 1.35 7.81 154 P 0.00 5.20 0.00 2.11 1.64 0.00 3.82 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.70 0.00 155 S 9.03 4.05 0.00 3.87 3.89 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 0.00 156 A 10.04 4.37 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 0.00 157 Y 7.45 4.54 0.00 2.99 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 0.00 158 H 7.78 4.24 0.00 3.27 3.76 0.00 5.73 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.61 4.03 0.00 2.09 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 2.10 2.29 0.00 160 K 7.15 4.11 0.00 1.88 1.86 0.00 1.93 0.00 0.00 1.27 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.47 1.38 7.81 161 G 8.47 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 162 I 7.74 4.45 1.90 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 1.34 0.69 0.92 0.00 0.00 163 Y 8.64 4.17 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 0.00 164 Y 8.22 4.83 0.00 2.99 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 0.00 165 A 7.69 5.50 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 0.00 166 G 8.05 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 0.00 0.00 0.00 167 E 8.46 4.70 0.00 1.98 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 2.24 2.30 0.00 168 P 0.00 4.71 0.00 2.41 2.35 0.00 3.81 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 2.02 1.93 0.00 169 V 8.28 4.07 2.14 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 0.83 0.00 0.00 0.98 0.00 0.00 170 R 8.79 3.61 0.00 1.77 1.96 0.00 3.23 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 *171 L 7.75 4.13 0.00 1.43 1.52 0.92 0.72 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 * Residues marked with a * may have inaccurate shift predictions.