NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.7963 8.2127 109.7334 46.7255 0.0000 172.9025 5 C 4.5184 8.1605 113.9819 55.0517 45.2498 172.2719 6 A 3.9545 10.6000 132.0870 52.5881 19.1565 176.7475 7 R 4.3335 7.8783 117.4276 55.7560 31.7181 176.9561 8 W 4.6501 6.9226 113.6639 55.9273 28.7737 176.9373 9 C 3.8126 7.5965 116.6812 56.9558 36.3736 172.1767 10 P 4.5351 0.0000 0.0000 62.2806 31.5266 175.3437 11 Q 3.8577 8.2906 120.2347 57.7782 29.4522 175.8179 12 D 4.2940 8.8450 122.9155 54.5578 37.9029 173.2286 13 S 5.1249 7.5369 112.4451 56.6299 66.3122 173.3916 14 S 4.8242 9.0267 116.9962 56.4023 66.2701 171.6385 15 C 4.7599 8.7308 118.4509 56.0417 41.8211 173.6886 16 V 4.1164 8.2270 109.3513 60.9383 33.8572 174.9516 17 N 4.6033 7.5337 113.8104 53.2631 39.3177 174.3221 18 A 4.1767 8.7518 120.0968 53.6690 18.6691 178.0532 19 T 4.6810 8.6972 105.7733 61.7574 70.9369 173.9547 20 A 5.2318 7.8971 121.4673 50.4425 23.7463 175.1188 21 C 5.3039 9.0165 115.5780 55.8681 40.5297 173.1228 22 R 4.9441 8.8417 118.5417 55.4652 33.3298 173.9964 23 C 4.5314 9.0952 123.6039 57.8376 41.0977 173.5701 24 N 4.7926 9.0100 119.6107 52.0103 39.9227 173.0325 25 P 4.3488 0.0000 0.0000 65.0558 31.7156 176.7821 26 G 4.0964 9.4002 110.1987 45.8021 0.0000 172.2182 27 F 5.3571 8.3021 117.1165 56.0790 43.4441 173.8537 28 S 4.9025 9.0681 113.7937 57.4143 66.1144 172.8073 29 S 5.0384 8.4138 117.2979 56.3688 65.8448 173.5961 30 F 4.0678 9.3033 123.1189 61.1907 39.0401 175.5191 31 S 4.8533 7.9790 114.4249 56.4185 64.4354 173.7569 32 E 3.9669 9.0416 125.9067 58.5166 29.4732 176.5394 33 I 4.5243 7.4503 119.3762 59.1113 38.2798 175.3109 34 I 4.2225 8.2812 127.6356 61.7533 37.4111 177.1832 35 T 4.9341 8.8399 111.2408 61.0155 70.4007 173.5261 36 T 4.1508 8.5410 117.5137 59.2844 70.1972 172.5939 37 P 4.6441 0.0000 0.0000 65.0844 31.7195 177.0507 38 M 4.2528 7.7415 117.3338 56.5100 32.4330 176.3613 39 E 4.2924 7.7352 118.9541 56.0469 30.3409 176.1597 40 T 4.5722 8.2748 111.2065 60.0630 71.2421 174.4521 41 C 4.9439 8.6784 122.0746 55.9084 41.9198 172.6115 42 D 5.1492 8.7004 124.3488 52.6304 42.6484 175.9682 43 D 4.1652 8.8499 121.9416 54.6005 41.7331 175.8803 44 I 4.0111 8.0277 126.6910 60.9096 38.4355 175.6316 45 N 5.1355 8.3851 123.6050 51.0828 38.6711 174.9649 46 E 3.9148 8.6053 125.5317 58.5988 29.8120 178.4584 47 C 4.5465 8.0809 115.5099 56.7269 40.0050 173.7165 48 A 4.3857 7.3806 122.8265 51.5574 19.1444 179.5978 49 T 3.8747 8.5905 117.0652 66.9194 68.5331 176.0933 50 L 4.2931 7.7293 118.5822 57.1674 43.3338 179.2127 51 S 4.2831 6.9589 108.7960 58.8530 62.0719 177.7052 *54 S 4.3944 8.6231 125.9853 59.1606 63.6452 174.1903 55 C 4.4837 8.6220 118.2961 60.0472 40.5469 173.8604 56 G 3.7078 7.8245 105.9513 44.3916 0.0000 172.3525 57 K 3.5732 8.3319 121.1727 58.1144 33.3321 176.9494 58 F 3.5051 7.5181 118.6153 58.4107 36.6849 174.5638 59 S 5.4294 7.4530 111.8178 56.6708 65.1263 172.7347 60 D 5.0361 9.1826 124.8071 52.6067 44.4679 173.9410 61 C 5.0687 8.7003 122.7836 55.5302 44.5921 172.5349 62 W 4.6848 9.2922 126.3085 54.7446 31.5165 174.5471 63 N 5.0782 8.8296 124.3948 53.5969 40.0333 173.9613 64 T 4.8187 8.9700 113.8183 59.5851 72.0081 173.5667 65 E 4.3749 8.5605 122.5492 58.4396 27.2152 176.8256 66 G 3.7478 8.6216 110.0002 44.8854 0.0000 171.5770 67 S 4.9580 8.0454 112.9134 58.9966 66.8235 173.5900 68 Y 5.3160 7.9505 115.6104 56.7781 40.7299 173.6659 69 D 4.5670 9.4512 119.1417 52.9295 46.0029 173.8807 70 C 5.0800 8.7492 120.3113 55.4735 41.4896 173.2614 71 V 5.0357 8.4035 117.0054 59.2288 35.1597 174.8052 72 C 5.0410 9.1416 121.3095 57.4434 42.0878 173.9988 73 S 4.7012 9.5738 119.1792 57.4893 64.0392 172.1920 74 P 4.4646 0.0000 0.0000 64.7797 31.6354 176.9478 75 G 4.1507 9.2951 110.0525 45.9591 0.0000 172.2112 76 Y 5.7660 8.1297 116.6360 55.4755 41.7086 174.5344 77 E 5.0814 8.5737 119.9397 53.9895 34.3831 172.5345 78 P 4.7941 0.0000 0.0000 61.4463 32.5185 177.4293 79 V 3.6279 8.4307 124.2972 65.7091 31.8901 176.7052 80 S 4.4322 8.1543 112.8616 57.6387 62.8274 175.7537 81 G 3.8545 7.7317 106.5549 46.6166 0.0000 175.0490 82 A 4.3075 7.7815 123.6427 50.8771 16.6507 178.1848 83 K 4.2441 8.4099 120.7530 59.5522 33.0107 178.1366 84 T 4.8341 7.6352 114.9826 61.8277 72.0135 172.8332 85 F 5.1291 8.8217 120.2296 55.2327 41.2647 175.1029 86 K 4.1934 10.2823 119.7012 56.8585 33.9413 175.8149 87 N 5.2410 8.1986 114.0720 50.8770 40.8824 174.7173 88 E 4.3720 9.3214 116.8467 59.0824 29.5477 179.9671 89 S 3.6970 8.2391 111.3002 61.4096 62.6594 174.8884 90 E 4.3229 7.8889 117.5371 55.8077 29.2613 175.3060 91 N 3.4818 8.6603 120.7238 53.4091 38.5593 174.5534 92 T 4.6575 7.6909 115.7653 61.4888 70.4242 174.1555 93 C 4.9799 8.9699 120.2409 58.1202 41.4024 172.9492 94 Q 4.5904 8.5769 119.6975 54.9479 32.2896 172.8498 95 D 4.1592 8.4043 119.5446 53.9633 42.0720 175.2101 96 V 4.0197 7.8366 125.4700 61.7981 32.9746 176.6623 97 D 4.8394 8.4015 128.9661 52.1555 39.4781 176.2783 98 E 3.9316 8.2634 123.8725 58.6502 29.6361 178.2549 99 C 4.6181 8.0785 117.1285 58.9103 40.3349 175.3845 100 S 3.9036 9.1065 118.4234 61.9596 62.8691 176.1019 101 S 4.3309 8.4709 112.7232 57.5421 62.7352 174.4256 102 G 4.0446 8.4626 107.9410 46.7493 0.0000 174.9358 103 Q 3.9746 7.5938 120.5886 58.1541 28.8810 176.4433 104 H 3.7760 8.3692 113.8553 55.8986 29.1094 175.1626 105 Q 4.5385 8.3013 115.8960 54.5881 28.9815 174.7516 106 C 4.7555 7.9519 115.2424 55.3147 41.2399 174.0601 107 D 4.6196 8.5369 122.6836 54.4362 41.3263 177.5658 108 S 4.1501 8.5298 119.1847 61.1453 63.1107 175.6300 109 S 3.4815 8.2047 113.7507 58.6339 63.3270 173.3298 110 T 5.1388 7.3616 111.2197 59.9490 71.8047 173.6793 111 V 4.3251 9.2488 122.1982 59.5281 33.8676 174.4734 112 C 4.6309 8.6455 125.1763 57.1663 44.1565 173.0980 113 F 4.5756 9.2990 123.4025 55.8769 42.1699 173.7440 114 N 4.9935 8.9201 123.3785 53.8719 40.1585 173.8718 115 T 4.7116 8.0594 112.1499 59.8800 72.0485 175.1906 116 V 3.9830 8.1169 123.3597 60.7497 29.7489 174.5866 117 G 4.1599 9.1701 121.1329 45.5098 0.0000 168.8239 118 S 4.4985 7.0729 121.3653 56.3474 62.5864 172.8036 119 Y 4.9711 7.7477 115.4983 56.2276 40.0451 173.3728 120 S 4.8381 9.3587 114.5058 56.9934 67.4139 171.8586 121 C 5.5123 8.8310 117.9312 55.4365 41.0806 173.0157 122 R 5.7994 8.7553 122.1933 53.2682 33.2381 174.7283 123 C 4.3305 9.1483 119.5021 57.6797 39.0363 174.1361 124 R 4.1127 8.5130 122.1936 55.0974 31.0337 174.4833 125 P 4.3724 0.0000 0.0000 65.0607 31.5293 176.6443 126 G 4.1428 9.3724 111.8566 44.5918 0.0000 172.7345 127 W 4.9605 8.5648 119.9347 55.1537 30.8966 175.8910 128 K 4.7287 8.4206 122.7588 53.8661 34.2692 174.2241 129 P 4.7010 0.0000 0.0000 63.1083 32.4820 175.6815 130 R 4.4497 9.9586 125.3238 54.8661 31.1247 175.8121 131 H 4.6597 8.3890 122.3333 55.7501 29.4279 174.9491 132 G 4.0035 8.2625 108.0965 45.5895 0.0000 174.8328 133 I 3.9926 7.1949 120.1407 59.5337 37.2540 175.1335 134 P 4.4076 0.0000 0.0000 62.4554 32.0632 175.5700 135 N 4.6492 8.3729 118.0705 53.7895 40.0740 173.8127 136 N 4.2082 8.4284 116.5864 54.9261 37.6550 173.7300 137 Q 4.7231 8.2879 113.7460 53.1683 32.5964 176.9825 138 K 4.1033 8.5571 118.7050 58.7778 32.2043 177.7896 139 D 4.9494 7.8116 117.1221 53.1617 39.8195 176.2263 140 T 4.2063 7.4636 116.8392 64.1758 68.6614 174.4957 141 V 4.5315 8.2127 124.4365 61.5109 34.9857 174.7589 142 C 5.5533 9.1238 124.5049 55.0699 38.2628 173.8759 143 E 4.4178 9.3423 117.5549 56.7966 29.5801 175.4969 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 4 G 8.21 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 C 8.16 4.52 0.00 2.89 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 6 A 10.60 3.95 0.18 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 7 R 7.88 4.33 0.00 1.77 1.91 0.00 3.19 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 8 W 6.92 4.65 0.00 3.50 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 C 7.60 3.81 0.00 2.78 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 10 P 0.00 4.54 0.00 2.25 2.39 0.00 3.79 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 11 Q 8.29 3.86 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.45 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 12 D 8.84 4.29 0.00 2.48 1.59 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 13 S 7.54 5.12 0.00 3.77 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 14 S 9.03 4.82 0.00 3.71 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 15 C 8.73 4.76 0.00 2.99 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 16 V 8.23 4.12 2.07 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 0.73 0.00 0.00 1.01 0.00 0.00 17 N 7.53 4.60 0.00 2.88 2.89 0.00 0.00 6.64 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 18 A 8.75 4.18 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 19 T 8.70 4.68 4.37 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 1.32 0.00 0.00 20 A 7.90 5.23 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 21 C 9.02 5.30 0.00 2.82 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 22 R 8.84 4.94 0.00 1.82 1.72 0.00 3.13 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 23 C 9.10 4.53 0.00 2.96 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 24 N 9.01 4.79 0.00 2.69 2.80 0.00 0.00 6.97 8.27 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 25 P 0.00 4.35 0.00 2.10 2.07 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 26 G 9.40 4.10 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 0.00 0.00 0.00 27 F 8.30 5.36 0.00 2.99 2.95 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 28 S 9.07 4.90 0.00 3.90 3.67 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 29 S 8.41 5.04 0.00 3.96 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 30 F 9.30 4.07 0.00 3.02 3.15 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 31 S 7.98 4.85 0.00 4.09 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 9.04 3.97 0.00 1.93 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 33 I 7.45 4.52 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.07 0.97 0.00 0.00 34 I 8.28 4.22 1.98 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 1.46 0.66 1.25 0.00 0.00 35 T 8.84 4.93 4.30 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 1.37 0.00 0.00 36 T 8.54 4.15 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 37 P 0.00 4.64 0.00 2.22 2.39 0.00 3.32 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.66 0.00 38 M 7.74 4.25 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.56 0.00 39 E 7.74 4.29 0.00 2.14 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 2.36 2.25 0.00 40 T 8.27 4.57 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 41 C 8.68 4.94 0.00 3.02 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 42 D 8.70 5.15 0.00 2.72 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.85 4.17 0.00 2.27 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 I 8.03 4.01 1.78 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.62 0.86 0.00 0.00 45 N 8.39 5.14 0.00 2.64 2.64 0.00 0.00 7.70 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.61 3.91 0.00 1.48 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 2.11 2.26 0.00 47 C 8.08 4.55 0.00 2.96 2.95 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 48 A 7.38 4.39 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 49 T 8.59 3.87 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 50 L 7.73 4.29 0.00 1.57 1.68 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 51 S 6.96 4.28 0.00 4.02 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 *54 S 8.62 4.39 0.00 3.87 3.88 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 55 C 8.62 4.48 0.00 3.03 3.22 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 56 G 7.82 3.71 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 0.00 0.00 0.00 57 K 8.33 3.57 0.00 0.79 1.52 0.00 1.91 0.00 0.00 2.01 0.00 0.00 3.42 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.43 7.81 58 F 7.52 3.51 0.00 2.73 1.45 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 0.00 59 S 7.45 5.43 0.00 4.30 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 60 D 9.18 5.04 0.00 2.84 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 C 8.70 5.07 0.00 2.91 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 62 W 9.29 4.68 0.00 3.38 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 63 N 8.83 5.08 0.00 2.94 2.69 0.00 0.00 6.64 7.22 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 64 T 8.97 4.82 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 1.27 0.00 0.00 65 E 8.56 4.37 0.00 2.05 2.12 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 2.36 2.32 0.00 66 G 8.62 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 67 S 8.05 4.96 0.00 3.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 7.95 5.32 0.00 2.95 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 69 D 9.45 4.57 0.00 2.55 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 0.00 0.00 0.00 0.00 70 C 8.75 5.08 0.00 1.55 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 71 V 8.40 5.04 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 0.78 0.00 0.00 1.09 0.00 0.00 72 C 9.14 5.04 0.00 3.02 3.31 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 73 S 9.57 4.70 0.00 3.91 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 74 P 0.00 4.46 0.00 2.14 2.10 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 75 G 9.30 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.13 5.77 0.00 3.07 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.57 5.08 0.00 1.87 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 0.00 2.30 2.31 0.00 78 P 0.00 4.79 0.00 2.12 2.20 0.00 3.89 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.85 0.00 79 V 8.43 3.63 2.07 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 0.79 0.00 0.00 0.93 0.00 0.00 80 S 8.15 4.43 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 81 G 7.73 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.78 4.31 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 83 K 8.41 4.24 0.00 1.90 1.99 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.48 7.81 84 T 7.64 4.83 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 85 F 8.82 5.13 0.00 3.48 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 86 K 10.28 4.19 0.00 1.80 1.92 0.00 0.87 0.00 0.00 1.37 0.00 0.00 2.52 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.27 1.34 7.81 87 N 8.20 5.24 0.00 2.89 2.99 0.00 0.00 6.27 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 E 9.32 4.37 0.00 2.12 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 2.37 2.38 0.00 89 S 8.24 3.70 0.00 3.98 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 7.89 4.32 0.00 2.13 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 2.35 2.31 0.00 91 N 8.66 3.48 0.00 2.56 2.65 0.00 0.00 6.85 7.58 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 92 T 7.69 4.66 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 1.12 0.00 0.00 93 C 8.97 4.98 0.00 3.22 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 94 Q 8.58 4.59 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.01 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 95 D 8.40 4.16 0.00 2.44 2.45 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 0.00 96 V 7.84 4.02 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 0.72 0.00 0.00 0.89 0.00 0.00 97 D 8.40 4.84 0.00 2.69 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.26 3.93 0.00 1.72 1.58 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 2.50 2.44 0.00 99 C 8.08 4.62 0.00 3.02 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 0.00 100 S 9.11 3.90 0.00 3.75 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.47 4.33 0.00 3.95 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 0.00 102 G 8.46 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 0.00 0.00 0.00 0.00 103 Q 7.59 3.97 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.23 0.00 104 H 8.37 3.78 0.00 2.05 2.48 0.00 5.70 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.30 4.54 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 106 C 7.95 4.76 0.00 2.98 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 0.00 107 D 8.54 4.62 0.00 2.77 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 0.00 108 S 8.53 4.15 0.00 3.86 3.88 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 0.00 109 S 8.20 3.48 0.00 4.10 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 0.00 110 T 7.36 5.14 4.32 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 1.24 0.00 0.00 111 V 9.25 4.33 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 0.85 0.00 0.00 0.61 0.00 0.00 112 C 8.65 4.63 0.00 2.31 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 F 9.30 4.58 0.00 3.08 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 0.00 114 N 8.92 4.99 0.00 2.93 2.69 0.00 0.00 6.64 7.22 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 0.00 115 T 8.06 4.71 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 1.26 0.00 0.00 116 V 8.12 3.98 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 0.91 0.00 0.00 0.97 0.00 0.00 117 G 9.17 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 0.00 118 S 7.07 4.50 0.00 3.68 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 0.00 119 Y 7.75 4.97 0.00 2.87 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 0.00 120 S 9.36 4.84 0.00 3.95 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 0.00 121 C 8.83 5.51 0.00 3.06 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 8.76 5.80 0.00 1.97 1.86 0.00 2.41 0.00 0.00 2.90 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.47 0.00 123 C 9.15 4.33 0.00 2.91 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 0.00 124 R 8.51 4.11 0.00 0.67 1.41 0.00 2.82 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.31 0.00 125 P 0.00 4.37 0.00 2.12 2.11 0.00 3.62 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 126 G 9.37 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 0.00 127 W 8.56 4.96 0.00 3.18 3.22 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 0.00 128 K 8.42 4.73 0.00 1.76 1.71 0.00 1.57 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.47 7.81 129 P 0.00 4.70 0.00 1.94 2.01 0.00 3.69 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 2.05 2.12 0.00 130 R 9.96 4.45 0.00 1.90 1.81 0.00 3.13 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.99 0.00 131 H 8.39 4.66 0.00 3.30 3.31 0.00 5.59 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 0.00 132 G 8.26 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 0.00 0.00 0.00 133 I 7.19 3.99 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.81 1.00 0.00 0.00 134 P 0.00 4.41 0.00 2.04 1.99 0.00 3.67 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 2.03 2.08 0.00 135 N 8.37 4.65 0.00 2.81 2.67 0.00 0.00 6.58 6.71 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 0.00 136 N 8.43 4.21 0.00 2.86 2.90 0.00 0.00 6.94 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Q 8.29 4.72 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.25 6.58 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 138 K 8.56 4.10 0.00 1.63 1.78 0.00 1.32 0.00 0.00 0.61 0.00 0.00 2.43 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.96 1.09 7.81 139 D 7.81 4.95 0.00 2.76 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 0.00 140 T 7.46 4.21 4.32 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 1.28 0.00 0.00 141 V 8.21 4.53 2.12 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 1.13 0.00 0.00 0.96 0.00 0.00 142 C 9.12 5.55 0.00 3.15 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 0.00 143 E 9.34 4.42 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.45 0.00 * Residues marked with a * may have inaccurate shift predictions.