NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4799 8.1627 120.3307 55.4150 33.3669 177.0902 2 D 4.1628 9.1648 126.8364 57.0532 42.1476 174.2235 3 K 3.8463 8.9846 120.1708 59.8913 32.4758 178.4543 4 I 3.8157 7.7909 118.9492 64.0749 37.2122 178.1409 5 K 4.0076 7.7881 119.2880 59.7454 31.9157 178.8828 6 Q 3.9642 8.5171 119.8999 59.0979 28.9513 177.9144 7 L 3.8598 7.7728 121.2404 58.5759 42.0319 179.1835 8 F 4.1556 8.4181 117.1460 60.2072 38.7126 177.6715 9 A 4.0613 8.4718 120.7033 55.3044 18.2005 179.0261 10 N 4.2657 8.7772 115.4514 56.7927 38.7135 177.1208 11 N 4.4230 8.3564 117.8661 56.8768 39.1518 176.0499 12 Y 4.0707 8.6203 121.4340 60.9679 38.7318 178.1979 13 S 4.1743 8.5673 114.0145 61.1979 62.3012 175.9019 14 W 4.0972 8.4257 130.1102 60.4124 30.2369 177.5503 15 A 3.4389 8.7733 121.1827 54.7079 17.6105 179.2233 16 Q 3.7072 7.6403 117.1601 59.4204 29.1704 178.2625 17 R 3.8999 7.2527 118.2369 61.1246 30.5299 177.3117 18 M 4.1090 7.1453 122.3298 54.8541 31.9515 175.2950 *33 Q 3.9792 8.4362 124.2490 57.2160 30.1210 175.1089 34 T 4.2368 8.3220 121.8797 61.8174 68.9794 173.0264 35 P 4.8921 0.0000 0.0000 62.3873 32.2889 175.9629 36 H 4.8638 9.1305 116.6460 55.6642 31.1598 173.0964 37 Y 5.2511 7.9053 115.9088 56.1145 42.6094 173.6796 38 L 5.2333 9.1729 125.9288 53.5087 44.1871 174.7124 39 W 5.0527 9.6277 135.0000 55.9406 32.8467 174.3325 40 I 4.9953 8.7496 129.3284 59.8544 38.7315 175.0573 41 A 5.2047 8.7800 127.7444 49.8186 23.7142 173.6228 42 C 5.0370 8.5751 118.2041 58.4735 32.8292 174.8003 43 S 4.1682 8.6874 121.5101 61.8739 62.4626 175.8436 44 D 4.4061 8.4080 118.9210 56.9980 40.8532 176.9100 45 S 3.7697 7.4908 111.6418 58.9294 62.7408 174.3412 46 R 3.9917 8.7773 126.8175 58.9853 30.2559 177.1030 47 V 3.8123 7.2941 117.6539 61.1453 31.4842 174.5537 48 P 4.3406 0.0000 0.0000 62.2843 33.3122 177.1086 49 A 3.1992 8.1319 121.4977 55.1570 17.9552 179.9600 50 E 3.6900 7.7745 116.4704 59.3949 29.3301 179.3961 51 K 3.8362 7.6901 117.7815 59.5040 32.4000 178.3361 52 L 3.9571 7.4993 118.3702 57.0290 41.5425 178.5689 53 T 4.3197 7.6048 107.2294 60.1749 69.6608 174.1785 54 N 4.2839 8.2252 119.2314 54.3351 38.0865 173.9518 55 L 4.3514 6.9242 114.6045 53.4713 42.9499 176.9032 56 E 4.2787 8.3828 119.5765 55.1031 30.3263 174.9212 57 P 4.6217 0.0000 0.0000 63.7910 31.8848 177.1068 58 G 4.0925 8.9722 109.7638 45.6402 0.0000 175.3927 59 E 4.1133 8.1473 119.0121 58.4321 29.7912 176.4458 60 L 5.2344 7.8443 118.0849 52.9798 43.7841 175.8294 61 F 5.0704 9.3069 126.4026 56.4998 41.5249 174.2466 62 V 5.0159 8.0527 125.4601 61.2999 34.3135 173.7362 63 H 4.9670 9.4040 127.5865 54.3605 32.5929 172.5227 64 R 5.3269 8.3842 123.8404 54.4285 33.0772 174.2877 65 N 5.0020 8.8397 120.2182 50.5893 41.9055 173.5814 66 V 3.8734 8.2113 118.9788 63.3664 31.9174 175.2244 67 A 3.6755 8.9984 130.5309 53.0473 16.6157 176.9102 68 N 4.2334 8.0948 112.6777 55.4582 36.0508 173.4044 69 Q 4.6931 9.1181 116.0340 55.3848 30.7909 177.1420 70 V 4.1860 8.2536 122.0263 61.0171 31.2010 174.4470 71 I 3.7466 7.5194 125.6606 60.2295 38.0333 177.0303 72 H 4.1642 8.5908 122.0389 58.5709 28.6606 176.4178 73 T 4.4041 7.6315 106.5069 61.1399 68.0810 173.9835 74 D 4.6436 8.0278 122.8029 53.9196 41.4106 176.0228 75 F 3.7756 8.9661 130.3121 61.3559 39.3060 176.1812 76 N 4.3745 8.0466 113.4105 56.9616 38.8395 176.4793 77 C 3.8683 8.2107 119.4301 62.4227 31.6774 175.4666 78 L 3.8970 7.9057 120.0876 57.7642 41.0769 179.4146 79 S 4.0619 8.0952 115.1504 61.6971 62.7762 176.7468 80 V 3.7899 7.7085 120.7277 66.3175 31.1105 178.2822 81 V 3.6090 7.8819 117.7772 66.0044 31.3189 177.8313 82 Q 3.8862 8.4479 119.8032 59.1741 28.8654 177.4805 83 Y 4.0808 8.4682 120.6950 60.5856 38.8346 177.7612 84 A 3.6760 8.3158 121.8306 55.1553 18.3565 179.8104 85 V 3.4124 7.8957 116.6706 66.4268 31.5394 178.0350 86 D 4.3282 8.2463 117.4601 55.8701 40.7688 177.1772 87 V 4.0548 7.2524 116.3242 64.3051 33.0853 176.7002 88 L 3.8155 7.3766 117.4190 55.2224 41.5694 177.2974 89 K 4.0879 7.7654 115.4858 56.4794 29.3477 175.7179 90 I 3.7808 7.6663 119.2886 61.8298 37.5084 176.1261 91 E 4.7161 8.6241 121.9576 56.5628 31.3774 174.9803 92 H 5.3974 7.9106 115.3696 54.1792 33.1863 172.2437 93 I 4.9455 8.9245 124.2443 59.5057 40.1876 174.5488 94 I 4.3376 8.9847 128.0726 59.3448 39.8870 174.5319 95 I 4.4132 8.2924 128.8923 59.9040 38.8756 174.4348 96 C 5.0195 8.9547 127.3842 57.6828 34.4514 173.7974 97 G 4.2171 9.0624 115.4107 43.7096 0.0000 171.0227 98 H 5.0651 8.0391 113.4062 54.1700 30.9437 173.7325 99 T 3.9626 8.0350 110.9109 60.8080 69.9193 173.1083 100 N 4.0346 7.9332 116.9668 54.4937 37.8921 175.1310 101 C 4.3464 7.6237 117.6989 58.2607 32.6617 172.3521 102 G 3.8505 8.9618 116.3379 47.9637 0.0000 174.7243 103 G 3.6756 8.5324 107.7655 47.6942 0.0000 175.8347 104 I 3.6610 7.6469 122.0349 64.4047 37.3048 178.0431 105 H 4.0750 8.3113 116.8537 58.7738 28.2847 177.6786 106 A 4.0180 8.2465 121.6781 55.2370 18.3165 179.2540 107 A 4.1537 7.9547 118.0904 55.5406 18.5115 179.3886 108 M 4.0945 7.7918 115.7209 56.7429 32.4777 177.2611 109 A 4.2423 7.3357 121.2365 52.2846 19.2676 176.7840 110 D 4.9469 8.3921 119.6443 53.7763 41.5908 176.7909 111 K 4.2560 7.7759 117.0179 55.3531 33.4020 176.9959 112 D 4.5281 8.5514 122.2655 54.1152 40.4373 175.8363 113 L 4.4787 8.7331 126.1408 54.2861 43.4521 178.4287 114 G 3.9786 8.1067 105.7841 44.6290 0.0000 175.3260 115 L 3.9068 8.8394 120.1196 58.6668 41.8622 179.2461 116 I 3.8205 7.8805 117.5031 64.1526 37.8424 177.2578 117 N 4.3959 8.5379 117.7013 56.3648 38.0569 177.0161 118 N 4.4038 8.1346 117.3563 55.8965 39.0184 176.8931 119 W 4.3474 8.2904 129.3693 60.4729 31.0594 177.3676 120 L 4.3174 8.3874 117.3694 56.0671 41.1875 178.8990 121 L 4.0588 7.7967 119.8875 58.0620 41.3418 178.9720 122 H 4.1178 7.6445 115.4981 58.7590 28.4409 177.9165 123 I 3.8031 7.5621 121.2784 64.4502 36.9756 178.5176 124 R 4.2788 8.1039 118.8060 59.3559 29.7935 178.6560 125 D 4.4293 8.5511 119.1915 57.6425 40.8618 179.1175 126 I 3.8815 7.6497 120.3317 63.9350 36.9000 178.1611 127 W 4.4353 8.4389 128.5916 60.6652 30.9624 177.4230 128 F 3.9836 8.6617 120.8202 61.1339 38.5965 176.7088 129 K 3.9766 8.3865 118.3247 59.1223 32.1604 177.5043 130 H 5.0538 8.1767 115.8419 55.4747 30.1531 177.2321 131 G 3.4718 7.7759 110.5134 47.9118 0.0000 175.4613 132 H 4.0887 7.9764 119.2222 58.9494 30.1790 176.4940 133 L 4.0681 7.9291 121.4991 58.4656 41.9843 178.9251 134 L 4.1657 8.3374 118.9926 57.6407 41.3169 179.7621 135 G 3.7568 8.3300 105.5601 46.8692 0.0000 174.2985 136 K 4.3644 7.6672 119.2454 56.6829 32.8880 176.3632 137 L 4.9167 7.2783 119.0272 53.2153 43.5063 176.3846 138 S 4.2499 8.5541 115.7952 57.7004 62.7811 173.5631 139 P 4.2788 0.0000 0.0000 65.5867 31.1966 177.5740 140 E 4.3964 8.0907 112.8012 56.8413 30.2042 177.2676 141 K 4.4260 7.8904 118.9169 56.8310 33.1368 178.3434 142 R 3.8461 7.6108 118.0030 58.8833 29.8849 178.4301 143 A 3.7111 7.8214 120.0781 55.4656 18.2633 179.3476 144 D 4.1996 7.9322 116.6774 57.4702 40.8214 178.6259 145 M 3.9613 7.8795 118.8911 58.5699 32.2604 178.0802 146 L 3.8726 8.2914 120.8582 58.3247 42.1034 178.9077 147 T 3.7865 8.0989 116.1256 66.5797 68.4650 176.6885 148 K 4.0065 7.8196 120.2205 59.3816 32.1257 179.5084 149 I 3.6519 7.8818 120.2345 64.2214 37.0198 177.7058 150 N 4.2514 8.6166 118.2585 56.8992 38.7457 176.8969 151 V 3.5677 7.6139 118.7151 65.9901 31.6166 177.6747 152 A 4.1215 7.9025 119.9838 55.4964 18.1463 179.5398 153 E 4.1919 8.5716 117.0477 59.6362 29.4204 179.5779 154 Q 4.0184 8.3528 118.2483 58.5439 28.7388 178.6503 155 V 3.5699 7.9638 119.5319 65.9702 31.3483 177.3191 156 Y 4.1847 7.8552 118.1524 60.9255 38.9650 177.5124 157 N 4.3284 8.4376 117.5691 56.2567 38.7987 176.9451 158 L 3.9522 8.1903 121.9766 58.2737 41.9646 179.2672 159 G 3.6851 8.1282 103.5751 46.6044 0.0000 174.7499 160 R 4.3190 7.0766 118.0116 55.1046 31.0749 176.6773 161 T 3.9451 7.0611 110.6372 61.1455 69.6233 175.4724 162 S 4.0130 8.6661 119.0757 61.7945 62.7439 176.8524 163 I 3.5459 7.5107 122.6270 64.1777 36.8636 178.4137 164 V 3.0944 7.4550 118.7754 65.6816 31.2161 178.0973 165 K 3.9891 7.9173 118.6191 59.5960 31.9300 179.3668 166 S 4.1788 8.2455 113.9612 60.6277 63.1634 176.2362 167 A 3.9026 7.8733 124.6894 55.0704 18.2265 179.5892 168 W 4.4400 8.1535 117.5761 60.0351 28.8967 178.4152 169 E 4.0859 8.4157 118.8163 58.7419 29.1514 178.0424 170 R 4.4451 7.8618 113.5873 55.9245 29.8748 177.0128 171 G 3.9038 7.8159 107.0149 45.8292 0.0000 173.4808 172 Q 4.0600 7.9669 120.8847 54.9645 29.4993 175.6904 173 K 4.1548 8.5724 126.7989 56.4170 32.4538 175.7406 174 L 4.8648 8.5253 127.9370 54.0156 45.7990 173.8189 175 S 5.2680 9.3427 121.1403 56.6566 66.2781 172.8148 176 L 5.1534 9.2165 124.0545 53.6814 43.9310 175.2893 177 H 5.1369 9.0802 118.8925 54.0814 33.7871 173.0512 178 G 4.2693 8.5495 107.3547 44.7121 0.0000 171.3667 179 W 5.8010 9.1136 125.9176 54.6421 33.8074 174.8787 180 V 5.4876 9.2156 119.9044 60.7266 34.9838 173.2884 181 Y 5.5117 8.4363 124.4709 54.3132 41.2809 174.1398 182 D 4.8503 8.8040 121.7669 53.5479 42.1826 177.5446 183 V 4.1092 8.2370 120.5022 64.6116 31.9118 177.5162 184 N 4.5631 9.1299 117.5479 55.5231 38.3791 175.4680 185 D 4.7269 7.8906 113.6179 51.7526 41.0713 176.6583 186 G 3.7778 8.8495 107.7158 45.8059 0.0000 173.0881 187 F 4.5998 9.0195 120.1796 56.2460 40.0498 175.2768 188 L 4.5523 8.7808 124.8737 54.9168 42.3868 176.6680 189 V 4.3481 9.0949 124.1362 60.7629 34.2856 174.0226 190 D 5.0905 8.6626 128.2198 54.5778 41.3107 176.0787 191 Q 4.2090 9.2007 124.6968 56.5349 29.2294 176.8002 192 G 4.0075 8.4207 105.9852 44.9065 0.0000 173.8147 193 V 4.0816 7.5895 119.6638 62.3995 32.1104 175.3623 194 M 5.3612 9.2632 128.3608 53.8802 34.9988 173.7117 195 A 4.8471 8.8644 128.1543 50.1487 22.1751 176.0731 196 T 4.6620 8.3529 110.6788 59.5035 69.4523 173.8317 197 S 2.7900 5.8100 116.3641 56.3858 64.5529 177.8806 198 R 3.9788 7.3546 119.9267 59.1021 29.7124 177.9424 199 E 3.8731 7.8789 119.1285 59.5177 29.8730 178.8249 200 T 3.9027 7.3687 108.5897 64.2242 68.6321 176.2586 201 L 4.0040 7.8469 123.5524 58.2007 42.1152 178.4493 202 E 4.1644 8.2066 118.4185 59.7141 29.4695 179.4132 203 I 3.7283 7.8793 119.5682 64.6612 37.2869 178.7992 204 S 4.2311 8.1330 114.5105 61.0097 62.9567 175.8674 205 Y 4.0172 8.2948 123.8286 60.6557 38.5783 177.6994 206 R 3.6827 8.2867 119.2821 59.3488 30.2014 178.9020 207 N 4.2735 8.3135 115.9613 56.0934 38.5795 177.2190 208 A 3.9447 8.0064 122.2374 55.3643 18.4469 179.8480 209 I 3.4731 7.4117 117.8592 64.2592 36.9029 178.3693 210 A 3.9237 7.5707 120.4288 55.2874 18.4588 179.6267 211 R 3.9833 8.3999 116.6573 59.5248 30.0007 179.3735 212 L 4.0381 7.6943 117.0207 57.6304 41.6203 179.2188 213 S 4.5705 7.7010 113.5037 59.0794 63.0767 174.3381 214 I 4.0464 7.3136 122.8477 60.3437 36.1569 175.1828 215 L 4.5658 8.1048 125.3189 53.6803 43.0592 176.4528 216 D 4.6591 8.5252 120.6896 54.2337 41.1726 176.5293 217 E 4.3291 8.4942 126.4891 56.6306 28.9194 176.4024 218 E 4.0878 7.9757 113.6206 58.5024 30.0398 177.1222 219 N 4.6322 7.9824 116.0228 54.0338 39.4767 175.1463 220 I 4.1822 7.0317 119.4631 60.7926 37.7913 175.8055 221 L 4.1313 8.1431 124.4557 55.4319 41.8246 176.5693 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 4.48 0.00 2.15 1.91 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 2 D 9.16 4.16 0.00 2.80 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 3 K 8.98 3.85 0.00 1.89 1.88 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.51 7.81 4 I 7.79 3.82 1.95 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 1.74 1.09 1.11 0.00 0.00 5 K 7.79 4.01 0.00 1.99 1.92 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.70 7.81 6 Q 8.52 3.96 0.00 2.23 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 7 L 7.77 3.86 0.00 1.97 1.54 0.83 0.93 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 8 F 8.42 4.16 0.00 3.30 3.08 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 0.00 0.00 0.00 9 A 8.47 4.06 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 10 N 8.78 4.27 0.00 2.91 2.92 0.00 0.00 6.75 7.35 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 11 N 8.36 4.42 0.00 2.73 3.04 0.00 0.00 6.91 7.13 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 12 Y 8.62 4.07 0.00 3.35 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.57 4.17 0.00 4.04 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.43 4.10 0.00 3.33 3.46 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 15 A 8.77 3.44 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 16 Q 7.64 3.71 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 17 R 7.25 3.90 0.00 1.82 1.89 0.00 3.24 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 18 M 7.15 4.11 0.00 1.77 1.44 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 1.41 1.90 0.00 *33 Q 8.44 3.98 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.91 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 34 T 8.32 4.24 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 1.10 0.00 0.00 35 P 0.00 4.89 0.00 2.05 2.13 0.00 3.53 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.08 0.00 36 H 9.13 4.86 0.00 2.70 2.81 0.00 5.75 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 7.91 5.25 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 9.17 5.23 0.00 1.96 1.66 1.16 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 39 W 9.63 5.05 0.00 3.44 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 40 I 8.75 5.00 1.78 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 1.22 0.45 0.96 0.00 0.00 41 A 8.78 5.20 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 8.58 5.04 0.00 3.35 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 43 S 8.69 4.17 0.00 3.78 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.41 4.41 0.00 2.80 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 45 S 7.49 3.77 0.00 4.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.78 3.99 0.00 1.91 1.98 0.00 3.43 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 47 V 7.29 3.81 1.73 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 0.54 0.00 0.00 0.91 0.00 0.00 48 P 0.00 4.34 0.00 2.06 1.85 0.00 3.56 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 49 A 8.13 3.20 0.16 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 0.00 0.00 50 E 7.77 3.69 0.00 1.89 1.91 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 2.27 2.24 0.00 51 K 7.69 3.84 0.00 1.63 1.82 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.44 7.81 52 L 7.50 3.96 0.00 1.59 1.63 0.86 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.60 4.32 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 54 N 8.23 4.28 0.00 2.72 2.83 0.00 0.00 7.19 7.51 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 55 L 6.92 4.35 0.00 1.60 1.55 0.49 0.86 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 56 E 8.38 4.28 0.00 2.12 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 2.42 2.41 0.00 57 P 0.00 4.62 0.00 2.06 2.04 0.00 3.76 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 58 G 8.97 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.15 4.11 0.00 2.24 2.27 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 2.47 2.65 0.00 60 L 7.84 5.23 0.00 1.53 1.63 0.59 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 61 F 9.31 5.07 0.00 3.14 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 8.05 5.02 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 0.97 0.00 0.00 0.95 0.00 0.00 63 H 9.40 4.97 0.00 3.19 3.13 0.00 5.77 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 8.38 5.33 0.00 1.62 1.76 0.00 3.29 0.00 0.00 3.41 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 65 N 8.84 5.00 0.00 2.77 2.87 0.00 0.00 6.21 7.78 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 66 V 8.21 3.87 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 0.87 0.00 0.00 0.78 0.00 0.00 67 A 9.00 3.68 1.46 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 0.00 0.00 68 N 8.09 4.23 0.00 2.98 3.14 0.00 0.00 6.08 7.44 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 69 Q 9.12 4.69 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.06 0.00 0.00 0.00 0.00 0.00 2.65 2.21 0.00 70 V 8.25 4.19 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 0.73 0.00 0.00 0.90 0.00 0.00 71 I 7.52 3.75 1.55 0.00 0.00 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 -0.06 0.58 0.00 0.00 72 H 8.59 4.16 0.00 3.09 3.27 0.00 5.65 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.63 4.40 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 1.22 0.00 0.00 74 D 8.03 4.64 0.00 2.93 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 75 F 8.97 3.78 0.00 3.27 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.05 4.37 0.00 2.90 3.21 0.00 0.00 6.83 7.53 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 77 C 8.21 3.87 0.00 3.15 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.91 3.90 0.00 1.55 1.49 0.82 0.84 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 79 S 8.10 4.06 0.00 4.20 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 80 V 7.71 3.79 2.23 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 1.17 0.00 0.00 0.95 0.00 0.00 81 V 7.88 3.61 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 0.94 0.00 0.00 0.93 0.00 0.00 82 Q 8.45 3.89 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 83 Y 8.47 4.08 0.00 3.15 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.32 3.68 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 85 V 7.90 3.41 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 0.91 0.00 0.00 0.85 0.00 0.00 86 D 8.25 4.33 0.00 2.76 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 87 V 7.25 4.05 1.72 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 0.67 0.00 0.00 0.93 0.00 0.00 88 L 7.38 3.82 0.00 1.53 1.39 -0.04 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 89 K 7.77 4.09 0.00 1.83 1.84 0.00 1.76 0.00 0.00 0.61 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.28 7.81 90 I 7.67 3.78 1.92 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 1.35 0.33 0.97 0.00 0.00 91 E 8.62 4.72 0.00 1.76 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 92 H 7.91 5.40 0.00 3.20 3.38 0.00 5.56 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 8.92 4.95 1.85 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 1.26 0.72 0.93 0.00 0.00 94 I 8.98 4.34 1.24 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.64 -0.95 0.00 0.00 95 I 8.29 4.41 1.71 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.45 0.82 0.00 0.00 96 C 8.95 5.02 0.00 1.99 2.57 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 0.00 97 G 9.06 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 0.00 0.00 0.00 0.00 98 H 8.04 5.07 0.00 2.22 2.36 0.00 5.73 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.04 3.96 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 1.17 0.00 0.00 100 N 7.93 4.03 0.00 2.85 2.88 0.00 0.00 7.10 7.53 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 0.00 101 C 7.62 4.35 0.00 2.88 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 0.00 102 G 8.96 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 0.00 103 G 8.53 3.68 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 0.00 0.00 0.00 104 I 7.65 3.66 1.85 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 1.57 1.25 0.70 0.00 0.00 105 H 8.31 4.08 0.00 3.29 3.31 0.00 5.62 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 0.00 106 A 8.25 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.95 4.15 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 0.00 108 M 7.79 4.09 0.00 1.57 1.92 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 1.51 0.00 109 A 7.34 4.24 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 0.00 110 D 8.39 4.95 0.00 2.70 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 0.00 111 K 7.78 4.26 0.00 1.82 1.74 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.45 7.81 112 D 8.55 4.53 0.00 2.64 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 0.00 113 L 8.73 4.48 0.00 1.85 1.71 0.99 1.06 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 0.00 114 G 8.11 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 0.00 0.00 0.00 115 L 8.84 3.91 0.00 1.78 1.72 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 116 I 7.88 3.82 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.39 0.95 0.00 0.00 117 N 8.54 4.40 0.00 3.09 2.91 0.00 0.00 6.88 7.55 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 0.00 118 N 8.13 4.40 0.00 2.92 2.94 0.00 0.00 6.97 7.61 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 0.00 119 W 8.29 4.35 0.00 3.47 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 0.00 120 L 8.39 4.32 0.00 1.83 1.78 1.07 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.80 4.06 0.00 1.76 1.64 0.90 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 122 H 7.64 4.12 0.00 3.23 3.19 0.00 5.62 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 0.00 123 I 7.56 3.80 2.08 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 1.62 0.98 0.93 0.00 0.00 124 R 8.10 4.28 0.00 2.12 2.11 0.00 3.42 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 125 D 8.55 4.43 0.00 2.90 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 0.00 126 I 7.65 3.88 2.17 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 1.52 1.15 1.05 0.00 0.00 127 W 8.44 4.44 0.00 3.34 3.45 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 0.00 128 F 8.66 3.98 0.00 3.00 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 0.00 129 K 8.39 3.98 0.00 2.05 2.09 0.00 1.91 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.28 1.52 7.81 130 H 8.18 5.05 0.00 3.31 3.29 0.00 5.67 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 0.00 131 G 7.78 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 H 7.98 4.09 0.00 3.06 3.31 0.00 5.75 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 L 7.93 4.07 0.00 1.78 1.86 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.34 4.17 0.00 2.03 1.90 1.21 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.33 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 0.00 0.00 0.00 136 K 7.67 4.36 0.00 1.86 1.96 0.00 1.25 0.00 0.00 1.60 0.00 0.00 2.73 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.63 1.36 7.81 137 L 7.28 4.92 0.00 1.87 1.62 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 138 S 8.55 4.25 0.00 3.93 3.72 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 0.00 139 P 0.00 4.28 0.00 2.22 2.12 0.00 3.64 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 2.13 2.11 0.00 140 E 8.09 4.40 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 141 K 7.89 4.43 0.00 1.90 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.58 7.81 142 R 7.61 3.85 0.00 1.98 1.83 0.00 3.18 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 143 A 7.82 3.71 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 D 7.93 4.20 0.00 2.69 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 0.00 145 M 7.88 3.96 0.00 2.22 2.01 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.56 0.00 146 L 8.29 3.87 0.00 1.58 1.61 0.93 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 147 T 8.10 3.79 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 1.13 0.00 0.00 148 K 7.82 4.01 0.00 1.89 1.95 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.59 7.81 149 I 7.88 3.65 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.60 0.75 0.00 0.00 150 N 8.62 4.25 0.00 2.88 3.01 0.00 0.00 6.88 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 0.00 151 V 7.61 3.57 2.23 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 0.96 0.00 0.00 0.98 0.00 0.00 152 A 7.90 4.12 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 0.00 153 E 8.57 4.19 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 154 Q 8.35 4.02 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.68 2.71 0.00 155 V 7.96 3.57 2.32 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 1.20 0.00 0.00 0.99 0.00 0.00 156 Y 7.86 4.18 0.00 2.82 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 N 8.44 4.33 0.00 2.87 2.89 0.00 0.00 6.72 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 0.00 158 L 8.19 3.95 0.00 1.82 1.83 0.83 1.23 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 0.00 159 G 8.13 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 R 7.08 4.32 0.00 1.54 1.74 0.00 2.21 0.00 0.00 2.63 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.21 0.00 161 T 7.06 3.95 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 162 S 8.67 4.01 0.00 4.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 I 7.51 3.55 1.73 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.76 0.80 0.00 0.00 164 V 7.46 3.09 1.71 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 -0.42 0.00 0.00 0.65 0.00 0.00 165 K 7.92 3.99 0.00 1.84 1.87 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.60 1.56 7.81 166 S 8.25 4.18 0.00 4.03 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 0.00 167 A 7.87 3.90 1.23 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 0.00 0.00 168 W 8.15 4.44 0.00 3.61 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 E 8.42 4.09 0.00 2.21 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 2.35 2.36 0.00 170 R 7.86 4.45 0.00 2.03 2.02 0.00 3.13 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.64 0.00 171 G 7.82 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 0.00 172 Q 7.97 4.06 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 173 K 8.57 4.15 0.00 1.78 1.73 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.46 7.81 174 L 8.53 4.86 0.00 1.77 1.56 0.88 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 175 S 9.34 5.27 0.00 3.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 L 9.22 5.15 0.00 1.67 1.62 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 177 H 9.08 5.14 0.00 2.38 2.72 0.00 5.56 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 0.00 178 G 8.55 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 0.00 179 W 9.11 5.80 0.00 3.27 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 0.00 180 V 9.22 5.49 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 1.13 0.00 0.00 0.97 0.00 0.00 181 Y 8.44 5.51 0.00 3.16 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 0.00 182 D 8.80 4.85 0.00 2.78 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 V 8.24 4.11 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 0.81 0.00 0.00 0.97 0.00 0.00 184 N 9.13 4.56 0.00 2.83 2.92 0.00 0.00 6.79 8.05 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 0.00 185 D 7.89 4.73 0.00 2.90 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 G 8.85 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 0.00 0.00 0.00 187 F 9.02 4.60 0.00 3.22 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 L 8.78 4.55 0.00 1.43 1.47 1.10 1.33 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 0.00 189 V 9.09 4.35 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.05 0.00 0.00 190 D 8.66 5.09 0.00 2.61 2.57 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 0.00 191 Q 9.20 4.21 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 192 G 8.42 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 V 7.59 4.08 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 0.98 0.00 0.00 1.12 0.00 0.00 194 M 9.26 5.36 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.67 0.00 195 A 8.86 4.85 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 0.00 196 T 8.35 4.66 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 1.24 0.00 0.00 197 S 5.81 2.79 0.00 3.53 3.43 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 0.00 198 R 7.35 3.98 0.00 2.11 1.97 0.00 3.38 0.00 0.00 3.41 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 199 E 7.88 3.87 0.00 2.02 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 2.35 2.34 0.00 200 T 7.37 3.90 4.17 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 0.00 0.00 0.00 1.12 0.00 0.00 201 L 7.85 4.00 0.00 2.05 2.03 1.20 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 202 E 8.21 4.16 0.00 2.27 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 2.44 2.59 0.00 203 I 7.88 3.73 1.88 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 1.59 0.73 0.92 0.00 0.00 204 S 8.13 4.23 0.00 4.29 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 Y 8.29 4.02 0.00 3.10 3.17 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 0.00 0.00 0.00 0.00 206 R 8.29 3.68 0.00 2.11 1.93 0.00 3.22 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 207 N 8.31 4.27 0.00 2.72 2.83 0.00 0.00 6.93 6.90 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 0.00 208 A 8.01 3.94 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 I 7.41 3.47 1.50 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 0.75 0.06 0.81 0.00 0.00 210 A 7.57 3.92 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 0.00 211 R 8.40 3.98 0.00 1.93 1.96 0.00 3.12 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 212 L 7.69 4.04 0.00 1.73 1.69 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 213 S 7.70 4.57 0.00 3.98 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 0.00 214 I 7.31 4.05 1.93 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 1.41 0.73 0.90 0.00 0.00 215 L 8.10 4.57 0.00 1.61 1.57 0.90 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 216 D 8.53 4.66 0.00 2.65 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 0.00 217 E 8.49 4.33 0.00 2.22 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 2.24 2.33 0.00 218 E 7.98 4.09 0.00 2.11 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 2.40 2.32 0.00 219 N 7.98 4.63 0.00 2.79 2.88 0.00 0.00 7.18 7.26 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 0.00 220 I 7.03 4.18 2.08 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 1.17 0.73 0.90 0.00 0.00 221 L 8.14 4.13 0.00 1.68 1.54 0.93 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 * Residues marked with a * may have inaccurate shift predictions.