NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4446 8.1633 120.2681 54.4938 35.0796 174.4799 2 N 5.0581 8.1131 115.5542 51.0306 41.0927 172.5538 3 S 4.7185 8.9660 120.0904 56.5828 67.4413 172.6912 4 V 5.0473 8.0100 111.9944 60.4130 35.3618 175.1658 5 T 4.8261 8.9019 116.5194 60.6173 71.5895 172.3067 6 V 4.8968 8.3786 124.1415 61.0684 33.4036 174.7803 7 S 4.8316 9.1154 126.4217 58.4940 64.2991 174.8353 8 H 5.0041 9.1341 116.1665 56.8546 29.4175 174.6450 9 A 2.6018 7.9165 122.7427 52.1763 15.8422 176.2099 10 P 4.2800 0.0000 0.0000 62.6173 32.5425 175.3548 11 Y 4.5729 8.5882 117.3021 58.0757 35.9180 168.9420 12 T 5.1798 7.5408 113.4181 61.7243 72.5770 173.7223 13 I 4.4537 8.6765 126.5749 59.8375 39.8027 174.7610 14 T 4.9770 8.6119 124.6832 62.9318 69.5025 174.0981 15 Y 5.1136 8.5314 123.4773 55.1896 42.0031 174.5746 16 H 4.6966 9.8966 121.8985 55.9844 30.9033 176.0135 17 N 4.5545 8.7068 123.3117 56.7972 38.4387 176.9708 18 D 4.4257 8.5401 119.1495 56.7827 41.1311 177.8179 19 W 4.5375 8.5915 118.4737 57.6956 29.4159 177.8144 20 E 3.9053 8.3857 120.4087 59.0923 28.8151 177.2551 21 P 4.3116 0.0000 0.0000 64.5962 31.8073 177.0431 22 V 4.0900 7.6913 116.9491 63.7085 32.6729 177.5964 23 M 3.8760 7.6531 119.6134 58.0996 31.3423 178.5488 24 S 3.9632 7.7868 113.0740 61.5465 62.7009 176.1060 25 Q 3.5450 7.7772 120.2386 58.3294 28.3030 178.2037 26 L 3.9301 7.7788 121.5184 58.1053 42.0890 179.0859 27 V 3.5709 7.5297 118.0019 66.0525 31.6266 177.3293 28 E 3.9734 7.7592 118.9099 59.6139 29.2255 178.9347 29 F 4.6722 8.0769 116.3319 60.7605 39.2365 176.8678 30 Y 4.2911 8.6744 119.6384 60.8785 38.4618 177.4194 31 N 4.2992 8.3369 116.5899 55.9622 38.7181 175.5894 32 E 4.5030 7.5633 114.4388 56.3104 30.1778 177.1213 33 V 4.4725 7.2501 116.1020 60.7410 34.4096 176.7376 34 A 3.5004 7.9205 123.6203 54.8469 17.7649 179.5529 35 S 3.8324 7.8636 112.4361 61.3281 62.6314 176.6524 36 W 3.6737 7.6690 121.2676 59.0370 28.7098 178.2827 37 L 3.7835 7.3865 118.6630 57.3338 40.9504 178.8248 38 L 4.1794 7.7743 117.3265 56.5226 41.8081 178.9695 39 R 3.9452 7.3634 118.1557 58.2123 30.3239 176.9635 40 D 4.7382 6.8130 116.8570 53.2034 42.1936 175.9284 41 E 4.3347 8.6566 121.9407 56.7387 30.4339 176.1840 42 T 5.1992 8.6358 113.9656 59.9551 72.4307 173.1038 43 S 4.8711 8.6679 117.3090 56.0119 64.7902 172.5437 44 P 4.8745 0.0000 0.0000 61.3565 33.1267 175.5056 45 I 3.7269 8.1599 118.1005 61.1500 37.4563 175.5087 46 P 2.9700 0.0000 0.0000 65.2917 31.1697 178.0681 47 D 4.4778 7.8194 115.5327 55.8528 40.4724 176.6737 48 K 4.5175 8.1083 118.0878 55.7425 33.4909 177.7323 49 F 4.2566 7.7185 118.8907 60.5242 38.8759 176.5174 50 F 4.7396 8.0641 115.8783 57.1421 39.3267 176.8348 51 I 4.0362 7.5398 114.4386 62.1095 38.0220 176.8331 52 Q 4.3693 7.8317 121.9039 57.3069 29.3795 176.4857 53 L 3.4275 7.9762 117.1613 56.3811 41.6924 178.3378 54 K 4.3835 7.5943 116.4047 57.4813 32.4343 176.9961 55 Q 4.4541 7.8885 118.9468 54.1686 29.5313 174.2426 56 P 4.1973 0.0000 0.0000 62.7922 32.3350 176.0726 57 L 4.2580 9.2850 121.4393 55.7851 43.1173 179.4377 58 R 3.9787 8.0768 116.7670 58.4996 30.2027 176.8152 59 N 4.7754 8.0242 113.9724 52.2623 37.6414 173.9906 60 K 4.7033 7.5680 117.8123 55.3311 34.0030 176.3053 61 R 4.6613 8.9702 116.4914 55.3323 31.8038 174.6950 62 V 4.8558 7.6540 119.9462 61.3161 35.2953 173.1247 63 C 5.1926 9.0154 128.1590 57.7359 33.8519 172.3268 64 V 4.7160 8.5731 126.7635 61.6462 32.8720 173.8331 65 C 5.4192 9.3457 129.6828 57.7446 33.8374 173.1475 66 G 4.3468 8.9811 113.6305 44.6169 0.0000 174.1454 67 I 3.8056 8.5710 121.3858 63.6883 38.8490 174.9705 68 D 5.1144 7.3660 117.0117 52.2297 42.1692 172.8252 69 P 4.0862 0.0000 0.0000 62.0099 31.9302 176.2250 70 Y 4.2545 7.9866 117.7224 57.8011 38.3033 176.1775 71 P 4.2953 0.0000 0.0000 65.1904 31.4027 176.0350 72 K 4.7867 7.3096 115.5432 55.5440 35.8827 174.9728 73 D 4.5075 8.9999 117.9592 55.2129 38.1708 174.6511 74 G 3.8484 8.1417 108.2078 46.1035 0.0000 174.4733 75 T 4.3871 8.7479 111.2942 60.8873 70.1060 174.4961 76 G 3.9715 8.4318 109.3287 46.3473 0.0000 173.6423 77 V 4.1913 7.4224 119.9259 60.5154 31.9602 173.4894 78 P 4.0923 0.0000 0.0000 63.9860 31.6039 177.3086 79 F 4.1277 8.1190 118.7501 58.1432 37.7864 175.0818 80 E 4.1242 8.0384 121.8228 56.2032 29.8003 176.1236 81 S 4.5925 8.6490 120.7448 55.4448 63.0029 171.8739 82 P 4.5060 0.0000 0.0000 64.8711 31.2716 177.2602 83 N 4.7770 8.1967 112.8089 51.5290 37.9545 174.8968 84 F 3.9590 8.3606 118.9009 60.3949 37.8668 174.7294 85 T 4.3541 8.6091 113.7147 61.5661 69.9430 174.7782 86 K 3.9905 7.4861 120.9736 55.5790 33.7614 177.9475 87 K 3.9165 8.4547 123.0495 59.5552 32.1135 179.7330 88 S 4.1940 8.1926 114.9824 61.9086 62.8184 176.5702 89 I 4.1378 7.9278 120.4119 63.6756 37.8411 177.8799 90 K 3.9863 7.7448 119.6404 59.4688 31.8632 179.1373 91 E 4.0671 8.5687 119.1537 59.0663 29.3616 179.4436 92 I 3.5197 8.2744 120.2392 64.3377 37.2366 178.0303 93 A 3.0496 8.1196 121.8048 55.2993 18.1463 179.9025 94 S 4.2968 8.1375 113.3633 61.7116 62.8567 177.1417 95 S 4.0488 7.8157 117.3740 61.7252 62.5653 176.8044 96 I 3.5380 7.4426 122.4016 64.2045 36.7060 178.2279 97 S 4.2623 8.5614 114.4330 61.8586 61.9778 176.6922 98 R 4.0196 7.8141 119.2245 58.7844 29.7849 178.5986 99 L 4.1250 7.7193 120.0663 57.8350 42.3202 178.2053 100 T 4.5063 8.3582 107.3885 60.7364 69.7178 174.7640 101 G 3.7355 8.0610 109.5813 46.6584 0.0000 173.6367 102 V 4.0985 7.8230 119.7892 61.0886 32.1048 174.9951 103 I 4.0481 8.4178 128.3939 63.1307 37.8023 175.9126 104 D 4.6995 7.9036 121.3874 53.2014 40.6242 175.1589 105 Y 4.7286 7.6410 120.8150 55.7139 40.4927 174.6923 106 K 4.3129 8.1706 119.7097 56.6149 33.9224 175.8090 107 G 3.4826 7.5835 105.8597 45.7706 0.0000 171.4752 108 Y 5.0877 8.3122 119.9629 56.1273 42.0289 173.5732 109 N 4.9510 8.2634 124.7915 52.0498 41.8027 174.9556 110 L 4.1741 8.9593 126.2113 56.6145 42.0541 177.2203 111 N 4.6920 8.6057 116.6161 53.9777 39.1452 175.0503 112 I 4.4201 7.5553 109.5311 61.1310 38.0914 174.6408 113 I 4.4104 7.3567 122.1192 59.6963 38.5241 174.9211 114 D 4.3410 8.2880 125.8293 55.9889 41.0926 177.1896 115 G 3.8990 9.1012 112.2809 43.7523 0.0000 172.2717 116 V 4.7309 7.1004 119.6150 60.9467 33.7275 174.5591 117 I 4.6152 8.7099 129.0844 58.4740 39.7186 172.8511 118 P 5.1675 0.0000 0.0000 62.8479 32.4670 175.6311 119 W 5.2830 9.6497 131.4636 56.1743 34.6620 172.9803 120 N 4.8720 7.5431 124.0925 51.8205 38.8436 173.9276 121 Y 4.3364 8.8788 126.5933 60.9231 39.1202 175.8351 122 Y 4.3746 8.0929 117.3751 56.7921 39.4329 176.1437 123 L 3.5814 5.8539 122.2633 54.6263 42.0898 176.0506 124 S 4.9692 6.5328 112.1300 57.4416 66.0657 172.8985 125 C 4.8943 8.9735 114.5395 55.9042 33.6224 173.2042 126 K 4.3583 8.2548 121.6054 56.2565 32.9355 176.0018 127 L 4.1867 8.8980 129.6362 57.0202 42.2081 177.4108 128 G 3.9243 9.7773 115.1796 45.4242 0.0000 172.7569 129 E 4.5474 8.0897 118.7208 54.3880 31.5689 175.8474 130 T 4.1137 8.3734 121.4724 64.4266 69.2665 175.4447 131 K 4.1817 9.8883 124.0742 57.2689 30.1988 177.6880 132 S 4.3173 7.5753 113.8722 60.2317 63.5623 174.5121 133 H 5.1275 7.9275 118.1051 55.5759 29.6952 175.8639 134 A 2.5800 7.5223 124.3943 54.8471 17.8200 180.3538 135 I 3.3554 7.0666 115.1875 64.1287 38.0197 177.1044 136 Y 4.1952 6.9347 116.1906 60.4187 38.2555 177.4387 137 W 4.4500 8.4313 119.1085 59.8056 29.0327 178.8086 138 D 4.4390 7.9412 116.9951 56.8721 41.3095 178.8344 139 K 4.0697 7.9340 118.6515 59.2053 32.2137 179.4549 140 I 4.1144 7.9258 119.6997 64.7989 37.2195 178.2979 141 S 4.0194 8.6719 116.3291 61.4267 62.5250 176.9020 142 K 4.1201 7.9869 121.9187 59.4835 32.0735 178.5110 143 L 4.0870 8.2185 120.6400 58.4700 42.0305 179.0545 144 L 4.3022 8.5440 119.2135 57.7493 41.6514 179.1700 145 L 3.9497 8.2504 120.2884 57.8276 41.8142 178.9373 146 Q 4.0459 8.0698 117.7441 59.1303 28.5647 177.8179 147 H 4.3243 8.2096 118.9211 59.0875 29.8728 177.2987 148 I 3.3805 7.5541 121.9676 64.3981 36.7580 177.8004 149 T 4.2067 7.4623 106.7195 62.5964 68.8769 175.8232 150 K 4.1353 7.5224 120.6344 57.8852 32.3767 176.7586 151 H 4.5653 7.8268 115.0509 57.1825 30.3487 175.7915 152 V 4.0351 7.4165 110.4703 61.4015 32.2057 176.0583 153 S 4.5345 8.7521 118.4132 59.4397 64.8011 174.3715 154 V 4.6145 7.6638 119.2469 60.7780 34.6350 173.8893 155 L 5.0470 9.0390 130.1832 53.5738 44.4205 174.2777 156 Y 5.2875 9.2646 127.7947 56.2283 41.0025 173.4308 157 C 4.3442 8.8526 125.1758 58.2610 30.1175 172.8750 158 L 4.5767 8.1138 124.2156 54.6076 43.0862 176.1295 159 G 4.1826 9.2361 115.3306 45.0065 0.0000 174.1561 160 K 4.0166 8.7933 127.4855 59.1784 32.9086 179.3320 161 T 4.2099 7.7681 107.6210 62.6922 69.5864 175.4003 162 D 4.3254 8.0021 121.5759 56.1273 41.1982 177.0450 163 F 4.7189 7.9298 115.8127 56.9889 40.0147 175.0243 164 S 4.2685 7.5400 116.4484 58.7225 61.8382 173.4414 165 N 4.5420 7.4259 120.9491 54.7697 39.1837 176.0030 166 I 4.5796 6.5707 112.8340 60.4530 46.1015 175.0576 167 R 4.3006 7.8840 120.2531 56.6648 33.2969 176.9964 *170 L 4.3446 7.5569 115.0554 53.9016 43.6540 175.1833 171 E 4.2969 7.2366 126.5600 54.9041 32.6150 173.7161 172 S 4.5549 8.1159 112.5490 56.8983 65.0360 175.6472 173 P 4.6206 0.0000 0.0000 62.9423 28.1684 175.3066 174 V 4.4887 7.3143 117.6355 60.1015 35.9464 175.6116 175 T 3.9500 8.2241 118.8706 64.5453 68.8477 173.1765 176 T 4.9553 8.3229 123.5978 61.8829 70.3522 174.2472 177 I 4.2961 9.0038 128.0476 59.4417 39.6321 174.8743 178 V 4.7756 8.6758 126.5522 61.4638 33.6109 174.3750 179 G 4.2682 9.0034 115.9106 44.1731 0.0000 171.2134 180 Y 4.6413 8.2704 116.7368 57.7883 38.7826 176.1750 181 H 4.3340 8.9540 121.7307 55.5078 30.5804 174.5949 182 P 4.2865 0.0000 0.0000 64.7709 31.3652 176.4922 183 A 4.7411 7.9969 119.2017 51.4593 19.8549 175.9001 184 A 4.1314 8.1826 122.0268 53.3445 18.8561 179.3999 185 R 4.0175 8.2282 117.8336 55.4558 28.9371 175.9886 *190 E 4.0036 8.1804 125.6309 55.3415 29.7018 175.6474 191 K 4.0010 7.3843 115.1907 56.5507 36.0622 175.9753 192 D 4.5116 7.8036 117.9812 54.9852 38.7625 175.0284 193 R 4.6311 7.7509 122.3563 54.3158 33.6524 175.1704 194 S 4.5588 8.3587 115.1975 58.6170 63.2254 174.3410 195 F 4.3417 7.8829 120.4085 58.6163 39.1678 174.3443 196 E 3.8785 8.6186 123.6415 55.8127 26.9170 176.1841 197 I 4.2718 7.1293 109.8812 61.1149 39.4425 177.1633 198 I 4.0289 7.4915 113.8845 61.8715 37.8425 176.9250 199 N 4.1205 8.0790 119.5536 57.2617 38.6596 176.5751 200 V 3.6877 7.9270 118.5157 65.7224 31.7391 177.8829 201 L 4.0100 7.7477 118.6047 57.6430 41.3661 179.1194 202 L 3.9604 7.9787 118.1401 57.7524 41.6106 179.0391 203 E 4.0507 8.2930 118.4682 59.4900 29.4797 178.8756 204 L 4.1111 8.3461 120.4472 58.6096 41.7451 179.3803 205 D 4.6381 7.7671 113.3460 54.3043 40.5077 175.4980 206 N 4.3159 7.4243 125.6066 52.8173 40.8956 174.6502 207 K 4.5425 10.3403 115.9544 53.4005 35.0553 175.5683 208 A 4.1000 8.2230 123.6002 51.3541 18.7941 176.1272 209 P 4.4414 0.0000 0.0000 62.4693 32.2457 175.8148 210 I 3.7470 7.7588 120.1952 60.4722 38.0400 176.4265 211 N 4.6112 7.9872 124.1293 51.8479 37.4097 175.1258 212 W 4.4449 8.2598 123.5444 58.5388 28.9926 176.8608 213 A 4.6519 8.3519 120.0281 54.2394 17.7943 179.1459 214 Q 4.1737 8.0368 116.3150 58.6376 28.9465 178.5980 215 G 2.9015 7.7235 106.9244 46.7686 0.0000 173.5632 216 F 4.6706 6.9683 119.8092 57.7731 39.4806 175.1480 217 I 4.3665 8.5046 125.0788 60.0907 39.2133 175.6409 218 Y 4.4214 8.5368 122.4899 58.1453 37.8960 175.6616 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.16 4.44 0.00 1.85 2.17 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 2 N 8.11 5.06 0.00 2.60 2.61 0.00 0.00 6.72 6.68 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 3 S 8.97 4.72 0.00 3.10 3.38 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 4 V 8.01 5.05 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 0.67 0.00 0.00 0.93 0.00 0.00 5 T 8.90 4.83 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 1.13 0.00 0.00 6 V 8.38 4.90 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 0.94 0.00 0.00 0.96 0.00 0.00 7 S 9.12 4.83 0.00 3.92 3.94 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 8 H 9.13 5.00 0.00 3.07 3.27 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.92 2.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.28 0.00 2.20 2.23 0.00 3.91 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 1.99 2.19 0.00 11 Y 8.59 4.57 0.00 3.18 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.54 5.18 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 1.25 0.00 0.00 13 I 8.68 4.45 1.71 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.46 0.77 0.00 0.00 14 T 8.61 4.98 4.27 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 1.28 0.00 0.00 15 Y 8.53 5.11 0.00 3.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 H 9.90 4.70 0.00 3.49 3.63 0.00 5.79 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.71 4.55 0.00 2.98 2.81 0.00 0.00 7.30 9.17 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 18 D 8.54 4.43 0.00 2.54 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 19 W 8.59 4.54 0.00 3.72 3.25 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 20 E 8.39 3.91 0.00 2.41 2.40 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 2.41 2.50 0.00 21 P 0.00 4.31 0.00 2.00 2.09 0.00 3.74 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 2.08 2.10 0.00 22 V 7.69 4.09 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 1.10 0.00 0.00 0.91 0.00 0.00 23 M 7.65 3.88 0.00 1.54 1.69 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.37 0.00 24 S 7.79 3.96 0.00 3.82 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 7.78 3.54 0.00 1.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.67 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 26 L 7.78 3.93 0.00 1.80 1.71 1.18 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.53 3.57 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 1.10 0.00 0.00 0.94 0.00 0.00 28 E 7.76 3.97 0.00 2.10 1.97 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 2.45 2.42 0.00 29 F 8.08 4.67 0.00 3.27 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 30 Y 8.67 4.29 0.00 3.24 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 31 N 8.34 4.30 0.00 2.80 2.90 0.00 0.00 7.09 7.24 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 32 E 7.56 4.50 0.00 2.17 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 2.54 2.21 0.00 33 V 7.25 4.47 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 0.58 0.00 0.00 0.85 0.00 0.00 34 A 7.92 3.50 0.39 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 0.00 0.00 35 S 7.86 3.83 0.00 3.56 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 7.67 3.67 0.00 2.79 1.74 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 37 L 7.39 3.78 0.00 1.75 1.76 0.28 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.77 4.18 0.00 1.59 1.65 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.36 3.95 0.00 1.59 1.91 0.00 2.73 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 40 D 6.81 4.74 0.00 2.77 2.64 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 0.00 0.00 0.00 0.00 41 E 8.66 4.33 0.00 1.95 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 2.41 2.32 0.00 42 T 8.64 5.20 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 1.52 0.00 0.00 43 S 8.67 4.87 0.00 3.96 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 44 P 0.00 4.87 0.00 2.26 2.13 0.00 4.08 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.99 0.00 45 I 8.16 3.73 1.83 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 0.49 0.84 0.00 0.00 46 P 0.00 2.97 0.00 1.87 1.65 0.00 3.43 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.88 0.00 47 D 7.82 4.48 0.00 2.61 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 48 K 8.11 4.52 0.00 1.83 1.89 0.00 1.91 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.51 7.81 49 F 7.72 4.26 0.00 2.61 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 0.00 0.00 0.00 50 F 8.06 4.74 0.00 3.05 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 51 I 7.54 4.04 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.83 0.96 0.00 0.00 52 Q 7.83 4.37 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 7.02 0.00 0.00 0.00 0.00 0.00 2.73 2.77 0.00 53 L 7.98 3.43 0.00 1.67 1.22 0.80 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.59 4.38 0.00 1.99 1.94 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.67 1.46 7.81 55 Q 7.89 4.45 0.00 2.55 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.86 0.00 0.00 0.00 0.00 0.00 2.50 2.62 0.00 56 P 0.00 4.20 0.00 2.18 1.80 0.00 3.66 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 57 L 9.28 4.26 0.00 0.98 0.83 -0.54 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.08 3.98 0.00 1.75 1.97 0.00 3.18 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 59 N 8.02 4.78 0.00 2.82 2.98 0.00 0.00 6.17 6.73 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 60 K 7.57 4.70 0.00 1.81 1.69 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.40 1.44 7.81 61 R 8.97 4.66 0.00 1.75 2.04 0.00 2.66 0.00 0.00 3.03 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 62 V 7.65 4.86 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 1.34 0.00 0.00 1.04 0.00 0.00 63 C 9.02 5.19 0.00 3.02 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.57 4.72 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 0.63 0.00 0.00 1.22 0.00 0.00 65 C 9.35 5.42 0.00 3.01 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.98 4.35 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 0.00 67 I 8.57 3.81 1.71 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.77 0.95 0.00 0.00 68 D 7.37 5.11 0.00 2.66 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 69 P 0.00 4.09 0.00 2.08 1.90 0.00 3.58 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 2.01 1.82 0.00 70 Y 7.99 4.25 0.00 3.08 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 71 P 0.00 4.30 0.00 2.24 2.36 0.00 3.82 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 72 K 7.31 4.79 0.00 1.71 1.70 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.35 1.45 7.81 73 D 9.00 4.51 0.00 2.80 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.14 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 0.00 0.00 0.00 75 T 8.75 4.39 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 1.32 0.00 0.00 76 G 8.43 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 77 V 7.42 4.19 2.34 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 1.05 0.00 0.00 0.97 0.00 0.00 78 P 0.00 4.09 0.00 2.19 1.88 0.00 3.88 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 2.13 1.79 0.00 79 F 8.12 4.13 0.00 3.30 3.35 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 80 E 8.04 4.12 0.00 2.03 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 2.43 2.35 0.00 81 S 8.65 4.59 0.00 3.70 3.76 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 82 P 0.00 4.51 0.00 2.12 2.17 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 83 N 8.20 4.78 0.00 2.86 2.92 0.00 0.00 6.16 7.43 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 84 F 8.36 3.96 0.00 3.04 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 85 T 8.61 4.35 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 86 K 7.49 3.99 0.00 1.30 1.03 0.00 1.17 0.00 0.00 1.49 0.00 0.00 2.75 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.02 0.21 7.81 87 K 8.45 3.92 0.00 1.81 1.86 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.48 7.81 88 S 8.19 4.19 0.00 4.23 4.14 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 89 I 7.93 4.14 2.36 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.88 1.04 0.00 0.00 90 K 7.74 3.99 0.00 1.82 1.72 0.00 1.30 0.00 0.00 1.39 0.00 0.00 2.79 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.74 7.81 91 E 8.57 4.07 0.00 2.13 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 2.56 2.74 0.00 92 I 8.27 3.52 1.97 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.10 0.67 0.00 0.00 93 A 8.12 3.05 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 94 S 8.14 4.30 0.00 4.07 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 S 7.82 4.05 0.00 3.82 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 96 I 7.44 3.54 1.29 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.35 0.87 0.00 0.00 97 S 8.56 4.26 0.00 4.11 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 98 R 7.81 4.02 0.00 2.02 1.98 0.00 3.20 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 99 L 7.72 4.13 0.00 1.82 1.79 0.89 1.06 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 0.00 100 T 8.36 4.51 4.42 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 1.42 0.00 0.00 101 G 8.06 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 0.00 102 V 7.82 4.10 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 0.35 0.00 0.00 0.95 0.00 0.00 103 I 8.42 4.05 1.88 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 1.44 0.71 0.92 0.00 0.00 104 D 7.90 4.70 0.00 2.69 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 0.00 105 Y 7.64 4.73 0.00 2.76 2.41 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 0.00 106 K 8.17 4.31 0.00 1.63 1.84 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.37 7.81 107 G 7.58 3.48 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 0.00 108 Y 8.31 5.09 0.00 2.72 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 0.00 109 N 8.26 4.95 0.00 2.69 2.47 0.00 0.00 7.00 6.21 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 0.00 110 L 8.96 4.17 0.00 1.78 1.79 0.47 1.31 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 0.00 111 N 8.61 4.69 0.00 2.76 2.91 0.00 0.00 6.97 8.50 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 0.00 112 I 7.56 4.42 1.84 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 1.43 0.71 0.91 0.00 0.00 113 I 7.36 4.41 1.76 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 1.36 1.32 0.75 0.00 0.00 114 D 8.29 4.34 0.00 2.58 2.55 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 0.00 115 G 9.10 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 0.00 116 V 7.10 4.73 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.52 0.00 0.00 117 I 8.71 4.62 1.94 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.92 0.00 0.00 118 P 0.00 5.17 0.00 2.59 2.23 0.00 3.95 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.10 0.00 119 W 9.65 5.28 0.00 3.47 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 0.00 120 N 7.54 4.87 0.00 1.98 2.47 0.00 0.00 6.96 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 Y 8.88 4.34 0.00 3.08 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 0.00 122 Y 8.09 4.37 0.00 2.77 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 0.00 123 L 5.85 3.58 0.00 0.27 0.28 0.22 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 124 S 6.53 4.97 0.00 3.97 3.27 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 0.00 125 C 8.97 4.89 0.00 3.11 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 0.00 126 K 8.25 4.36 0.00 1.82 1.69 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.42 7.81 127 L 8.90 4.19 0.00 1.70 1.61 1.05 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 128 G 9.78 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 0.00 129 E 8.09 4.55 0.00 2.05 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 2.23 2.24 0.00 130 T 8.37 4.11 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 1.25 0.00 0.00 131 K 9.89 4.18 0.00 1.94 1.92 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.40 7.81 132 S 7.58 4.32 0.00 3.91 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 0.00 133 H 7.93 5.13 0.00 3.57 3.53 0.00 5.64 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 0.00 134 A 7.52 2.58 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 0.00 135 I 7.07 3.36 1.45 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.30 -0.39 0.00 0.00 136 Y 6.93 4.20 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 W 8.43 4.45 0.00 3.51 3.30 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 0.00 138 D 7.94 4.44 0.00 2.95 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 0.00 139 K 7.93 4.07 0.00 1.45 1.32 0.00 1.44 0.00 0.00 1.17 0.00 0.00 2.86 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.39 7.81 140 I 7.93 4.11 2.55 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 2.10 1.11 1.43 0.00 0.00 141 S 8.67 4.02 0.00 3.76 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 0.00 142 K 7.99 4.12 0.00 2.12 2.11 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.58 1.62 7.81 143 L 8.22 4.09 0.00 2.14 2.20 1.01 0.60 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 0.00 144 L 8.54 4.30 0.00 2.04 2.06 1.24 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.25 3.95 0.00 2.13 1.91 0.88 1.02 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 0.00 146 Q 8.07 4.05 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 147 H 8.21 4.32 0.00 3.35 3.46 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 7.55 3.38 1.72 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.21 0.70 0.00 0.00 149 T 7.46 4.21 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 150 K 7.52 4.14 0.00 1.67 1.73 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.65 7.81 151 H 7.83 4.57 0.00 3.07 3.30 0.00 5.65 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 0.00 152 V 7.42 4.04 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 0.60 0.00 0.00 0.94 0.00 0.00 153 S 8.75 4.53 0.00 3.89 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.66 4.61 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 1.00 0.00 0.00 0.91 0.00 0.00 155 L 9.04 5.05 0.00 1.74 1.48 0.90 0.56 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 0.00 156 Y 9.26 5.29 0.00 2.91 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 0.00 157 C 8.85 4.34 0.00 2.53 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 0.00 158 L 8.11 4.58 0.00 1.45 1.56 0.12 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 159 G 9.24 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 0.00 0.00 0.00 0.00 160 K 8.79 4.02 0.00 1.90 1.90 0.00 1.40 0.00 0.00 1.92 0.00 0.00 3.45 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.95 1.24 7.81 161 T 7.77 4.21 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 1.22 0.00 0.00 162 D 8.00 4.33 0.00 2.53 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 0.00 0.00 0.00 0.00 163 F 7.93 4.72 0.00 3.09 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 0.00 164 S 7.54 4.27 0.00 3.90 3.94 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 0.00 165 N 7.43 4.54 0.00 2.60 2.80 0.00 0.00 7.03 7.45 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 0.00 166 I 6.57 4.58 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.30 0.92 0.00 0.00 167 R 7.88 4.30 0.00 1.79 1.97 0.00 3.40 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 *170 L 7.56 4.34 0.00 1.93 1.81 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 171 E 7.24 4.30 0.00 1.73 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 2.20 2.37 0.00 172 S 8.12 4.55 0.00 3.94 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.62 0.00 2.18 2.12 0.00 3.69 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 1.97 1.97 0.00 174 V 7.31 4.49 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 0.74 0.00 0.00 0.92 0.00 0.00 175 T 8.22 3.95 4.33 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 1.15 0.00 0.00 176 T 8.32 4.96 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 1.19 0.00 0.00 177 I 9.00 4.30 1.91 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.44 0.38 0.00 0.00 178 V 8.68 4.78 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 0.86 0.00 0.00 0.95 0.00 0.00 179 G 9.00 4.27 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 0.00 180 Y 8.27 4.64 0.00 2.83 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 0.00 181 H 8.95 4.33 0.00 3.31 3.26 0.00 5.89 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 P 0.00 4.29 0.00 2.10 2.14 0.00 3.23 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 183 A 8.00 4.74 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 0.00 184 A 8.18 4.13 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 0.00 185 R 8.23 4.02 0.00 1.92 2.00 0.00 3.24 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 *190 E 8.18 4.00 0.00 1.90 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 2.01 2.20 0.00 191 K 7.38 4.00 0.00 1.55 1.63 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.66 7.81 192 D 7.80 4.51 0.00 2.65 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 0.00 193 R 7.75 4.63 0.00 1.63 1.73 0.00 2.21 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.47 0.00 194 S 8.36 4.56 0.00 4.05 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 0.00 195 F 7.88 4.34 0.00 2.72 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 0.00 0.00 0.00 0.00 196 E 8.62 3.88 0.00 1.76 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 0.00 1.99 1.94 0.00 197 I 7.13 4.27 1.84 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 1.53 0.63 0.83 0.00 0.00 198 I 7.49 4.03 1.80 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.96 0.93 0.00 0.00 199 N 8.08 4.12 0.00 2.73 3.15 0.00 0.00 6.86 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 0.00 200 V 7.93 3.69 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 0.98 0.00 0.00 1.13 0.00 0.00 201 L 7.75 4.01 0.00 1.84 1.69 0.92 0.68 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 0.00 202 L 7.98 3.96 0.00 1.71 1.69 0.78 0.83 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 0.00 203 E 8.29 4.05 0.00 2.17 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 2.44 2.48 0.00 204 L 8.35 4.11 0.00 1.95 1.82 0.92 1.32 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 0.00 205 D 7.77 4.64 0.00 2.90 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 0.00 206 N 7.42 4.32 0.00 2.76 2.84 0.00 0.00 6.67 6.76 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 0.00 207 K 10.34 4.54 0.00 1.80 1.71 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.45 7.81 208 A 8.22 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 P 0.00 4.44 0.00 2.16 2.06 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 210 I 7.76 3.75 0.59 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.20 -0.65 0.00 0.00 211 N 7.99 4.61 0.00 2.73 2.63 0.00 0.00 7.22 7.95 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 0.00 212 W 8.26 4.44 0.00 3.48 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 0.00 213 A 8.35 4.65 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 0.00 214 Q 8.04 4.17 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 215 G 7.72 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 0.00 0.00 0.00 216 F 6.97 4.67 0.00 2.97 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 0.00 0.00 0.00 0.00 217 I 8.50 4.37 1.82 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 1.21 0.67 0.94 0.00 0.00 218 Y 8.54 4.42 0.00 2.86 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 * Residues marked with a * may have inaccurate shift predictions.