NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 N 4.7221 8.4093 118.2095 53.1360 38.5476 173.6396 7 S 4.5217 8.1862 111.3950 57.5470 63.3196 173.7557 8 A 3.8960 8.9966 127.9609 55.2750 19.1685 179.8864 9 Y 4.6514 7.6319 111.3610 56.2299 40.9518 176.1977 10 A 4.3384 8.5550 127.5758 50.9994 17.3611 176.3920 11 A 4.5132 8.2728 119.9862 51.4790 19.8448 177.9051 12 G 3.7471 8.2410 104.0038 46.3524 0.0000 174.4436 13 V 3.8905 7.6971 119.3592 62.2552 30.7207 175.5416 14 K 4.8439 8.4599 125.7980 55.3443 34.1753 175.8983 15 I 5.5199 7.8253 120.6149 58.2918 40.9285 174.2121 16 A 5.4531 8.7663 126.9699 50.3008 22.4013 175.0089 17 I 4.8368 9.1500 123.4073 60.1288 39.1622 175.3413 18 V 5.3956 8.1959 121.0143 58.5250 35.0570 176.5164 *20 G 4.1423 8.6468 106.6575 46.8668 0.0000 173.6589 21 S 4.8061 8.2591 114.9109 55.5095 67.3539 174.8129 22 K 3.9029 8.9134 124.3500 59.9348 31.9243 179.1951 23 S 4.2570 8.1071 113.4879 61.0028 63.0792 175.6384 24 D 4.5840 8.2742 122.4263 56.1760 40.2833 178.0088 25 W 4.4837 8.3029 128.6345 60.1246 30.6760 177.2107 26 A 4.0860 7.5177 119.4083 55.0956 17.9754 177.9190 27 T 4.2834 7.7166 113.1468 64.1745 68.6232 176.6138 *29 Q 2.9614 8.0292 121.8606 55.5753 30.1195 177.2220 30 F 3.8627 8.0142 117.2840 59.8189 38.8874 177.5278 31 A 4.0399 7.8845 120.2589 54.9647 18.2562 179.2225 32 A 3.1553 7.6912 118.7944 55.2405 18.4599 179.4504 33 D 4.2872 8.1509 117.4999 57.3701 40.8531 179.1878 34 V 3.6466 7.4100 117.4918 66.0535 31.5061 178.1792 35 L 4.0146 7.6909 118.4231 57.8409 41.3837 179.5419 36 T 4.0500 8.3369 116.0897 67.1642 68.2437 176.6509 37 T 4.0234 7.7949 116.1268 66.5222 68.6146 175.8349 38 L 4.3545 7.9253 117.5140 53.9874 42.0670 176.3357 39 N 4.1700 8.0227 115.4176 54.4017 36.5469 174.2740 40 V 4.3522 7.8220 118.1493 60.5461 33.2720 173.8496 41 P 4.6195 0.0000 0.0000 62.9665 32.4307 175.3574 42 F 5.3769 8.0356 116.5092 56.1385 41.2103 172.5739 43 H 5.0676 9.3337 119.4541 54.4732 32.4760 173.0097 44 V 5.0527 7.9028 123.3623 61.3630 34.2975 174.0854 45 E 4.6271 8.8068 125.9377 55.1065 33.6351 173.7038 46 V 4.3910 8.2185 125.8356 61.8816 32.8743 175.2830 47 V 4.2972 8.1041 126.9766 61.3460 34.8620 173.6588 48 S 4.7962 8.8419 123.0749 56.2881 63.5659 174.7361 49 A 4.0262 8.6518 130.6216 54.9416 18.3943 177.7004 50 H 4.7929 7.9363 110.9140 56.8536 30.2454 176.1398 51 R 4.3006 8.2449 117.7110 57.4113 31.3223 176.6886 52 T 4.7242 7.8278 107.4820 58.9981 68.8979 173.0605 53 P 4.1834 0.0000 0.0000 66.8903 31.7650 178.0925 54 D 4.2469 7.9219 118.1682 57.0149 40.7304 178.5538 55 R 3.9995 7.9623 118.8245 59.0350 30.1444 178.0607 56 L 4.0601 8.1411 120.4194 58.3171 42.0358 179.0649 57 F 4.3645 8.3474 117.2393 60.8330 38.8822 177.9017 58 S 4.3555 8.4782 114.8669 61.4413 62.3806 176.5306 59 F 3.9120 8.5753 122.6424 61.2218 39.6331 176.7671 60 A 4.2352 8.3797 120.3703 55.3540 18.0022 179.3982 61 E 3.9276 8.3924 116.2712 59.0166 29.7931 178.6682 62 Q 4.3727 7.7924 115.3421 55.4480 29.1410 177.2043 63 A 3.6979 7.4618 123.8212 55.2638 18.3342 179.9231 64 E 3.8534 8.0553 116.1467 59.6156 29.4361 179.3848 65 A 3.9158 7.8820 119.8576 55.0572 18.5665 177.7566 66 N 4.4606 8.1153 111.1137 53.7466 38.4486 176.0901 67 G 3.9537 8.4584 107.9378 45.2280 0.0000 173.4420 68 L 4.4449 7.6878 119.3049 54.8814 42.2114 176.4571 69 H 4.8981 9.2591 118.9038 56.2930 31.4174 175.1093 70 V 4.7000 7.6892 117.0527 61.2590 35.3493 173.6413 71 I 5.0045 8.8809 128.2477 59.7254 39.8468 174.4148 72 I 4.8715 8.9577 128.2629 59.6789 39.1646 174.5012 73 A 5.1288 9.3712 129.4562 50.0541 21.6651 174.7294 74 G 4.3908 8.7774 110.7166 44.8942 0.0000 172.2283 75 N 4.8841 8.6086 120.2572 52.7740 43.1754 172.9032 76 G 4.4406 8.1545 108.7206 43.9369 0.0000 175.4900 77 G 3.9917 8.8603 110.5302 46.1918 0.0000 178.0455 78 A 4.2343 8.6414 126.5380 51.1434 16.5944 176.7421 79 A 4.4537 8.0143 124.5832 51.5955 17.6056 176.8913 80 H 4.7532 8.0892 117.0751 55.8549 30.2109 177.4590 81 L 3.8804 8.1268 121.3156 57.7443 42.2411 176.2495 82 P 4.4262 0.0000 0.0000 65.6611 31.5720 179.2418 83 G 3.9933 7.5853 106.1767 45.9366 0.0000 175.5328 *85 L 4.2195 8.1743 120.7933 54.4149 43.6183 179.4371 86 A 4.0001 8.1423 120.9094 54.8754 18.4219 179.3249 87 A 4.0122 7.9057 117.9102 54.1339 18.4903 178.2022 88 K 4.3571 7.7604 112.9998 56.2411 33.1113 175.6505 89 T 4.6170 7.2508 111.8328 60.7683 70.3615 173.4661 90 L 4.2360 8.2847 124.3326 55.7361 42.2863 177.6487 91 V 3.7021 7.5624 119.8976 62.3292 31.9325 174.1383 92 P 4.3918 0.0000 0.0000 63.1227 32.7336 175.0730 93 V 4.8185 8.4555 122.9829 61.1103 34.4332 173.8065 94 L 5.2057 9.1545 128.2652 52.9685 44.3014 175.4754 95 G 4.3958 9.1760 111.3241 44.3563 0.0000 172.2966 96 V 4.6965 8.5977 124.6707 60.2017 33.9737 172.9031 97 P 4.8235 0.0000 0.0000 62.3917 32.2294 175.9838 98 V 4.1156 8.5483 126.1980 62.0243 32.4238 175.6809 99 Q 4.0042 8.6562 129.0610 56.1080 29.5518 175.7128 100 S 4.6318 8.4483 119.2668 56.6895 65.0006 174.6820 101 A 3.9531 8.2829 123.5500 55.3566 18.6927 179.1794 102 A 4.0771 8.0338 117.2752 55.1338 18.8474 178.5210 103 L 4.3994 7.8627 112.9899 53.9486 42.0739 176.9558 104 S 3.9532 8.3739 112.6965 58.6129 60.3415 173.3273 105 G 3.9077 8.4255 107.5668 45.9120 0.0000 176.5851 106 V 3.3132 7.7588 120.4317 65.5022 31.2391 177.6110 107 D 4.2783 7.8515 118.5318 56.6148 39.1307 178.4836 108 S 4.2205 8.0018 116.4604 61.0641 62.8569 176.3742 109 L 3.9929 8.1641 123.0818 58.5447 41.8413 178.6452 110 Y 4.4345 8.2517 117.2570 61.1037 37.6155 178.4119 111 S 4.4016 8.3190 113.3282 60.1590 63.3265 175.6728 112 I 4.2071 7.2020 123.2627 63.5492 37.8754 177.9271 113 V 3.8939 7.9967 120.1673 62.7859 31.8185 176.7165 114 Q 4.0652 7.3481 118.4274 54.4805 29.1773 173.5789 *116 P 4.1494 0.0000 0.0000 61.8196 32.4984 175.6604 117 R 3.9084 8.4485 118.7579 57.6478 30.0931 175.5750 118 G 3.9202 8.6469 113.6668 45.7537 0.0000 173.6329 119 I 4.4064 7.3704 118.3013 58.8666 39.2396 172.9847 120 P 4.6687 0.0000 0.0000 61.7023 32.6551 175.6854 121 V 4.4567 8.0264 119.1414 61.0974 34.4230 174.9068 122 G 3.8508 8.9802 116.1881 46.4069 0.0000 172.3207 123 T 5.1619 8.5307 122.9547 61.9085 71.1986 174.2284 124 L 4.7388 8.2701 124.6263 52.3349 44.9835 176.0560 125 A 4.1291 8.3711 121.9090 52.0568 18.8507 177.1156 126 I 4.0199 8.0490 120.9748 62.9107 38.0848 177.8071 127 G 3.7511 8.9304 113.6989 44.7089 0.0000 173.7202 128 K 3.6489 8.3023 116.6492 59.7988 32.2523 178.7830 129 A 4.0154 7.7905 121.7905 54.9869 18.2730 179.6652 130 G 4.0806 8.2026 104.8589 47.0116 0.0000 175.8176 131 A 3.9451 7.9955 122.9376 55.0250 18.4520 179.5346 132 A 4.0947 8.0280 119.3032 55.5449 18.4479 179.6883 133 N 4.2765 8.2994 114.6801 56.1041 38.4683 177.6016 134 A 4.0035 8.3743 122.6527 54.9238 18.3375 179.5362 135 A 3.8399 7.8330 118.9874 55.2516 18.3677 179.9119 136 L 3.6770 7.8327 117.5219 57.6684 41.5563 179.5213 137 L 3.8841 8.3287 120.5566 57.9689 41.9830 178.7501 138 A 3.9488 8.2890 120.8802 55.2606 18.2317 179.5210 139 A 3.9175 8.2384 119.4389 55.3438 18.1825 179.8723 140 Q 3.9148 8.1285 116.2181 59.0010 29.1353 178.8778 141 I 3.8740 8.0120 121.0508 64.4713 37.1686 178.4300 142 L 4.0513 8.1533 119.6736 57.7689 41.5943 179.3014 143 A 4.2544 8.3656 120.1835 54.2251 18.0338 179.2949 144 L 4.0592 7.6780 116.8333 57.2196 41.6542 177.2809 145 H 4.9274 8.2582 115.1036 54.9084 30.1342 173.9377 146 D 4.5724 7.8987 120.2736 52.3395 42.2477 175.1669 147 T 3.8946 8.3170 120.3654 64.6132 67.5408 175.3302 148 E 4.0024 8.1866 120.3954 59.1469 29.5538 178.7062 149 L 3.9566 8.3331 120.2528 58.0528 42.1395 178.7491 150 A 4.1151 8.2146 120.9456 55.2428 18.2927 179.8762 151 G 3.5938 8.1603 104.1051 48.0658 0.0000 176.2267 152 R 4.0670 8.1588 120.4911 58.9168 29.9534 179.1733 153 L 4.0316 8.4738 119.1906 57.6944 41.5260 179.3520 154 A 4.0411 8.2466 120.8212 55.3896 18.2485 179.1797 155 H 4.0729 8.5066 116.8045 59.0305 29.9485 177.1881 156 W 4.0942 8.5609 130.3059 60.6646 30.4636 178.1393 157 R 4.1307 8.5912 118.1564 59.4841 29.5076 178.8743 158 Q 3.9288 8.3978 119.5647 59.1448 28.9755 178.2845 159 S 3.9491 8.1620 114.4658 61.2159 62.1171 175.9195 160 Q 3.7204 7.7929 122.3144 59.3082 28.7209 178.3362 161 T 3.8672 8.0353 116.8715 66.8793 68.4523 176.4984 162 D 4.3250 8.4305 121.1373 57.2418 40.5368 178.3524 163 D 4.2373 7.8114 118.1100 57.0106 41.4351 178.2534 164 V 3.7145 7.4968 118.7410 65.9890 31.4032 178.1486 165 L 4.0523 7.8583 117.4324 57.6180 41.5110 178.6113 166 D 4.6139 8.1803 117.1679 55.1652 42.2833 176.1850 167 N 5.0720 7.6719 116.1039 51.1368 38.9650 172.7009 168 P 4.2472 0.0000 0.0000 64.5156 32.6694 176.6576 169 D 4.7192 7.8541 119.4444 51.7061 41.4615 174.7000 170 P 4.4794 0.0000 0.0000 64.5697 31.6834 177.4290 171 R 4.1286 8.3279 117.6623 57.4922 30.3479 176.0760 172 E 4.6628 7.6982 117.8764 54.0681 31.4977 175.5134 173 E 4.0671 8.6077 123.2542 56.0005 30.5843 176.3876 174 A 4.3099 8.4079 126.3782 52.3265 19.2757 176.8739 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 N 8.41 4.72 0.00 2.80 2.93 0.00 0.00 5.85 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.19 4.52 0.00 4.00 3.89 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 8 A 9.00 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 7.63 4.65 0.00 2.93 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 10 A 8.56 4.34 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 11 A 8.27 4.51 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 12 G 8.24 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 13 V 7.70 3.89 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 0.93 0.00 0.00 14 K 8.46 4.84 0.00 1.69 1.68 0.00 1.83 0.00 0.00 1.46 0.00 0.00 2.71 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.24 1.36 7.81 15 I 7.83 5.52 2.00 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 1.16 2.25 0.97 0.00 0.00 16 A 8.77 5.45 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 9.15 4.84 2.02 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.98 1.04 0.00 0.00 18 V 8.20 5.40 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.84 0.00 0.00 *20 G 8.65 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 0.00 0.00 0.00 0.00 21 S 8.26 4.81 0.00 3.90 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.91 3.90 0.00 1.82 1.84 0.00 1.70 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.51 7.81 23 S 8.11 4.26 0.00 4.12 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 24 D 8.27 4.58 0.00 2.95 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 25 W 8.30 4.48 0.00 3.31 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 26 A 7.52 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 27 T 7.72 4.28 4.40 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 1.16 0.00 0.00 *29 Q 8.03 2.96 0.00 1.32 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.91 0.00 0.00 0.00 0.00 0.00 2.01 1.64 0.00 30 F 8.01 3.86 0.00 3.21 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 31 A 7.88 4.04 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 32 A 7.69 3.16 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 33 D 8.15 4.29 0.00 2.57 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 34 V 7.41 3.65 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 0.68 0.00 0.00 0.93 0.00 0.00 35 L 7.69 4.01 0.00 1.55 1.97 0.66 0.54 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 36 T 8.34 4.05 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 37 T 7.79 4.02 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 38 L 7.93 4.35 0.00 1.62 1.70 0.68 0.83 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 39 N 8.02 4.17 0.00 2.90 2.93 0.00 0.00 6.73 7.24 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 40 V 7.82 4.35 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.01 0.00 0.00 41 P 0.00 4.62 0.00 2.28 1.93 0.00 3.68 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 42 F 8.04 5.38 0.00 3.10 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 43 H 9.33 5.07 0.00 3.35 3.33 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.90 5.05 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 0.55 0.00 0.00 1.26 0.00 0.00 45 E 8.81 4.63 0.00 2.09 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 46 V 8.22 4.39 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 0.79 0.00 0.00 0.87 0.00 0.00 47 V 8.10 4.30 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.60 0.00 0.00 48 S 8.84 4.80 0.00 4.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.65 4.03 1.14 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 0.00 0.00 0.00 50 H 7.94 4.79 0.00 3.14 3.33 0.00 5.71 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.24 4.30 0.00 1.77 1.98 0.00 3.11 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 52 T 7.83 4.72 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 53 P 0.00 4.18 0.00 2.08 2.40 0.00 3.75 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 1.99 2.01 0.00 54 D 7.92 4.25 0.00 2.69 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 55 R 7.96 4.00 0.00 1.96 2.11 0.00 3.35 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.83 0.00 56 L 8.14 4.06 0.00 1.82 1.98 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.35 4.36 0.00 3.23 3.11 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 58 S 8.48 4.36 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0.00 0.00 0.00 0.00 0.00 101 A 8.28 3.95 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 0.00 102 A 8.03 4.08 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 0.00 103 L 7.86 4.40 0.00 1.81 1.61 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 104 S 8.37 3.95 0.00 3.95 3.89 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 0.00 105 G 8.43 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 0.00 106 V 7.76 3.31 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.81 0.00 0.00 107 D 7.85 4.28 0.00 2.90 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 0.00 108 S 8.00 4.22 0.00 4.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 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0.00 0.00 0.00 0.00 0.00 135 A 7.83 3.84 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 0.00 136 L 7.83 3.68 0.00 1.68 1.50 0.62 -0.69 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 0.00 137 L 8.33 3.88 0.00 1.74 1.62 0.91 0.95 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 0.00 138 A 8.29 3.95 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 0.00 139 A 8.24 3.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.13 3.91 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 141 I 8.01 3.87 2.05 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 1.53 1.26 0.94 0.00 0.00 142 L 8.15 4.05 0.00 1.85 1.73 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 143 A 8.37 4.25 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 0.00 144 L 7.68 4.06 0.00 1.79 1.69 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 145 H 8.26 4.93 0.00 3.12 3.26 0.00 5.66 0.00 0.00 0.00 0.00 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 7.90 4.57 0.00 2.68 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 0.00 147 T 8.32 3.89 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 0.00 148 E 8.19 4.00 0.00 2.19 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 2.41 2.37 0.00 149 L 8.33 3.96 0.00 1.88 1.84 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 150 A 8.21 4.12 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 0.00 151 G 8.16 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 R 8.16 4.07 0.00 2.04 2.06 0.00 3.17 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 153 L 8.47 4.03 0.00 1.84 1.73 0.92 0.48 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 0.00 154 A 8.25 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 0.00 155 H 8.51 4.07 0.00 3.33 3.58 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 W 8.56 4.09 0.00 3.59 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 0.00 157 R 8.59 4.13 0.00 2.22 2.06 0.00 3.25 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.94 0.00 158 Q 8.40 3.93 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 159 S 8.16 3.95 0.00 3.75 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 Q 7.79 3.72 0.00 1.70 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 161 T 8.04 3.87 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 1.20 0.00 0.00 162 D 8.43 4.32 0.00 2.64 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 D 7.81 4.24 0.00 2.68 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 0.00 164 V 7.50 3.71 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 0.96 0.00 0.00 0.95 0.00 0.00 165 L 7.86 4.05 0.00 1.64 1.71 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 166 D 8.18 4.61 0.00 2.66 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 0.00 167 N 7.67 5.07 0.00 2.63 2.69 0.00 0.00 6.98 8.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 P 0.00 4.25 0.00 2.17 2.17 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 1.97 1.94 0.00 169 D 7.85 4.72 0.00 2.68 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 0.00 170 P 0.00 4.48 0.00 2.21 2.15 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 171 R 8.33 4.13 0.00 1.94 2.02 0.00 3.12 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 1.66 1.59 0.00 172 E 7.70 4.66 0.00 2.05 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 173 E 8.61 4.07 0.00 1.92 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 174 A 8.41 4.31 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 * Residues marked with a * may have inaccurate shift predictions.