NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.6549 8.2348 114.6536 58.3964 63.3403 173.3851 3 F 4.6322 9.4786 126.2228 57.6287 39.9283 175.6607 4 I 4.0715 8.1884 123.2043 64.2081 38.8479 178.3197 5 K 3.3744 7.8962 121.8673 57.0017 31.6231 179.0610 6 P 4.3327 0.0000 0.0000 64.7758 31.3417 177.2162 7 I 4.4982 7.5085 110.0483 60.6720 38.0603 176.9093 8 Y 4.2375 8.1201 127.4055 62.2256 38.2901 178.2367 9 Q 3.7566 8.1878 121.0883 60.3981 27.9630 180.7741 10 D 4.5391 7.9219 119.8884 57.4108 41.1414 178.5527 11 I 2.8608 7.7124 121.4651 64.4184 37.5726 178.2468 12 N 4.2001 8.1598 120.6102 57.5980 37.0952 179.6449 13 S 4.1263 7.3476 116.6101 61.2575 63.0064 176.5333 14 I 3.7374 7.4700 121.9492 64.0523 36.7584 178.1864 15 L 4.3387 7.5324 119.0928 57.0200 41.9231 176.0865 16 I 3.9192 6.1736 122.0314 61.3852 37.4156 175.4804 17 G 4.0536 8.2059 115.9020 46.2573 0.0000 170.7896 18 Q 4.8122 8.9652 123.5043 57.4006 29.3369 175.9610 19 K 3.8298 9.3234 128.0501 56.3767 38.2710 176.1884 *34 G 3.7223 8.8742 111.7145 46.3220 0.0000 174.3242 35 E 4.2289 8.6157 119.7269 60.1612 29.0252 176.0248 36 P 4.3014 0.0000 0.0000 68.3993 30.6490 183.8754 37 F 4.3825 7.8594 116.9907 59.7841 38.6509 177.5520 38 E 4.1292 8.3281 121.5024 59.8680 29.3924 179.4904 39 K 4.1637 8.1603 123.8203 59.5969 31.7666 181.0967 40 L 4.2279 7.6264 119.5854 57.7816 41.5694 179.6609 41 V 3.7056 7.9124 118.0611 66.4398 31.4783 177.3741 42 Y 4.2598 8.1161 121.5630 61.2130 38.3496 178.8219 43 K 3.8484 8.2137 124.0578 59.9706 32.1311 180.5013 44 F 4.4760 8.3271 122.2625 61.1743 39.3758 177.0394 45 L 4.0816 8.4772 121.0194 58.4182 41.2793 180.4625 46 K 3.8420 7.7921 124.9208 59.2206 31.5280 182.8619 47 E 4.3537 7.8455 116.6189 61.2380 30.2716 183.0421 48 N 4.5420 7.5400 115.8813 54.4576 39.9622 175.7681 49 L 4.6908 7.7660 121.7916 54.6639 42.0927 178.7321 50 S 4.8269 7.5442 109.0995 57.6526 62.0853 176.6978 51 D 4.6707 7.6717 119.6647 54.9407 46.0472 176.3678 52 L 4.5853 7.5920 116.7001 54.7974 43.6945 176.5176 53 T 4.5307 7.4249 116.2089 62.9280 69.3283 174.1786 54 F 5.2879 8.9982 125.4201 56.9572 44.2585 174.4818 55 K 4.4954 8.7607 124.4356 54.3681 33.1922 178.2762 56 Q 3.9260 8.9065 122.0593 60.2741 28.8066 178.9428 57 Y 4.1461 7.8988 117.8859 59.8847 37.9687 177.6472 58 E 3.8155 6.9907 120.6200 59.3864 29.7167 178.0415 59 Y 3.3397 8.3743 119.7582 60.3679 38.7447 178.0550 60 L 3.3712 7.7993 119.9614 57.6706 41.7307 179.2480 61 N 4.4050 8.4322 116.6682 56.2126 38.4679 177.0398 62 D 4.2071 7.7978 119.5854 56.9777 41.0293 178.0146 63 L 3.4808 6.9529 119.9208 58.1706 41.8172 178.8566 64 F 4.3657 7.1919 117.3012 60.3461 38.3161 177.7792 65 M 4.3814 7.8504 118.1453 58.2285 31.9099 178.3922 66 K 4.2304 7.9634 116.7555 57.5562 33.7639 176.7752 67 N 5.1170 7.5994 115.8560 50.7815 38.9087 173.2671 68 P 4.2534 0.0000 0.0000 66.0038 31.7173 178.1757 69 A 4.0480 7.9247 118.7159 53.0874 18.4467 176.9421 70 I 4.1250 7.5917 117.7685 60.0859 36.9642 175.3183 71 I 4.3960 8.1508 125.8506 60.1144 40.2976 176.0029 72 G 4.0474 8.4698 109.4106 46.3711 0.0000 174.4466 73 H 3.8278 9.4131 120.9804 58.9606 28.2572 178.6936 74 E 4.0439 7.5808 120.2808 60.8275 29.3998 181.2839 75 A 4.2718 7.6618 120.4213 55.0933 18.7885 179.5706 76 R 3.8259 7.8865 116.5684 59.2594 29.5435 178.7561 77 Y 4.8315 8.1002 116.9042 61.3045 37.6933 178.7543 78 K 4.1648 7.7628 116.6922 59.0138 32.1671 178.8887 79 L 4.3121 7.9914 118.8294 56.1704 41.9741 177.3306 80 F 4.6259 8.3181 118.8074 56.0997 37.6730 177.1818 81 N 4.8604 8.3826 129.1558 52.0126 37.9398 176.4510 82 S 4.4240 9.4156 114.5090 55.9785 64.8625 172.8445 83 P 4.3242 0.0000 0.0000 65.8799 30.9852 178.9116 84 T 3.8877 7.9664 114.0880 66.5558 68.5265 176.7335 85 L 3.5569 8.2887 122.5925 57.7178 42.0101 178.3316 86 L 2.7862 8.0590 120.7274 57.9313 41.6925 178.4503 87 F 3.9706 7.5209 118.6560 61.6750 39.3237 177.0703 88 L 3.6180 7.4389 116.6236 56.5499 41.4269 177.8574 89 L 4.3457 7.5759 116.0807 54.2098 43.2427 176.4871 90 S 4.1523 7.5997 114.6880 58.7622 62.8523 173.6765 91 R 4.3554 8.8001 116.6422 54.6460 31.7524 174.3611 92 G 4.2637 8.6728 106.9818 44.7693 0.0000 175.7127 93 K 4.0739 9.3567 128.1968 59.0864 31.7985 179.8261 94 A 4.1831 8.0179 121.7033 54.8751 17.8717 179.2962 95 A 4.1132 8.1131 118.7581 55.9763 18.3293 179.9367 96 T 4.2713 8.1169 112.8389 66.4022 68.4850 176.5488 97 E 4.0592 7.9360 120.9247 59.2627 29.9340 177.9308 98 N 4.5939 8.1792 113.1139 52.8210 39.1874 175.4518 99 W 4.0994 7.2793 132.5706 58.4218 31.6145 175.3727 100 S 3.9414 6.1969 118.9682 56.8492 65.8917 175.8002 101 I 3.4090 7.7208 112.9834 64.6067 37.5021 177.1536 102 E 4.3513 7.5412 115.3083 55.7667 30.7859 181.0910 103 N 4.8738 7.1159 116.3142 52.9688 39.0169 173.7167 104 L 4.0368 7.2346 119.4924 54.1311 43.0596 177.8158 105 F 4.8518 9.2888 120.7477 58.0437 39.4204 174.4396 106 E 4.1852 8.2949 121.6587 53.7994 32.9140 175.5462 107 E 4.0419 7.6244 118.4703 56.7252 30.0924 176.9763 108 K 4.4421 8.4952 121.3967 54.8641 34.9786 177.0225 109 Q 4.2462 8.8839 122.3420 57.5871 28.3232 176.2714 110 N 4.5299 8.0879 117.8446 54.8159 39.8724 175.0069 111 D 4.5348 7.9815 116.1387 54.2732 41.2815 176.3408 112 T 3.8391 8.8207 121.0870 66.1448 68.5670 174.0043 113 A 4.7567 7.4786 121.0193 50.3559 21.5713 175.8697 114 D 4.6627 8.5513 119.7243 56.5471 42.0521 177.3283 115 I 4.8919 8.0327 117.7708 59.3592 42.2411 174.2406 116 L 4.9269 9.5762 128.5018 53.3432 44.8365 175.0353 117 L 5.5518 9.2934 126.9329 52.3872 43.0322 175.6790 118 V 4.5757 7.8024 122.7818 59.6457 34.1653 175.5630 119 K 3.9195 8.9488 121.7288 57.8071 35.9889 175.2438 120 D 4.2114 9.7175 126.1738 54.6521 36.8539 171.1727 121 Q 3.9389 8.2929 117.1237 56.4148 27.3260 173.3965 122 F 5.2289 7.9960 121.7960 56.8554 41.3250 173.7702 123 Y 4.8344 8.4989 123.8967 56.1464 40.3983 174.4707 124 E 4.6985 8.9003 125.1057 54.2486 31.8453 174.7892 125 L 4.3550 8.9334 128.7022 54.1373 42.4939 175.6113 126 L 4.8156 8.6433 127.3003 53.4349 44.3457 174.6143 127 D 5.0160 8.4146 125.3509 52.4311 43.9902 174.3940 128 V 4.6649 8.7169 126.4632 61.8996 33.0780 175.1829 129 K 4.7912 9.1257 126.7418 54.8263 35.2031 175.0034 130 T 5.1236 8.7542 115.6787 60.3549 70.7395 174.0067 131 R 4.5560 9.0242 125.5725 54.5905 33.3555 174.2214 132 N 3.1479 8.3240 124.6626 51.4559 37.9606 174.4283 133 I 3.5875 7.6877 129.0529 64.2337 37.4796 179.2358 134 S 4.2499 7.0195 114.7270 59.5717 62.1915 178.9182 135 K 4.3871 7.2397 115.3263 56.7970 35.0605 175.4923 136 S 4.2523 8.6007 117.2960 58.0491 62.7869 173.6119 137 A 4.7670 8.0695 127.6373 49.5813 21.6883 175.0805 138 Q 4.1499 8.4001 120.2882 55.5257 29.7942 175.9625 139 A 3.6785 8.2198 124.3759 51.2290 18.5074 175.9235 140 P 4.6051 0.0000 0.0000 62.0744 33.5874 174.8203 141 N 4.3566 8.4727 117.0904 53.6363 38.6979 174.6417 142 I 4.0384 8.0131 123.4610 61.7882 38.2573 175.8083 143 I 4.3786 6.8904 112.2995 59.8147 41.2560 172.8197 144 S 4.4919 8.5176 117.4359 57.7830 62.9589 174.5992 145 A 4.3482 9.6865 132.5517 55.0184 18.0571 179.1644 146 Y 4.1280 8.0864 117.6040 60.6091 38.8935 177.8636 147 K 3.8949 8.4916 121.1456 59.4141 32.3676 178.5952 148 L 3.9308 8.1406 120.5062 57.8981 41.9595 178.7421 149 A 4.0520 8.1889 120.9853 55.4813 18.2923 179.7252 150 Q 3.7680 7.9646 116.4854 59.1139 28.3670 179.3328 151 T 3.9710 7.9435 116.5031 66.7790 68.8405 176.2144 152 C 4.4326 8.7489 118.7540 62.8687 28.2494 175.9910 153 A 4.0291 8.1025 122.1874 55.3232 17.8024 179.9044 154 K 3.9559 8.1298 116.4194 59.3036 31.9333 179.5978 155 M 4.0019 7.9678 119.6508 58.4130 31.9602 178.3680 156 I 3.8951 7.8006 119.5434 64.2273 37.1830 177.6328 157 D 4.3776 7.9938 119.4209 57.6950 40.8172 178.1848 158 N 4.5022 7.8478 114.6708 52.9595 39.0961 175.6006 159 K 3.3212 7.7883 119.3704 55.3136 29.4925 181.1633 160 E 4.2010 7.8292 120.6578 55.2759 29.6301 175.9624 161 F 4.8419 7.8527 123.7022 56.2906 43.2334 174.4862 162 D 4.5017 8.4296 116.9430 54.7665 37.2344 172.3383 163 L 5.0109 7.9045 122.0438 56.7480 44.7303 175.7840 164 F 5.1472 7.3141 110.0902 55.4111 41.4545 173.3961 165 D 5.2005 9.1399 118.5256 52.7538 45.4660 174.7974 166 I 4.6443 8.0683 122.5151 59.7820 39.3536 174.3466 167 N 5.1717 8.4536 123.8214 51.3900 42.8289 173.1273 168 Y 5.2662 8.4807 116.9791 55.0603 42.5730 174.7036 169 L 5.0562 8.3687 122.7120 53.4778 45.6136 174.4894 170 E 4.8865 9.4693 128.9181 55.1657 31.3482 174.8459 171 V 4.6116 8.9882 128.4147 61.4994 33.1114 174.0841 172 D 5.2093 9.1972 129.3689 53.5406 42.1975 176.3082 173 W 5.4371 7.5391 117.8723 55.1598 31.8889 172.8928 *180 L 4.5737 8.4773 117.5273 55.2673 43.2109 176.1754 181 V 5.0759 8.4415 122.1768 61.1486 34.7746 173.7626 182 C 4.6992 9.5360 129.1745 59.7291 31.9224 174.0193 183 V 4.4683 8.5483 119.2757 62.1397 33.7646 175.4035 184 S 4.7449 7.7921 113.3445 58.2332 66.1688 173.3282 185 T 5.7782 8.3442 109.5873 61.8547 71.7238 172.5682 186 S 5.3687 8.3618 112.9073 58.6120 65.6629 174.0678 187 F 5.3372 8.4617 122.6825 55.5498 42.5091 173.8069 188 A 4.3498 5.9848 120.1421 51.4081 22.2288 174.9577 189 E 4.8502 8.1679 119.2259 53.5619 31.9783 176.6870 190 L 3.8179 8.6525 127.5472 58.4816 42.1680 179.0962 191 F 3.0936 7.2463 111.2443 57.8070 38.3257 175.5674 192 K 4.5159 8.0270 122.0840 56.0224 33.1520 175.9023 193 S 4.8022 7.9576 112.7393 57.0798 65.0756 173.0920 194 E 4.2418 8.9568 121.8078 54.5554 28.8369 175.2134 195 P 3.8346 0.0000 0.0000 65.0878 31.0360 177.3777 196 S 4.1063 7.7086 113.4857 59.7747 63.2339 174.5812 197 E 4.2835 7.9618 118.4572 56.6590 29.7856 176.5421 198 L 4.1665 7.7949 119.8842 54.9475 42.2002 175.6164 199 Y 4.5595 8.8134 125.6460 57.1394 40.2870 173.8929 200 I 3.8750 7.7965 127.6678 59.7441 38.5918 175.3082 201 N 4.2344 8.2216 128.4449 51.4090 37.9740 175.3185 202 W 4.1268 8.6527 124.5263 59.4014 29.5156 178.7607 203 A 4.1544 8.2870 118.5349 54.7961 18.8034 177.7936 204 A 4.2913 8.1748 121.1815 51.6378 17.6655 177.2484 205 A 3.6453 8.1095 116.7880 53.2509 16.5923 177.5415 206 M 3.0150 8.1440 115.9270 57.9080 30.5399 176.6670 207 Q 4.7386 7.5670 116.1672 54.7116 31.0486 175.8328 208 I 4.8884 8.3570 116.6952 60.4596 39.2785 174.8143 209 Q 4.9065 8.5645 121.9897 52.8431 32.3446 174.7019 210 F 4.5999 7.7011 115.2075 56.9384 39.7481 172.8719 211 H 4.6797 8.3111 119.9803 54.6562 29.5866 176.1553 212 V 3.7484 8.9869 125.2869 66.3789 31.2769 177.8059 213 R 4.4654 8.9233 111.8638 56.8973 28.6853 176.7632 214 D 4.6978 8.2690 114.1236 54.5755 43.9364 175.0479 215 L 4.0905 7.5053 122.3481 54.0193 42.7053 176.3728 216 D 4.6859 8.2524 124.4399 53.6265 40.1727 175.5484 217 Q 4.7865 7.9092 117.1469 54.7731 30.1184 176.1531 218 G 3.9446 8.3177 108.4165 43.4302 0.0000 172.2223 219 F 4.6548 8.5728 128.5998 57.0480 41.1140 175.4986 220 N 4.6207 8.1401 128.6581 49.8934 36.1479 171.5931 221 G 3.7045 6.7874 109.7010 43.8195 0.0000 170.4339 222 T 4.6089 8.1866 109.0779 59.9414 72.2269 175.0785 223 R 3.9295 8.4906 124.6588 60.4204 30.0539 179.3343 224 E 3.4176 7.4964 119.9244 61.4078 29.6023 181.8593 225 E 4.2638 8.0576 119.0990 60.6630 29.8044 181.0305 226 W 4.0810 8.9043 129.8621 60.2513 30.6603 177.9231 227 A 4.3827 8.5324 120.6718 55.4058 18.0624 179.7361 228 K 4.0105 8.1125 116.9154 59.6905 32.0298 179.8536 229 S 4.0821 8.6982 115.6763 61.7162 62.6640 175.9011 230 Y 3.7932 7.8881 122.3162 60.7837 38.3652 178.2778 231 L 4.1321 8.2296 122.2009 58.3852 41.5796 180.3372 232 K 4.0129 7.9737 123.2436 60.0956 31.7182 180.8096 233 H 4.4331 8.3077 119.7849 58.7611 29.6950 177.1938 234 F 3.7605 8.3833 123.1330 61.1494 39.2605 177.1514 235 V 3.5112 8.1566 117.9925 66.3622 31.3006 177.7455 236 T 3.8143 7.5925 115.1258 67.1538 68.3136 176.5305 237 Q 4.1749 8.0372 118.9993 58.7402 28.6238 179.0773 238 A 2.8186 7.6703 122.1518 54.7039 18.2788 179.5609 239 E 3.8011 8.1563 119.6319 60.0399 29.4629 180.1366 240 Q 3.9184 8.2889 121.1492 60.1998 28.1019 180.5497 241 R 3.8016 7.8306 121.0061 58.9805 29.7541 178.2623 242 A 3.8239 7.4357 119.3476 55.2404 18.5941 179.5175 243 I 3.7552 7.7976 118.1196 64.7785 37.2861 178.9978 244 S 4.6988 8.6290 117.3686 60.7627 62.5009 176.3420 245 M 4.1755 8.1834 121.9008 58.8517 31.9279 178.3353 246 I 3.7852 7.6041 119.3229 64.5964 37.4561 178.2699 247 D 4.3404 8.0506 119.1679 56.5243 40.4458 178.0418 248 K 3.9466 7.5025 118.5257 57.4847 32.7399 177.5063 249 F 5.1334 7.8474 115.3779 58.2830 40.5146 176.1958 250 V 4.1650 8.1230 119.9094 63.5943 31.8807 177.8821 251 K 3.9751 8.3194 122.5678 59.8740 31.8809 179.2401 252 P 4.3861 0.0000 0.0000 64.4246 31.3448 177.6453 253 F 5.0277 8.5727 115.1495 57.6033 40.5459 177.2694 254 K 3.4053 7.9763 121.4752 60.1237 31.5679 178.9201 255 K 4.1056 8.0110 122.0214 59.0807 31.7533 182.3823 256 Y 4.6849 8.7699 114.7594 58.8625 38.1675 175.5002 257 I 4.2182 7.6879 119.1958 60.9489 37.8309 175.1577 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 S 8.23 4.65 0.00 3.96 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 3 F 9.48 4.63 0.00 3.16 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 4 I 8.19 4.07 1.88 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 1.44 1.82 1.06 0.00 0.00 5 K 7.90 3.37 0.00 1.70 1.83 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.30 7.81 6 P 0.00 4.33 0.00 2.06 2.18 0.00 3.68 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 2.07 2.08 0.00 7 I 7.51 4.50 1.94 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 1.33 1.10 0.93 0.00 0.00 8 Y 8.12 4.24 0.00 2.88 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.19 3.76 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.04 0.00 10 D 7.92 4.54 0.00 3.09 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 11 I 7.71 2.86 2.13 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.97 1.09 0.00 0.00 12 N 8.16 4.20 0.00 2.72 2.81 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 13 S 7.35 4.13 0.00 3.71 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 14 I 7.47 3.74 1.26 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 1.55 0.26 0.63 0.00 0.00 15 L 7.53 4.34 0.00 1.74 1.76 0.98 0.72 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 16 I 6.17 3.92 1.85 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 1.10 1.03 0.92 0.00 0.00 17 G 8.21 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 0.00 0.00 0.00 18 Q 8.97 4.81 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.92 0.00 0.00 0.00 0.00 0.00 2.28 1.94 0.00 19 K 9.32 3.83 0.00 1.66 1.20 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.18 1.13 7.81 *34 G 8.87 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 0.00 0.00 0.00 35 E 8.62 4.23 0.00 1.99 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 2.32 1.95 0.00 36 P 0.00 4.30 0.00 2.06 2.10 0.00 3.69 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 2.03 1.70 0.00 37 F 7.86 4.38 0.00 3.12 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 38 E 8.33 4.13 0.00 2.08 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 0.00 2.46 2.37 0.00 39 K 8.16 4.16 0.00 1.83 1.80 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.35 7.81 40 L 7.63 4.23 0.00 2.00 1.82 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.91 3.71 2.42 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 1.17 0.00 0.00 1.15 0.00 0.00 42 Y 8.12 4.26 0.00 3.09 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 43 K 8.21 3.85 0.00 1.88 1.72 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.32 7.81 44 F 8.33 4.48 0.00 3.09 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 45 L 8.48 4.08 0.00 1.71 1.68 1.07 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.79 3.84 0.00 1.86 1.73 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.32 7.81 47 E 7.85 4.35 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 48 N 7.54 4.54 0.00 2.32 2.65 0.00 0.00 6.68 7.85 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 49 L 7.77 4.69 0.00 1.70 1.44 0.93 0.45 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 50 S 7.54 4.83 0.00 3.63 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 51 D 7.67 4.67 0.00 2.47 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 52 L 7.59 4.59 0.00 1.42 1.45 0.72 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.42 4.53 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 1.16 0.00 0.00 54 F 9.00 5.29 0.00 3.19 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.76 4.50 0.00 1.44 1.67 0.00 1.83 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.25 7.81 56 Q 8.91 3.93 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 57 Y 7.90 4.15 0.00 3.39 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 58 E 6.99 3.82 0.00 1.64 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 0.00 2.55 2.33 0.00 59 Y 8.37 3.34 0.00 2.83 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 60 L 7.80 3.37 0.00 2.08 1.58 0.63 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.43 4.40 0.00 3.00 3.13 0.00 0.00 6.68 8.87 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 62 D 7.80 4.21 0.00 2.56 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 6.95 3.48 0.00 0.65 0.88 0.61 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 64 F 7.19 4.37 0.00 1.51 1.63 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 65 M 7.85 4.38 0.00 2.10 2.39 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.18 2.82 0.00 66 K 7.96 4.23 0.00 1.67 1.83 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.49 7.81 67 N 7.60 5.12 0.00 2.70 2.68 0.00 0.00 6.58 7.91 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 68 P 0.00 4.25 0.00 2.19 2.24 0.00 3.86 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 69 A 7.92 4.05 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 70 I 7.59 4.12 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 1.41 0.84 0.82 0.00 0.00 71 I 8.15 4.40 1.83 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 1.48 0.85 0.88 0.00 0.00 72 G 8.47 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 0.00 0.00 0.00 73 H 9.41 3.83 0.00 2.73 3.48 0.00 5.27 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 74 E 7.58 4.04 0.00 2.00 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 2.31 1.95 0.00 75 A 7.66 4.27 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 76 R 7.89 3.83 0.00 1.34 1.02 0.00 2.69 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.37 0.00 77 Y 8.10 4.83 0.00 3.28 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.76 4.16 0.00 1.94 1.94 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.81 7.81 79 L 7.99 4.31 0.00 1.60 1.57 0.91 1.01 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 80 F 8.32 4.63 0.00 3.27 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 81 N 8.38 4.86 0.00 2.77 2.91 0.00 0.00 6.91 7.57 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 82 S 9.42 4.42 0.00 3.75 3.70 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 83 P 0.00 4.32 0.00 2.15 2.04 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.17 0.00 84 T 7.97 3.89 4.37 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 1.36 0.00 0.00 85 L 8.29 3.56 0.00 1.50 1.51 0.36 -0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.06 2.79 0.00 1.59 1.71 0.28 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 87 F 7.52 3.97 0.00 2.95 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.44 3.62 0.00 1.49 1.31 0.67 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.58 4.35 0.00 1.40 1.67 0.77 0.71 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 90 S 7.60 4.15 0.00 3.57 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.80 4.36 0.00 1.33 1.82 0.00 3.03 0.00 0.00 2.77 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.46 0.00 92 G 8.67 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 K 9.36 4.07 0.00 1.77 1.83 0.00 1.87 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 0.94 7.81 94 A 8.02 4.18 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.11 4.11 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.12 4.27 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 0.94 0.00 0.00 97 E 7.94 4.06 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 98 N 8.18 4.59 0.00 2.78 2.85 0.00 0.00 7.05 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 99 W 7.28 4.10 0.00 3.12 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 0.00 100 S 6.20 3.94 0.00 3.62 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 0.00 101 I 7.72 3.41 1.75 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 1.10 0.84 0.89 0.00 0.00 102 E 7.54 4.35 0.00 2.00 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 2.15 1.84 0.00 103 N 7.12 4.87 0.00 2.55 2.39 0.00 0.00 7.17 6.43 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 0.00 104 L 7.23 4.04 0.00 1.63 1.69 0.74 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 105 F 9.29 4.85 0.00 3.52 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 0.00 106 E 8.29 4.19 0.00 1.81 1.63 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 2.04 2.23 0.00 107 E 7.62 4.04 0.00 1.78 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.33 0.00 108 K 8.50 4.44 0.00 1.70 1.54 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.34 7.81 109 Q 8.88 4.25 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 110 N 8.09 4.53 0.00 2.64 2.80 0.00 0.00 7.07 8.90 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 0.00 111 D 7.98 4.53 0.00 2.68 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 0.00 112 T 8.82 3.84 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 1.04 0.00 0.00 113 A 7.48 4.76 1.22 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 0.00 114 D 8.55 4.66 0.00 2.72 2.93 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 0.00 115 I 8.03 4.89 1.96 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.97 1.12 0.00 0.00 116 L 9.58 4.93 0.00 1.69 1.55 0.86 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 117 L 9.29 5.55 0.00 1.90 1.83 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 118 V 7.80 4.58 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 0.61 0.00 0.00 -0.39 0.00 0.00 119 K 8.95 3.92 0.00 1.32 1.01 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.95 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.78 1.14 7.81 120 D 9.72 4.21 0.00 2.88 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 0.00 121 Q 8.29 3.94 0.00 2.32 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 122 F 8.00 5.23 0.00 3.25 3.32 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 0.00 123 Y 8.50 4.83 0.00 2.87 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 0.00 124 E 8.90 4.70 0.00 1.99 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 0.00 2.25 2.29 0.00 125 L 8.93 4.36 0.00 1.55 1.46 0.80 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.64 4.82 0.00 1.81 1.70 1.03 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.41 5.02 0.00 2.60 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 0.00 0.00 0.00 128 V 8.72 4.66 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 0.97 0.00 0.00 1.02 0.00 0.00 129 K 9.13 4.79 0.00 1.72 1.69 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.22 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.45 7.81 130 T 8.75 5.12 4.61 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 1.40 0.00 0.00 131 R 9.02 4.56 0.00 1.90 1.93 0.00 3.11 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.49 0.00 132 N 8.32 3.15 0.00 2.23 2.42 0.00 0.00 7.08 7.94 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 0.00 133 I 7.69 3.59 1.68 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.09 0.81 0.00 0.00 134 S 7.02 4.25 0.00 3.67 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 0.00 135 K 7.24 4.39 0.00 1.79 1.70 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.29 7.81 136 S 8.60 4.25 0.00 3.85 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 0.00 137 A 8.07 4.77 1.20 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 0.00 0.00 138 Q 8.40 4.15 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 139 A 8.22 3.68 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 4.61 0.00 2.04 2.18 0.00 3.49 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.91 0.00 141 N 8.47 4.36 0.00 2.57 2.97 0.00 0.00 6.75 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 0.00 142 I 8.01 4.04 1.56 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 -0.36 0.02 0.00 0.00 143 I 6.89 4.38 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.51 0.90 0.00 0.00 144 S 8.52 4.49 0.00 3.90 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 0.00 145 A 9.69 4.35 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 Y 8.09 4.13 0.00 3.15 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 0.00 147 K 8.49 3.89 0.00 1.78 1.92 0.00 1.56 0.00 0.00 1.33 0.00 0.00 2.53 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.26 7.81 148 L 8.14 3.93 0.00 1.87 1.60 0.78 0.60 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 0.00 149 A 8.19 4.05 0.60 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 0.00 0.00 150 Q 7.96 3.77 0.00 1.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.76 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 151 T 7.94 3.97 4.55 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 1.46 0.00 0.00 152 C 8.75 4.43 0.00 3.26 3.20 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 0.00 153 A 8.10 4.03 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 0.00 154 K 8.13 3.96 0.00 1.91 1.80 0.00 1.30 0.00 0.00 1.40 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.36 7.81 155 M 7.97 4.00 0.00 2.23 2.46 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.06 2.66 0.00 156 I 7.80 3.90 2.04 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.91 1.02 0.00 0.00 157 D 7.99 4.38 0.00 2.63 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 0.00 158 N 7.85 4.50 0.00 2.72 2.78 0.00 0.00 7.07 7.41 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 0.00 159 K 7.79 3.32 0.00 1.85 1.71 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.26 7.81 160 E 7.83 4.20 0.00 1.73 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 161 F 7.85 4.84 0.00 2.96 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 0.00 162 D 8.43 4.50 0.00 2.78 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 0.00 163 L 7.90 5.01 0.00 1.88 1.68 1.09 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 164 F 7.31 5.15 0.00 2.99 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 0.00 165 D 9.14 5.20 0.00 2.62 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 8.07 4.64 1.36 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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8.44 5.08 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 1.12 0.00 0.00 1.03 0.00 0.00 182 C 9.54 4.70 0.00 3.01 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 0.00 183 V 8.55 4.47 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 0.84 0.00 0.00 0.96 0.00 0.00 184 S 7.79 4.74 0.00 3.87 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 0.00 185 T 8.34 5.78 4.49 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 1.27 0.00 0.00 186 S 8.36 5.37 0.00 3.94 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 0.00 187 F 8.46 5.34 0.00 1.91 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 A 5.98 4.35 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 E 8.17 4.85 0.00 1.93 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 2.32 2.16 0.00 190 L 8.65 3.82 0.00 1.87 1.33 1.12 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 191 F 7.25 3.09 0.00 2.76 2.38 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 0.00 192 K 8.03 4.52 0.00 1.82 2.05 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.45 7.81 193 S 7.96 4.80 0.00 4.17 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 0.00 194 E 8.96 4.24 0.00 2.19 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 2.32 2.35 0.00 195 P 0.00 3.83 0.00 1.58 0.49 0.00 3.50 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.00 0.00 196 S 7.71 4.11 0.00 3.80 3.82 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 0.00 0.00 0.00 197 E 7.96 4.28 0.00 2.09 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 2.30 2.26 0.00 198 L 7.79 4.17 0.00 1.89 1.86 1.18 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 199 Y 8.81 4.56 0.00 3.13 2.93 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 0.00 200 I 7.80 3.88 1.43 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.60 -0.53 0.00 0.00 201 N 8.22 4.23 0.00 2.79 2.69 0.00 0.00 6.84 8.12 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 0.00 202 W 8.65 4.13 0.00 3.44 3.28 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 0.00 203 A 8.29 4.15 1.39 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 0.00 204 A 8.17 4.29 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 0.00 205 A 8.11 3.65 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 0.00 206 M 8.14 3.01 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.76 0.00 207 Q 7.57 4.74 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 208 I 8.36 4.89 1.96 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.17 0.99 0.00 0.00 209 Q 8.56 4.91 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 210 F 7.70 4.60 0.00 2.96 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 0.00 211 H 8.31 4.68 0.00 3.28 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.99 3.75 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 1.11 0.00 0.00 1.08 0.00 0.00 213 R 8.92 4.47 0.00 1.95 2.18 0.00 3.08 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.62 0.00 214 D 8.27 4.70 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 0.00 215 L 7.51 4.09 0.00 0.94 1.26 0.17 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 216 D 8.25 4.69 0.00 2.82 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 Q 7.91 4.79 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.08 0.00 0.00 0.00 0.00 0.00 2.39 2.25 0.00 218 G 8.32 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 0.00 0.00 0.00 219 F 8.57 4.65 0.00 3.13 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 N 8.14 4.62 0.00 2.78 2.62 0.00 0.00 6.66 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 0.00 221 G 6.79 3.70 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 0.00 0.00 0.00 222 T 8.19 4.61 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 223 R 8.49 3.93 0.00 1.75 1.70 0.00 2.21 0.00 0.00 2.73 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.57 0.00 224 E 7.50 3.42 0.00 2.01 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 2.31 1.95 0.00 225 E 8.06 4.26 0.00 1.99 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 2.24 2.18 0.00 226 W 8.90 4.08 0.00 3.12 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 A 8.53 4.38 1.59 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 0.00 0.00 228 K 8.11 4.01 0.00 2.02 1.93 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.68 1.68 7.81 229 S 8.70 4.08 0.00 3.74 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 Y 7.89 3.79 0.00 2.37 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 0.00 231 L 8.23 4.13 0.00 1.98 1.80 1.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 232 K 7.97 4.01 0.00 1.80 1.82 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.32 7.81 233 H 8.31 4.43 0.00 3.09 3.26 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 0.00 234 F 8.38 3.76 0.00 2.50 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 0.00 235 V 8.16 3.51 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.16 0.00 0.00 236 T 7.59 3.81 4.39 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 1.21 0.00 0.00 237 Q 8.04 4.17 0.00 2.31 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.51 2.39 0.00 238 A 7.67 2.82 1.02 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 0.00 0.00 239 E 8.16 3.80 0.00 2.13 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 240 Q 8.29 3.92 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 241 R 7.83 3.80 0.00 1.10 1.13 0.00 3.02 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.23 0.00 242 A 7.44 3.82 1.22 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 0.00 243 I 7.80 3.76 1.97 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 1.47 1.04 0.87 0.00 0.00 244 S 8.63 4.70 0.00 3.87 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 0.00 245 M 8.18 4.18 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.66 0.00 246 I 7.60 3.79 1.95 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 1.53 0.53 0.92 0.00 0.00 247 D 8.05 4.34 0.00 2.69 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 0.00 248 K 7.50 3.95 0.00 1.36 0.79 0.00 1.55 0.00 0.00 1.32 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.68 1.19 7.81 249 F 7.85 5.13 0.00 3.21 2.98 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 0.00 250 V 8.12 4.16 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 1.18 0.00 0.00 1.02 0.00 0.00 251 K 8.32 3.98 0.00 1.80 1.85 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.40 7.81 252 P 0.00 4.39 0.00 1.73 1.88 0.00 3.67 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.11 0.00 253 F 8.57 5.03 0.00 3.21 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 0.00 254 K 7.98 3.41 0.00 2.18 1.88 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.55 7.81 255 K 8.01 4.11 0.00 1.90 1.72 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.10 7.81 256 Y 8.77 4.68 0.00 3.07 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 0.00 257 I 7.69 4.22 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.73 1.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.