NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8904 8.3093 115.8795 57.0869 39.9830 175.9730 11 H 4.1673 6.7537 116.4910 56.0961 29.1894 173.8763 12 E 3.8699 8.4311 121.5387 58.9669 30.4701 178.1281 13 M 4.4548 7.8317 115.1161 55.2025 32.1637 176.4093 14 R 4.5123 7.5047 116.8953 55.6003 32.4924 175.6761 15 E 4.0686 7.6900 117.3610 54.9514 30.1919 175.0829 16 P 4.4603 0.0000 0.0000 62.9709 32.3235 175.4518 17 R 4.6340 8.2975 116.8146 54.7455 33.5487 174.0730 18 I 4.2438 8.3595 121.3108 61.1244 37.2512 175.5051 19 E 4.3017 9.1309 129.7059 58.3238 29.8533 176.6847 20 K 4.8295 7.7581 117.0554 55.6340 36.2687 174.3598 21 V 4.5073 8.6045 122.9763 61.3961 33.6642 174.8283 22 V 4.3593 8.6573 130.6279 61.6808 32.5104 175.0078 23 V 4.4902 8.4265 130.2457 61.9174 32.4747 174.0838 24 H 5.3716 9.2507 128.3969 54.5778 33.5557 172.4843 25 M 4.5911 8.6911 123.1812 53.5727 34.9400 175.1362 26 G 3.5640 8.4017 112.5922 45.6355 0.0000 171.7495 27 I 3.9879 9.0906 128.4122 59.0118 36.1986 175.5540 28 G 3.4616 6.8805 123.8537 46.3254 0.0000 174.5335 29 H 4.5755 7.4067 113.4669 56.6861 28.9619 174.3868 *35 A 4.2823 7.4449 122.2029 52.4416 20.3973 177.9419 36 N 4.5101 7.9277 113.4064 53.6401 37.5007 175.8629 37 A 4.4072 7.7835 121.4822 52.6834 19.1285 178.7994 38 E 4.1870 8.0205 117.7024 59.4782 28.1411 178.8004 39 D 4.4697 8.0505 118.9316 57.1290 41.0124 178.3667 40 I 3.9866 7.6895 112.6568 63.1731 37.9241 178.0750 41 L 4.2430 7.4481 118.6846 57.5416 40.0911 179.0963 42 G 3.7279 7.8226 103.3788 46.7223 0.0000 175.2559 43 E 4.4244 7.4486 120.0665 58.6040 29.9622 177.8658 44 I 4.1284 7.3419 116.3758 63.3209 38.2998 177.3434 45 T 4.1519 8.1655 110.3620 64.3663 69.2295 174.6959 46 G 3.5227 6.6214 112.7483 44.0332 0.0000 172.6338 47 Q 4.7914 7.1058 117.4738 54.2797 31.2913 174.2911 48 M 4.3079 8.3637 117.1976 54.4469 32.8695 174.3432 49 P 4.9218 0.0000 0.0000 61.9436 33.7817 175.1284 50 V 4.5680 8.2151 112.7771 59.3652 35.2892 176.0407 51 R 4.6464 8.6275 122.4416 56.6688 31.2754 175.9883 52 T 4.6040 8.5392 117.0886 62.0055 71.9984 174.4832 53 K 4.8899 8.8973 125.3179 54.6777 34.5030 175.2327 54 A 4.7350 8.0850 119.8876 50.8852 22.1874 176.1642 55 K 4.3975 8.5291 118.8148 55.2947 34.7765 172.5375 56 R 3.9171 8.4576 126.9810 55.7479 30.1711 176.5611 57 T 4.1436 8.4922 119.3336 63.4083 68.5747 174.0137 58 V 4.3912 8.1211 126.0975 60.8824 33.5475 176.3539 59 G 3.8916 8.6409 113.5061 46.5971 0.0000 173.5089 60 E 4.3793 7.9014 118.9866 56.2443 29.9499 175.9123 61 F 3.8089 8.1397 115.4380 60.5899 38.6830 175.2316 62 D 4.6720 7.6723 117.8780 52.6943 41.1407 175.1891 63 I 4.1314 7.2562 111.1551 60.6635 38.9911 176.2159 64 R 4.4283 7.4037 121.8718 54.6895 31.5521 174.8654 65 E 4.0431 8.4952 127.1531 58.7296 30.2487 176.8280 66 G 4.1625 7.5938 113.1424 43.9727 0.0000 171.4772 67 D 4.6478 7.7521 123.2077 50.9241 42.6576 173.8478 68 P 4.6168 0.0000 0.0000 63.5221 31.4821 175.6662 69 I 4.2623 8.8797 125.3664 62.4695 39.9596 175.5678 70 G 4.5244 7.5674 106.5363 45.9705 0.0000 171.4791 71 A 5.4096 8.2980 119.9274 50.6425 23.1421 176.1778 72 K 5.1026 9.0618 118.8535 55.2935 37.0213 175.5706 73 V 4.5964 8.4510 120.8260 61.5675 34.7289 174.0468 74 T 4.7207 8.5720 119.0005 60.3809 70.0323 173.8701 75 L 4.6580 8.6601 127.5072 53.1702 43.4426 176.1330 76 R 4.9107 7.9875 120.7027 55.0815 34.9266 176.6106 77 D 4.4158 9.0733 122.7781 55.8739 40.0277 176.8575 78 E 4.1068 9.1293 130.8117 60.3601 29.2360 177.4582 79 M 4.2339 7.7265 116.3012 57.1915 32.2287 177.9767 80 A 4.3932 7.7138 120.8023 54.6963 19.5143 179.1542 81 E 4.0802 8.0387 116.7111 59.4320 29.3811 178.8328 82 E 4.2547 8.1812 116.3061 57.6098 29.8057 177.8814 83 F 4.5994 7.9039 120.8090 60.3019 40.3289 177.2539 84 L 4.1837 8.0851 117.9607 57.2398 41.1746 179.2337 85 Q 4.1234 7.8211 117.9461 57.7153 28.7463 176.6770 86 T 4.3606 7.6616 106.5399 61.0869 70.0766 174.2537 87 A 4.3275 7.4355 125.1174 53.6243 20.2940 179.4073 88 L 3.9869 7.8121 115.6591 57.4729 41.7619 177.0476 89 P 4.5684 0.0000 0.0000 63.1751 31.0976 176.6499 90 L 4.3837 7.3929 117.1367 55.1639 42.3759 176.5050 91 A 4.6293 7.3413 119.8394 50.1135 22.1172 175.4605 92 E 4.2402 8.5596 120.4179 55.1078 29.6399 176.5737 93 L 4.0445 8.3359 124.7848 54.1925 42.3113 176.7567 94 A 4.9089 8.2871 125.9782 50.6809 21.6271 176.5663 95 T 4.2353 8.3770 115.1653 66.6349 68.7291 177.4636 96 S 4.2876 8.0308 112.9151 59.8952 63.0912 174.3252 97 Q 4.4294 8.2261 120.2303 56.2092 28.5445 174.8892 98 F 4.9596 7.5765 116.6480 55.6654 41.2533 175.1579 99 D 4.7888 8.9931 123.5968 53.5215 41.9723 177.1349 100 D 4.5134 8.5701 121.2881 56.7718 41.0167 177.8034 101 T 4.2252 7.7573 113.4287 63.7359 69.2634 175.0264 102 G 4.1252 8.0937 109.6022 46.2948 0.0000 172.6817 103 N 5.5667 8.2043 114.4238 51.1198 43.4207 174.4637 104 F 5.3037 8.3497 113.1822 54.2006 41.6880 173.4311 105 S 5.1468 8.7047 114.8325 56.5349 65.4637 172.9057 106 F 4.8962 8.4328 120.5213 56.2016 41.0531 173.7996 107 G 4.1397 8.9018 105.2123 45.3676 0.0000 174.6098 *128 L 4.0949 8.3022 125.3013 55.1516 43.4492 175.3730 129 D 4.9308 8.9208 127.5210 52.8075 42.9619 175.9648 130 V 4.4203 7.9312 123.4433 61.4753 33.6976 173.9458 131 T 4.7066 8.4343 125.4338 61.5853 71.0802 173.9191 132 V 4.5133 7.8377 125.8874 61.0093 34.3065 173.7036 133 N 4.7425 9.1519 128.2001 52.5415 39.8671 173.4124 134 L 5.2986 8.3588 126.5692 53.3426 44.1894 176.1387 135 V 4.2394 7.9938 120.6561 60.9436 35.3602 173.0038 136 R 4.4711 8.2731 119.6412 54.6329 30.8264 176.3894 137 P 4.2765 0.0000 0.0000 64.9765 31.4227 176.9516 138 G 4.2292 7.8966 107.7499 45.4122 0.0000 174.7542 139 Y 4.1353 8.0818 121.2818 59.2796 39.0032 175.7403 140 R 3.8548 8.0580 119.3957 59.5616 30.1222 178.1122 141 V 3.5090 7.4821 117.5499 65.0571 31.1926 176.7639 142 A 4.6705 7.4436 119.0091 51.0120 19.8038 177.0139 143 K 4.2121 7.4461 114.7239 56.0424 33.9774 176.7396 144 R 4.2429 7.7398 115.4672 55.5926 30.4056 176.7008 145 D 4.4271 8.4638 117.8779 57.0724 39.8818 177.5345 146 K 4.0190 7.9328 118.4270 57.3584 32.6318 177.1284 147 A 3.9523 8.7161 126.6231 52.7759 16.3062 177.0382 148 S 4.5427 7.2272 112.7529 60.0340 63.7846 173.8643 149 R 4.6930 9.0275 121.6849 54.7060 33.9393 173.7869 150 S 4.4539 8.5865 118.9472 57.5514 63.4291 173.9083 151 I 3.8656 8.3583 127.7343 60.6612 37.7461 174.4617 152 P 4.4732 0.0000 0.0000 62.4277 31.6338 177.4782 153 T 3.9575 8.5905 111.7219 64.9751 68.0644 176.5914 154 K 3.9265 7.9745 120.1906 58.9138 32.4640 177.6333 155 H 4.5022 7.9939 115.8471 55.9208 30.4539 175.4008 156 R 4.1706 6.9320 119.6104 55.9580 30.6608 176.2298 157 L 4.0529 8.2893 124.0275 55.1644 42.8919 176.5829 158 N 4.9131 8.3213 121.9519 51.4188 41.7983 174.7404 159 P 4.2477 0.0000 0.0000 65.6993 31.3455 179.0511 160 A 3.8579 7.8059 119.2159 55.1654 18.1912 179.1574 161 D 4.3428 7.9689 115.3148 56.5991 41.1129 178.2416 162 A 4.2731 7.5367 122.0468 54.8337 18.7660 179.6475 163 V 3.2398 7.3737 116.3650 66.0426 31.1301 178.1541 164 A 3.9994 7.7478 120.5420 54.8812 17.9030 179.4781 165 F 4.2862 7.7941 118.8467 61.5901 39.8363 177.3407 166 I 3.7398 7.7189 119.0007 64.0516 36.8038 177.8229 167 E 4.0997 8.0337 119.5181 58.6952 29.4842 177.7585 168 S 4.5515 7.2261 109.6211 57.9108 63.4685 174.5065 169 T 4.0767 6.9335 116.9253 63.1234 68.8571 172.4450 170 Y 3.7414 7.7323 118.8117 58.0802 35.8977 169.1792 171 D 4.5757 7.6746 117.4569 52.7861 42.1202 174.0977 172 V 4.4352 7.9478 118.7808 61.1997 34.5622 176.5193 173 E 4.5825 8.0813 125.3667 54.0627 28.0952 176.5178 174 V 3.5981 8.6809 117.6793 63.2536 32.5885 171.7574 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 10 F 8.31 4.89 0.00 3.20 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 11 H 6.75 4.17 0.00 3.18 3.01 0.00 5.46 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.43 3.87 0.00 1.64 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 13 M 7.83 4.45 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 14 R 7.50 4.51 0.00 1.83 1.90 0.00 3.33 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 15 E 7.69 4.07 0.00 2.00 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 2.51 2.23 0.00 16 P 0.00 4.46 0.00 0.49 1.53 0.00 3.36 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 1.79 1.87 0.00 17 R 8.30 4.63 0.00 1.84 1.92 0.00 2.75 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 18 I 8.36 4.24 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.85 0.99 0.00 0.00 19 E 9.13 4.30 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 20 K 7.76 4.83 0.00 1.80 1.84 0.00 1.50 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.41 7.81 21 V 8.60 4.51 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 1.09 0.00 0.00 0.99 0.00 0.00 22 V 8.66 4.36 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 0.79 0.00 0.00 0.87 0.00 0.00 23 V 8.43 4.49 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 0.85 0.00 0.00 0.37 0.00 0.00 24 H 9.25 5.37 0.00 3.11 3.01 0.00 5.58 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 25 M 8.69 4.59 0.00 1.89 1.86 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 2.40 0.00 26 G 8.40 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 27 I 9.09 3.99 1.92 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 1.25 0.71 0.87 0.00 0.00 28 G 6.88 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 29 H 7.41 4.58 0.00 3.22 3.40 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 7.44 4.28 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 36 N 7.93 4.51 0.00 2.85 2.96 0.00 0.00 5.94 7.26 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 37 A 7.78 4.41 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 38 E 8.02 4.19 0.00 2.02 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 2.38 2.39 0.00 39 D 8.05 4.47 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.69 3.99 1.88 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 1.64 0.82 0.92 0.00 0.00 41 L 7.45 4.24 0.00 1.83 1.70 0.88 0.73 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 42 G 7.82 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 43 E 7.45 4.42 0.00 2.24 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 2.32 2.44 0.00 44 I 7.34 4.13 1.96 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.86 1.18 0.00 0.00 45 T 8.17 4.15 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 0.86 0.00 0.00 46 G 6.62 3.52 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 0.00 0.00 0.00 47 Q 7.11 4.79 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.72 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 48 M 8.36 4.31 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 49 P 0.00 4.92 0.00 2.04 2.00 0.00 3.68 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 2.06 2.14 0.00 50 V 8.22 4.57 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 0.71 0.00 0.00 0.97 0.00 0.00 51 R 8.63 4.65 0.00 1.69 1.85 0.00 3.30 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 52 T 8.54 4.60 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 1.20 0.00 0.00 53 K 8.90 4.89 0.00 1.62 1.75 0.00 1.76 0.00 0.00 1.00 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.26 7.81 54 A 8.08 4.74 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.53 4.40 0.00 1.72 1.71 0.00 1.86 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.41 7.81 56 R 8.46 3.92 0.00 1.96 1.96 0.00 3.20 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 57 T 8.49 4.14 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 1.18 0.00 0.00 58 V 8.12 4.39 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 0.98 0.00 0.00 0.95 0.00 0.00 59 G 8.64 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 0.00 0.00 0.00 60 E 7.90 4.38 0.00 2.14 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 2.25 2.32 0.00 61 F 8.14 3.81 0.00 3.11 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 62 D 7.67 4.67 0.00 2.68 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.26 4.13 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.53 0.83 0.00 0.00 64 R 7.40 4.43 0.00 1.66 1.99 0.00 3.17 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.53 0.00 65 E 8.50 4.04 0.00 2.02 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 66 G 7.59 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 0.00 0.00 0.00 67 D 7.75 4.65 0.00 2.76 2.68 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 68 P 0.00 4.62 0.00 2.06 2.07 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 69 I 8.88 4.26 1.99 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 1.32 0.81 0.90 0.00 0.00 70 G 7.57 4.52 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 0.00 0.00 0.00 71 A 8.30 5.41 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 72 K 9.06 5.10 0.00 1.76 1.87 0.00 1.22 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.33 7.81 73 V 8.45 4.60 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.84 0.00 0.00 74 T 8.57 4.72 4.20 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 1.17 0.00 0.00 75 L 8.66 4.66 0.00 1.57 1.54 0.29 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.99 4.91 0.00 1.71 1.77 0.00 3.28 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.62 0.00 77 D 9.07 4.42 0.00 2.88 1.94 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 78 E 9.13 4.11 0.00 2.03 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 2.43 2.42 0.00 79 M 7.73 4.23 0.00 2.01 2.26 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 80 A 7.71 4.39 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 81 E 8.04 4.08 0.00 2.09 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 0.00 2.43 2.57 0.00 82 E 8.18 4.25 0.00 2.15 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 2.37 2.39 0.00 83 F 7.90 4.60 0.00 3.25 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.09 4.18 0.00 1.87 1.82 1.09 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 7.82 4.12 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.71 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 86 T 7.66 4.36 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 87 A 7.44 4.33 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 88 L 7.81 3.99 0.00 1.80 1.69 1.03 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.57 0.00 2.00 2.05 0.00 3.61 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 90 L 7.39 4.38 0.00 1.88 1.75 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.34 4.63 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 92 E 8.56 4.24 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 93 L 8.34 4.04 0.00 1.58 1.55 0.80 0.49 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 94 A 8.29 4.91 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 95 T 8.38 4.24 4.27 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 1.18 0.00 0.00 96 S 8.03 4.29 0.00 4.03 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 97 Q 8.23 4.43 0.00 2.36 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.88 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 98 F 7.58 4.96 0.00 3.24 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 99 D 8.99 4.79 0.00 2.92 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 0.00 100 D 8.57 4.51 0.00 2.73 2.75 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 0.00 101 T 7.76 4.23 4.43 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 1.23 0.00 0.00 102 G 8.09 4.13 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 0.00 0.00 0.00 103 N 8.20 5.57 0.00 2.69 2.81 0.00 0.00 6.47 8.13 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 0.00 104 F 8.35 5.30 0.00 2.75 1.74 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 0.00 105 S 8.70 5.15 0.00 3.77 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 F 8.43 4.90 0.00 3.10 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 0.00 107 G 8.90 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 *128 L 8.30 4.09 0.00 1.81 1.65 0.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.92 4.93 0.00 2.71 2.51 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 0.00 130 V 7.93 4.42 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.77 0.00 0.00 131 T 8.43 4.71 4.11 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 1.09 0.00 0.00 132 V 7.84 4.51 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 0.99 0.00 0.00 0.62 0.00 0.00 133 N 9.15 4.74 0.00 2.75 2.66 0.00 0.00 6.64 6.34 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 0.00 134 L 8.36 5.30 0.00 1.77 1.56 1.32 1.21 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 0.00 135 V 7.99 4.24 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 0.31 0.00 0.00 0.46 0.00 0.00 136 R 8.27 4.47 0.00 1.75 1.74 0.00 3.16 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 137 P 0.00 4.28 0.00 2.04 2.16 0.00 3.76 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 2.01 2.09 0.00 138 G 7.90 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 0.00 0.00 0.00 0.00 139 Y 8.08 4.14 0.00 3.15 2.99 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 0.00 140 R 8.06 3.85 0.00 1.93 1.92 0.00 3.24 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 141 V 7.48 3.51 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 0.96 0.00 0.00 0.99 0.00 0.00 142 A 7.44 4.67 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 0.00 143 K 7.45 4.21 0.00 1.55 1.72 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.63 1.08 7.81 144 R 7.74 4.24 0.00 1.88 1.90 0.00 3.03 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 145 D 8.46 4.43 0.00 2.67 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 0.00 146 K 7.93 4.02 0.00 1.80 1.72 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.72 3.95 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 0.00 148 S 7.23 4.54 0.00 3.97 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 0.00 149 R 9.03 4.69 0.00 1.84 1.72 0.00 3.12 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 150 S 8.59 4.45 0.00 3.92 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.36 3.87 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.22 1.05 0.00 0.00 152 P 0.00 4.47 0.00 2.21 1.99 0.00 3.65 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.59 3.96 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 1.23 0.00 0.00 154 K 7.97 3.93 0.00 1.77 1.93 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.57 7.81 155 H 7.99 4.50 0.00 3.17 3.36 0.00 5.94 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 6.93 4.17 0.00 1.88 1.86 0.00 3.43 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 157 L 8.29 4.05 0.00 1.51 1.77 0.84 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.32 4.91 0.00 2.82 2.68 0.00 0.00 7.11 8.03 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 0.00 159 P 0.00 4.25 0.00 2.10 2.10 0.00 3.58 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 2.13 2.37 0.00 160 A 7.81 3.86 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 0.00 161 D 7.97 4.34 0.00 2.63 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 0.00 162 A 7.54 4.27 1.51 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 0.00 163 V 7.37 3.24 1.94 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 0.78 0.00 0.00 0.01 0.00 0.00 164 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 0.00 165 F 7.79 4.29 0.00 2.93 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 0.00 166 I 7.72 3.74 1.80 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 1.69 0.78 0.92 0.00 0.00 167 E 8.03 4.10 0.00 2.06 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 2.25 2.25 0.00 168 S 7.23 4.55 0.00 3.99 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 T 6.93 4.08 4.04 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 0.00 0.00 1.19 0.00 0.00 170 Y 7.73 3.74 0.00 3.09 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 0.00 171 D 7.67 4.58 0.00 2.68 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 0.00 172 V 7.95 4.44 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 0.84 0.00 0.00 0.91 0.00 0.00 173 E 8.08 4.58 0.00 2.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 174 V 8.68 3.60 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 0.73 0.00 0.00 0.90 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.