NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 S 4.4239 8.3349 115.4095 57.7036 64.0896 173.8363 14 L 3.7692 7.5985 120.5664 54.0258 42.4778 176.3634 15 S 4.5390 8.5088 119.1838 56.2239 66.2542 173.0602 16 A 4.0270 8.0229 122.7491 51.7271 18.6858 176.9189 17 Y 4.5044 8.0626 117.8089 58.4218 38.7699 176.3625 18 K 4.3772 10.0822 123.9227 57.7772 34.5897 175.9793 19 T 4.9532 8.2247 116.1378 61.8173 71.2118 173.1636 20 V 4.6547 8.8382 127.8191 61.0913 33.7961 174.5790 21 V 4.9422 8.6291 127.8507 60.9982 34.1939 174.4966 22 V 4.9258 8.7865 126.9224 59.8723 34.5740 174.6370 23 G 4.4619 8.6966 110.3861 45.1504 0.0000 172.8044 24 T 4.8691 8.9797 117.2838 60.4368 70.6031 173.1644 25 D 4.7022 9.0800 125.9869 52.9642 39.9802 177.1582 26 G 3.9009 8.4051 109.1373 45.3900 0.0000 174.0164 27 S 4.4704 7.5964 113.8686 57.6376 64.2089 173.9237 28 D 4.5137 8.5446 119.6332 57.2987 40.9196 178.4378 29 S 4.2813 8.1714 112.9866 61.3992 63.1913 177.4150 30 S 4.1951 7.8712 115.8840 57.9282 62.1378 176.3021 *32 R 4.3172 8.1444 121.7532 57.1863 31.9529 177.8610 33 A 4.0800 8.0456 119.6929 54.6032 18.2417 179.9560 34 V 3.4928 7.6547 116.7006 66.2156 31.6622 177.7198 35 D 4.3438 8.0340 118.1588 57.5019 40.7493 178.7081 36 R 3.8569 8.0510 118.8858 59.3697 30.0486 178.4244 37 A 4.0012 8.3333 120.6291 54.9323 18.2564 179.5125 38 A 3.9146 8.4775 119.8635 55.4099 18.2760 179.6286 39 Q 3.9380 8.1661 117.1311 59.2638 29.0969 178.1997 40 I 4.0450 7.3864 119.4069 63.7584 37.7702 177.7689 41 A 4.1680 8.4248 122.0538 52.8985 18.5875 178.8194 42 G 3.6942 9.0869 106.0175 47.2591 0.0000 175.6202 43 A 4.6993 8.8022 126.1349 51.6455 19.9507 176.4110 44 D 4.8136 8.1575 113.3397 53.6004 42.5798 175.6263 45 A 4.9607 7.6110 120.0658 49.7445 22.0450 175.7993 46 K 4.4225 9.0480 121.6664 55.5163 34.1278 175.2992 47 L 5.1062 8.9083 129.4418 53.4655 44.6531 174.7465 48 I 4.8690 9.1021 128.1075 59.7486 39.6551 174.6621 49 I 4.8347 8.9766 128.6560 59.7617 38.9221 174.7726 50 A 5.8783 9.0135 128.9096 49.5916 22.5567 174.9096 51 S 4.9371 8.1935 113.0161 56.6151 66.2038 172.9313 52 A 4.6115 8.6361 129.0676 52.0383 19.0813 175.9207 53 Y 4.3151 9.0995 124.8302 57.1216 39.2245 174.4762 54 L 4.2638 8.2644 126.6163 55.7188 44.7409 176.6160 55 P 3.7899 0.0000 0.0000 65.4630 30.1911 178.5620 *76 T 4.0459 8.9684 116.4125 63.4673 70.4302 173.6472 77 A 4.1810 8.6952 128.8535 52.0226 18.9893 176.5186 78 P 4.3803 0.0000 0.0000 65.5070 31.2335 178.8925 79 I 3.6550 7.7621 117.2103 64.1399 37.8322 177.2953 80 Y 4.0682 7.9106 117.7530 60.6345 37.5730 177.9679 81 E 4.0228 8.1068 120.7932 59.2699 29.7291 178.8334 82 I 3.7356 7.7291 119.3901 64.3786 37.1370 178.2765 83 L 3.9618 8.1864 119.9989 57.9203 41.4245 178.9014 84 H 4.1152 8.6835 118.5757 59.5815 29.7490 177.0004 85 D 4.2976 8.6179 120.7429 57.2990 40.5583 178.6433 86 A 3.9484 8.2286 121.4322 55.0138 18.4156 179.6011 87 K 3.7873 8.3244 118.4381 59.6002 32.3123 178.9570 88 E 3.9493 8.1730 119.0245 59.4200 29.1556 179.3513 89 R 3.9056 8.0758 117.7526 59.0347 30.3892 178.0240 90 A 4.1204 8.1663 120.9123 55.4440 18.4108 179.1470 91 H 4.8212 7.8389 115.7333 58.7203 28.7251 177.5899 92 N 4.5910 7.9776 114.9855 54.8449 38.3509 175.9391 93 A 4.6434 7.8901 121.4520 51.6238 19.6335 177.5238 94 G 3.8458 8.6290 108.1692 45.4887 0.0000 174.2139 95 A 4.4352 7.8175 123.7446 52.1268 18.8482 178.1711 96 K 3.9839 8.9721 123.7077 58.7536 32.7662 177.2261 97 N 4.8485 7.9142 119.3244 51.6337 39.0764 173.5999 98 V 5.0277 8.2254 122.7194 60.7605 34.6746 174.1799 99 E 4.9448 9.1465 124.4714 54.6136 33.2590 174.3435 100 E 5.0413 8.5955 118.7799 55.4630 32.6509 175.1987 101 R 4.5097 8.4624 118.8724 55.1370 33.9866 172.0642 102 P 4.9981 0.0000 0.0000 61.9687 32.9913 175.2399 103 I 4.5045 8.8662 124.2524 59.6194 39.4205 174.8619 104 V 4.5138 8.3429 126.0111 62.2804 34.1124 177.2130 105 G 3.7051 8.8068 113.3569 45.2968 0.0000 173.0364 106 A 3.9883 8.4911 123.1183 51.6034 19.0944 176.2001 107 P 4.1473 0.0000 0.0000 66.7674 31.0805 178.7792 108 V 3.5579 7.7019 117.8454 65.4789 31.5310 177.5114 109 D 4.3178 8.0856 118.0046 57.2532 40.6169 178.4660 110 A 3.9947 8.0206 121.3865 54.9988 18.2957 179.4349 111 L 3.8670 8.1573 119.2330 58.2716 42.1850 179.3672 112 V 3.5514 8.0760 118.5107 65.9210 31.4460 177.5375 113 N 4.2927 8.1911 116.8694 56.5151 38.7981 176.6345 114 L 3.9145 8.2726 121.8637 58.1460 42.1585 178.7160 115 A 4.0294 8.2688 121.0118 55.3061 18.0970 179.4442 116 D 4.2548 8.2031 117.3447 57.5063 40.7437 178.6387 117 E 3.9699 8.5784 119.1063 58.4406 29.7154 177.6534 118 E 4.4435 8.4217 115.9376 54.5990 30.5775 175.7057 119 K 3.7736 7.7332 117.3714 57.0120 30.3025 175.3405 120 A 4.3519 8.0144 120.0619 52.6810 19.0109 177.6926 121 D 4.9651 8.5542 116.9135 52.7315 41.1997 175.7444 122 L 4.2091 7.5283 121.8374 53.9758 45.3852 173.6224 123 L 5.1130 8.4278 126.0867 52.9803 44.1570 175.9689 124 V 4.4947 8.8367 122.6707 61.2902 34.6920 174.6783 125 V 4.7585 8.2735 119.0290 59.7082 35.8860 174.8858 126 G 3.8947 8.5264 111.6462 44.3319 0.0000 173.5791 127 N 4.4855 8.4840 121.3248 53.6872 39.6760 174.2002 128 V 4.2824 7.2955 120.5060 61.2372 33.6246 172.0150 129 G 3.9238 7.8858 108.7200 45.8113 0.0000 172.3899 130 L 4.6879 8.3934 119.0835 53.2252 43.5415 176.9672 131 S 4.6114 8.4333 114.8809 58.4400 63.5462 174.7964 132 T 4.3207 7.4289 112.7838 60.9366 71.0677 175.3652 133 I 3.6410 8.2236 121.2690 64.6026 37.0343 178.3934 134 A 4.0635 8.0383 120.8792 55.1807 18.0704 179.4059 135 G 3.7209 7.8865 102.8487 48.3886 0.0000 175.6610 136 R 4.1309 8.1865 120.4072 58.5778 29.9648 178.8318 137 L 3.9369 8.1143 120.1732 57.9011 42.1710 177.5183 138 L 4.2867 8.0365 115.9442 54.8891 41.7641 176.9939 139 G 3.9265 7.5498 109.2861 44.8448 0.0000 173.5604 140 S 4.7912 8.0782 113.3104 56.6064 66.4025 175.2697 141 V 3.5975 8.1305 122.8550 65.6354 31.5648 176.5188 142 P 4.3479 0.0000 0.0000 66.0234 31.0235 178.2050 143 A 4.0273 7.7881 119.7775 54.6458 18.2693 179.1689 144 N 4.2361 7.9359 115.3195 56.7967 39.0386 177.3085 145 V 3.5403 8.2487 120.0579 66.0443 31.6308 177.5892 146 S 4.4741 7.8637 113.9905 60.8732 62.0275 176.3607 147 R 3.8936 7.8959 120.5150 59.3879 29.6619 178.1804 148 R 3.9091 8.3462 116.7791 59.2538 30.1704 177.9710 149 A 4.3963 8.1975 118.0473 50.8709 19.8557 177.6015 150 K 3.9245 7.5523 117.5424 58.4351 30.2726 174.5330 151 V 4.5702 7.6062 117.6698 59.7936 35.0490 174.8613 152 D 4.7265 8.4571 120.4463 53.7296 41.7023 176.2031 153 V 4.3866 8.1553 121.4755 60.7876 33.9888 174.4733 154 L 4.6509 8.4674 127.6986 53.2152 44.1366 175.2088 155 I 4.2750 8.3730 126.9499 59.6279 38.3721 175.0791 156 V 4.1653 8.2391 126.0577 61.1948 32.0310 175.2248 157 H 4.5085 8.8291 123.1981 55.6591 29.1850 173.7157 158 T 4.5957 7.9242 109.3163 59.0505 71.6310 174.0971 159 T 4.0509 8.5639 110.4386 62.3859 68.3735 173.7079 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 13 S 8.33 4.42 0.00 3.98 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 14 L 7.60 3.77 0.00 1.67 1.57 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.51 4.54 0.00 3.93 3.86 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 16 A 8.02 4.03 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 17 Y 8.06 4.50 0.00 3.04 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 18 K 10.08 4.38 0.00 1.71 1.87 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.45 7.81 19 T 8.22 4.95 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 1.25 0.00 0.00 20 V 8.84 4.65 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 0.85 0.00 0.00 0.93 0.00 0.00 21 V 8.63 4.94 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 1.01 0.00 0.00 0.90 0.00 0.00 22 V 8.79 4.93 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 0.86 0.00 0.00 1.00 0.00 0.00 23 G 8.70 4.46 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 24 T 8.98 4.87 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 1.25 0.00 0.00 25 D 9.08 4.70 0.00 2.78 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 26 G 8.41 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 0.00 0.00 0.00 27 S 7.60 4.47 0.00 4.03 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 28 D 8.54 4.51 0.00 2.69 2.76 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 29 S 8.17 4.28 0.00 3.97 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 30 S 7.87 4.20 0.00 4.04 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 0.00 *32 R 8.14 4.32 0.00 2.09 2.06 0.00 3.12 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 33 A 8.05 4.08 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 34 V 7.65 3.49 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 1.03 0.00 0.00 0.94 0.00 0.00 35 D 8.03 4.34 0.00 2.88 2.70 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 36 R 8.05 3.86 0.00 1.94 1.92 0.00 3.16 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 37 A 8.33 4.00 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 38 A 8.48 3.91 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 39 Q 8.17 3.94 0.00 2.16 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 40 I 7.39 4.04 2.04 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 1.51 0.92 1.07 0.00 0.00 41 A 8.42 4.17 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 42 G 9.09 3.69 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 0.00 0.00 0.00 43 A 8.80 4.70 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 44 D 8.16 4.81 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 45 A 7.61 4.96 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 46 K 9.05 4.42 0.00 1.82 1.69 0.00 1.79 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.39 7.81 47 L 8.91 5.11 0.00 1.77 1.60 0.97 1.16 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 48 I 9.10 4.87 1.86 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 1.23 0.61 0.91 0.00 0.00 49 I 8.98 4.83 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.98 0.89 0.00 0.00 50 A 9.01 5.88 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 51 S 8.19 4.94 0.00 3.85 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.64 4.61 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 53 Y 9.10 4.32 0.00 2.76 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 54 L 8.26 4.26 0.00 1.48 1.50 0.86 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 3.79 0.00 1.85 1.69 0.00 3.19 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 *76 T 8.97 4.05 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 1.21 0.00 0.00 77 A 8.70 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 78 P 0.00 4.38 0.00 2.21 2.16 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.20 0.00 79 I 7.76 3.66 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.51 0.40 0.00 0.00 80 Y 7.91 4.07 0.00 3.31 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 81 E 8.11 4.02 0.00 2.04 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 2.34 2.39 0.00 82 I 7.73 3.74 2.03 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 1.64 0.53 0.90 0.00 0.00 83 L 8.19 3.96 0.00 1.88 1.87 0.80 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 84 H 8.68 4.12 0.00 3.33 3.58 0.00 5.79 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 85 D 8.62 4.30 0.00 2.70 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 86 A 8.23 3.95 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 87 K 8.32 3.79 0.00 1.91 1.94 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.34 1.38 7.81 88 E 8.17 3.95 0.00 2.13 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 2.30 2.34 0.00 89 R 8.08 3.91 0.00 1.78 2.06 0.00 3.27 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 90 A 8.17 4.12 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 91 H 7.84 4.82 0.00 3.40 3.34 0.00 5.66 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 92 N 7.98 4.59 0.00 2.85 2.89 0.00 0.00 6.97 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 93 A 7.89 4.64 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 94 G 8.63 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 95 A 7.82 4.44 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 96 K 8.97 3.98 0.00 1.77 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.56 7.81 97 N 7.91 4.85 0.00 2.65 2.79 0.00 0.00 6.48 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 98 V 8.23 5.03 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 0.78 0.00 0.00 0.89 0.00 0.00 99 E 9.15 4.94 0.00 2.04 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 2.18 2.23 0.00 100 E 8.60 5.04 0.00 2.01 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 2.25 2.36 0.00 101 R 8.46 4.51 0.00 1.94 1.76 0.00 3.14 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 102 P 0.00 5.00 0.00 1.88 1.71 0.00 3.70 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 1.99 1.91 0.00 103 I 8.87 4.50 2.00 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 1.10 0.98 0.92 0.00 0.00 104 V 8.34 4.51 2.11 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 0.85 0.00 0.00 1.00 0.00 0.00 105 G 8.81 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 0.00 106 A 8.49 3.99 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 0.00 107 P 0.00 4.15 0.00 2.26 2.33 0.00 3.69 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 2.07 2.03 0.00 108 V 7.70 3.56 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 1.14 0.00 0.00 0.92 0.00 0.00 109 D 8.09 4.32 0.00 2.90 2.70 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 0.00 110 A 8.02 3.99 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 0.00 111 L 8.16 3.87 0.00 1.84 1.83 0.90 1.06 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 0.00 112 V 8.08 3.55 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 0.93 0.00 0.00 0.97 0.00 0.00 113 N 8.19 4.29 0.00 2.99 2.98 0.00 0.00 6.85 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 0.00 114 L 8.27 3.91 0.00 1.84 1.81 0.92 1.26 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 0.00 115 A 8.27 4.03 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 0.00 116 D 8.20 4.25 0.00 2.90 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 0.00 117 E 8.58 3.97 0.00 2.11 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 2.32 2.39 0.00 118 E 8.42 4.44 0.00 2.04 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 2.26 2.46 0.00 119 K 7.73 3.77 0.00 1.85 1.86 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.36 7.81 120 A 8.01 4.35 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 0.00 121 D 8.55 4.97 0.00 2.85 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 L 7.53 4.21 0.00 0.39 0.97 0.57 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.43 5.11 0.00 1.49 1.50 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.84 4.49 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 0.95 0.00 0.00 0.85 0.00 0.00 125 V 8.27 4.76 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 0.91 0.00 0.00 126 G 8.53 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 0.00 127 N 8.48 4.49 0.00 2.69 2.73 0.00 0.00 6.88 7.71 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 0.00 128 V 7.30 4.28 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 0.67 0.00 0.00 0.92 0.00 0.00 129 G 7.89 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.39 4.69 0.00 1.62 1.58 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.43 4.61 0.00 3.96 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 0.00 132 T 7.43 4.32 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 0.00 133 I 8.22 3.64 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 1.57 0.66 0.91 0.00 0.00 134 A 8.04 4.06 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 0.00 135 G 7.89 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 0.00 0.00 0.00 136 R 8.19 4.13 0.00 1.83 1.98 0.00 3.29 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 137 L 8.11 3.94 0.00 1.82 1.69 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.04 4.29 0.00 1.72 1.68 0.92 0.90 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 0.00 139 G 7.55 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 0.00 140 S 8.08 4.79 0.00 4.04 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 0.00 141 V 8.13 3.60 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 1.02 0.00 0.00 0.93 0.00 0.00 142 P 0.00 4.35 0.00 2.30 2.30 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 143 A 7.79 4.03 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 0.00 144 N 7.94 4.24 0.00 3.05 2.90 0.00 0.00 6.78 7.43 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 0.00 145 V 8.25 3.54 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 0.98 0.00 0.00 0.97 0.00 0.00 146 S 7.86 4.47 0.00 4.03 4.06 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 0.00 147 R 7.90 3.89 0.00 1.95 2.03 0.00 3.16 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 148 R 8.35 3.91 0.00 1.93 1.99 0.00 3.37 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 149 A 8.20 4.40 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 0.00 150 K 7.55 3.92 0.00 1.81 1.88 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.49 7.81 151 V 7.61 4.57 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 0.83 0.00 0.00 0.94 0.00 0.00 152 D 8.46 4.73 0.00 2.68 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.16 4.39 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 0.81 0.00 0.00 0.98 0.00 0.00 154 L 8.47 4.65 0.00 1.60 1.53 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.37 4.28 1.88 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 1.31 0.74 0.93 0.00 0.00 156 V 8.24 4.17 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 0.84 0.00 0.00 0.98 0.00 0.00 157 H 8.83 4.51 0.00 3.33 3.31 0.00 5.52 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 T 7.92 4.60 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 1.21 0.00 0.00 159 T 8.56 4.05 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.