NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.5063 0.0000 0.0000 62.4754 33.5069 174.7605 2 R 4.8795 8.4677 122.7260 54.4171 33.1083 169.0444 3 V 4.6211 9.9234 120.6961 59.5519 35.9697 173.8611 4 E 5.1335 8.8974 123.2071 54.5015 32.5716 175.2078 5 L 4.8281 8.8319 123.9382 52.8509 44.7497 175.5851 6 E 4.6212 8.9218 124.4279 55.9812 30.2253 176.3845 7 I 3.1698 8.4210 126.2275 59.3127 38.7812 173.9529 8 P 4.2264 0.0000 0.0000 62.5493 31.8647 177.0638 9 E 3.8624 8.5802 118.7409 59.4257 29.5866 177.9447 10 D 4.3483 7.9602 117.3372 55.6678 41.6251 175.5102 11 V 4.6784 7.3196 118.2763 61.5284 33.9825 174.7063 12 D 4.8613 8.6063 123.9305 52.5914 45.3030 174.4384 13 A 5.0259 8.5562 123.6552 49.1016 21.5214 175.2277 14 E 4.3284 8.6267 123.1312 56.2310 32.2393 174.6981 15 Q 5.1262 7.6832 118.6662 55.7144 31.9555 172.4802 16 D 4.8597 7.8625 126.1185 52.7765 43.0796 174.7501 17 H 3.9640 8.2740 118.7618 57.7131 27.0010 175.6553 18 L 4.4771 8.4441 128.5099 55.7060 41.6678 174.7280 19 D 5.5432 7.9235 119.8994 52.6436 43.4869 175.4171 20 I 4.6880 8.7503 122.9739 59.7892 40.9632 174.6994 21 T 5.0263 8.7520 121.8303 61.8584 72.0470 172.9356 22 V 4.7030 9.2097 126.8301 61.1495 34.2794 174.2181 23 E 5.2342 9.0811 125.9399 54.9724 33.9759 175.1250 24 G 4.4014 9.1368 109.0425 45.1918 0.0000 172.8804 25 D 4.6552 8.7365 117.5908 55.2921 40.4493 176.7373 26 N 4.7354 8.5732 116.7677 52.6167 40.0181 173.1065 27 G 3.9020 6.8925 103.4979 44.3887 0.0000 172.5936 28 S 5.3454 8.2442 113.1924 56.8098 66.4117 173.9564 29 V 4.4911 9.2308 120.7124 62.0452 34.7945 173.5897 30 T 5.2111 8.6259 123.8981 62.1533 71.3019 173.5685 31 R 4.6765 9.0890 122.4929 54.8487 35.5115 173.9357 32 R 4.7689 8.5205 121.1040 55.0669 31.5410 175.9575 33 L 4.1772 8.4222 128.3830 52.2195 40.9442 173.9396 34 W 5.0932 8.5463 130.0591 55.6142 32.2799 174.2886 35 Y 4.5040 8.6251 125.6800 54.9679 41.4278 172.0959 36 P 4.1219 0.0000 0.0000 64.3534 31.6090 175.7371 37 D 4.4924 8.9227 121.6775 55.2966 38.4657 172.9936 38 I 4.7013 7.6887 119.7692 59.8417 39.1001 174.8519 39 D 4.9968 9.5710 128.0196 52.5802 43.0583 175.5969 40 V 4.9578 8.5972 123.8411 61.2460 33.1736 174.6180 41 S 4.7991 9.3583 122.5027 56.5745 67.0747 173.3031 42 V 4.3979 8.4053 121.0805 61.7821 32.1608 175.6053 43 D 4.6583 9.6325 132.0444 52.6810 40.5696 177.2954 44 G 3.9336 8.5164 113.6253 45.1291 0.0000 171.1393 45 D 4.8543 8.7982 120.2273 52.7115 41.3753 176.4064 46 T 5.1227 7.7970 110.6374 60.1197 72.4519 172.8053 47 V 4.8091 8.9951 124.1796 61.4919 33.7036 174.3970 48 V 4.8311 9.3859 129.1064 61.2163 34.0816 174.2331 49 I 5.1717 8.8565 128.8638 59.6529 39.6054 174.3758 50 E 5.2986 9.1990 124.8694 55.1107 33.5773 174.2754 51 S 4.9055 8.5527 112.2610 57.9446 65.2537 175.2188 52 D 4.5355 8.9758 125.5788 56.5620 41.1858 176.9502 53 E 4.3638 7.9686 119.0785 56.0828 30.0159 176.1548 54 D 4.8592 8.3204 122.0244 52.3421 40.2960 175.8836 55 N 4.7064 8.1168 117.0659 52.5333 40.2271 174.3627 56 A 3.9332 8.4976 122.5412 55.7899 18.4497 180.2643 57 K 3.9394 8.0673 115.8645 59.5771 32.0940 179.7609 58 T 3.8779 8.4892 116.5975 66.8782 68.7019 176.9268 59 M 4.0064 8.3175 120.8328 58.3094 31.9524 179.1437 60 S 3.9861 7.8964 115.4004 61.9793 62.9323 176.8878 61 T 3.4535 6.9024 117.0188 66.0250 67.9046 176.9103 62 I 3.7740 7.3023 121.9979 64.4149 37.0645 178.5474 63 G 3.6444 7.7347 105.8224 48.0910 0.0000 175.8149 64 T 3.7685 7.5004 117.3613 66.5711 68.5292 176.7776 65 F 4.5427 8.9348 120.8596 61.1683 38.8621 176.8839 66 Q 3.9835 8.3775 119.4715 58.7780 28.7728 178.0463 67 S 4.2398 8.2182 115.7317 62.3378 63.1829 176.9925 68 H 4.2868 8.2115 118.5120 58.9557 28.4764 178.0018 69 I 3.5064 7.6637 121.5162 64.3238 36.9274 178.2541 70 E 3.8157 8.4645 119.7645 59.5477 29.1860 179.2860 71 N 4.8783 8.4828 116.5233 56.7521 38.6417 177.3262 72 M 4.0950 8.0023 119.9320 58.3770 31.5126 178.6817 73 F 4.5760 8.2773 117.9164 61.0506 39.1150 177.0097 74 H 4.0795 8.7040 117.7679 59.2946 29.6868 177.2242 75 G 4.1278 8.9934 109.7904 47.4859 0.0000 175.8303 76 V 3.8767 8.2300 114.3319 62.7640 31.3742 176.6254 77 T 4.2540 7.3071 113.4566 61.8813 70.0930 174.8935 *78 E 4.1738 8.3532 117.6366 55.5128 31.6353 177.1166 79 G 4.5057 7.9297 105.5429 45.4289 0.0000 173.7309 80 W 5.0642 8.8813 119.0408 54.9229 32.2984 175.0348 81 E 5.5483 8.9108 121.3020 55.2859 33.2980 174.1976 82 Y 4.9176 9.9029 121.2561 56.1643 41.8433 174.5853 83 G 4.5010 9.2726 110.8299 44.8352 0.0000 172.2247 84 M 5.9752 9.4836 123.8887 52.5058 35.9656 174.2265 85 E 5.1942 8.7320 121.4816 54.7683 32.4004 175.6703 86 V 4.5841 8.6320 124.5788 60.4438 31.9833 174.4596 87 F 5.1877 9.0128 130.0202 57.0496 41.3601 174.1870 88 Y 4.6690 7.2084 122.0748 55.5521 40.8504 174.3972 89 S 4.2674 8.4970 117.5462 60.2942 64.3468 174.5187 90 H 4.4222 8.2349 118.9717 56.3675 30.7280 174.5657 91 F 4.4476 7.9527 117.8084 54.9659 39.4904 173.5404 92 P 2.9700 0.0000 0.0000 62.2919 30.8948 175.6345 93 M 4.3981 6.9895 123.7955 55.1185 33.4427 175.2546 94 Q 4.6082 9.0618 124.6954 54.1861 31.5660 174.5444 95 V 4.8246 8.4776 124.4985 61.2616 33.2748 174.4091 96 N 5.1307 9.1540 124.4735 51.6154 43.5724 173.4848 97 V 4.4941 8.3344 121.2199 61.8136 32.9976 175.2177 98 E 4.5162 9.2182 127.6554 55.4692 32.7068 176.4316 99 G 4.0699 8.4541 116.5420 46.9421 0.0000 173.3472 100 D 5.2066 8.4827 121.8439 52.6905 41.4749 173.8644 101 E 5.0286 7.9372 112.7432 55.5275 33.7973 174.2794 102 V 4.6813 8.3683 115.0000 60.0211 34.0247 174.9944 103 V 4.7564 9.2692 125.6807 61.1343 34.0986 174.0998 104 I 4.9389 8.9163 128.8947 59.6639 39.5005 174.4914 105 E 4.7608 9.0738 126.6245 55.1573 33.1837 176.1960 106 N 4.4603 8.8604 118.8280 54.0592 37.5801 173.3179 107 F 4.3481 8.0967 119.2682 59.2176 39.5721 174.8124 108 L 3.5629 9.0474 126.3268 55.4880 39.0488 174.7688 109 G 2.6966 7.7042 104.3904 45.8978 0.0000 174.5652 110 E 4.1208 7.6657 118.4351 55.6566 30.2723 177.6554 111 K 3.9929 8.5788 121.5410 59.2614 32.5562 177.9372 112 A 4.1070 7.7383 121.0102 51.3252 18.7172 175.2051 113 P 4.6088 0.0000 0.0000 62.6170 32.3689 176.3367 114 R 4.6564 8.7556 123.1600 55.4474 32.1047 175.6022 115 R 4.9515 8.0066 116.1084 55.8780 32.1216 173.7654 116 T 4.6907 8.3715 113.9091 60.8511 71.3674 172.7878 117 T 4.7090 8.3221 122.7411 62.9100 69.8654 174.4369 118 I 4.0950 8.7929 127.2977 61.1054 38.0482 175.8280 119 H 4.5805 8.9965 123.8757 55.7163 30.5307 176.4513 120 G 3.8734 8.3223 110.2654 47.6496 0.0000 173.9202 121 D 4.7694 8.6156 124.1043 54.1716 41.2268 176.3790 122 T 4.1493 7.2945 116.6189 64.6955 69.2581 173.0373 123 D 4.9070 9.2834 125.7775 52.6144 43.3129 175.3379 124 V 4.6444 8.4693 123.8703 61.3179 33.1925 174.4628 125 E 4.7432 8.8529 127.4858 54.5353 32.3688 174.8388 126 I 4.8468 8.4557 124.6355 59.4529 40.4576 174.9118 127 D 4.5888 9.5713 128.7869 52.9632 43.0012 176.0871 128 G 3.7405 8.2045 118.9148 47.0780 0.0000 172.3082 129 E 4.4991 8.8585 124.4693 56.3213 29.2681 174.9855 130 E 5.3588 8.3102 119.1875 54.5405 33.1613 175.0046 131 L 5.2030 9.3644 122.7174 53.2123 46.2666 175.6095 132 T 4.9350 9.1540 117.3396 60.4766 70.3637 172.5057 133 V 4.8016 8.7900 130.2841 62.0705 33.2778 174.8913 134 S 5.8083 7.5061 120.1579 57.9540 66.9780 173.6850 135 G 4.2982 8.2635 108.0078 46.0349 0.0000 171.5796 136 P 4.5855 0.0000 0.0000 65.0565 32.0495 175.3895 137 D 4.5594 8.0620 119.5105 52.9389 40.5342 176.1659 138 I 3.4836 8.2696 127.8755 63.7516 37.6563 177.1849 139 E 3.8212 8.1480 119.1834 59.1625 29.3754 178.5871 140 A 3.9369 9.2959 121.5538 55.2513 18.4270 179.8946 141 V 3.5551 7.8926 116.6531 66.2227 31.7605 178.4609 142 G 3.1026 8.1033 105.6183 47.6234 0.0000 175.6484 143 Q 3.8603 8.2754 120.4551 59.0934 28.7686 178.6023 144 T 4.0138 7.9967 116.6769 66.6257 68.4992 176.1859 145 A 3.8271 8.0841 122.5848 55.1290 18.3814 179.2310 146 A 3.8778 7.8293 118.6851 55.5677 18.4038 179.4942 147 D 4.2644 9.1812 117.6227 57.5784 40.6732 179.0223 148 I 3.5923 7.7948 119.3807 64.5198 37.4346 177.7874 149 E 4.1820 8.0151 121.1970 58.8647 29.5071 178.8450 150 Q 3.9866 8.5429 118.3472 58.5951 28.4568 178.4360 151 L 3.9723 7.7923 121.0562 57.0926 41.6552 177.4352 152 T 3.6883 7.2193 108.3373 60.7011 68.9696 174.0314 153 R 4.0413 7.5825 122.4937 56.9200 30.5196 175.5567 154 I 4.5572 8.3137 124.1981 59.5134 40.3873 173.8488 155 N 4.7489 8.9076 124.6032 55.1477 39.9661 175.7078 156 D 4.4471 8.2430 115.8858 55.8118 39.0265 176.5381 157 K 4.3156 7.3391 116.1138 53.2393 34.9735 174.9189 158 D 4.4728 8.3604 119.0271 54.2574 41.1388 176.7656 159 V 4.0850 8.5389 127.1496 65.5068 31.7997 178.1362 160 R 4.0040 8.6229 118.4848 58.4056 30.1919 177.5377 161 V 3.8950 7.6914 115.8222 63.7084 32.6729 175.5207 162 F 4.5830 8.5406 121.2635 56.3705 38.2946 175.8690 163 Q 4.9504 8.5438 123.1059 55.1838 29.8827 176.0724 164 D 4.6633 8.1997 118.2452 55.0278 41.5759 175.2380 165 G 4.3616 8.4118 105.6186 44.2648 0.0000 173.3565 166 V 4.4523 7.9509 120.1462 61.9815 32.9007 174.4338 167 Y 4.9758 8.8983 123.3849 55.9845 42.3183 174.7173 168 I 4.3926 9.1476 123.6619 62.2412 37.1813 175.7999 169 T 4.4540 10.5220 123.9249 64.9599 69.9682 175.6117 170 R 4.7267 7.9527 119.3022 54.1513 33.7845 174.5187 171 K 4.5894 8.5128 122.6430 53.2678 34.7641 174.3810 172 P 4.4577 0.0000 0.0000 63.1986 30.7682 176.1204 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 P 0.00 4.51 0.00 2.08 2.03 0.00 3.78 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 2.00 2.09 0.00 2 R 8.47 4.88 0.00 1.85 1.75 0.00 3.20 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00 3 V 9.92 4.62 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 0.71 0.00 0.00 1.00 0.00 0.00 4 E 8.90 5.13 0.00 1.84 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 2.22 2.32 0.00 5 L 8.83 4.83 0.00 1.72 1.79 0.89 0.76 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 6 E 8.92 4.62 0.00 1.87 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 2.33 2.34 0.00 7 I 8.42 3.17 1.70 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 -0.19 0.91 0.00 0.00 8 P 0.00 4.23 0.00 1.97 1.84 0.00 2.39 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.93 0.00 9 E 8.58 3.86 0.00 2.02 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 2.22 2.25 0.00 10 D 7.96 4.35 0.00 2.60 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 7.32 4.68 1.84 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 0.87 0.00 0.00 0.79 0.00 0.00 12 D 8.61 4.86 0.00 2.52 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.56 5.03 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 14 E 8.63 4.33 0.00 2.08 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 2.36 2.30 0.00 15 Q 7.68 5.13 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.46 0.00 0.00 0.00 0.00 0.00 2.33 2.11 0.00 16 D 7.86 4.86 0.00 2.63 2.65 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 H 8.27 3.96 0.00 3.29 2.71 0.00 5.69 0.00 0.00 0.00 0.00 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.44 4.48 0.00 1.54 1.62 0.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 19 D 7.92 5.54 0.00 2.74 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 20 I 8.75 4.69 1.82 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.71 0.95 0.00 0.00 21 T 8.75 5.03 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 22 V 9.21 4.70 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 1.21 0.00 0.00 1.07 0.00 0.00 23 E 9.08 5.23 0.00 1.95 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 2.23 2.25 0.00 24 G 9.14 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 25 D 8.74 4.66 0.00 2.66 2.70 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 26 N 8.57 4.74 0.00 2.69 2.79 0.00 0.00 7.19 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 27 G 6.89 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 0.00 0.00 0.00 28 S 8.24 5.35 0.00 3.91 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 9.23 4.49 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 0.95 0.00 0.00 1.02 0.00 0.00 30 T 8.63 5.21 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 1.29 0.00 0.00 31 R 9.09 4.68 0.00 1.59 1.66 0.00 2.99 0.00 0.00 2.99 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 32 R 8.52 4.77 0.00 1.86 1.87 0.00 3.19 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 33 L 8.42 4.18 0.00 1.12 0.13 0.37 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 34 W 8.55 5.09 0.00 3.18 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 35 Y 8.63 4.50 0.00 3.07 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 36 P 0.00 4.12 0.00 1.74 1.84 0.00 2.20 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.74 0.00 37 D 8.92 4.49 0.00 2.87 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 38 I 7.69 4.70 2.14 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 1.12 0.00 0.00 39 D 9.57 5.00 0.00 2.60 2.63 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 0.00 0.00 0.00 0.00 40 V 8.60 4.96 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 0.83 0.00 0.00 1.02 0.00 0.00 41 S 9.36 4.80 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 42 V 8.41 4.40 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 0.84 0.00 0.00 1.01 0.00 0.00 43 D 9.63 4.66 0.00 2.72 2.65 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 44 G 8.52 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 45 D 8.80 4.85 0.00 2.79 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 46 T 7.80 5.12 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 47 V 9.00 4.81 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 1.02 0.00 0.00 1.15 0.00 0.00 48 V 9.39 4.83 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 1.03 0.00 0.00 0.97 0.00 0.00 49 I 8.86 5.17 1.94 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 1.40 0.74 1.05 0.00 0.00 50 E 9.20 5.30 0.00 2.06 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 2.37 2.28 0.00 51 S 8.55 4.91 0.00 3.99 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 52 D 8.98 4.54 0.00 2.73 2.73 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 53 E 7.97 4.36 0.00 2.01 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 2.36 2.41 0.00 54 D 8.32 4.86 0.00 2.71 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 N 8.12 4.71 0.00 3.01 2.99 0.00 0.00 5.97 7.77 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 56 A 8.50 3.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 1.11 0.00 0.00 65 F 8.93 4.54 0.00 3.02 3.03 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 66 Q 8.38 3.98 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.67 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 67 S 8.22 4.24 0.00 3.81 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 68 H 8.21 4.29 0.00 3.41 3.27 0.00 5.62 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 69 I 7.66 3.51 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.79 0.29 0.00 0.00 70 E 8.46 3.82 0.00 1.99 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 0.00 2.39 2.47 0.00 71 N 8.48 4.88 0.00 3.03 3.10 0.00 0.00 7.03 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 72 M 8.00 4.09 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.62 0.00 73 F 8.28 4.58 0.00 3.39 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 74 H 8.70 4.08 0.00 3.26 3.42 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.99 4.13 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 0.00 0.00 0.00 76 V 8.23 3.88 2.30 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 1.10 0.00 0.00 1.14 0.00 0.00 77 T 7.31 4.25 4.16 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 1.28 0.00 0.00 *78 E 8.35 4.17 0.00 1.76 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 2.13 2.38 0.00 79 G 7.93 4.51 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 80 W 8.88 5.06 0.00 3.51 3.23 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 0.00 81 E 8.91 5.55 0.00 1.86 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 2.32 2.40 0.00 82 Y 9.90 4.92 0.00 2.84 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 83 G 9.27 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 9.48 5.98 0.00 2.02 1.99 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 2.59 2.42 0.00 85 E 8.73 5.19 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 86 V 8.63 4.58 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 0.83 0.00 0.00 1.11 0.00 0.00 87 F 9.01 5.19 0.00 3.15 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 88 Y 7.21 4.67 0.00 3.18 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 89 S 8.50 4.27 0.00 3.92 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 90 H 8.23 4.42 0.00 2.96 3.20 0.00 5.91 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 7.95 4.45 0.00 2.97 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 92 P 0.00 2.97 0.00 1.85 1.76 0.00 3.61 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 1.96 2.04 0.00 93 M 6.99 4.40 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.64 0.00 94 Q 9.06 4.61 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.53 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 95 V 8.48 4.82 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 0.82 0.00 0.00 0.97 0.00 0.00 96 N 9.15 5.13 0.00 2.69 2.62 0.00 0.00 6.14 8.08 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 97 V 8.33 4.49 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 0.79 0.00 0.00 1.02 0.00 0.00 98 E 9.22 4.52 0.00 1.95 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 2.21 2.21 0.00 99 G 8.45 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 0.00 100 D 8.48 5.21 0.00 2.56 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 7.94 5.03 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 2.25 2.32 0.00 102 V 8.37 4.68 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 0.79 0.00 0.00 0.89 0.00 0.00 103 V 9.27 4.76 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 1.03 0.00 0.00 0.97 0.00 0.00 104 I 8.92 4.94 1.78 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.50 0.90 0.00 0.00 105 E 9.07 4.76 0.00 1.85 1.79 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 2.20 2.20 0.00 106 N 8.86 4.46 0.00 2.91 2.98 0.00 0.00 6.67 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0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 115 R 8.01 4.95 0.00 1.73 1.81 0.00 2.96 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 116 T 8.37 4.69 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 1.15 0.00 0.00 117 T 8.32 4.71 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 1.17 0.00 0.00 118 I 8.79 4.09 1.85 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 1.20 0.57 0.96 0.00 0.00 119 H 9.00 4.58 0.00 3.42 3.19 0.00 5.96 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 G 8.32 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 0.00 121 D 8.62 4.77 0.00 2.70 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 0.00 122 T 7.29 4.15 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 1.29 0.00 0.00 123 D 9.28 4.91 0.00 2.59 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 0.00 124 V 8.47 4.64 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 0.93 0.00 0.00 125 E 8.85 4.74 0.00 1.99 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 2.23 2.24 0.00 126 I 8.46 4.85 1.90 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 1.27 1.06 0.93 0.00 0.00 127 D 9.57 4.59 0.00 2.56 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 0.00 128 G 8.20 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.86 4.50 0.00 2.09 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 2.47 2.34 0.00 130 E 8.31 5.36 0.00 2.11 1.84 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 2.26 2.30 0.00 131 L 9.36 5.20 0.00 1.70 1.55 0.95 0.46 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 0.00 132 T 9.15 4.93 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 133 V 8.79 4.80 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 0.94 0.00 0.00 0.95 0.00 0.00 134 S 7.51 5.81 0.00 3.99 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.26 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.59 0.00 2.33 2.38 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 2.15 2.01 0.00 137 D 8.06 4.56 0.00 2.75 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.27 3.48 0.56 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.62 0.58 0.00 0.00 139 E 8.15 3.82 0.00 2.22 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 2.29 2.23 0.00 140 A 9.30 3.94 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 0.00 141 V 7.89 3.56 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 1.22 0.00 0.00 1.09 0.00 0.00 142 G 8.10 3.10 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 0.00 143 Q 8.28 3.86 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.72 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 144 T 8.00 4.01 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 1.18 0.00 0.00 145 A 8.08 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.83 3.88 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 0.00 147 D 9.18 4.26 0.00 2.85 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 0.00 148 I 7.79 3.59 1.99 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 1.36 0.68 0.86 0.00 0.00 149 E 8.02 4.18 0.00 1.99 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 2.12 2.17 0.00 150 Q 8.54 3.99 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.56 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 151 L 7.79 3.97 0.00 1.70 1.67 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 152 T 7.22 3.69 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 0.58 0.00 0.00 153 R 7.58 4.04 0.00 1.85 1.90 0.00 3.19 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.58 0.00 154 I 8.31 4.56 2.04 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 1.41 1.06 1.06 0.00 0.00 155 N 8.91 4.75 0.00 2.73 2.83 0.00 0.00 7.13 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 0.00 156 D 8.24 4.45 0.00 2.69 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 0.00 157 K 7.34 4.32 0.00 1.07 1.02 0.00 0.61 0.00 0.00 1.19 0.00 0.00 2.28 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.00 1.05 7.81 158 D 8.36 4.47 0.00 2.78 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 0.00 159 V 8.54 4.08 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 1.24 0.00 0.00 1.02 0.00 0.00 160 R 8.62 4.00 0.00 2.02 2.03 0.00 3.22 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 161 V 7.69 3.89 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 0.27 0.00 0.00 0.96 0.00 0.00 162 F 8.54 4.58 0.00 3.22 3.07 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 0.00 163 Q 8.54 4.95 0.00 2.45 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.91 0.00 0.00 0.00 0.00 0.00 2.61 2.49 0.00 164 D 8.20 4.66 0.00 2.57 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 0.00 165 G 8.41 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 0.00 166 V 7.95 4.45 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 1.11 0.00 0.00 0.95 0.00 0.00 167 Y 8.90 4.98 0.00 3.00 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 0.00 168 I 9.15 4.39 2.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.83 1.11 0.00 0.00 169 T 10.52 4.45 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 170 R 7.95 4.73 0.00 1.74 1.78 0.00 3.09 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 171 K 8.51 4.59 0.00 1.55 1.54 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.45 7.81 172 P 0.00 4.46 0.00 2.53 2.26 0.00 2.42 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.