NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 I 4.8438 7.7832 120.9039 62.2355 39.2270 179.3109 7 W 4.0723 8.9126 121.4123 57.3541 29.6558 172.9246 8 V 3.7705 8.5467 117.5646 64.4170 31.6827 177.2544 9 E 4.1736 8.2058 119.7301 58.5742 29.7467 177.8012 10 K 3.6046 8.0696 117.6917 58.4200 32.3937 175.9666 11 Y 4.4710 7.3376 113.2063 57.7667 39.7999 175.0588 12 R 3.7492 8.8036 121.7654 56.1501 30.3088 174.6366 13 P 4.3934 0.0000 0.0000 63.1923 31.7900 176.3985 14 R 4.2353 8.3309 119.2843 56.5685 31.3430 176.3572 15 T 4.5887 7.2424 111.3736 60.0811 70.8748 173.7477 16 L 3.8389 8.6725 127.5760 58.2973 41.8613 179.5717 17 D 4.3829 8.1766 115.9838 57.6143 40.7356 178.1037 18 E 4.1197 8.3989 116.6772 57.5346 29.9173 176.9737 19 V 3.8077 7.4075 119.7127 62.0532 31.9650 175.4048 20 V 4.3625 8.0970 125.4409 60.7141 34.0444 176.6464 21 G 4.0861 8.8199 107.1981 46.1770 0.0000 174.0513 22 Q 4.5005 7.2998 117.1440 55.9401 29.3835 177.5577 23 D 3.9044 8.3819 116.6117 57.4497 40.7424 182.6142 24 E 3.0745 6.5924 117.2869 57.3732 33.2175 178.7357 25 V 3.7831 7.7228 118.0130 65.4918 31.9780 178.3508 26 I 3.5306 7.5006 118.6637 64.9158 36.7448 178.1487 27 Q 3.9176 8.1252 119.1671 58.7809 28.4419 179.4500 28 R 4.4438 7.8910 113.2680 56.6215 30.0037 177.2086 29 L 4.4802 7.5476 120.6428 56.5889 42.3548 178.2056 30 K 4.0240 8.6753 119.3510 59.6771 32.1217 179.0174 31 G 3.7465 7.5645 100.9261 46.7043 0.0000 173.2970 32 Y 4.5406 7.8650 116.3946 57.9479 39.0825 177.7895 33 V 4.1614 8.2354 113.8648 63.0029 32.6374 178.3681 34 E 3.9276 8.2314 119.1847 59.3663 29.4784 179.0503 35 R 4.0189 7.9723 115.5864 56.4235 30.7598 176.3016 36 K 4.2029 7.2520 115.7629 57.6281 30.0533 174.8409 37 N 4.7521 7.7731 113.2705 51.6352 40.5038 175.5732 38 I 4.6220 8.2218 122.4442 59.1835 39.8945 173.4290 39 P 4.6780 0.0000 0.0000 61.6009 32.7768 175.4986 40 H 4.4231 8.7327 115.8047 56.6311 29.6140 174.8915 41 L 4.8623 8.9163 124.0123 54.0981 43.5766 175.9264 42 L 5.0647 9.1129 125.1334 53.5458 44.3656 174.9131 43 F 5.9369 9.6984 127.7584 56.6024 40.6813 175.1615 44 S 5.7258 9.5936 118.9682 54.9223 65.2602 173.4033 45 G 4.4066 8.0262 111.1503 45.1922 0.0000 170.0419 46 P 4.4473 0.0000 0.0000 62.0893 31.4502 173.9068 47 P 4.5058 0.0000 0.0000 63.1036 32.6200 175.3150 48 G 3.9044 8.6499 104.9546 47.8374 0.0000 175.2206 49 T 4.5237 8.5876 115.3568 62.5767 71.1801 174.1673 50 G 3.5430 8.5095 110.7336 45.2733 0.0000 175.4792 51 K 3.0986 7.2815 120.5578 58.2464 31.7432 178.6531 52 T 3.3426 8.0420 115.1406 67.0170 68.7002 176.0577 53 A 3.8322 7.7815 121.9550 55.5213 18.5190 179.7466 54 T 3.7543 8.4512 108.1796 64.4849 68.7414 176.1729 55 A 4.2971 8.3811 122.4524 54.1479 18.6621 178.8150 56 I 3.1651 7.2945 118.8297 63.1346 37.5724 177.7450 57 A 3.7783 8.0743 122.0529 54.5124 16.7964 179.1985 58 L 3.8427 7.9481 119.0920 57.6365 41.9011 178.5619 59 A 3.6617 7.3327 120.0032 54.3658 18.1339 179.2563 60 R 3.0884 7.6227 117.9035 58.9317 29.8848 177.9069 61 D 4.3541 7.5016 116.5086 55.7947 40.9654 177.4176 62 L 4.4613 6.7524 115.6574 54.7368 42.9993 177.3611 63 F 5.2137 7.4119 115.7436 55.9625 40.2137 176.6713 64 G 4.0273 8.4208 108.6887 45.0719 0.0000 173.3643 65 E 4.7446 8.8611 123.4407 55.5314 32.1426 175.7010 66 N 4.9833 7.9548 115.3602 53.2892 39.5546 177.2701 67 W 4.7283 8.3867 117.0206 60.2100 28.4748 177.2184 68 R 3.8541 6.7805 118.0831 58.9416 29.3891 178.0667 69 D 4.4462 7.9320 117.0736 56.7655 40.8868 177.4644 70 N 4.9222 8.2636 115.5209 54.1734 39.9036 175.4250 71 F 4.7139 8.0185 121.1491 58.1394 40.4105 173.9378 72 I 4.3940 7.3805 125.3695 59.3962 41.0403 173.6009 73 E 5.0129 8.6066 128.2418 55.4081 30.8000 174.9623 74 M 4.9209 8.7232 122.9267 53.6232 35.3734 173.2970 75 N 5.0522 8.6644 118.9361 52.9137 39.8387 175.6446 76 A 3.9335 9.1246 130.1935 54.0389 18.8763 178.3020 77 S 4.2814 8.2700 109.9005 60.1329 64.2267 175.0717 78 D 4.6781 7.8699 123.1496 53.7933 38.8544 176.5481 79 E 3.8350 7.5675 120.2662 58.6515 30.5284 179.1905 80 R 4.5459 7.8023 114.0252 55.6495 29.7100 176.7896 81 G 4.0918 7.7557 104.9281 45.2874 0.0000 174.8683 82 I 3.6125 8.0450 119.9584 64.0544 37.9233 176.3427 83 D 4.6531 7.9724 117.2787 55.2440 41.2630 177.5156 84 V 3.9226 7.6161 117.3068 62.4713 32.7441 176.6052 85 V 4.3366 7.7402 121.3513 62.1681 30.8361 175.0762 86 R 4.5137 7.4966 121.0184 57.4065 32.7231 176.6483 87 H 4.3782 8.1314 116.1749 58.1049 30.0050 176.4443 88 K 4.1450 8.0046 120.6340 58.9611 31.7534 178.2111 89 I 4.0252 7.8018 119.9370 63.3856 36.9590 177.8069 90 K 4.1642 7.8230 118.6972 58.3555 32.4278 178.4377 91 E 3.8953 7.6796 118.4096 59.1398 29.3394 178.6564 92 F 4.1704 7.6785 118.3570 61.0681 39.5387 176.6010 93 A 3.7047 7.3138 117.8597 53.9107 18.3507 178.8726 94 R 4.1376 7.4286 116.6491 57.1330 30.3962 176.4177 95 T 4.0599 6.9297 109.6131 60.4660 69.4694 174.2685 96 A 3.9914 8.3457 129.9188 50.6149 19.1349 174.4869 97 P 3.9179 0.0000 0.0000 62.6675 31.4387 176.3455 98 I 3.6766 8.0369 125.2025 61.6064 36.6238 173.3651 99 G 3.6155 8.1163 119.6771 43.0925 0.0000 173.0425 100 G 4.2866 7.2811 111.8075 44.3343 0.0000 172.3947 101 A 4.8628 8.0464 122.6553 49.8786 20.7780 175.9927 102 P 4.5366 0.0000 0.0000 64.1506 32.1143 175.5526 103 F 5.4097 8.9316 111.9055 55.0195 41.3973 174.0601 104 K 4.9216 9.0440 116.7738 55.1721 36.9006 175.6240 105 I 5.2729 9.0341 121.0167 59.8531 41.6588 174.5804 106 I 4.3508 8.8381 126.0837 59.4122 40.8918 174.1119 107 F 5.1882 8.4547 129.1062 56.7852 42.0174 174.5105 108 L 4.8531 7.3747 126.3607 53.0728 43.6423 174.4514 109 D 4.2692 8.6093 125.0398 54.2153 42.7391 175.7139 110 E 3.8416 8.6446 121.5131 57.2425 27.0625 175.5000 111 A 4.1132 7.7665 124.0156 55.5936 18.3292 182.0335 112 D 4.8133 7.9280 114.0082 53.6402 38.6702 176.5426 113 A 4.6169 8.6347 122.6269 52.8789 20.7737 177.2599 114 L 4.5589 7.6225 115.3149 53.3360 43.4691 176.3852 115 T 4.3234 8.3527 110.6346 61.0709 70.4601 176.6005 116 A 3.8237 8.1331 125.6432 55.2597 19.3022 179.4921 117 D 4.3789 7.9724 115.8411 57.6270 40.3597 178.8331 118 A 4.0153 8.0009 120.5174 55.3987 17.7712 179.4270 119 Q 3.8672 7.7341 114.9903 59.0484 28.6616 178.8479 120 A 3.9452 8.0386 121.4546 55.1938 18.2570 179.4162 121 A 3.3949 7.4195 116.8745 54.6530 18.1742 179.1276 122 L 3.7460 7.3837 118.3797 58.3360 41.9591 179.1379 123 R 3.9189 8.8024 119.4996 58.7173 29.6772 176.9799 124 R 4.5440 7.7369 116.5331 55.9091 32.0053 177.1016 125 T 4.4851 7.6119 104.9963 62.2010 72.0250 175.3127 126 M 4.3608 7.5556 122.8852 58.6019 32.3488 177.6906 127 E 4.1531 7.9510 117.9512 58.6641 30.1897 177.9318 128 M 4.0401 7.8484 117.6367 57.1458 33.3313 175.6063 129 Y 5.0319 7.6367 115.5311 56.0511 38.0965 175.5485 130 S 5.0083 8.1689 112.0770 57.9708 64.8736 175.6628 131 K 4.5642 8.0703 119.7393 56.3877 32.3553 175.7756 132 S 4.8942 7.9610 114.2433 59.5346 70.0800 174.0664 133 C 5.1829 7.6613 116.6345 57.7927 30.5013 173.0736 134 R 4.7667 8.6027 118.0384 55.1740 34.8544 174.1545 135 F 5.3824 9.1654 120.3986 55.8620 42.5365 174.5282 136 I 4.7965 9.0489 123.5060 59.6773 39.8157 174.4228 137 L 4.6326 9.0115 128.4807 53.1709 43.6091 175.5881 138 S 5.4631 8.1927 119.1778 56.7066 64.8240 172.5019 139 C 4.9934 8.9945 120.5980 56.8810 33.1229 174.4317 140 N 4.3203 9.1284 120.1663 56.1281 39.6231 174.5387 141 Y 5.1920 7.5176 113.0426 56.2789 42.6022 176.4195 142 V 3.7102 8.7110 122.9340 64.6804 32.0304 178.1856 143 S 4.0273 8.2421 114.0927 60.8057 62.0379 174.4829 144 R 4.3820 7.7356 118.1753 55.8630 29.7565 175.3167 145 I 4.4363 7.6254 118.0525 59.1294 39.0641 175.6068 146 I 3.7499 7.9911 118.3978 60.8683 38.1264 176.2381 147 E 3.8576 9.1432 124.1757 59.5409 29.1388 177.7758 148 P 4.1412 0.0000 0.0000 64.8541 31.7063 177.2723 149 I 4.1635 7.6585 117.9993 63.3595 38.1067 177.5672 150 Q 3.9354 8.1136 118.2592 59.2972 28.1549 178.9501 151 S 4.1000 7.9646 113.2849 60.9893 63.0043 176.4304 152 R 4.6429 7.9444 119.7058 55.6633 30.0505 176.6028 153 C 5.7059 7.9702 113.7760 57.3895 32.6919 175.3865 154 A 4.2036 8.7484 124.8890 51.7730 19.5175 176.2297 155 V 4.6442 7.7336 120.3371 60.9618 34.6543 174.8689 156 F 4.8992 9.5668 125.3399 56.0227 42.7438 174.1815 157 R 5.1742 8.8749 123.8714 54.7600 30.5626 176.2074 158 F 4.2465 10.0181 124.7974 57.2560 40.0152 175.3023 159 K 4.8054 8.3912 122.7476 53.3494 34.4682 174.5380 160 P 4.2459 0.0000 0.0000 62.8513 31.3912 176.3974 161 V 3.6747 8.2793 123.1703 60.5000 31.6168 174.2755 162 P 4.2803 0.0000 0.0000 62.1335 31.4479 176.2478 163 K 3.8836 8.1141 118.8359 59.8044 31.8124 178.0524 164 E 3.9419 8.0783 117.4570 59.6372 29.4189 179.3776 165 A 4.1622 8.0313 119.9897 55.0497 18.4088 179.0007 166 M 4.1622 7.5802 116.2754 58.1678 32.5987 178.0892 167 K 3.9317 8.4785 120.5255 59.3008 32.2668 178.8997 168 K 3.9695 8.6977 119.3538 60.1507 32.4994 179.1778 169 R 4.0568 7.6094 117.9698 57.8487 30.2275 178.0711 170 L 4.1994 7.9936 119.2456 57.8538 41.7120 178.8677 171 L 3.9323 7.7350 118.3990 58.0497 41.6983 179.1536 172 E 3.8647 8.0507 118.2706 59.9705 29.2716 179.9049 173 I 2.8651 7.0929 117.1477 63.9668 36.9900 176.9697 174 C 4.2565 8.6011 118.5524 60.5381 28.1433 175.8336 175 E 3.8047 7.5078 120.4491 59.5981 30.0998 179.6257 176 K 4.5087 7.5878 114.0289 56.8554 31.4730 177.9095 177 E 4.4139 9.7187 114.5918 55.8671 33.0736 175.5166 178 G 4.0291 7.7842 106.8871 46.9787 0.0000 173.9574 179 V 4.4518 7.4511 114.8938 60.9140 35.0340 175.1127 180 K 4.4840 8.3743 125.9524 55.0948 32.4158 175.7548 181 I 4.5793 8.1432 125.4761 60.9148 39.0006 175.1915 182 T 4.4548 7.9857 114.1747 60.5235 71.5611 175.5138 183 E 3.9039 8.8750 119.7389 59.7991 29.3299 178.8604 184 D 4.5147 8.2415 118.7064 57.7805 40.8318 179.7207 185 G 3.4775 7.9622 105.4215 47.3780 0.0000 175.5278 186 L 3.9291 7.5060 121.4997 58.1640 42.6497 178.2873 187 E 4.0890 8.2567 118.2242 59.4943 29.3500 179.5132 188 A 3.9587 8.2299 120.7877 54.9932 18.2169 179.4317 189 L 4.0949 7.6679 113.9983 56.5347 42.4890 177.3893 190 I 4.9592 8.7686 117.9559 60.8498 40.2575 176.4670 191 Y 4.0476 8.0032 119.7592 61.2710 38.2139 178.2312 192 I 3.8476 8.0314 119.5410 64.8652 37.4518 178.0991 193 S 4.2690 8.0484 113.7583 59.3235 62.5414 175.4265 194 G 3.8995 8.6725 107.4218 45.9987 0.0000 173.5790 195 G 3.6560 8.6701 105.7538 46.0342 0.0000 174.3305 196 D 4.6991 8.1199 118.8249 51.1361 43.7465 174.2674 197 F 4.2113 8.8819 126.8388 60.8204 39.1785 177.3750 198 R 4.0149 8.3338 117.6335 59.7708 29.6459 177.9896 199 K 3.9720 8.6498 118.8059 59.3475 32.1407 178.6415 200 A 3.9766 7.8954 120.6359 55.6581 18.4152 179.1081 201 I 3.7517 8.7738 118.7465 64.7645 37.0662 178.3339 202 N 4.1020 8.4060 115.9850 56.5317 38.5387 177.3705 203 A 3.9096 7.7983 121.7614 55.0674 18.5767 178.9570 204 L 3.7238 8.1721 118.8724 59.1024 42.0342 179.4525 205 Q 2.5200 7.9145 119.1353 58.6104 29.0966 179.8490 206 G 3.4610 7.3821 105.2056 47.2226 0.0000 174.9220 207 A 4.1712 7.7490 122.4752 54.2242 18.4779 179.4934 208 A 3.9354 7.7919 119.2898 54.9671 18.4431 178.9523 209 A 4.0081 7.6704 118.6441 57.3083 18.8463 178.6930 210 I 3.9150 7.3311 117.0568 61.1086 38.2953 176.5923 211 G 3.8482 8.5356 113.2739 45.9109 0.0000 174.7699 212 E 3.5469 8.3703 130.0946 56.0935 27.5736 176.3958 213 V 3.6728 8.5043 125.8382 63.8302 31.9125 176.0418 214 V 4.1230 9.0868 125.1707 61.4903 32.4457 174.5463 215 D 4.9715 8.2931 127.1249 52.9282 43.2324 176.9168 216 A 3.8059 8.7882 122.7150 55.5515 18.0005 179.5775 217 D 4.3906 8.0024 116.3498 57.9087 41.0557 178.8884 218 T 3.8399 8.0220 109.6073 64.9713 67.9567 176.1255 219 I 3.6364 7.3487 122.5317 64.6063 37.2325 177.6666 220 Y 4.3773 7.2870 117.0052 61.2347 37.5700 178.9898 221 Q 4.0780 8.5338 120.6892 59.4707 29.1570 178.2794 222 I 3.9781 7.5375 119.0224 63.6021 37.1822 177.4862 223 T 4.4958 7.5809 108.1382 59.7577 69.8572 172.9554 224 A 3.7591 8.4054 127.4898 52.7163 15.9475 175.9852 225 T 4.1487 7.8136 107.2528 60.6189 72.0263 174.2941 226 A 3.0455 8.0612 128.6730 51.6317 19.0797 177.2943 227 R 2.9729 8.2584 121.1089 55.9803 30.5745 176.1268 228 P 4.1165 0.0000 0.0000 65.2976 31.0757 178.5214 229 E 3.9384 7.9768 117.3083 59.3387 29.3628 178.9627 230 E 4.0770 7.9740 118.3799 60.0185 29.6211 178.7000 231 M 3.9407 8.1427 117.9893 59.3586 31.8163 178.4249 232 T 4.1622 7.9236 107.8603 63.2621 69.0830 175.7880 233 E 3.9433 7.8790 123.3849 58.8872 29.9521 178.1062 234 L 4.0119 8.2538 120.3708 59.0666 40.6674 179.3815 235 I 3.8268 8.4072 121.1078 63.6145 36.9170 178.2180 236 Q 3.9503 7.6032 120.7519 59.2731 28.7782 177.9613 237 T 4.0043 8.4731 110.4781 63.8754 68.3630 176.0488 238 A 4.0552 7.9478 124.4305 55.3473 18.4066 179.6143 239 L 4.2813 7.3989 117.0226 57.2035 41.6891 179.6082 240 K 4.2054 7.9159 118.2458 58.7040 32.0835 176.6963 241 G 3.4159 7.1565 109.7686 45.7109 0.0000 174.4946 242 N 4.7419 7.7641 121.1603 51.8017 34.8414 175.0299 243 F 4.1362 8.1102 127.2076 62.1180 40.0132 176.1376 244 M 3.7153 8.0744 117.3159 58.0057 31.7471 178.3179 245 E 3.8087 8.0013 118.7820 59.2710 29.9680 178.3599 246 A 3.9487 8.0166 120.9841 55.3224 18.4380 179.6005 247 R 3.6472 7.6782 116.9839 59.2836 30.0570 178.4239 248 E 3.8847 8.0311 118.3980 59.6935 29.5083 179.1025 249 L 3.9369 7.8457 118.6954 57.7015 41.6390 179.0209 250 L 3.9924 8.2038 120.0084 58.8468 41.9339 178.8960 251 D 4.3350 8.0770 118.2877 57.4104 40.8392 178.5916 252 R 3.8904 8.1859 118.2895 59.6987 29.6879 178.9274 253 L 4.1785 8.3696 120.1807 58.1702 42.1402 178.4637 254 M 3.9741 8.3523 117.9829 56.9385 32.2206 178.5721 255 V 3.8408 7.6249 112.7682 63.5332 32.1505 177.7828 256 E 3.6921 7.9989 118.4206 58.9325 29.5040 177.3705 257 Y 4.5808 7.2627 112.6528 56.6023 40.6994 175.1765 258 G 4.1526 7.6563 105.5829 45.2683 0.0000 173.5248 259 M 4.4133 7.6777 116.7988 54.1472 34.0463 178.6311 260 S 4.5534 8.4687 116.1277 58.1656 65.6758 174.7445 261 G 3.5574 8.4716 106.7745 48.2696 0.0000 175.2038 262 E 3.8893 8.2422 121.0672 59.4087 29.4390 178.8634 263 D 4.4246 8.5975 118.6218 57.8468 41.0608 179.4904 264 I 3.7210 7.6178 119.4586 64.4761 37.1838 178.9319 265 V 3.7361 8.3260 120.0259 65.2976 30.9119 177.2742 266 A 4.0856 8.6259 122.3422 54.6279 18.1213 179.1372 267 Q 4.0635 8.4348 114.7686 58.6258 28.8652 179.5388 268 L 4.0264 8.2092 119.7327 58.7724 42.0232 178.4899 269 F 4.0948 8.7455 118.3131 61.5603 38.9220 177.5180 270 R 3.5674 8.2634 116.7315 59.5023 30.5203 178.4059 271 E 4.1314 8.1280 116.4065 58.3372 29.6765 178.7468 272 I 3.9975 8.1285 119.9938 63.6868 37.0259 177.8711 273 I 3.8899 7.2751 120.3902 63.6311 36.9844 177.2542 274 S 4.4609 7.7820 113.9472 58.9286 63.0540 174.5260 275 M 4.3865 7.3718 119.2265 54.7309 32.3227 174.1804 276 P 4.7176 0.0000 0.0000 63.0103 32.1781 175.8499 277 I 4.1865 7.4674 118.6493 60.2481 39.5346 174.8568 278 K 4.0600 8.2999 121.9337 56.4815 32.1707 178.1273 279 D 4.4911 8.7451 122.5600 56.6656 40.8298 178.5011 280 S 4.3365 7.7989 113.0094 60.3539 63.0900 174.9216 281 L 4.3381 7.7333 122.1724 57.7458 42.2362 178.2180 282 K 3.9343 7.9266 119.5996 59.9726 31.9092 178.0772 283 V 3.5939 7.8600 118.0028 65.6225 31.6886 177.4649 284 Q 4.0294 8.0108 117.0918 59.2133 28.6279 179.4352 285 L 3.9894 7.8821 119.3842 58.2582 41.7575 179.9231 286 I 3.8617 8.0725 119.4930 64.2325 36.8220 177.6940 287 D 4.3756 8.6889 118.8916 57.5839 41.2427 178.5413 288 K 4.0757 7.8690 118.1179 59.5937 32.0944 179.1686 289 L 3.8779 8.6589 119.7591 58.0048 41.2587 179.9344 290 G 3.6051 7.9989 104.5677 47.3034 0.0000 175.1604 291 E 4.1916 8.6798 122.5260 58.9076 29.7786 178.5925 292 V 3.5433 7.8033 117.5553 66.5098 31.5092 177.5465 293 D 4.3610 7.9908 116.3213 57.7795 41.2380 177.3415 294 F 4.5980 8.7818 121.8033 61.2931 39.4838 178.1787 295 R 3.0711 7.4512 112.9640 57.0113 30.5964 178.0926 296 L 3.9091 8.3776 119.2681 58.7052 41.9530 180.1816 297 T 3.9594 8.0652 108.2019 64.4187 68.9578 176.0316 298 E 4.0619 7.5572 119.4833 57.0667 29.3077 177.6040 299 G 3.7493 7.8890 107.2122 45.6187 0.0000 174.1997 300 A 4.1473 7.5074 122.6330 51.2108 19.9168 177.0014 301 N 4.6641 8.4816 115.5308 52.7263 39.9119 174.9821 302 E 3.8167 8.8412 128.6535 60.1256 29.8261 178.7419 303 R 3.9422 7.9797 117.6573 59.3365 30.1807 178.6399 304 I 3.8201 7.5052 118.9631 64.3893 37.2775 177.8775 305 Q 4.0865 8.0648 117.6049 59.3772 28.8654 178.8752 306 L 4.1651 8.1042 119.6968 57.9402 41.6882 178.9848 307 D 4.5909 8.3084 117.7347 57.8666 40.8293 179.1672 308 A 4.1718 8.6893 121.2065 55.0021 18.1485 178.6309 309 Y 4.4386 8.6223 118.0654 60.0112 38.8797 177.5623 310 L 4.1691 8.1581 118.7625 57.2436 42.0104 178.6809 311 A 4.0250 8.5836 122.8467 54.7369 18.2632 178.8105 312 Y 4.1523 7.4151 115.2563 61.7086 37.6835 179.4886 313 L 3.9910 7.7665 118.9698 56.8463 41.3483 178.6755 314 S 4.7309 8.1324 113.3679 58.9226 63.5100 176.2556 315 T 3.9890 7.9405 114.9245 64.9142 68.4943 176.6698 316 L 4.3670 7.6421 116.8212 54.8758 41.2790 177.8374 317 A 4.2819 8.1785 123.9420 55.0365 18.5854 180.4728 318 K 4.4843 7.7425 114.6234 56.2285 32.7515 177.1787 *319 K 4.1215 7.9379 124.2851 54.8998 32.3269 177.6927 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 6 I 7.78 4.84 1.97 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 1.49 1.01 1.00 0.00 0.00 7 W 8.91 4.07 0.00 3.62 3.57 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 8 V 8.55 3.77 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 0.95 0.00 0.00 1.00 0.00 0.00 9 E 8.21 4.17 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 10 K 8.07 3.60 0.00 1.71 1.83 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 1.06 7.81 11 Y 7.34 4.47 0.00 2.97 2.82 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 12 R 8.80 3.75 0.00 1.94 1.80 0.00 3.28 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 13 P 0.00 4.39 0.00 1.95 1.96 0.00 3.59 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 1.92 1.99 0.00 14 R 8.33 4.24 0.00 1.71 1.84 0.00 3.26 0.00 0.00 3.07 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 15 T 7.24 4.59 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 1.13 0.00 0.00 16 L 8.67 3.84 0.00 1.83 1.66 0.81 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.18 4.38 0.00 2.59 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.40 4.12 0.00 2.01 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 2.28 2.18 0.00 19 V 7.41 3.81 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 0.76 0.00 0.00 0.84 0.00 0.00 20 V 8.10 4.36 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 0.91 0.00 0.00 0.95 0.00 0.00 21 G 8.82 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 22 Q 7.30 4.50 0.00 1.92 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.53 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 23 D 8.38 3.90 0.00 2.67 2.82 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 24 E 6.59 3.07 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 25 V 7.72 3.78 1.55 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 0.41 0.00 0.00 0.47 0.00 0.00 26 I 7.50 3.53 1.76 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.14 0.87 0.00 0.00 27 Q 8.13 3.92 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 28 R 7.89 4.44 0.00 2.09 2.12 0.00 3.39 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.98 0.00 29 L 7.55 4.48 0.00 1.72 1.72 0.26 0.44 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 30 K 8.68 4.02 0.00 2.08 1.84 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.36 7.81 31 G 7.56 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.86 4.54 0.00 3.29 3.19 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 33 V 8.24 4.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.99 0.00 0.00 34 E 8.23 3.93 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 35 R 7.97 4.02 0.00 1.78 1.95 0.00 3.25 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 36 K 7.25 4.20 0.00 2.01 2.08 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.69 7.81 37 N 7.77 4.75 0.00 2.82 2.91 0.00 0.00 6.58 7.33 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 38 I 8.22 4.62 2.38 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 1.86 0.96 1.01 0.00 0.00 39 P 0.00 4.68 0.00 2.28 2.19 0.00 3.71 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.24 0.00 40 H 8.73 4.42 0.00 3.38 3.52 0.00 5.61 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.92 4.86 0.00 1.45 1.16 1.01 0.04 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 42 L 9.11 5.06 0.00 1.70 1.59 0.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 43 F 9.70 5.94 0.00 3.05 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 44 S 9.59 5.73 0.00 3.91 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 45 G 8.03 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.45 0.00 2.19 2.12 0.00 4.04 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 47 P 0.00 4.51 0.00 2.20 2.06 0.00 3.84 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.93 0.00 48 G 8.65 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 49 T 8.59 4.52 4.45 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 1.36 0.00 0.00 50 G 8.51 3.54 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 0.00 51 K 7.28 3.10 0.00 1.72 1.81 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.15 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 0.53 7.81 52 T 8.04 3.34 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 1.13 0.00 0.00 53 A 7.78 3.83 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 54 T 8.45 3.75 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 55 A 8.38 4.30 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 56 I 7.29 3.17 1.69 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.36 0.19 0.00 0.00 57 A 8.07 3.78 1.17 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 0.00 0.00 58 L 7.95 3.84 0.00 1.81 1.64 0.83 1.16 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 59 A 7.33 3.66 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 60 R 7.62 3.09 0.00 0.89 1.36 0.00 2.21 0.00 0.00 2.76 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.50 0.00 61 D 7.50 4.35 0.00 2.65 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 62 L 6.75 4.46 0.00 0.77 1.27 0.71 0.84 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 63 F 7.41 5.21 0.00 3.16 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 64 G 8.42 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.86 4.74 0.00 1.95 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 2.19 2.36 0.00 66 N 7.95 4.98 0.00 2.75 2.74 0.00 0.00 6.99 8.55 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 67 W 8.39 4.73 0.00 3.76 3.65 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 68 R 6.78 3.85 0.00 1.25 1.76 0.00 2.55 0.00 0.00 2.67 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.50 0.00 69 D 7.93 4.45 0.00 2.59 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 70 N 8.26 4.92 0.00 2.73 3.21 0.00 0.00 7.00 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.02 4.71 0.00 3.33 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 72 I 7.38 4.39 1.54 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 1.13 0.72 0.73 0.00 0.00 73 E 8.61 5.01 0.00 2.12 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 2.40 2.78 0.00 74 M 8.72 4.92 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 75 N 8.66 5.05 0.00 2.81 2.74 0.00 0.00 6.88 8.15 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 76 A 9.12 3.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.27 4.28 0.00 3.98 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 78 D 7.87 4.68 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 79 E 7.57 3.83 0.00 2.09 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 2.28 2.41 0.00 80 R 7.80 4.55 0.00 1.97 2.04 0.00 3.00 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 81 G 7.76 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 82 I 8.05 3.61 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.10 0.94 0.00 0.00 83 D 7.97 4.65 0.00 2.71 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 84 V 7.62 3.92 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 0.73 0.00 0.00 0.93 0.00 0.00 85 V 7.74 4.34 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 0.74 0.00 0.00 0.95 0.00 0.00 86 R 7.50 4.51 0.00 1.91 2.04 0.00 3.28 0.00 0.00 3.33 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 87 H 8.13 4.38 0.00 3.30 3.31 0.00 5.91 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.00 4.14 0.00 1.87 1.74 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.35 1.39 7.81 89 I 7.80 4.03 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.37 1.05 0.00 0.00 90 K 7.82 4.16 0.00 1.74 1.84 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.59 1.69 7.81 91 E 7.68 3.90 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 92 F 7.68 4.17 0.00 2.98 3.06 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 93 A 7.31 3.70 0.50 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 R 7.43 4.14 0.00 1.90 1.91 0.00 3.26 0.00 0.00 3.27 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 95 T 6.93 4.06 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 1.29 0.00 0.00 96 A 8.35 3.99 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 97 P 0.00 3.92 0.00 2.20 1.85 0.00 3.64 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.06 0.00 98 I 8.04 3.68 1.81 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 1.30 0.38 0.88 0.00 0.00 99 G 8.12 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.28 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.05 4.86 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.54 0.00 2.15 2.20 0.00 3.95 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.07 0.00 103 F 8.93 5.41 0.00 3.07 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 9.04 4.92 0.00 1.25 1.07 0.00 1.06 0.00 0.00 0.61 0.00 0.00 2.66 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.02 1.11 7.81 105 I 9.03 5.27 2.21 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.49 1.18 0.00 0.00 106 I 8.84 4.35 1.30 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.10 0.86 0.00 0.00 107 F 8.45 5.19 0.00 3.05 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 0.00 108 L 7.37 4.85 0.00 1.65 1.24 0.95 1.12 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 0.00 109 D 8.61 4.27 0.00 2.86 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.64 3.84 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 111 A 7.77 4.11 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 7.93 4.81 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.63 4.62 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.62 4.56 0.00 1.61 1.57 0.87 0.92 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 0.00 115 T 8.35 4.32 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 1.21 0.00 0.00 116 A 8.13 3.82 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 0.00 117 D 7.97 4.38 0.00 2.73 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 0.00 118 A 8.00 4.02 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 0.00 119 Q 7.73 3.87 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 120 A 8.04 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.42 3.39 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 0.00 122 L 7.38 3.75 0.00 1.76 1.46 0.38 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.80 3.92 0.00 1.83 1.93 0.00 3.09 0.00 0.00 3.14 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 124 R 7.74 4.54 0.00 1.81 1.90 0.00 3.25 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 1.56 1.65 0.00 125 T 7.61 4.49 4.80 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 1.53 0.00 0.00 126 M 7.56 4.36 0.00 2.02 2.26 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.37 0.00 127 E 7.95 4.15 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 128 M 7.85 4.04 0.00 1.23 1.80 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 2.26 1.83 0.00 129 Y 7.64 5.03 0.00 3.37 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 0.00 130 S 8.17 5.01 0.00 4.03 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.07 4.56 0.00 1.82 1.90 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.43 7.81 132 S 7.96 4.89 0.00 3.76 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 C 7.66 5.18 0.00 3.22 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 0.00 134 R 8.60 4.77 0.00 2.10 1.82 0.00 3.31 0.00 0.00 3.57 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.60 0.00 135 F 9.17 5.38 0.00 3.16 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 0.00 136 I 9.05 4.80 2.12 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 1.12 0.78 0.43 0.00 0.00 137 L 9.01 4.63 0.00 1.49 1.50 0.82 0.43 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 0.00 138 S 8.19 5.46 0.00 3.97 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 C 8.99 4.99 0.00 2.97 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 0.00 140 N 9.13 4.32 0.00 2.67 2.34 0.00 0.00 6.86 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 7.52 5.19 0.00 3.03 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 0.00 142 V 8.71 3.71 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 0.83 0.00 0.00 0.97 0.00 0.00 143 S 8.24 4.03 0.00 3.83 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 0.00 144 R 7.74 4.38 0.00 1.86 1.96 0.00 3.35 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 145 I 7.63 4.44 2.00 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 1.34 0.79 0.89 0.00 0.00 146 I 7.99 3.75 1.86 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 1.40 0.70 0.90 0.00 0.00 147 E 9.14 3.86 0.00 2.01 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 2.39 2.38 0.00 148 P 0.00 4.14 0.00 2.02 2.12 0.00 3.60 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 2.02 2.20 0.00 149 I 7.66 4.16 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.61 0.83 0.00 0.00 150 Q 8.11 3.94 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 151 S 7.96 4.10 0.00 4.14 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 R 7.94 4.64 0.00 1.82 1.91 0.00 3.18 0.00 0.00 3.26 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 153 C 7.97 5.71 0.00 2.74 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 A 8.75 4.20 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 0.00 155 V 7.73 4.64 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.92 0.00 0.00 156 F 9.57 4.90 0.00 3.49 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 0.00 157 R 8.87 5.17 0.00 1.77 2.02 0.00 3.26 0.00 0.00 3.29 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 158 F 10.02 4.25 0.00 3.03 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 0.00 159 K 8.39 4.81 0.00 1.71 1.72 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.35 7.81 160 P 0.00 4.25 0.00 2.16 2.09 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 161 V 8.28 3.67 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 0.49 0.00 0.00 0.92 0.00 0.00 162 P 0.00 4.28 0.00 2.18 2.05 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 163 K 8.11 3.88 0.00 1.79 1.71 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.51 7.81 164 E 8.08 3.94 0.00 2.09 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 2.40 2.45 0.00 165 A 8.03 4.16 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 0.00 166 M 7.58 4.16 0.00 2.09 1.55 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 167 K 8.48 3.93 0.00 1.94 1.94 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 168 K 8.70 3.97 0.00 1.98 2.26 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.46 7.81 169 R 7.61 4.06 0.00 1.85 2.32 0.00 3.14 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.63 0.00 170 L 7.99 4.20 0.00 1.97 1.75 0.97 0.49 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 0.00 171 L 7.74 3.93 0.00 1.89 1.71 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 172 E 8.05 3.86 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.62 0.00 173 I 7.09 2.87 1.72 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.54 -0.19 0.00 0.00 174 C 8.60 4.26 0.00 3.05 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 0.00 175 E 7.51 3.80 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 176 K 7.59 4.51 0.00 1.93 1.81 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.38 7.81 177 E 9.72 4.41 0.00 1.60 1.64 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 1.82 1.47 0.00 178 G 7.78 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 V 7.45 4.45 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.33 0.00 0.00 180 K 8.37 4.48 0.00 1.75 1.75 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.47 7.81 181 I 8.14 4.58 1.88 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 1.44 0.40 0.90 0.00 0.00 182 T 7.99 4.45 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 1.20 0.00 0.00 183 E 8.87 3.90 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 184 D 8.24 4.51 0.00 2.72 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 0.00 185 G 7.96 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 0.00 186 L 7.51 3.93 0.00 1.85 1.70 0.93 1.35 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 0.00 187 E 8.26 4.09 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 188 A 8.23 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 L 7.67 4.09 0.00 1.97 1.72 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 190 I 8.77 4.96 2.15 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 1.12 1.33 0.89 0.00 0.00 191 Y 8.00 4.05 0.00 3.12 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 0.00 192 I 8.03 3.85 2.04 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 1.79 1.27 0.95 0.00 0.00 193 S 8.05 4.27 0.00 4.08 4.25 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 0.00 194 G 8.67 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 0.00 195 G 8.67 3.66 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 0.00 0.00 0.00 196 D 8.12 4.70 0.00 2.65 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 0.00 197 F 8.88 4.21 0.00 3.23 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 0.00 198 R 8.33 4.01 0.00 1.95 2.16 0.00 3.23 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.80 0.00 199 K 8.65 3.97 0.00 2.03 1.93 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.49 7.81 200 A 7.90 3.98 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 I 8.77 3.75 2.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.90 1.12 0.00 0.00 202 N 8.41 4.10 0.00 3.13 2.90 0.00 0.00 7.07 7.16 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 0.00 203 A 7.80 3.91 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 L 8.17 3.72 0.00 1.80 1.96 0.99 0.88 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 0.00 205 Q 7.91 2.52 0.00 1.80 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 206 G 7.38 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 0.00 0.00 0.00 207 A 7.75 4.17 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 0.00 208 A 7.79 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 A 7.67 4.01 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 I 7.33 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 1.40 0.81 0.90 0.00 0.00 211 G 8.54 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 0.00 212 E 8.37 3.55 0.00 2.14 1.69 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 2.22 2.23 0.00 213 V 8.50 3.67 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 0.66 0.00 0.00 0.93 0.00 0.00 214 V 9.09 4.12 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 0.88 0.00 0.00 0.98 0.00 0.00 215 D 8.29 4.97 0.00 2.87 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 A 8.79 3.81 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 D 8.00 4.39 0.00 2.72 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 T 8.02 3.84 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 219 I 7.35 3.64 1.76 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 1.42 0.91 0.73 0.00 0.00 220 Y 7.29 4.38 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 0.00 221 Q 8.53 4.08 0.00 2.33 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 222 I 7.54 3.98 1.86 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 1.81 0.89 0.89 0.00 0.00 223 T 7.58 4.50 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 1.28 0.00 0.00 224 A 8.41 3.76 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 0.00 225 T 7.81 4.15 4.08 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 1.22 0.00 0.00 226 A 8.06 3.05 1.06 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 0.00 0.00 227 R 8.26 2.97 0.00 1.92 1.72 0.00 3.34 0.00 0.00 3.57 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 228 P 0.00 4.12 0.00 1.94 1.92 0.00 2.96 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.98 0.00 229 E 7.98 3.94 0.00 2.00 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 2.39 2.45 0.00 230 E 7.97 4.08 0.00 2.14 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 2.34 2.33 0.00 231 M 8.14 3.94 0.00 2.03 2.23 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 2.68 2.50 0.00 232 T 7.92 4.16 4.25 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 1.26 0.00 0.00 233 E 7.88 3.94 0.00 2.10 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 0.00 2.28 2.31 0.00 234 L 8.25 4.01 0.00 1.92 2.06 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 235 I 8.41 3.83 1.91 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 1.53 1.24 0.97 0.00 0.00 236 Q 7.60 3.95 0.00 2.48 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 237 T 8.47 4.00 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 1.27 0.00 0.00 238 A 7.95 4.06 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 0.00 0.00 0.00 0.00 0.00 239 L 7.40 4.28 0.00 1.77 1.76 0.98 1.31 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 0.00 240 K 7.92 4.21 0.00 1.76 1.88 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.46 7.81 241 G 7.16 3.42 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 0.00 242 N 7.76 4.74 0.00 2.88 2.80 0.00 0.00 6.44 7.80 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 0.00 243 F 8.11 4.14 0.00 3.14 3.12 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 0.00 244 M 8.07 3.72 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.70 0.00 245 E 8.00 3.81 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 246 A 8.02 3.95 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 0.00 247 R 7.68 3.65 0.00 1.20 1.72 0.00 3.22 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 248 E 8.03 3.88 0.00 2.20 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 2.28 2.46 0.00 249 L 7.85 3.94 0.00 1.89 1.69 0.92 0.33 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 0.00 250 L 8.20 3.99 0.00 1.77 1.81 0.95 1.22 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 0.00 251 D 8.08 4.34 0.00 3.02 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 0.00 252 R 8.19 3.89 0.00 2.09 1.98 0.00 3.08 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 253 L 8.37 4.18 0.00 1.84 1.85 0.97 1.18 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 0.00 254 M 8.35 3.97 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.61 0.00 255 V 7.62 3.84 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.98 0.00 0.00 256 E 8.00 3.69 0.00 1.77 1.17 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 1.47 2.05 0.00 257 Y 7.26 4.58 0.00 2.80 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 0.00 258 G 7.66 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 M 7.68 4.41 0.00 2.04 2.04 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 2.64 2.53 0.00 260 S 8.47 4.55 0.00 4.05 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 0.00 261 G 8.47 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 262 E 8.24 3.89 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 263 D 8.60 4.42 0.00 2.74 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 0.00 264 I 7.62 3.72 1.88 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 1.60 0.82 0.93 0.00 0.00 265 V 8.33 3.74 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 0.85 0.00 0.00 0.78 0.00 0.00 266 A 8.63 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 267 Q 8.43 4.06 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.69 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 268 L 8.21 4.03 0.00 1.79 1.77 0.87 0.93 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 0.00 269 F 8.75 4.09 0.00 3.09 3.12 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 0.00 270 R 8.26 3.57 0.00 1.92 1.90 0.00 2.91 0.00 0.00 2.96 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.56 0.00 271 E 8.13 4.13 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 272 I 8.13 4.00 1.97 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.81 0.98 0.00 0.00 273 I 7.28 3.89 1.65 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.46 0.73 0.00 0.00 274 S 7.78 4.46 0.00 3.84 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 0.00 275 M 7.37 4.39 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.92 0.00 276 P 0.00 4.72 0.00 2.15 2.12 0.00 3.49 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.05 0.00 277 I 7.47 4.19 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.72 0.91 0.00 0.00 278 K 8.30 4.06 0.00 1.92 1.72 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.47 7.81 279 D 8.75 4.49 0.00 2.62 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 0.00 280 S 7.80 4.34 0.00 3.86 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 L 7.73 4.34 0.00 1.74 1.62 0.92 0.40 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 0.00 282 K 7.93 3.93 0.00 2.02 1.82 0.00 1.67 0.00 0.00 1.52 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.62 7.81 283 V 7.86 3.59 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 1.02 0.00 0.00 0.97 0.00 0.00 284 Q 8.01 4.03 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.62 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 285 L 7.88 3.99 0.00 1.92 1.86 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 286 I 8.07 3.86 2.13 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 1.88 0.87 1.07 0.00 0.00 287 D 8.69 4.38 0.00 2.72 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 0.00 288 K 7.87 4.08 0.00 2.07 1.68 0.00 1.36 0.00 0.00 0.61 0.00 0.00 2.44 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.35 1.23 7.81 289 L 8.66 3.88 0.00 1.94 1.68 1.02 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 290 G 8.00 3.61 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 0.00 0.00 0.00 291 E 8.68 4.19 0.00 2.08 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 0.00 2.46 2.45 0.00 292 V 7.80 3.54 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.16 0.00 0.00 293 D 7.99 4.36 0.00 2.62 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 294 F 8.78 4.60 0.00 3.08 3.19 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 0.00 295 R 7.45 3.07 0.00 1.98 1.72 0.00 3.36 0.00 0.00 3.38 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.78 0.00 296 L 8.38 3.91 0.00 1.90 1.75 0.97 0.71 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 0.00 297 T 8.07 3.96 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 298 E 7.56 4.06 0.00 1.81 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 1.47 1.59 0.00 299 G 7.89 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 300 A 7.51 4.15 1.21 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 0.00 0.00 301 N 8.48 4.66 0.00 2.79 2.71 0.00 0.00 6.50 7.65 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 0.00 302 E 8.84 3.82 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 303 R 7.98 3.94 0.00 1.93 1.93 0.00 3.24 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 304 I 7.51 3.82 1.88 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 1.66 0.52 0.92 0.00 0.00 305 Q 8.06 4.09 0.00 2.03 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 306 L 8.10 4.17 0.00 2.03 1.76 0.92 0.88 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 0.00 307 D 8.31 4.59 0.00 3.03 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 0.00 308 A 8.69 4.17 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 309 Y 8.62 4.44 0.00 3.25 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 310 L 8.16 4.17 0.00 2.06 1.88 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 311 A 8.58 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 Y 7.42 4.15 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 0.00 313 L 7.77 3.99 0.00 1.63 1.68 0.94 1.01 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 0.00 314 S 8.13 4.73 0.00 4.09 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 0.00 315 T 7.94 3.99 4.25 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 1.17 0.00 0.00 316 L 7.64 4.37 0.00 1.65 1.72 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 317 A 8.18 4.28 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 0.00 318 K 7.74 4.48 0.00 1.72 1.77 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.33 7.81 *319 K 7.94 4.12 0.00 1.52 1.62 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.