NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3126 8.2649 123.5804 51.0251 19.8190 176.5511 2 P 4.5757 0.0000 0.0000 61.0547 32.0486 174.1152 3 S 4.8556 9.6975 118.1346 56.8231 67.4646 171.7313 4 Y 5.2581 8.6366 117.3327 56.5453 40.1800 175.4274 5 R 5.0001 9.0875 121.1917 54.5083 35.3035 174.2484 6 V 4.9314 8.3338 119.0953 59.9787 34.3931 175.0971 7 K 4.4764 8.7886 122.0742 54.6280 36.1720 175.5504 8 R 5.1007 8.5271 124.8899 54.2573 30.3888 174.7803 *10 D 4.3896 8.3531 125.5774 53.6674 42.2478 176.1523 11 I 2.9822 8.3909 126.5993 63.4651 38.2004 177.0838 12 A 4.2066 8.2405 121.8918 53.7978 18.1635 177.9001 13 K 4.5244 7.7578 115.2450 55.6761 32.6379 176.2882 14 N 4.9012 7.7487 115.7292 52.8740 37.5384 173.8629 15 D 4.9365 8.7963 116.4826 54.1272 41.5930 175.4233 16 E 4.7405 8.6641 117.2607 54.1202 31.6358 175.9390 17 E 4.4762 8.8874 119.2838 58.6500 29.9683 176.6436 18 C 3.7514 7.4838 114.1335 56.9060 33.6344 173.1238 19 V 4.7966 7.7107 118.0067 59.8484 34.5570 174.4415 20 V 4.5782 8.4886 123.0971 61.3975 32.9443 174.5586 21 N 4.6978 9.0762 127.2202 52.8628 40.4952 174.1718 22 A 4.8251 8.6771 128.0123 51.2858 17.7002 176.5689 23 A 4.6514 9.1835 124.2034 51.1532 21.2974 175.7007 24 N 5.1755 8.3679 115.4868 50.6127 40.0891 174.5567 25 P 5.1266 0.0000 0.0000 64.8345 31.6062 178.2039 26 R 4.3963 8.2295 114.7736 55.1688 30.5128 176.0441 27 G 3.9715 7.8881 106.0960 46.5599 0.0000 173.9494 28 L 4.6317 8.0375 117.7458 52.0279 43.5649 175.4713 29 P 4.1601 0.0000 0.0000 62.5923 32.4975 176.7742 30 G 3.9456 8.0714 112.1369 45.3365 0.0000 170.5392 31 D 4.9227 8.5370 123.3858 53.1476 44.9302 177.2285 32 G 3.7280 8.2862 109.3039 46.7159 0.0000 175.9680 33 V 3.6162 8.5745 120.0535 66.2593 31.1823 177.1273 34 C 5.0552 8.0879 119.0453 61.8222 31.3497 175.4470 35 K 3.9108 7.9689 120.5958 59.3424 31.8906 178.5317 36 A 3.9630 7.8340 120.6282 55.3064 18.2587 179.6057 37 V 3.9787 8.3110 117.0033 66.7126 31.4306 177.6038 38 Y 3.8862 8.3111 118.0678 60.6087 38.5789 177.8869 39 K 3.9848 7.9670 118.7496 58.5422 32.1815 178.7345 40 K 3.7256 7.5966 119.0292 57.1782 33.7576 177.0204 41 W 5.1153 8.6053 117.5107 54.1902 29.7366 174.4428 42 P 3.8887 0.0000 0.0000 66.0823 30.8730 178.1291 43 E 4.1247 8.3856 117.8926 59.0809 29.1530 178.6262 44 S 4.4829 8.2887 112.0268 59.7448 63.1958 175.1211 45 F 4.7107 8.0726 122.1393 55.5753 39.0556 175.2950 46 K 4.0352 7.6354 121.4766 57.1807 31.9631 176.3563 47 N 4.2068 8.7651 126.2453 54.3758 35.7809 175.1870 48 S 4.2194 7.8674 110.1727 58.7038 64.1015 173.6208 49 A 4.4217 7.6996 123.7266 53.1970 18.6460 176.7740 50 T 4.5915 8.3457 115.4701 60.2045 71.4462 171.3925 51 P 4.7957 0.0000 0.0000 61.7451 32.9938 175.8703 52 V 3.5747 8.3438 120.7734 65.1406 31.5963 176.4635 53 G 3.9112 9.5117 114.2102 46.5432 0.0000 172.3568 54 T 4.9456 7.6630 108.6869 59.6679 72.8583 172.4292 55 A 5.2828 8.8686 122.3699 50.0939 22.4076 175.5877 56 K 4.5298 8.8626 121.3590 54.9434 35.7602 174.9911 57 T 4.7629 8.5161 123.6477 62.4691 69.8718 174.3108 58 V 4.2127 8.1585 127.3926 62.0098 35.6612 174.8370 *60 C 4.2402 8.7545 119.1073 59.8738 32.7924 176.1933 61 G 3.9758 8.6736 120.6765 47.1420 0.0000 173.0897 62 T 4.3886 9.0068 112.4773 60.9733 69.3155 173.1198 63 Y 4.2388 8.0814 124.7302 56.3252 39.3946 172.9483 64 P 4.2655 0.0000 0.0000 62.0763 33.1392 175.3021 65 V 4.1176 8.1480 124.3690 61.0725 33.9873 174.4518 66 I 4.3506 8.5649 130.4862 60.2312 38.5047 175.1982 67 H 4.8120 8.9956 126.5668 54.9626 29.5506 174.3709 68 A 5.0553 8.8625 126.3557 49.9460 21.7830 175.3517 69 V 4.6190 8.4279 122.7177 60.8497 32.9766 175.7147 70 G 4.1173 8.8468 116.3858 43.6320 0.0000 170.1474 71 P 3.6609 0.0000 0.0000 61.9218 31.9950 175.8890 72 N 4.0535 7.8608 118.9947 52.4812 38.3878 175.6540 73 F 4.4663 9.0671 125.5862 59.2222 39.2310 177.2578 74 S 4.3718 8.7930 118.0675 60.9132 62.9556 175.8102 75 N 4.4807 7.9659 115.8486 54.6897 39.5787 175.1718 76 Y 4.1241 8.1247 115.2068 56.8064 38.9313 176.0735 77 S 4.4996 8.3859 118.1032 58.0977 65.2849 175.3524 78 E 4.2220 8.7719 121.4463 59.6755 29.0546 179.4772 79 S 4.1487 8.1201 112.4885 61.6957 62.6272 175.9928 80 E 4.1534 8.4519 121.3484 59.2950 29.1452 179.6267 81 G 3.0296 8.5332 106.1775 47.5334 0.0000 175.1277 82 D 4.5891 8.4717 120.5121 57.3869 41.2643 178.7034 83 R 3.9429 7.7890 118.4716 59.3625 29.7330 178.9756 84 E 3.9008 8.0349 118.3615 58.9847 29.3012 179.1622 85 L 3.8778 8.1789 120.6245 57.9678 42.2134 178.6431 86 A 3.9327 7.8924 120.5034 55.3518 18.2773 179.4943 87 A 3.9398 8.0672 118.8212 55.1049 18.4216 179.6571 88 A 3.8524 8.1213 119.3753 55.6653 18.4162 179.5502 89 Y 4.1826 7.7720 114.8349 61.2233 37.9196 178.7965 90 R 3.9917 8.1930 119.1282 59.5178 30.1228 178.9671 91 E 4.0050 8.3051 118.3058 59.1228 29.3807 179.4687 92 V 3.5382 7.9161 118.1935 66.0052 31.5943 177.7992 93 A 4.0272 8.2242 120.5261 55.0477 18.1162 179.4307 94 K 3.8396 8.0897 117.8890 59.8226 32.3593 178.7990 95 E 3.9159 8.4858 119.1548 59.4195 28.9584 179.5173 96 V 3.5482 8.1856 118.5958 66.2624 31.5369 178.2310 97 T 3.7252 8.0428 115.4024 66.7407 68.1297 176.6437 98 R 3.8991 8.0651 119.5320 59.4324 30.1407 178.2201 99 L 4.1554 7.9345 117.7413 55.2416 41.6024 177.9619 100 G 3.8965 7.6906 105.8391 46.1828 0.0000 174.3391 101 V 3.9587 6.9923 111.9155 61.1668 32.1353 176.1798 102 N 4.8136 9.4796 119.4499 54.9228 38.7097 175.1100 103 S 5.7311 7.9660 112.0362 57.7033 66.6904 173.6509 104 V 4.8457 8.1968 119.5874 60.3324 34.9353 173.1842 105 A 5.2338 9.0976 126.6553 51.0288 20.5057 175.9030 106 I 4.9938 9.1223 123.0403 58.7110 41.6007 173.1103 107 P 5.3360 0.0000 0.0000 61.5448 33.8698 175.6553 108 L 4.5476 8.4892 119.9286 53.3530 40.7232 176.6534 109 L 4.0951 8.6023 124.2215 56.2697 41.7491 177.7494 110 S 4.1210 8.9007 115.9446 59.9665 60.3305 173.2153 111 T 4.7857 7.8255 107.7682 61.5651 71.1998 174.9633 112 G 3.8953 7.8823 109.1246 45.6752 0.0000 177.4151 113 V 3.7475 9.0149 119.5787 63.8307 32.0118 176.1001 114 Y 5.1159 7.9919 116.2807 57.9874 38.2074 176.9013 115 S 4.7444 7.9759 115.3823 58.1230 63.5275 175.2240 116 G 3.7867 9.1787 108.6326 46.5429 0.0000 174.6005 117 G 3.9125 8.0625 105.6924 45.1098 0.0000 174.1380 118 K 4.4347 7.6327 120.0371 54.3175 33.8522 175.4100 119 D 4.8203 8.5267 123.5591 54.1400 41.2354 176.0102 120 R 4.5806 8.6249 125.5032 55.5504 31.5466 177.5342 121 L 3.4707 7.9409 121.3253 58.6438 41.6782 179.0628 122 T 3.6796 7.4574 114.8555 66.3909 68.4382 176.2439 123 Q 3.8262 7.8631 120.9416 59.3868 29.1350 178.3274 124 S 4.2729 8.2680 114.2480 61.2474 62.3830 175.7767 125 L 3.4871 8.0182 123.3396 57.9993 41.7741 178.6147 126 N 4.3237 8.1499 116.5848 56.8140 38.5560 177.1457 127 H 4.2650 7.9591 117.4792 58.4350 28.5058 177.5432 128 L 2.8309 6.7766 121.3324 57.8193 41.8906 178.6342 129 F 4.5250 7.4171 116.2661 61.0740 38.9341 177.4068 130 T 4.1166 7.8491 113.6111 66.6337 68.1118 175.9590 131 A 4.2788 7.7328 119.6277 53.1834 17.9586 178.6224 *133 D 4.4753 8.0125 121.1697 55.2185 42.7643 176.5963 134 S 4.5600 7.6513 111.2600 58.2530 63.4496 173.9852 135 T 4.4985 7.5826 111.2707 60.7713 70.4121 173.8829 136 D 4.7159 8.3562 119.9128 52.9884 39.7810 176.1891 137 A 4.3623 7.2258 121.1403 52.0601 19.3485 177.9109 138 D 4.5028 9.0383 122.2084 54.3403 42.3064 175.5821 139 V 4.8460 8.6267 123.3350 60.9872 34.6015 174.3107 140 V 4.8592 8.8262 127.1952 61.2289 34.3280 174.1584 141 I 4.7819 9.1863 130.2159 60.9716 38.7908 174.5071 142 Y 5.1863 9.1891 125.1166 56.4862 40.3498 174.7566 143 C 5.4467 9.0946 117.7905 57.0547 33.5652 174.3629 144 R 4.5069 8.7163 114.6591 55.3400 32.2434 175.8964 145 D 4.8084 7.7479 117.4411 52.3124 43.3968 176.7481 146 K 4.0253 8.5668 126.2982 59.8763 32.2656 179.4059 147 E 4.1188 8.4043 118.2482 58.9676 29.4836 179.2649 148 W 4.0747 8.8953 119.3467 59.6043 29.0459 177.9042 149 E 3.9944 8.4631 119.2941 59.3346 28.9514 179.0854 150 K 3.9586 7.8778 118.2196 59.5070 32.1741 179.4532 151 K 3.9040 8.1214 118.6084 59.5044 31.9393 179.4635 152 I 3.6232 8.2185 120.3451 64.4311 37.0088 178.4142 153 S 4.1113 8.2989 114.0662 61.3776 61.9776 175.8676 154 E 3.9248 8.2984 120.3588 59.5116 29.3099 179.0152 155 A 4.1227 7.7518 119.3385 55.0651 18.5279 179.3136 156 I 3.8009 7.7044 117.2616 64.5025 37.7931 180.9515 157 Q 4.1342 8.1252 120.6406 55.5832 28.4105 178.8241 *159 R 4.1666 8.0523 119.9314 55.9710 32.3692 176.0927 160 T 4.0214 7.5046 111.6876 62.1379 68.4223 173.5498 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 4.31 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 2 P 0.00 4.58 0.00 1.95 1.90 0.00 3.60 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.23 0.00 3 S 9.70 4.86 0.00 3.90 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 4 Y 8.64 5.26 0.00 2.91 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 5 R 9.09 5.00 0.00 1.73 1.76 0.00 3.08 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 6 V 8.33 4.93 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 0.76 0.00 0.00 0.93 0.00 0.00 7 K 8.79 4.48 0.00 0.90 1.51 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.20 1.02 7.81 8 R 8.53 5.10 0.00 1.98 1.90 0.00 3.20 0.00 0.00 2.25 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.50 0.00 *10 D 8.35 4.39 0.00 2.76 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.39 2.98 1.88 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 1.19 0.47 0.98 0.00 0.00 12 A 8.24 4.21 1.15 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 13 K 7.76 4.52 0.00 1.85 1.79 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.26 7.81 14 N 7.75 4.90 0.00 2.96 2.39 0.00 0.00 6.69 7.86 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 15 D 8.80 4.94 0.00 2.72 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 16 E 8.66 4.74 0.00 2.16 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.39 0.00 17 E 8.89 4.48 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 18 C 7.48 3.75 0.00 2.84 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.71 4.80 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 20 V 8.49 4.58 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 0.71 0.00 0.00 0.92 0.00 0.00 21 N 9.08 4.70 0.00 2.72 2.55 0.00 0.00 6.67 8.17 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 22 A 8.68 4.83 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 23 A 9.18 4.65 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.37 5.18 0.00 2.97 2.98 0.00 0.00 5.94 7.76 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 25 P 0.00 5.13 0.00 2.24 2.17 0.00 3.97 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.13 0.00 26 R 8.23 4.40 0.00 1.81 1.98 0.00 3.44 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 27 G 7.89 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.04 4.63 0.00 1.67 1.54 0.92 0.75 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 29 P 0.00 4.16 0.00 1.44 0.62 0.00 3.34 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.47 0.00 30 G 8.07 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.54 4.92 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.29 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.57 3.62 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 1.21 0.00 0.00 0.98 0.00 0.00 34 C 8.09 5.06 0.00 3.29 3.10 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 0.00 0.00 0.00 0.00 35 K 7.97 3.91 0.00 2.18 1.97 0.00 1.61 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.51 7.81 36 A 7.83 3.96 1.44 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 0.00 0.00 37 V 8.31 3.98 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 1.30 0.00 0.00 38 Y 8.31 3.89 0.00 2.41 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 39 K 7.97 3.98 0.00 1.97 1.74 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.46 7.81 40 K 7.60 3.73 0.00 1.10 0.74 0.00 1.01 0.00 0.00 1.10 0.00 0.00 2.72 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.21 7.81 41 W 8.61 5.12 0.00 3.54 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 42 P 0.00 3.89 0.00 1.96 1.64 0.00 3.73 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 1.97 1.84 0.00 43 E 8.39 4.12 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 44 S 8.29 4.48 0.00 4.18 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 0.00 45 F 8.07 4.71 0.00 3.39 3.29 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 46 K 7.64 4.04 0.00 1.88 1.79 0.00 1.98 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.46 7.81 47 N 8.77 4.21 0.00 2.86 2.84 0.00 0.00 7.19 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 48 S 7.87 4.22 0.00 3.38 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 49 A 7.70 4.42 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 50 T 8.35 4.59 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 51 P 0.00 4.80 0.00 2.11 1.95 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 2.10 2.08 0.00 52 V 8.34 3.57 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 0.42 0.00 0.00 0.93 0.00 0.00 53 G 9.51 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 0.00 0.00 0.00 54 T 7.66 4.95 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 55 A 8.87 5.28 1.15 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 56 K 8.86 4.53 0.00 1.77 1.57 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.36 7.81 57 T 8.52 4.76 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 1.08 0.00 0.00 58 V 8.16 4.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.95 0.00 0.00 *60 C 8.75 4.24 0.00 3.22 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 61 G 8.67 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 9.01 4.39 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 1.24 0.00 0.00 63 Y 8.08 4.24 0.00 2.95 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 64 P 0.00 4.27 0.00 1.77 1.73 0.00 2.79 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.87 0.00 65 V 8.15 4.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 74 S 8.79 4.37 0.00 4.10 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.97 4.48 0.00 2.70 2.65 0.00 0.00 6.92 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.12 4.12 0.00 2.58 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.39 4.50 0.00 4.11 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 78 E 8.77 4.22 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.36 0.00 79 S 8.12 4.15 0.00 3.93 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 80 E 8.45 4.15 0.00 2.23 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 2.39 2.52 0.00 81 G 8.53 3.03 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 82 D 8.47 4.59 0.00 3.11 2.91 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0.00 0.00 *133 D 8.01 4.48 0.00 2.86 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 7.65 4.56 0.00 3.81 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 0.00 135 T 7.58 4.50 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 1.23 0.00 0.00 136 D 8.36 4.72 0.00 2.75 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 0.00 137 A 7.23 4.36 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 D 9.04 4.50 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.63 4.85 1.79 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 1.14 0.00 0.00 0.86 0.00 0.00 140 V 8.83 4.86 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.08 0.00 0.00 141 I 9.19 4.78 1.90 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 1.30 0.59 0.98 0.00 0.00 142 Y 9.19 5.19 0.00 2.95 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 0.00 143 C 9.09 5.45 0.00 3.10 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.72 4.51 0.00 1.71 1.94 0.00 3.41 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 145 D 7.75 4.81 0.00 2.49 2.36 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 0.00 146 K 8.57 4.03 0.00 1.87 1.88 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.56 7.81 147 E 8.40 4.12 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 148 W 8.90 4.07 0.00 3.51 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 E 8.46 3.99 0.00 2.11 2.19 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 2.34 2.39 0.00 150 K 7.88 3.96 0.00 1.94 1.85 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.47 1.51 7.81 151 K 8.12 3.90 0.00 1.79 1.68 0.00 1.40 0.00 0.00 1.43 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.53 7.81 152 I 8.22 3.62 1.89 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.73 0.90 0.00 0.00 153 S 8.30 4.11 0.00 3.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 E 8.30 3.92 0.00 2.10 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 2.34 2.44 0.00 155 A 7.75 4.12 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 0.00 156 I 7.70 3.80 2.06 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 1.71 0.85 1.05 0.00 0.00 157 Q 8.13 4.13 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.38 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 *159 R 8.05 4.17 0.00 1.60 1.80 0.00 2.21 0.00 0.00 2.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.61 0.00 160 T 7.50 4.02 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 * Residues marked with a * may have inaccurate shift predictions.