NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2559 8.3049 118.1466 54.9614 32.5562 174.3274 2 F 4.8624 8.4841 118.4214 53.9556 42.1225 173.9977 3 D 5.0313 9.1745 125.6957 51.5051 43.4048 176.5364 4 A 3.8757 8.3332 120.3456 55.5349 18.0228 179.9692 5 F 4.0850 7.8885 115.7032 61.0404 39.3334 178.0801 6 T 4.0501 8.9680 109.7114 64.4542 68.3026 176.2402 7 K 3.0032 7.9703 122.6297 59.2579 32.1901 178.9469 8 V 3.5033 7.1722 118.8528 65.9215 31.5729 178.1312 9 V 3.5943 7.8406 118.0943 65.9640 31.0998 177.9110 10 S 4.0933 8.1446 112.4952 61.5140 62.1840 175.9371 11 Q 4.0560 7.7429 120.6639 58.7708 28.4476 178.4121 12 A 3.9817 7.9813 121.9457 55.1607 18.3948 179.1709 13 D 4.3237 8.0849 116.2764 57.7694 41.0168 178.6543 14 T 3.9816 7.5451 115.3540 65.8411 68.5115 175.8987 15 R 4.4063 7.8517 117.2020 54.9630 30.7566 176.2780 16 G 3.9937 7.9271 107.0325 46.4594 0.0000 173.3615 17 E 4.7667 7.9428 115.5613 54.0076 32.4692 175.3872 18 M 4.3914 8.2564 119.1841 54.2991 33.1358 176.5783 19 L 4.2687 8.2212 121.1410 55.0236 42.5193 178.0504 20 S 4.5795 9.3917 117.8493 57.7601 65.5593 175.6771 21 T 3.8282 8.3569 112.7533 64.7911 68.4431 176.4578 22 A 3.9594 7.9136 123.1824 55.0989 18.4688 179.4023 23 Q 3.9529 8.0687 116.5730 59.3103 28.6824 179.2391 24 I 3.8167 8.0657 120.9826 64.4224 36.9507 178.2977 25 D 4.8215 8.7924 121.3380 56.7052 40.3559 178.6243 26 A 4.0189 8.1210 121.4790 55.1021 18.4874 179.7068 27 L 3.8243 7.8831 117.4358 57.6581 41.7127 179.7821 28 S 4.2586 7.8633 114.7054 61.3720 62.8275 176.4927 29 Q 4.0161 7.7098 120.9568 58.9516 28.5363 178.1915 30 M 4.1460 7.6517 119.0004 58.4864 32.3848 178.4654 31 V 3.6319 7.7364 117.8681 65.8730 31.4409 177.8578 32 A 4.0826 8.1905 120.1581 54.4746 18.3342 178.4333 33 E 4.4774 7.6430 115.2975 56.3693 29.9398 178.0479 34 S 4.1441 7.7924 117.0704 61.7596 62.8481 176.4071 35 N 4.3790 8.1183 119.5407 56.1489 38.4232 177.2774 36 K 4.0319 7.9020 120.0009 59.4285 32.1001 179.4233 37 R 3.9781 7.9205 118.6085 59.3292 30.0165 178.3968 38 L 4.1894 7.9624 118.5518 57.6101 41.6301 179.1365 39 D 4.3812 8.1030 118.7906 57.1224 40.7289 178.7789 40 V 3.5978 7.7483 118.6579 66.0678 31.5572 178.3024 41 V 3.6249 7.8767 117.8446 65.9878 31.4403 177.3135 42 N 4.3028 8.5381 117.1678 56.8250 38.5509 176.9428 43 R 3.9199 8.2656 118.2199 59.3509 30.5451 178.6038 44 I 3.9048 7.7025 119.4355 65.0341 37.0945 178.5480 45 T 3.8913 7.9316 116.2172 66.8597 68.0938 176.6017 46 S 4.4147 8.1972 115.1180 60.1189 63.0616 174.6559 47 N 4.9638 7.8290 118.7324 52.6303 39.5476 176.1354 48 A 4.0218 7.9719 122.4619 55.6229 18.2491 180.6736 49 S 4.0950 8.0408 111.7723 62.1232 63.0121 176.6977 50 T 3.8999 7.8478 118.8807 66.0472 68.1690 176.6718 51 I 3.6836 7.8580 121.8269 64.4604 37.2148 178.6918 52 V 3.5929 7.8903 118.9234 66.2312 31.3501 177.6880 53 S 4.1147 8.3928 115.1231 62.2226 62.7822 176.5609 54 N 4.3356 8.5400 118.4218 56.3426 38.3638 177.5403 55 A 3.9386 7.8823 121.7845 55.2584 18.3552 179.0554 56 A 3.4692 8.0628 119.6775 54.6631 18.2364 179.4259 57 R 3.9606 8.0107 117.2546 59.6808 30.5717 178.7724 58 S 4.1881 7.9257 112.5921 61.2015 62.3625 175.8319 59 L 3.8669 7.6177 123.0470 58.1625 41.5574 178.8944 60 F 4.5341 7.6982 116.2869 59.8857 38.8542 177.2679 61 A 4.2167 7.6069 120.0384 54.9976 18.3108 179.2585 62 E 4.2288 8.0992 115.5859 58.2975 31.0893 177.7216 63 Q 5.3238 8.3086 120.3821 52.6094 28.3741 174.3375 64 P 4.5770 0.0000 0.0000 64.7105 32.2176 179.2572 65 Q 4.1192 8.0323 118.0489 58.0733 29.1780 178.2646 66 L 4.0599 8.0456 118.7962 57.0543 41.8102 178.3534 67 I 4.2450 7.2915 108.8397 60.4014 38.3027 175.6765 68 A 4.1115 7.5924 125.1148 50.8892 19.0853 175.1029 69 P 2.9700 0.0000 0.0000 63.9453 31.5152 176.9982 70 G 4.0783 8.5651 111.6191 45.2825 0.0000 174.0780 71 G 4.4169 8.3437 114.5552 44.5836 0.0000 175.3884 *73 A 4.1473 8.7027 127.5403 51.2131 19.7692 176.3192 74 Y 4.2652 7.7975 118.7919 58.9101 39.8074 175.7952 75 T 3.0604 7.4699 112.7216 62.0451 68.9656 172.6923 76 S 4.0424 8.5075 119.5035 61.8852 62.8419 177.3268 77 R 3.8970 7.7920 118.0388 59.4900 29.2406 178.9837 78 R 3.9104 7.5802 118.0725 58.8212 30.0274 178.7646 79 M 3.9309 8.0586 117.7869 58.6265 32.3250 178.0440 80 A 4.0063 8.3916 121.1322 55.3013 18.5429 179.5165 81 A 4.0189 8.2192 119.1597 55.1498 18.4586 179.5576 82 C 4.1096 8.0983 117.5264 62.7669 31.7269 175.8141 83 L 4.1007 8.1475 120.6376 57.6196 41.0635 179.5269 84 R 3.8959 8.1795 118.7692 59.5605 30.0696 178.2136 85 D 4.4499 8.1250 118.6483 57.6875 40.8816 178.7343 86 M 4.0882 7.9583 118.5474 58.4818 31.9457 178.4431 87 E 3.9374 8.2065 119.3112 59.2682 29.7345 178.7948 88 I 3.7083 8.1343 120.1888 64.6382 37.3346 178.5037 89 I 3.7567 7.9680 120.5624 64.2669 37.0197 178.3215 90 L 3.9253 7.9453 121.1966 57.8629 42.0267 178.9552 91 R 3.5116 8.0849 119.0402 59.6944 30.0411 178.2668 92 Y 3.4990 7.8509 116.3854 60.5641 37.7138 178.7926 93 V 3.4155 7.5477 119.5687 66.0617 31.5852 178.2178 94 T 3.9463 7.6136 109.2140 64.8688 68.5244 176.1751 95 Y 4.2972 7.5925 118.9869 60.8943 37.8903 178.2373 96 A 4.0634 7.8635 122.9928 54.5604 18.1420 179.8504 97 V 3.8061 7.5363 115.5127 66.1793 31.7017 177.6793 98 F 4.2910 8.3435 119.1741 61.2169 39.5677 176.5139 99 A 4.2829 8.5927 119.7618 52.2219 18.2723 178.3054 100 G 4.0457 9.0720 104.9096 45.9427 0.0000 172.9733 101 D 4.6441 7.6174 116.4786 51.7486 44.1624 175.4654 102 A 4.0889 8.6918 126.5767 52.7724 18.9115 179.4543 103 S 4.1216 8.0438 114.3696 61.5953 62.8243 177.1445 104 V 3.6489 7.7910 122.2543 64.3760 31.0588 177.9314 105 L 3.9449 7.8233 120.5924 57.7002 41.9518 178.5983 106 E 3.8804 8.4370 118.7817 59.5454 29.2605 179.1116 107 D 4.2563 8.2999 117.5742 57.4888 41.1799 178.6750 108 R 4.1709 7.7017 115.2313 57.3729 30.3980 175.8024 109 C 4.1537 7.2888 115.8252 60.5588 33.7880 174.9253 110 L 3.9206 8.3953 119.8231 57.1905 41.5489 176.7545 111 N 4.2596 8.0787 117.9459 55.7714 38.8012 174.7764 112 G 3.9329 8.8947 114.4397 45.6336 0.0000 174.5292 113 L 3.5703 7.9485 120.7366 57.5886 41.6570 178.8626 114 R 3.9313 7.9810 118.1492 59.8162 29.7735 178.0950 115 E 3.9769 8.0451 117.4113 59.6386 29.5661 179.2126 116 T 3.8141 7.7424 115.7061 67.0282 68.5015 176.3011 117 Y 4.5290 7.9904 118.6873 60.9798 37.6950 178.5759 118 L 4.0133 8.1866 119.7696 57.7614 41.5600 179.2110 119 A 4.0244 7.9645 119.2360 55.4495 18.5243 179.6119 120 L 4.1876 7.9263 115.3673 55.8086 41.6516 178.4835 121 G 3.9071 7.6088 106.6519 46.1170 0.0000 173.3836 122 T 4.0216 7.9285 116.8727 61.8602 68.9059 173.5453 123 P 4.4704 0.0000 0.0000 62.3424 31.8237 177.2507 124 G 3.8316 8.8827 112.8275 47.1696 0.0000 173.8173 125 S 4.1569 8.1997 116.3105 61.7843 62.6559 176.9008 126 S 4.1242 7.9546 117.9777 61.0963 62.5938 176.6115 127 V 3.5453 7.4157 120.7925 65.8719 31.2251 177.9371 128 A 4.0753 8.3262 121.0146 55.1934 18.2126 179.8108 129 V 3.6418 7.7817 116.7754 65.7965 31.6175 178.6456 130 G 3.5087 8.0499 105.8984 47.8056 0.0000 176.2435 131 V 3.9449 8.3635 122.5935 64.0096 31.3259 178.7342 132 G 3.5360 8.1643 106.9687 47.6888 0.0000 176.0155 133 K 4.0052 8.0948 120.9704 59.2442 31.9424 179.5051 134 M 4.0097 7.9294 119.0596 57.9010 31.8153 178.4005 135 K 2.0000 7.4925 119.7564 59.0109 32.2038 178.4596 136 E 3.7885 7.6383 117.8652 59.4966 29.3427 179.3948 137 A 3.9586 7.7025 120.2725 54.7991 18.3243 179.5427 138 A 3.9152 8.1205 119.7535 55.4326 18.5591 179.7097 139 L 3.9108 7.9955 117.2605 58.0683 41.4977 179.7436 140 A 3.9978 7.7549 119.4304 55.1969 18.3555 179.3827 141 I 3.9205 7.5539 118.0134 64.1187 37.0448 178.7636 142 V 3.7287 7.8078 118.6011 65.9038 31.5528 177.1550 143 N 4.6829 8.0438 112.8596 52.5483 38.8113 174.9097 144 D 4.4098 7.1806 120.6075 53.7743 41.6245 174.6035 145 P 4.3539 0.0000 0.0000 64.8194 31.2030 176.7862 146 A 3.9797 8.2816 123.4230 53.3518 18.6327 177.4924 147 G 3.9404 8.8106 109.6150 45.9469 0.0000 173.1389 148 I 4.5694 7.1106 114.1544 58.7645 41.2626 174.6163 149 T 3.8974 8.5354 123.4938 63.1237 68.6463 172.4558 150 P 4.2225 0.0000 0.0000 62.9638 31.8223 175.7899 151 G 3.8346 7.8549 109.3154 45.8125 0.0000 171.4309 152 D 4.7792 8.7117 118.9355 53.0311 41.9192 175.4335 153 C 4.9097 8.4014 124.2052 59.3542 29.6055 176.3387 154 S 4.0921 9.4719 119.2413 61.6466 62.3133 175.9547 155 A 3.9842 7.9304 124.0441 54.6051 18.1707 179.2608 156 L 3.8968 7.8364 118.2193 58.2368 42.4449 178.8403 157 A 4.0881 8.7068 121.2438 54.9354 18.2310 179.5919 158 S 4.1721 8.0090 112.6080 61.1293 63.2196 176.3527 159 E 3.6942 7.7755 123.1749 58.9040 29.3484 178.8503 160 I 3.7236 7.8007 119.6227 64.4365 37.1771 178.0907 161 A 4.2966 8.0252 121.5389 55.3259 18.1391 179.8706 162 G 3.4765 7.9365 104.0655 48.2409 0.0000 175.5852 163 Y 4.4464 7.4199 119.2125 60.6890 37.7290 178.5596 164 F 4.0841 8.1845 118.3188 60.8832 39.1396 177.4224 165 D 4.4552 8.5733 118.5822 57.4027 40.3122 179.2242 166 R 3.9510 7.9419 117.6830 59.2434 30.5207 178.6642 167 A 4.1377 8.0958 120.2145 55.1623 18.5643 179.4557 168 A 4.0146 8.4799 119.4651 55.3087 17.9600 179.4570 169 A 4.2483 8.4872 119.6345 53.5415 18.4882 178.8704 170 A 4.0435 7.6495 117.4660 53.6972 18.7260 178.2485 171 V 4.4951 7.5965 108.0679 60.5652 34.4560 175.8905 172 S 4.3270 8.1172 119.2898 58.5058 62.7655 173.9392 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.26 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 2 F 8.48 4.86 0.00 3.25 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 3 D 9.17 5.03 0.00 3.11 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 A 8.33 3.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 F 7.89 4.09 0.00 3.24 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 6 T 8.97 4.05 4.56 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 1.36 0.00 0.00 7 K 7.97 3.00 0.00 1.96 1.91 0.00 1.11 0.00 0.00 1.03 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.34 7.81 8 V 7.17 3.50 2.22 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 0.93 0.00 0.00 0.94 0.00 0.00 9 V 7.84 3.59 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 0.97 0.00 0.00 1.02 0.00 0.00 10 S 8.14 4.09 0.00 3.71 3.51 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 0.00 0.00 0.00 0.00 11 Q 7.74 4.06 0.00 2.14 2.07 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 2.28 2.34 0.00 12 A 7.98 3.98 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 13 D 8.08 4.32 0.00 2.85 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 14 T 7.55 3.98 4.38 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 1.21 0.00 0.00 15 R 7.85 4.41 0.00 1.86 1.96 0.00 3.53 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.84 0.00 16 G 7.93 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 0.00 0.00 0.00 17 E 7.94 4.77 0.00 2.05 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 2.22 0.00 18 M 8.26 4.39 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 19 L 8.22 4.27 0.00 1.62 1.62 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 20 S 9.39 4.58 0.00 3.99 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 21 T 8.36 3.83 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 1.21 0.00 0.00 22 A 7.91 3.96 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 23 Q 8.07 3.95 0.00 2.40 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 24 I 8.07 3.82 2.01 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 1.02 0.93 0.00 0.00 25 D 8.79 4.82 0.00 2.89 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 26 A 8.12 4.02 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 27 L 7.88 3.82 0.00 1.94 1.89 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.86 4.26 0.00 4.01 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 29 Q 7.71 4.02 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.02 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 30 M 7.65 4.15 0.00 2.15 1.97 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 2.52 2.48 0.00 31 V 7.74 3.63 2.26 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 1.00 0.00 0.00 1.16 0.00 0.00 32 A 8.19 4.08 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.64 4.48 0.00 1.94 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 2.34 2.46 0.00 34 S 7.79 4.14 0.00 4.05 4.19 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 35 N 8.12 4.38 0.00 2.77 2.92 0.00 0.00 7.18 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.90 4.03 0.00 1.91 1.87 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.47 1.45 7.81 37 R 7.92 3.98 0.00 1.89 2.10 0.00 3.10 0.00 0.00 3.52 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 38 L 7.96 4.19 0.00 1.94 1.77 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 39 D 8.10 4.38 0.00 2.92 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 40 V 7.75 3.60 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.98 0.00 0.00 41 V 7.88 3.62 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 1.05 0.00 0.00 1.17 0.00 0.00 42 N 8.54 4.30 0.00 2.96 3.04 0.00 0.00 7.28 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 43 R 8.27 3.92 0.00 1.92 2.01 0.00 3.36 0.00 0.00 3.39 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 44 I 7.70 3.90 1.93 0.00 0.00 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 1.61 1.08 1.00 0.00 0.00 45 T 7.93 3.89 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 1.21 0.00 0.00 46 S 8.20 4.41 0.00 4.03 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 47 N 7.83 4.96 0.00 2.83 2.76 0.00 0.00 6.69 7.20 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 48 A 7.97 4.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 57 R 8.01 3.96 0.00 1.92 2.20 0.00 3.28 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 58 S 7.93 4.19 0.00 3.91 4.02 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 59 L 7.62 3.87 0.00 1.58 1.35 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 60 F 7.70 4.53 0.00 3.08 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 61 A 7.61 4.22 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 62 E 8.10 4.23 0.00 1.95 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 2.30 2.59 0.00 63 Q 8.31 5.32 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.22 0.00 64 P 0.00 4.58 0.00 2.30 2.33 0.00 3.46 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 65 Q 8.03 4.12 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.97 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 66 L 8.05 4.06 0.00 1.85 1.80 1.17 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 67 I 7.29 4.24 1.75 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 1.19 0.63 0.33 0.00 0.00 68 A 7.59 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 69 P 0.00 2.97 0.00 1.69 1.39 0.00 3.46 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 70 G 8.57 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 0.00 0.00 0.00 71 G 8.34 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *73 A 8.70 4.15 1.25 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 0.00 0.00 74 Y 7.80 4.27 0.00 3.03 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 75 T 7.47 3.06 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 0.61 0.00 0.00 76 S 8.51 4.04 0.00 3.80 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 77 R 7.79 3.90 0.00 2.01 2.15 0.00 2.94 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 1.61 1.67 0.00 78 R 7.58 3.91 0.00 2.14 2.00 0.00 3.36 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 79 M 8.06 3.93 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 80 A 8.39 4.01 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 81 A 8.22 4.02 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 82 C 8.10 4.11 0.00 3.21 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.15 4.10 0.00 1.93 1.75 0.98 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 84 R 8.18 3.90 0.00 2.03 2.15 0.00 3.13 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 85 D 8.12 4.45 0.00 3.11 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 86 M 7.96 4.09 0.00 2.11 2.32 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 2.74 2.58 0.00 87 E 8.21 3.94 0.00 2.06 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 2.30 2.33 0.00 88 I 8.13 3.71 2.11 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 1.59 0.64 1.13 0.00 0.00 89 I 7.97 3.76 2.06 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.34 0.95 0.00 0.00 90 L 7.95 3.93 0.00 1.85 1.84 1.08 0.89 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 91 R 8.08 3.51 0.00 1.76 1.73 0.00 2.98 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.09 0.00 92 Y 7.85 3.50 0.00 2.93 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.55 3.42 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 0.56 0.00 0.00 0.50 0.00 0.00 94 T 7.61 3.95 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 1.22 0.00 0.00 95 Y 7.59 4.30 0.00 3.15 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 96 A 7.86 4.06 0.57 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 0.00 0.00 97 V 7.54 3.81 2.35 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 0.97 0.00 0.00 1.19 0.00 0.00 98 F 8.34 4.29 0.00 3.15 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.59 4.28 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 7.70 4.17 0.00 1.93 2.00 0.00 3.28 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 109 C 7.29 4.15 0.00 1.32 2.62 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 0.00 110 L 8.40 3.92 0.00 1.65 1.66 0.95 0.46 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 0.00 111 N 8.08 4.26 0.00 2.72 2.83 0.00 0.00 7.40 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 0.00 112 G 8.89 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 0.00 0.00 0.00 113 L 7.95 3.57 0.00 1.79 1.55 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.98 3.93 0.00 2.07 1.94 0.00 3.21 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 115 E 8.05 3.98 0.00 2.20 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 2.39 2.45 0.00 116 T 7.74 3.81 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 1.13 0.00 0.00 117 Y 7.99 4.53 0.00 3.11 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.19 4.01 0.00 1.95 1.75 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.96 4.02 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 0.00 120 L 7.93 4.19 0.00 1.74 1.81 1.11 0.83 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 0.00 121 G 7.61 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 0.00 122 T 7.93 4.02 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 123 P 0.00 4.47 0.00 2.23 2.21 0.00 3.61 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 124 G 8.88 3.83 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 0.00 125 S 8.20 4.16 0.00 4.06 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 S 7.95 4.12 0.00 4.00 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 0.00 127 V 7.42 3.55 2.22 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 1.15 0.00 0.00 0.57 0.00 0.00 128 A 8.33 4.08 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 0.00 129 V 7.78 3.64 2.22 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 0.96 0.00 0.00 0.98 0.00 0.00 130 G 8.05 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 V 8.36 3.94 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.15 0.00 0.00 132 G 8.16 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 0.00 133 K 8.09 4.01 0.00 1.91 1.80 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.65 7.81 134 M 7.93 4.01 0.00 2.23 2.31 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.56 0.00 135 K 7.49 2.00 0.00 1.03 1.64 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.16 1.00 7.81 136 E 7.64 3.79 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 137 A 7.70 3.96 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 0.00 138 A 8.12 3.92 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 0.00 139 L 8.00 3.91 0.00 1.67 1.71 0.97 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.75 4.00 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 0.00 141 I 7.55 3.92 2.04 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 1.41 1.19 0.93 0.00 0.00 142 V 7.81 3.73 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.99 0.00 0.00 143 N 8.04 4.68 0.00 2.83 2.84 0.00 0.00 7.02 7.67 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 0.00 144 D 7.18 4.41 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 0.00 145 P 0.00 4.35 0.00 2.20 2.17 0.00 3.57 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 1.98 2.08 0.00 146 A 8.28 3.98 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 0.00 147 G 8.81 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 0.00 148 I 7.11 4.57 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.95 0.00 0.00 149 T 8.54 3.90 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 1.22 0.00 0.00 150 P 0.00 4.22 0.00 2.04 2.00 0.00 3.73 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 2.03 2.10 0.00 151 G 7.85 3.83 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 0.00 152 D 8.71 4.78 0.00 2.63 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 0.00 153 C 8.40 4.91 0.00 2.99 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 9.47 4.09 0.00 4.00 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 0.00 155 A 7.93 3.98 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 0.00 156 L 7.84 3.90 0.00 1.78 1.88 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 157 A 8.71 4.09 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 0.00 158 S 8.01 4.17 0.00 4.07 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 7.78 3.69 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.11 0.00 160 I 7.80 3.72 2.13 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.08 1.20 0.00 0.00 161 A 8.03 4.30 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 G 7.94 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 0.00 163 Y 7.42 4.45 0.00 2.98 2.83 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 0.00 164 F 8.18 4.08 0.00 3.32 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 0.00 165 D 8.57 4.46 0.00 2.87 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 0.00 166 R 7.94 3.95 0.00 2.11 2.07 0.00 3.40 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 167 A 8.10 4.14 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 A 8.48 4.01 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 0.00 169 A 8.49 4.25 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 0.00 170 A 7.65 4.04 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 V 7.60 4.50 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 1.14 0.00 0.00 1.11 0.00 0.00 172 S 8.12 4.33 0.00 4.06 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 * Residues marked with a * may have inaccurate shift predictions.