NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 45 K 4.2834 8.2993 119.9899 56.5569 34.0344 174.1509 46 K 4.4967 8.3074 116.7033 55.0917 36.2078 173.6698 47 A 4.9571 9.1438 124.1465 50.9195 21.3132 177.3417 48 Y 5.2079 9.0624 118.1041 56.3061 42.3144 174.5584 49 F 5.5297 8.8774 120.5325 56.0789 42.0413 174.2201 50 Y 4.9913 9.6795 119.8072 56.6659 42.2414 174.0591 51 H 5.8213 8.6596 116.0332 54.2439 32.0089 172.3327 52 S 4.5545 8.6183 114.0369 57.7005 67.8049 173.0533 53 S 5.0811 8.3158 117.6154 57.1943 64.2443 173.6422 54 F 5.0629 9.0953 124.7322 55.7014 41.2959 175.5483 55 Q 4.3209 9.1142 123.4035 56.2034 29.7348 175.5595 56 I 4.7992 8.7577 126.5816 59.5974 35.8795 175.5565 57 L 4.0092 8.5271 127.5291 55.2198 42.8950 177.3240 58 N 4.1449 8.9005 117.5123 54.1445 36.0263 174.1755 59 V 4.3279 7.1923 114.7255 60.8758 33.9311 174.5244 60 E 4.3366 8.6945 128.4523 55.9015 30.6317 175.0903 61 Y 4.3364 9.0124 128.6410 57.6028 39.9895 174.3982 62 T 4.6436 7.7753 115.6180 59.2750 72.5001 174.6574 63 E 3.9062 8.9411 120.9046 59.7694 28.8602 179.3656 64 A 4.1837 8.0744 119.9875 55.2005 18.0640 178.8593 65 L 4.2462 7.5198 115.3731 56.4563 41.7704 178.5519 66 N 4.8562 8.5163 118.1987 53.3548 39.0041 174.7813 67 S 4.6080 7.3334 114.8092 55.4238 64.3097 172.9813 68 P 2.0000 0.0000 0.0000 64.1848 31.1414 177.2880 69 A 4.1000 7.3764 119.9814 53.9201 18.8936 178.5262 70 T 4.2430 7.5429 107.0467 61.3473 70.9556 175.1797 71 H 4.1344 8.7082 121.4107 59.4939 29.9820 177.2705 72 E 3.9471 8.2484 119.8558 59.5923 29.2817 178.5514 73 Y 3.8813 7.9661 119.2288 60.9539 38.8928 178.3505 74 R 4.1000 8.3452 119.2476 59.4767 30.1701 179.2485 75 T 3.8742 8.1913 109.9760 64.5341 68.8692 176.6756 76 L 3.9206 7.8734 123.1930 58.0042 42.1326 179.1089 77 S 4.0862 8.2998 115.5099 61.4903 62.7293 176.3294 78 E 3.9632 8.4351 122.2726 59.1127 29.3763 178.8688 79 R 3.8741 8.0649 118.8381 59.4645 30.1783 178.5677 80 I 3.6554 7.7991 119.6011 64.4773 37.0854 178.3386 81 E 4.0396 8.4123 119.2357 59.2498 29.1696 179.3041 82 A 4.0312 8.2066 120.9717 55.2399 18.4336 179.6088 83 M 3.9368 8.1235 117.1814 58.6612 32.0928 179.0765 84 I 3.6433 7.6771 119.8259 64.6042 37.2591 178.6296 85 T 3.5807 8.0501 116.5084 66.7461 68.4606 176.3418 86 D 4.3334 8.3435 121.0169 57.3533 40.5887 178.7787 87 E 3.7935 7.7652 117.8902 59.5464 29.7249 179.2584 88 F 4.1683 7.7042 117.6138 60.4004 38.6177 178.0286 89 R 4.1675 8.0951 117.2816 57.9880 30.2070 177.9897 90 G 4.2473 7.6639 105.3218 43.8688 0.0000 172.4352 91 S 4.6950 7.7868 114.0675 56.4435 66.5118 174.4440 92 S 4.4270 8.6594 114.4760 60.1396 62.7525 174.9742 93 L 5.5884 8.2301 120.2150 53.5644 41.7702 178.3282 94 K 4.1592 7.9540 121.0096 59.8968 32.3608 178.3156 95 S 4.4347 8.0933 112.2192 59.5547 63.8831 174.5609 96 E 4.4514 8.0773 120.1914 57.6247 30.3771 176.0686 97 F 3.8876 8.5169 121.6610 58.4144 39.7562 173.8412 98 I 4.0276 7.0802 129.6231 61.5734 37.7784 175.8932 99 R 3.9869 5.8400 115.0981 55.7828 32.0422 172.2943 100 T 5.3580 8.3309 113.6224 61.0824 71.2301 172.2700 101 H 5.0131 8.7097 117.6754 54.5238 32.2586 173.0971 102 V 4.1547 9.2565 123.1954 63.1462 31.1285 176.3307 103 V 4.1380 9.1319 122.8355 63.2672 32.3029 176.6147 104 K 5.1037 7.3926 117.3135 56.7642 34.9586 173.5445 105 L 5.1127 8.8832 121.5222 53.2877 43.5198 176.0851 106 R 4.7812 9.5956 123.4292 54.2042 33.9924 174.5022 107 K 4.4586 8.0715 122.3694 54.8471 33.7233 175.5535 108 E 4.5045 8.4725 126.5340 55.4133 33.2184 176.0260 109 G 3.9723 8.4830 115.3046 47.1821 0.0000 174.7733 110 T 4.4289 8.6460 116.0178 60.8011 69.9063 173.9928 111 G 4.4102 7.7783 112.2519 44.6720 0.0000 172.2208 112 V 4.9983 8.0931 117.5952 61.0091 34.7669 174.6267 113 V 4.9964 9.1326 125.9429 61.0413 34.9687 173.7364 114 A 5.2458 9.0915 129.3789 50.3240 21.6839 174.9254 115 D 5.1189 9.2103 123.8364 53.4309 42.5542 175.7830 116 V 4.9077 9.0639 124.1888 61.0575 34.7060 174.2006 117 V 5.0222 8.7129 127.5695 61.5934 34.0142 174.1641 118 M 5.1204 9.9361 127.3953 53.4159 35.7348 174.1272 119 K 4.6425 8.3907 124.8623 54.5528 34.7317 174.9093 120 F 5.2755 9.2450 125.3989 55.5517 43.3557 173.8347 121 R 4.9223 8.7911 118.0043 53.8856 31.8817 174.4919 122 S 4.5823 8.8775 120.6553 58.1712 66.2680 179.2942 *127 N 4.8016 8.4785 115.7237 53.2926 40.5980 173.3228 128 R 3.7064 8.2052 125.0488 57.8982 29.9172 179.1517 129 K 4.0006 7.9682 119.5089 59.1955 32.0358 179.1324 130 V 3.5133 7.7653 118.0403 66.3380 31.5635 177.6264 131 M 3.8938 7.7920 117.9357 58.4572 31.8836 178.0079 132 K 3.4739 7.8096 119.4004 59.6529 31.9603 178.8922 133 T 4.2636 7.6486 111.1505 64.3927 68.3910 176.6662 134 R 3.9152 7.7176 120.8147 58.9637 30.0533 179.0325 135 I 3.7650 7.5452 119.6454 64.5376 36.9453 178.4219 136 Q 4.0241 8.3402 119.2073 59.2020 28.2812 179.2276 137 S 4.1817 7.6096 114.4658 60.7955 63.0308 176.4385 138 V 3.6850 7.1465 120.8711 65.5897 31.3540 178.0067 139 L 3.9602 7.9819 118.6811 57.7240 41.2753 179.4024 140 R 3.8721 8.0462 118.6698 59.3849 29.6674 178.6817 141 R 3.9648 7.8262 117.0367 58.5053 30.0891 178.1250 142 L 4.1673 7.8896 117.6699 54.9607 42.2587 176.6176 143 S 4.9268 7.0122 113.3268 56.8704 63.7693 173.6942 144 S 4.7203 9.1720 120.2191 57.9928 64.3882 174.7848 145 S 4.5698 8.5052 112.7374 57.4452 64.0938 174.8581 146 G 3.9957 8.3373 109.8327 45.3748 0.0000 173.8171 147 N 4.5593 7.3079 116.6085 52.5040 39.4847 175.2444 148 L 4.4833 8.2607 120.7706 54.7578 42.0283 175.7706 149 E 5.5458 8.7282 120.7820 55.1424 33.6479 174.7823 150 I 4.5439 8.7695 119.8465 59.9312 41.9564 174.0889 151 A 4.4218 8.5312 128.9713 49.5831 19.4607 174.0545 152 P 4.2860 0.0000 0.0000 65.8816 31.7411 177.5783 153 S 4.5791 7.6372 110.1649 56.3405 65.3366 172.3065 154 N 4.7487 8.6204 124.5377 51.6944 39.4708 174.2988 155 E 4.1618 8.8063 124.6879 55.5654 30.5215 175.3737 156 I 4.4068 8.2943 127.1069 60.0003 38.4440 175.3333 157 T 4.5151 8.5346 114.5326 61.2196 70.3443 173.4018 158 S 4.7066 7.6880 114.9392 57.0682 66.2171 173.3635 159 L 4.5623 8.4448 117.9952 54.5402 41.8946 176.5722 160 T 4.5467 7.1787 108.8994 59.1333 71.1217 173.6328 161 D 4.2865 8.5522 122.2693 55.0680 40.5556 175.5199 162 Q 4.2148 8.5813 126.8900 54.9267 29.5638 174.8992 163 D 4.7394 8.6297 122.1841 55.4913 42.7771 172.8864 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 45 K 8.30 4.28 0.00 2.12 1.84 0.00 1.45 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.37 7.81 46 K 8.31 4.50 0.00 1.58 1.75 0.00 1.17 0.00 0.00 1.47 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.99 0.69 7.81 47 A 9.14 4.96 1.09 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 0.00 0.00 48 Y 9.06 5.21 0.00 3.00 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 49 F 8.88 5.53 0.00 2.90 2.94 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 50 Y 9.68 4.99 0.00 3.11 2.96 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 51 H 8.66 5.82 0.00 3.27 3.29 0.00 5.14 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.62 4.55 0.00 3.00 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 53 S 8.32 5.08 0.00 3.67 3.79 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 0.00 0.00 0.00 54 F 9.10 5.06 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 55 Q 9.11 4.32 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 56 I 8.76 4.80 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.82 0.91 0.00 0.00 57 L 8.53 4.01 0.00 1.65 1.60 1.04 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.90 4.14 0.00 2.88 2.92 0.00 0.00 6.66 7.68 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 59 V 7.19 4.33 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 0.75 0.00 0.00 1.00 0.00 0.00 60 E 8.69 4.34 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 2.34 2.36 0.00 61 Y 9.01 4.34 0.00 3.34 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 62 T 7.78 4.64 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 1.24 0.00 0.00 63 E 8.94 3.91 0.00 2.00 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 0.00 2.44 2.36 0.00 64 A 8.07 4.18 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 65 L 7.52 4.25 0.00 0.60 1.39 0.68 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.52 4.86 0.00 2.86 2.96 0.00 0.00 6.67 7.47 0.00 0.00 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 7.33 4.61 0.00 3.81 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 P 0.00 2.00 0.00 1.73 1.48 0.00 3.50 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.49 0.00 69 A 7.38 4.10 1.23 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 70 T 7.54 4.24 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 1.27 0.00 0.00 71 H 8.71 4.13 0.00 3.22 3.34 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.25 3.95 0.00 2.12 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 0.00 2.40 2.47 0.00 73 Y 7.97 3.88 0.00 3.07 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 74 R 8.35 4.10 0.00 2.01 2.01 0.00 3.19 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.95 0.00 75 T 8.19 3.87 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 0.89 0.00 0.00 76 L 7.87 3.92 0.00 1.77 1.66 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.30 4.09 0.00 4.14 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 78 E 8.44 3.96 0.00 2.13 2.14 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 2.31 2.33 0.00 79 R 8.06 3.87 0.00 2.02 2.04 0.00 3.18 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 80 I 7.80 3.66 1.97 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.52 0.82 0.00 0.00 81 E 8.41 4.04 0.00 2.24 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 2.41 2.45 0.00 82 A 8.21 4.03 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 83 M 8.12 3.94 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.53 0.00 84 I 7.68 3.64 1.93 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.67 1.24 0.00 0.00 85 T 8.05 3.58 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 1.36 0.00 0.00 86 D 8.34 4.33 0.00 2.80 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 87 E 7.77 3.79 0.00 1.71 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 2.41 2.29 0.00 88 F 7.70 4.17 0.00 2.20 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 89 R 8.10 4.17 0.00 1.94 2.01 0.00 3.37 0.00 0.00 3.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.83 0.00 90 G 7.66 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 0.00 0.00 0.00 0.00 91 S 7.79 4.69 0.00 3.90 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 92 S 8.66 4.43 0.00 3.90 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 93 L 8.23 5.59 0.00 2.04 2.02 1.02 1.06 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 94 K 7.95 4.16 0.00 1.93 2.31 0.00 1.63 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.45 7.81 95 S 8.09 4.43 0.00 4.04 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 96 E 8.08 4.45 0.00 2.33 2.34 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 2.43 2.42 0.00 97 F 8.52 3.89 0.00 2.96 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 98 I 7.08 4.03 1.51 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.61 0.70 0.00 0.00 99 R 5.84 3.99 0.00 1.71 1.78 0.00 2.86 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.40 0.00 100 T 8.33 5.36 4.57 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 1.41 0.00 0.00 101 H 8.71 5.01 0.00 3.42 3.36 0.00 5.51 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 9.26 4.15 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 0.77 0.00 0.00 0.99 0.00 0.00 103 V 9.13 4.14 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 0.66 0.00 0.00 0.99 0.00 0.00 104 K 7.39 5.10 0.00 1.96 1.98 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.21 7.81 105 L 8.88 5.11 0.00 1.41 1.61 0.21 0.72 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 0.00 106 R 9.60 4.78 0.00 1.67 1.75 0.00 3.11 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 107 K 8.07 4.46 0.00 0.79 0.79 0.00 1.57 0.00 0.00 1.44 0.00 0.00 2.82 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.04 1.08 7.81 108 E 8.47 4.50 0.00 2.02 1.77 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 2.17 2.18 0.00 109 G 8.48 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 8.65 4.43 4.28 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 1.23 0.00 0.00 111 G 7.78 4.41 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 0.00 112 V 8.09 5.00 2.15 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 1.09 0.00 0.00 1.18 0.00 0.00 113 V 9.13 5.00 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 0.94 0.00 0.00 1.07 0.00 0.00 114 A 9.09 5.25 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 0.00 115 D 9.21 5.12 0.00 2.65 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 0.00 116 V 9.06 4.91 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 1.14 0.00 0.00 1.13 0.00 0.00 117 V 8.71 5.02 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 1.15 0.00 0.00 0.94 0.00 0.00 118 M 9.94 5.12 0.00 1.98 2.31 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 2.79 2.72 0.00 119 K 8.39 4.64 0.00 1.61 1.36 0.00 1.49 0.00 0.00 1.46 0.00 0.00 2.63 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.87 0.40 7.81 120 F 9.24 5.28 0.00 3.10 2.93 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 0.00 121 R 8.79 4.92 0.00 1.66 1.81 0.00 3.15 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 122 S 8.88 4.58 0.00 3.87 2.96 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 *127 N 8.48 4.80 0.00 2.90 2.76 0.00 0.00 6.66 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 0.00 128 R 8.21 3.71 0.00 1.76 1.53 0.00 3.03 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 129 K 7.97 4.00 0.00 2.15 1.89 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.43 7.81 130 V 7.77 3.51 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 1.02 0.00 0.00 131 M 7.79 3.89 0.00 2.19 2.22 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 1.91 2.74 0.00 132 K 7.81 3.47 0.00 2.13 2.00 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.44 7.81 133 T 7.65 4.26 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 134 R 7.72 3.92 0.00 1.86 1.97 0.00 3.12 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 135 I 7.55 3.76 1.71 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.18 1.04 0.00 0.00 136 Q 8.34 4.02 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 137 S 7.61 4.18 0.00 3.98 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 0.00 138 V 7.15 3.69 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 0.24 0.00 0.00 0.89 0.00 0.00 139 L 7.98 3.96 0.00 1.81 1.89 1.16 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 140 R 8.05 3.87 0.00 2.03 2.06 0.00 3.08 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 141 R 7.83 3.96 0.00 1.78 1.90 0.00 3.14 0.00 0.00 3.14 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.87 0.00 142 L 7.89 4.17 0.00 1.77 1.81 0.74 1.01 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 0.00 143 S 7.01 4.93 0.00 3.89 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 0.00 144 S 9.17 4.72 0.00 3.84 3.82 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 0.00 145 S 8.51 4.57 0.00 3.93 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 0.00 146 G 8.34 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 0.00 147 N 7.31 4.56 0.00 2.87 2.78 0.00 0.00 7.00 7.82 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 0.00 148 L 8.26 4.48 0.00 1.48 1.30 0.76 0.59 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 0.00 149 E 8.73 5.55 0.00 2.05 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 2.45 2.38 0.00 150 I 8.77 4.54 1.77 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.70 0.78 0.00 0.00 151 A 8.53 4.42 1.20 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 0.00 0.00 0.00 152 P 0.00 4.29 0.00 2.03 2.11 0.00 3.78 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 2.01 2.05 0.00 153 S 7.64 4.58 0.00 3.75 3.66 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 0.00 154 N 8.62 4.75 0.00 2.72 2.73 0.00 0.00 6.97 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 0.00 155 E 8.81 4.16 0.00 1.93 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 2.28 2.33 0.00 156 I 8.29 4.41 1.87 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 1.47 0.74 0.93 0.00 0.00 157 T 8.53 4.52 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 0.00 158 S 7.69 4.71 0.00 3.93 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 0.00 159 L 8.44 4.56 0.00 1.62 1.72 0.92 0.78 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 0.00 160 T 7.18 4.55 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 0.00 161 D 8.55 4.29 0.00 2.65 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 0.00 162 Q 8.58 4.21 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.00 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 163 D 8.63 4.74 0.00 2.76 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 * Residues marked with a * may have inaccurate shift predictions.