NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3289 8.3149 122.1429 54.2918 34.1237 175.8571 3 Q 4.4842 7.8524 117.1986 53.2732 30.3837 173.1913 4 S 4.8051 9.1785 115.9713 57.0623 65.7066 173.7681 5 H 4.7294 8.8370 122.9524 56.0116 28.6029 176.9863 6 F 4.2554 8.4346 125.1829 61.8089 39.1384 177.2874 7 F 3.8524 8.2087 116.0722 59.7995 38.5734 177.5600 8 A 4.0134 8.0014 119.7761 55.3206 18.5056 178.9601 9 H 4.2725 8.2564 114.7208 58.9626 28.8494 177.9258 10 L 3.8261 7.6578 120.7745 57.8077 41.2086 179.3242 11 S 4.1439 8.1770 112.2667 61.1906 62.4793 175.7399 12 R 4.1102 8.0276 120.3817 58.1262 29.9706 177.7289 13 L 3.9719 7.7873 119.6321 58.1021 41.5009 179.1914 14 K 4.4377 7.9619 115.4830 58.7931 32.6696 177.9811 15 L 4.5020 8.1692 119.8101 55.1207 42.3742 176.2930 16 I 4.1751 7.3493 120.4221 60.5038 37.8357 175.1983 17 N 5.1293 8.7566 124.8630 52.7571 39.8756 174.9571 18 R 4.8695 8.9408 120.8234 52.8188 33.1528 175.7271 19 W 3.6732 7.8783 117.3650 57.5629 26.5145 174.0053 20 P 4.4544 0.0000 0.0000 65.6065 31.6027 178.1889 21 L 4.4256 7.8853 116.0726 55.4744 41.6789 176.2287 22 M 4.9555 7.5553 118.1185 52.8895 35.6988 175.1954 23 R 4.0506 9.3885 122.9283 56.5373 30.6761 175.6346 24 N 5.1474 8.5413 122.4354 51.2571 40.9187 175.0745 25 V 3.6890 9.0374 123.6089 65.2149 31.8731 176.4486 26 R 4.5159 7.7184 119.2256 54.4096 32.5897 174.3195 27 T 4.1376 8.6480 122.6387 63.7367 69.2770 173.2319 28 E 4.9758 9.0351 127.5848 54.7314 32.0243 174.5628 29 N 5.3319 8.9728 123.7535 51.1589 40.3226 175.9280 30 V 3.6666 8.3621 117.5816 65.6371 31.3767 177.7584 31 S 4.0487 8.1461 112.7746 61.4319 62.2314 175.5511 32 E 3.9437 8.4563 121.0422 59.8098 29.2551 178.7607 33 H 4.1787 8.4445 118.0599 59.7997 29.8449 177.4193 34 S 4.1381 8.3722 116.9148 61.4431 62.6356 176.4565 35 L 3.9280 7.9684 123.1429 57.9953 41.6653 178.8719 36 Q 3.9915 7.8597 119.4192 58.9163 28.9443 177.9874 37 V 3.4772 8.1614 119.5591 65.8863 31.4111 177.8131 38 A 3.9830 8.1798 120.5597 55.5022 18.1544 179.6194 39 M 4.0081 8.0661 117.1788 58.4141 31.9943 179.2738 40 V 3.4458 8.0797 118.4547 65.9018 31.7548 177.9500 41 A 3.9000 8.7720 121.7646 55.2264 18.1933 178.9021 42 H 4.0047 8.4990 116.7746 59.5268 29.9650 177.0611 43 A 4.0110 8.2203 122.5505 55.3925 18.1253 179.6489 44 L 3.9980 8.3468 117.4241 57.8072 41.6572 179.5302 45 A 3.9502 8.0749 120.4835 55.1499 18.3380 179.5608 46 A 3.8698 7.9987 119.2065 55.2215 18.4487 179.8316 47 I 3.3948 7.8152 118.3162 64.2889 37.1105 178.3154 48 K 4.0810 8.1962 120.3320 59.8172 31.8065 178.0467 49 N 4.4841 7.9823 115.1192 56.5959 38.6204 177.0431 50 R 3.9197 8.2779 118.4321 59.0981 30.3952 177.9410 51 K 4.1452 7.9452 115.1428 55.9788 31.7611 176.8915 52 F 5.0167 7.9347 118.1638 57.2090 40.0504 176.2930 53 G 3.7298 8.6817 106.8650 45.7659 0.0000 174.8143 54 G 3.8867 7.1947 106.4884 45.5077 0.0000 173.1120 55 N 5.0322 8.2133 116.6319 52.9602 39.4930 174.6530 56 V 4.1102 7.7423 109.1149 59.8145 33.5250 176.7913 57 N 4.5677 8.4050 120.7228 52.8159 39.2721 175.6846 58 A 4.0199 8.4157 131.2869 54.9321 18.5677 178.5716 59 E 3.9188 8.2003 116.7370 59.6802 29.5622 179.3199 60 R 3.8607 8.5261 118.7150 59.6878 30.1128 178.4823 61 I 3.6143 7.7402 119.1651 64.2302 36.9284 178.2716 62 A 3.9767 7.8878 121.1820 55.1422 18.1258 179.5045 63 L 4.0309 7.7466 118.9433 58.1759 41.9364 179.0890 64 L 4.0228 8.1232 118.4052 57.7710 41.7942 179.0336 65 A 4.1672 8.1614 120.7165 55.3810 18.0683 179.2840 66 M 3.9457 8.2204 116.7262 58.5366 32.4209 177.7265 67 Y 4.5179 7.7972 114.5331 58.3469 38.3877 177.2623 68 H 4.5923 8.1153 117.8316 57.4175 28.7916 175.7723 69 D 4.7797 7.4319 119.0909 53.8804 41.2207 177.8629 70 A 4.1059 8.1078 124.9732 54.8770 18.1597 180.1693 71 S 4.2663 8.0745 111.3236 60.1595 63.2826 175.9207 72 A 4.3095 7.9459 126.5586 54.7311 17.7824 179.8512 73 V 3.5489 7.4117 110.4047 64.1127 31.5723 177.3682 74 L 4.3369 7.9489 118.0048 55.9955 42.2972 177.5378 75 T 4.1856 7.8712 107.0466 60.5978 70.1234 175.3674 76 G 4.0348 8.0167 110.4266 44.8036 0.0000 171.5601 77 D 4.5857 8.2236 117.4622 52.4358 42.0120 174.6881 78 L 4.6439 8.2083 128.7046 52.5998 43.0427 174.1958 79 P 4.1677 0.0000 0.0000 62.8208 31.9922 176.1211 80 T 3.9556 8.5913 120.1184 66.5382 68.4060 174.1042 81 P 4.3870 0.0000 0.0000 62.4081 28.5362 175.3108 *90 A 4.3435 8.2246 127.3275 52.6111 21.0168 180.0886 91 Q 4.1991 7.9968 119.2844 60.4685 28.2030 181.3205 92 E 4.1677 8.0221 118.2842 61.6482 29.9661 182.3065 *93 Y 4.2049 7.9913 122.9652 60.9310 38.5307 178.7899 94 K 3.9394 7.7955 123.4333 60.0037 31.6341 180.5758 95 A 4.2116 7.9704 123.6387 55.7206 18.1481 180.1105 96 I 3.6194 8.0383 116.8821 65.1220 35.6376 179.8712 97 E 4.1059 7.9996 121.2837 59.4024 29.4018 179.3440 98 K 3.9180 8.0801 118.0283 59.4312 32.0259 179.5002 99 I 3.7236 8.0868 120.3951 64.2160 36.9722 178.3397 100 A 4.0120 8.5737 122.2937 55.0490 18.1749 179.7897 101 Q 4.0138 8.4979 119.3980 59.6682 28.7725 179.4750 102 Q 3.9706 7.9984 121.6128 60.2627 27.9851 180.2729 103 K 4.0227 7.8267 119.4823 59.5199 32.4389 178.8977 104 L 4.1812 8.0471 118.7844 57.9474 41.4575 179.8014 105 V 3.4977 7.7445 118.0744 65.9758 31.2380 177.4160 106 D 4.4822 8.0369 116.8238 56.3909 40.8124 177.9441 107 M 4.1621 7.6165 118.8589 56.5299 32.4552 177.0740 108 V 3.2802 6.6131 118.9081 61.4242 32.3746 173.9410 109 P 4.2752 0.0000 0.0000 62.7894 32.1146 176.6400 110 E 3.8919 9.0780 122.7194 59.6752 29.2025 179.0945 111 E 4.1696 8.1866 114.9487 58.1119 30.0838 177.5950 112 L 4.6698 7.8769 118.7210 54.2056 42.9089 177.7878 113 R 3.8882 7.8566 120.5111 59.6411 29.7941 177.5827 114 D 4.6559 7.9337 115.5977 55.3427 39.7332 177.8165 115 I 3.7623 7.6393 121.5127 63.7012 37.4133 177.1502 116 F 4.2673 7.8091 117.0572 58.5333 39.7511 177.5919 117 A 3.9750 8.4101 122.4086 54.8812 18.0978 177.2501 118 P 4.6518 0.0000 0.0000 63.6055 31.7952 176.6618 119 L 4.4635 7.8349 119.3946 56.4834 42.4975 177.7730 120 I 4.0767 7.6944 117.8078 62.8848 38.0498 175.2149 121 D 4.6441 8.1751 121.3000 52.8109 40.7353 176.3996 122 E 2.8416 9.1168 129.5708 58.5239 29.7561 178.5840 123 H 4.1557 7.9647 115.0686 58.7584 28.7467 176.1078 124 A 4.3304 7.8363 120.0294 53.0349 18.4544 176.9876 125 Y 4.5666 7.9060 115.7282 57.1683 38.5815 175.9648 126 S 4.2920 9.2378 120.5277 58.1832 65.1555 175.1899 127 D 4.3945 8.6263 121.4197 57.8738 40.5299 179.1120 128 E 4.0724 8.1167 118.3109 59.0215 29.5367 179.1033 129 E 3.8676 8.2905 118.8215 59.2388 29.5846 178.8497 130 K 4.0182 8.3800 120.0956 59.8651 32.0608 178.5161 131 S 4.0602 8.0010 112.7150 61.4790 62.4005 176.0625 132 L 3.9380 7.9169 121.6533 57.8075 41.2560 179.8260 133 V 3.5541 7.9668 118.1981 65.9811 31.6143 178.3480 134 K 4.0404 8.1722 118.1637 59.2462 31.8729 179.4993 135 Q 3.9676 8.4244 118.8548 58.7892 28.5272 178.4684 136 A 3.8360 8.0702 121.9027 54.8517 18.3330 179.0664 137 D 4.2616 8.3905 116.7514 57.6693 41.3608 178.5477 138 A 4.0708 7.8781 120.6407 54.8898 18.2613 179.3705 139 L 3.9187 7.8140 117.5117 58.4899 41.7931 179.6367 140 C 4.1275 8.3920 116.3275 62.7505 28.0390 176.1350 141 A 4.4754 8.4623 122.5344 55.3707 17.9961 178.9678 142 Y 4.1226 8.7939 118.3797 60.9574 38.8096 178.3600 143 L 3.7772 8.6511 120.2486 57.5144 41.6051 179.0494 144 K 3.6532 8.0740 119.6105 60.0176 31.9249 178.1966 145 C 3.7722 7.7386 116.3568 62.7764 27.9512 176.1293 146 L 3.8024 7.6845 120.4140 57.7025 41.0734 179.5169 147 E 3.8777 8.3376 118.6327 59.4789 29.4590 179.0964 148 E 3.6357 7.8441 118.7248 59.3912 29.3542 179.6547 149 L 3.8930 7.9361 118.7199 57.7160 41.5170 179.2137 150 A 4.1332 7.9839 119.5236 54.7473 18.1961 178.4586 151 A 4.3927 7.3628 116.8917 51.8660 19.0614 178.2369 152 G 3.7411 8.3739 107.3808 45.6657 0.0000 174.0876 153 N 4.5862 7.8839 119.4076 52.6203 37.8466 174.6182 154 N 4.8838 8.4713 121.6312 53.4925 39.0546 177.3177 155 E 4.0519 8.1138 118.9333 58.8355 29.7715 177.6970 156 F 4.2874 7.9971 115.3386 57.2787 39.4391 177.2862 157 L 4.0173 8.0297 126.7012 58.9701 41.8051 179.6175 158 L 4.0170 7.8852 121.2726 59.4548 40.9455 180.8193 159 A 4.2938 8.0922 121.5042 55.0034 18.2385 179.1734 160 K 3.8957 8.3230 117.9613 60.1727 32.2667 178.6778 161 T 3.9549 7.8927 115.5094 67.0700 68.5072 176.5580 162 R 3.9853 8.2796 120.2411 59.3796 30.1211 178.4604 163 L 4.1572 8.3639 118.9116 57.7311 41.5637 179.3600 164 E 3.8609 8.4860 118.6542 59.1147 29.4705 179.0270 165 A 3.9952 7.8854 120.3863 55.6693 18.4745 179.8372 166 T 3.8582 7.8602 114.1420 66.5952 68.2235 176.9708 167 L 3.9038 7.7696 120.0600 57.9851 41.7006 179.1749 168 E 4.0505 8.2048 118.1483 59.1905 29.0602 179.4013 169 A 4.0473 7.7676 120.1279 54.6565 18.4705 178.9028 170 R 4.3869 7.4142 113.9758 55.0756 30.9194 176.6750 171 R 3.9104 6.8319 119.2971 57.2294 30.5736 176.2553 172 S 4.6128 8.1334 117.6177 55.8475 67.4062 175.1367 173 Q 3.6809 8.2837 120.9670 59.0467 28.1630 179.1746 174 E 4.2552 7.9030 117.9699 59.5160 29.7021 178.7377 175 M 4.1002 7.9988 118.8774 58.6484 32.3191 177.8539 176 D 4.4256 8.5154 119.5180 57.4811 41.0883 178.1410 177 Y 3.9927 8.4726 120.1813 60.6614 38.8548 177.7496 178 F 4.3102 8.8138 121.6494 62.0540 39.3849 176.5934 179 M 4.2031 8.8748 118.6768 58.6125 31.6208 178.5954 180 E 3.9429 8.3852 117.5379 58.8327 29.6416 178.2351 181 I 3.8523 7.0491 118.8869 62.2381 38.4836 176.9445 182 F 4.8049 8.0429 116.3886 58.3624 40.1212 178.0422 183 V 3.9399 7.5249 118.3665 65.2624 31.1938 176.0784 184 P 4.3547 0.0000 0.0000 65.7642 31.3348 177.7162 185 S 4.2157 8.2269 112.7817 60.9931 63.0264 174.2164 186 F 4.3087 8.7118 123.6235 57.5966 38.7080 175.3560 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 2 K 8.31 4.33 0.00 1.79 1.79 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 3 Q 7.85 4.48 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.65 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 4 S 9.18 4.81 0.00 3.85 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 0.00 5 H 8.84 4.73 0.00 3.33 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.43 4.26 0.00 2.86 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 7 F 8.21 3.85 0.00 3.23 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 8 A 8.00 4.01 1.29 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 0.00 0.00 0.00 9 H 8.26 4.27 0.00 3.31 3.28 0.00 5.63 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 10 L 7.66 3.83 0.00 1.65 1.57 -0.31 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.18 4.14 0.00 4.02 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 12 R 8.03 4.11 0.00 1.95 2.05 0.00 3.21 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 13 L 7.79 3.97 0.00 1.78 1.71 0.86 0.53 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 14 K 7.96 4.44 0.00 1.91 1.94 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.53 7.81 15 L 8.17 4.50 0.00 1.69 1.76 0.92 0.80 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 16 I 7.35 4.18 1.87 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 1.39 1.42 0.90 0.00 0.00 17 N 8.76 5.13 0.00 2.64 2.80 0.00 0.00 7.05 7.66 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 18 R 8.94 4.87 0.00 1.90 1.71 0.00 3.25 0.00 0.00 3.15 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.42 0.00 19 W 7.88 3.67 0.00 3.64 3.31 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 20 P 0.00 4.45 0.00 2.23 2.32 0.00 3.64 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 2.06 1.96 0.00 21 L 7.89 4.43 0.00 1.66 1.74 0.89 0.81 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 22 M 7.56 4.96 0.00 1.68 1.84 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 23 R 9.39 4.05 0.00 1.76 2.00 0.00 3.24 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 24 N 8.54 5.15 0.00 2.81 2.79 0.00 0.00 7.05 7.68 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 25 V 9.04 3.69 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 0.67 0.00 0.00 0.88 0.00 0.00 26 R 7.72 4.52 0.00 1.66 1.68 0.00 3.30 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 27 T 8.65 4.14 4.28 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 1.27 0.00 0.00 28 E 9.04 4.98 0.00 2.17 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 2.43 2.40 0.00 29 N 8.97 5.33 0.00 3.05 2.95 0.00 0.00 6.38 7.23 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 30 V 8.36 3.67 2.25 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 1.07 0.00 0.00 0.95 0.00 0.00 31 S 8.15 4.05 0.00 4.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.46 3.94 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 33 H 8.44 4.18 0.00 3.33 3.61 0.00 5.78 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 34 S 8.37 4.14 0.00 3.88 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.97 3.93 0.00 1.77 1.80 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 7.86 3.99 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 37 V 8.16 3.48 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 0.79 0.00 0.00 0.76 0.00 0.00 38 A 8.18 3.98 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 39 M 8.07 4.01 0.00 2.11 2.33 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 2.71 2.54 0.00 40 V 8.08 3.45 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 0.43 0.00 0.00 0.95 0.00 0.00 41 A 8.77 3.90 1.25 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 0.00 0.00 0.00 42 H 8.50 4.00 0.00 3.23 3.55 0.00 5.61 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 43 A 8.22 4.01 1.51 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 44 L 8.35 4.00 0.00 1.79 1.72 0.77 0.59 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 45 A 8.07 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.00 3.87 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 47 I 7.82 3.39 2.04 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.55 0.79 0.00 0.00 48 K 8.20 4.08 0.00 1.97 2.04 0.00 1.92 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.59 7.81 49 N 7.98 4.48 0.00 2.86 2.86 0.00 0.00 7.09 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 50 R 8.28 3.92 0.00 1.69 1.94 0.00 3.21 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 51 K 7.95 4.15 0.00 0.79 0.91 0.00 1.38 0.00 0.00 1.04 0.00 0.00 3.17 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.03 0.94 7.81 52 F 7.93 5.02 0.00 3.14 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 53 G 8.68 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 54 G 7.19 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 55 N 8.21 5.03 0.00 2.61 2.72 0.00 0.00 6.98 7.71 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 56 V 7.74 4.11 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 0.70 0.00 0.00 0.99 0.00 0.00 57 N 8.40 4.57 0.00 2.74 2.70 0.00 0.00 6.90 8.54 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 58 A 8.42 4.02 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 59 E 8.20 3.92 0.00 2.16 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 2.41 2.41 0.00 60 R 8.53 3.86 0.00 1.87 2.10 0.00 3.10 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 1.58 1.64 0.00 61 I 7.74 3.61 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.48 0.88 0.00 0.00 62 A 7.89 3.98 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 63 L 7.75 4.03 0.00 1.76 1.90 1.16 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.12 4.02 0.00 1.43 1.05 0.42 0.49 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 65 A 8.16 4.17 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 66 M 8.22 3.95 0.00 1.77 2.41 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.58 0.00 67 Y 7.80 4.52 0.00 3.17 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 68 H 8.12 4.59 0.00 3.55 3.80 0.00 5.52 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 7.43 4.78 0.00 2.57 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 70 A 8.11 4.11 1.50 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 71 S 8.07 4.27 0.00 4.05 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 72 A 7.95 4.31 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 73 V 7.41 3.55 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 0.85 0.00 0.00 0.94 0.00 0.00 74 L 7.95 4.34 0.00 1.73 1.69 0.92 0.93 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 75 T 7.87 4.19 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 1.19 0.00 0.00 76 G 8.02 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 77 D 8.22 4.59 0.00 2.71 2.50 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 78 L 8.21 4.64 0.00 1.58 1.50 0.89 0.98 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 79 P 0.00 4.17 0.00 2.01 1.87 0.00 3.71 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 1.98 2.04 0.00 80 T 8.59 3.96 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 1.17 0.00 0.00 81 P 0.00 4.39 0.00 2.01 2.01 0.00 3.58 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 2.00 2.06 0.00 *90 A 8.22 4.34 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 91 Q 8.00 4.20 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.87 0.00 0.00 0.00 0.00 0.00 2.36 1.99 0.00 92 E 8.02 4.17 0.00 1.97 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 2.31 1.93 0.00 *93 Y 7.99 4.20 0.00 2.44 2.29 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 0.00 94 K 7.80 3.94 0.00 1.84 1.81 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.38 1.34 7.81 95 A 7.97 4.21 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.04 3.62 1.87 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 1.41 0.70 0.91 0.00 0.00 97 E 8.00 4.11 0.00 2.08 2.24 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 2.26 2.34 0.00 98 K 8.08 3.92 0.00 2.12 1.80 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.46 1.35 7.81 99 I 8.09 3.72 1.97 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 1.60 0.93 0.90 0.00 0.00 100 A 8.57 4.01 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 0.00 101 Q 8.50 4.01 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 102 Q 8.00 3.97 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 103 K 7.83 4.02 0.00 2.15 1.91 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.49 1.38 7.81 104 L 8.05 4.18 0.00 1.96 1.87 1.09 0.71 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 0.00 105 V 7.74 3.50 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 0.99 0.00 0.00 0.99 0.00 0.00 106 D 8.04 4.48 0.00 2.80 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 0.00 107 M 7.62 4.16 0.00 2.10 2.37 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.55 0.00 108 V 6.61 3.28 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 0.47 0.00 0.00 -0.51 0.00 0.00 109 P 0.00 4.28 0.00 2.21 1.97 0.00 3.54 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 110 E 9.08 3.89 0.00 2.01 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 2.38 2.38 0.00 111 E 8.19 4.17 0.00 2.17 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 2.29 2.42 0.00 112 L 7.88 4.67 0.00 1.87 1.94 1.04 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 113 R 7.86 3.89 0.00 1.99 1.93 0.00 3.06 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 114 D 7.93 4.66 0.00 2.85 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 0.00 115 I 7.64 3.76 1.80 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 1.40 0.46 0.38 0.00 0.00 116 F 7.81 4.27 0.00 2.84 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.41 3.98 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 0.00 118 P 0.00 4.65 0.00 2.20 2.18 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 2.04 2.02 0.00 119 L 7.83 4.46 0.00 1.53 1.63 0.57 0.63 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 0.00 120 I 7.69 4.08 1.90 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.41 1.01 0.00 0.00 121 D 8.18 4.64 0.00 2.70 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 0.00 122 E 9.12 2.84 0.00 1.51 1.62 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 1.97 1.47 0.00 123 H 7.96 4.16 0.00 3.29 3.32 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 0.00 124 A 7.84 4.33 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 7.91 4.57 0.00 2.99 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 0.00 126 S 9.24 4.29 0.00 4.04 4.04 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 0.00 127 D 8.63 4.39 0.00 2.80 2.78 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 0.00 128 E 8.12 4.07 0.00 2.01 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 2.40 2.40 0.00 129 E 8.29 3.87 0.00 2.25 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 130 K 8.38 4.02 0.00 2.27 2.04 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.35 7.81 131 S 8.00 4.06 0.00 4.11 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 0.00 132 L 7.92 3.94 0.00 1.91 1.66 0.91 0.66 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 0.00 133 V 7.97 3.55 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 1.15 0.00 0.00 0.85 0.00 0.00 134 K 8.17 4.04 0.00 1.87 1.85 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.77 7.81 135 Q 8.42 3.97 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 136 A 8.07 3.84 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 0.00 137 D 8.39 4.26 0.00 2.86 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.88 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 L 7.81 3.92 0.00 1.81 1.60 0.52 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 140 C 8.39 4.13 0.00 3.18 3.22 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 0.00 141 A 8.46 4.48 1.65 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 0.00 0.00 142 Y 8.79 4.12 0.00 3.12 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 0.00 143 L 8.65 3.78 0.00 1.77 1.46 0.58 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.07 3.65 0.00 1.92 2.07 0.00 1.21 0.00 0.00 1.56 0.00 0.00 2.65 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.54 0.68 7.81 145 C 7.74 3.77 0.00 2.96 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.68 3.80 0.00 1.82 1.71 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.34 3.88 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.65 0.00 148 E 7.84 3.64 0.00 1.17 1.25 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 1.57 1.47 0.00 149 L 7.94 3.89 0.00 1.66 1.66 0.90 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 150 A 7.98 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 0.00 151 A 7.36 4.39 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 G 8.37 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 0.00 153 N 7.88 4.59 0.00 2.80 2.83 0.00 0.00 7.15 6.79 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 0.00 154 N 8.47 4.88 0.00 2.89 2.83 0.00 0.00 7.05 7.66 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 0.00 155 E 8.11 4.05 0.00 2.21 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 2.30 2.28 0.00 156 F 8.00 4.29 0.00 3.03 2.90 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 0.00 157 L 8.03 4.02 0.00 2.05 1.68 0.94 0.77 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 0.00 158 L 7.89 4.02 0.00 1.69 1.66 0.92 0.63 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 0.00 159 A 8.09 4.29 1.48 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 0.00 0.00 160 K 8.32 3.90 0.00 1.98 2.10 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.28 7.81 161 T 7.89 3.95 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 162 R 8.28 3.99 0.00 1.90 1.98 0.00 3.28 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 163 L 8.36 4.16 0.00 2.25 1.94 1.36 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 164 E 8.49 3.86 0.00 2.27 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 2.28 2.51 0.00 165 A 7.89 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 T 7.86 3.86 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 167 L 7.77 3.90 0.00 1.69 1.60 0.32 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 168 E 8.20 4.05 0.00 1.97 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 2.29 2.45 0.00 169 A 7.77 4.05 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 0.00 170 R 7.41 4.39 0.00 1.78 1.93 0.00 3.18 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 171 R 6.83 3.91 0.00 1.84 1.82 0.00 3.28 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 172 S 8.13 4.61 0.00 4.08 3.85 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 0.00 173 Q 8.28 3.68 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.94 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 174 E 7.90 4.26 0.00 2.31 2.44 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 2.40 2.49 0.00 175 M 8.00 4.10 0.00 2.36 2.27 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 176 D 8.52 4.43 0.00 2.89 2.74 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 0.00 177 Y 8.47 3.99 0.00 3.35 3.33 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 0.00 178 F 8.81 4.31 0.00 3.56 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 M 8.87 4.20 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.96 0.00 180 E 8.39 3.94 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.19 0.00 181 I 7.05 3.85 1.19 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 -0.36 -0.15 0.00 0.00 182 F 8.04 4.80 0.00 1.96 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 0.00 183 V 7.52 3.94 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 1.17 0.00 0.00 184 P 0.00 4.35 0.00 2.10 2.14 0.00 3.77 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 185 S 8.23 4.22 0.00 3.90 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 0.00 186 F 8.71 4.31 0.00 3.10 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 * Residues marked with a * may have inaccurate shift predictions.