NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 K 4.3864 8.1733 120.0841 55.9659 34.9622 174.9753 24 I 4.8541 7.5681 120.0551 58.9989 40.3948 172.8236 25 A 5.0314 8.9433 127.1288 50.3909 23.8469 174.2181 26 I 5.2018 8.9301 112.1259 59.3608 41.4737 175.0914 27 V 4.7497 8.3990 121.9307 60.4034 34.9701 173.7814 28 N 4.6711 9.2020 123.0673 53.1160 40.5337 175.8852 *30 G 3.8805 8.6085 111.2801 45.7856 0.0000 175.2238 31 S 4.0961 8.9527 115.3125 61.0283 62.2895 176.1092 32 L 3.9951 8.0679 121.6412 57.8562 41.3312 179.3260 33 F 3.9960 8.2596 119.9938 61.1610 39.3932 176.7029 34 Q 3.9925 8.3338 119.1057 59.4754 28.9627 178.3418 35 Q 3.9764 8.1740 119.0123 59.0093 28.7596 179.0759 36 V 3.5364 8.1418 119.4653 65.6788 31.5401 177.9653 37 A 3.7353 7.8062 120.7342 54.9336 17.9373 179.3260 38 Q 3.8410 7.7236 116.8748 59.3805 29.2744 178.3410 39 K 4.0638 7.8903 119.2725 59.0997 32.3437 178.0884 40 T 4.2612 8.1130 109.2589 61.2098 69.1289 175.7541 41 G 4.0563 8.0072 110.3445 46.5526 0.0000 176.0135 42 V 3.6015 7.1121 120.2175 64.7595 31.0244 177.7749 43 S 4.0858 7.9360 112.9372 61.4222 62.3617 175.8080 44 N 4.4635 8.0998 118.5739 56.4090 38.3582 177.4960 45 T 3.9234 7.9738 117.5164 66.4977 68.3736 176.7822 46 L 4.1936 8.1157 121.0713 57.3411 41.5784 179.1129 47 E 4.0458 8.2143 119.2797 59.5023 29.4739 178.3129 48 N 4.2791 8.0771 115.1648 56.6988 38.7360 176.6941 49 E 3.9455 8.1207 119.1253 58.2192 29.9628 177.7423 50 F 4.8665 7.8133 115.5832 56.7516 40.2137 177.3342 51 K 4.2184 8.5488 120.5042 60.1911 32.2904 178.8903 52 G 3.6323 8.1885 106.4090 47.8354 0.0000 175.5389 53 R 3.9600 8.1184 120.2633 58.2651 30.1490 179.1655 54 A 3.6299 8.2062 120.8258 55.1465 18.4796 179.8657 55 S 4.0566 8.5587 114.1460 61.6884 62.6922 176.4517 56 E 3.9834 8.1778 121.0123 58.9937 29.2621 178.4848 57 L 4.2902 7.0455 116.9646 57.1217 42.3229 178.3679 58 Q 4.1916 8.0460 119.7861 59.0153 29.1921 181.1254 59 R 4.4833 7.9385 118.3845 55.9443 29.2054 178.2717 *61 E 3.6286 8.2163 120.3387 57.3488 31.7213 177.3365 62 T 3.2849 7.6606 108.8526 64.9787 68.2449 175.9286 63 D 4.2934 8.0175 121.2366 56.8305 40.8679 177.6972 64 L 4.2302 7.5321 121.5713 58.0687 42.5511 178.8809 65 Q 4.0588 8.6578 120.7921 59.2540 28.5057 179.1176 66 A 4.7253 7.6840 121.1450 50.1013 19.1599 177.6111 67 K 4.3838 8.1228 125.2523 58.7013 38.5947 178.4048 *91 R 4.3857 9.2543 132.6747 57.1413 32.0698 180.3267 92 Q 4.2980 7.9492 117.2530 60.5115 27.6859 183.3897 93 T 4.3742 7.8628 114.6064 66.2330 68.7687 176.7581 94 F 4.1186 8.1056 122.1751 61.2971 39.5697 176.8015 95 A 3.9545 8.1726 122.3673 55.8776 18.0485 179.7312 96 Q 4.2052 7.6750 115.4655 58.4729 28.6012 179.0204 97 K 4.5133 7.4055 117.9990 58.7341 33.5386 177.7662 98 A 3.9795 8.3959 123.4417 54.9483 18.1416 180.4274 99 Q 3.8877 7.8035 119.3069 60.3634 28.2986 182.9939 100 A 4.2088 8.0064 122.7733 54.8922 18.3930 179.1958 101 F 4.1370 8.1989 118.9664 61.5373 39.4784 176.7538 102 E 3.6966 8.1183 118.2818 59.4046 29.3770 178.8408 103 Q 3.8383 8.0060 117.6735 59.1609 28.7712 178.2013 104 D 4.4214 8.2720 120.1988 57.6328 40.8530 179.3351 105 R 2.6972 7.3363 118.4128 58.8224 29.8477 178.3616 106 A 3.8252 7.5202 120.5137 55.0355 18.4072 179.4182 107 R 3.7847 8.3105 117.4680 59.8775 30.1947 178.9334 108 R 3.9986 8.2176 117.9359 59.2408 29.9405 179.1132 109 S 4.1067 8.4409 113.4126 61.4165 62.4377 175.8592 110 N 4.3123 8.3836 119.4296 56.3351 38.2155 177.1763 111 E 3.9561 8.2656 119.7820 59.6812 29.7546 179.4017 112 E 3.9966 8.2661 118.5049 59.1442 29.4629 179.4788 113 R 4.2881 8.4566 119.2846 59.5987 30.2635 178.8194 114 G 3.7110 8.6435 105.8954 47.8671 0.0000 175.7845 115 K 4.1037 8.3968 120.8142 59.0451 32.0208 179.5895 116 L 3.9681 7.9196 119.0496 57.7177 41.5371 179.4376 117 V 3.7317 8.0529 118.1976 66.4437 31.4137 178.1154 118 T 3.8841 7.9847 115.2774 66.8936 68.2053 176.8423 119 R 3.9619 7.9557 119.6161 59.2259 29.9295 179.2995 120 I 3.7938 7.9454 119.7449 64.3930 37.1242 178.3971 121 Q 4.0128 8.5172 119.3675 59.2907 28.6045 178.9700 122 T 3.8542 8.1389 116.5594 66.6578 68.3851 176.5226 123 A 4.0240 7.7512 122.8183 54.8417 18.3622 179.7773 124 V 3.5020 8.1146 117.2484 66.0786 31.6361 178.1532 125 K 3.8805 8.1721 119.3114 59.4814 32.0170 178.5289 126 S 4.0462 7.9435 113.1473 61.4762 62.3324 176.4065 127 V 3.5377 8.0575 120.7696 65.8563 31.3127 177.6841 128 A 3.9966 8.6002 120.8546 55.4746 18.1064 179.4248 129 N 4.4031 8.6898 115.2344 56.5000 38.3335 177.9117 130 S 4.1838 7.9476 115.8766 61.1626 62.9564 175.7618 131 Q 4.4080 7.9226 117.7761 54.4926 29.3462 175.3793 132 D 4.3674 7.4895 118.3983 55.4394 38.9562 173.9325 133 I 4.3704 8.1279 118.6914 60.1954 38.7355 176.1864 134 D 4.7655 8.6946 124.5055 54.9682 41.9938 176.6448 135 L 4.4837 7.6322 120.8488 53.7359 45.6920 173.9361 136 V 4.7536 8.4907 126.1465 61.2257 33.7003 174.4923 137 V 4.3538 8.5443 128.4535 60.8679 33.9469 174.6502 138 D 4.7736 8.6025 126.3333 54.0547 41.7312 176.8541 139 A 3.9893 9.1440 130.8055 55.1697 18.4973 178.7119 140 N 4.4351 8.3648 111.6639 54.6376 37.3975 175.5172 141 A 4.5759 8.0897 121.3493 51.6457 19.5131 176.0350 142 V 4.3124 7.7477 117.1608 61.5412 33.2638 175.4302 143 A 4.4846 8.4818 129.0878 53.2374 19.8538 176.1393 144 Y 4.7005 7.4809 113.4587 56.7949 41.5114 173.0262 145 N 4.6296 7.0959 122.7617 50.9909 40.4226 174.5356 146 S 4.3386 8.1827 116.6251 57.1246 64.4276 175.0359 147 S 4.1082 8.4088 114.5107 61.2391 62.6835 175.2215 148 D 4.3668 7.5987 118.4839 55.7333 40.5700 176.4078 149 V 4.4024 7.2181 119.7384 59.8416 31.6452 174.8134 150 K 4.0894 8.3356 128.8528 56.1551 33.7122 174.7655 151 D 5.1695 8.6269 126.9747 52.8847 41.9009 175.5031 152 I 4.3367 8.6525 119.8281 61.1609 38.2577 177.4470 153 T 3.8478 8.5225 120.2614 67.4816 68.0987 175.9706 154 A 3.9793 7.9417 121.6343 55.3228 18.2573 179.2563 155 D 4.2999 7.9645 115.9234 57.3137 41.2366 178.8248 156 V 3.6940 8.0213 118.8724 65.8678 31.6925 177.4733 157 L 3.9029 8.0533 120.4259 58.5605 41.6297 179.2778 158 K 4.0732 7.6882 116.2372 58.6261 32.0118 178.1974 159 Q 4.4776 8.0641 116.5685 54.5231 29.6856 176.0483 160 V 3.4336 7.1758 122.9399 64.5265 32.0188 176.5185 161 K 4.2512 8.6988 127.2373 55.1342 31.4478 172.3424 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 23 K 8.17 4.39 0.00 1.73 1.92 0.00 1.58 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.48 7.81 24 I 7.57 4.85 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 1.27 1.39 0.90 0.00 0.00 25 A 8.94 5.03 1.21 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 0.00 0.00 26 I 8.93 5.20 1.85 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 1.37 1.29 0.88 0.00 0.00 27 V 8.40 4.75 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 0.70 0.00 0.00 0.94 0.00 0.00 28 N 9.20 4.67 0.00 2.79 2.72 0.00 0.00 6.84 8.58 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 *30 G 8.61 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 0.00 0.00 0.00 31 S 8.95 4.10 0.00 3.87 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 32 L 8.07 4.00 0.00 1.79 1.74 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.26 4.00 0.00 3.10 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 34 Q 8.33 3.99 0.00 2.36 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 35 Q 8.17 3.98 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 36 V 8.14 3.54 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 0.91 0.00 0.00 0.95 0.00 0.00 37 A 7.81 3.74 1.02 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 0.00 0.00 38 Q 7.72 3.84 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 39 K 7.89 4.06 0.00 1.77 1.78 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.42 7.81 40 T 8.11 4.26 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 41 G 8.01 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 0.00 0.00 0.00 42 V 7.11 3.60 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 0.71 0.00 0.00 0.93 0.00 0.00 43 S 7.94 4.09 0.00 3.91 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 44 N 8.10 4.46 0.00 2.81 2.86 0.00 0.00 7.11 7.05 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 45 T 7.97 3.92 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 1.21 0.00 0.00 46 L 8.12 4.19 0.00 1.93 1.82 0.96 0.79 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 47 E 8.21 4.05 0.00 2.12 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 2.38 2.42 0.00 48 N 8.08 4.28 0.00 2.92 2.89 0.00 0.00 7.08 7.18 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 49 E 8.12 3.95 0.00 2.05 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 1.61 2.10 0.00 50 F 7.81 4.87 0.00 3.10 3.24 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 51 K 8.55 4.22 0.00 2.04 2.27 0.00 1.34 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.50 7.81 52 G 8.19 3.63 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 0.00 0.00 0.00 53 R 8.12 3.96 0.00 2.23 2.20 0.00 3.14 0.00 0.00 3.36 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.76 0.00 54 A 8.21 3.63 1.55 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 0.00 0.00 55 S 8.56 4.06 0.00 3.96 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 56 E 8.18 3.98 0.00 1.95 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 2.33 2.37 0.00 57 L 7.05 4.29 0.00 1.71 1.59 0.12 0.62 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 58 Q 8.05 4.19 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.16 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 59 R 7.94 4.48 0.00 2.09 2.14 0.00 2.85 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.64 0.00 *61 E 8.22 3.63 0.00 2.21 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 0.00 2.24 2.24 0.00 62 T 7.66 3.28 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 1.24 0.00 0.00 63 D 8.02 4.29 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 64 L 7.53 4.23 0.00 1.38 1.46 0.87 0.50 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 65 Q 8.66 4.06 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.37 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 66 A 7.68 4.73 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 67 K 8.12 4.38 0.00 1.84 1.48 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.32 1.52 7.81 *91 R 9.25 4.39 0.00 1.76 1.97 0.00 3.24 0.00 0.00 3.37 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.20 0.00 92 Q 7.95 4.30 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.01 0.00 93 T 7.86 4.37 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 1.25 0.00 0.00 94 F 8.11 4.12 0.00 3.12 3.25 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 95 A 8.17 3.95 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 96 Q 7.67 4.21 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 97 K 7.41 4.51 0.00 1.96 1.81 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.41 7.81 98 A 8.40 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 7.80 3.89 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 100 A 8.01 4.21 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 0.00 101 F 8.20 4.14 0.00 3.15 3.19 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 0.00 102 E 8.12 3.70 0.00 2.42 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 2.32 2.36 0.00 103 Q 8.01 3.84 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.49 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 104 D 8.27 4.42 0.00 2.87 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 0.00 105 R 7.34 2.70 0.00 0.67 1.29 0.00 2.79 0.00 0.00 2.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.71 0.00 106 A 7.52 3.83 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 0.00 107 R 8.31 3.78 0.00 1.81 2.15 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.68 0.00 108 R 8.22 4.00 0.00 2.19 2.13 0.00 3.54 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.09 0.00 109 S 8.44 4.11 0.00 3.89 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 0.00 110 N 8.38 4.31 0.00 2.93 2.85 0.00 0.00 7.07 8.49 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 0.00 111 E 8.27 3.96 0.00 2.23 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 2.34 2.37 0.00 112 E 8.27 4.00 0.00 2.04 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 2.56 2.49 0.00 113 R 8.46 4.29 0.00 2.02 2.24 0.00 2.95 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 114 G 8.64 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 0.00 115 K 8.40 4.10 0.00 1.99 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.67 7.81 116 L 7.92 3.97 0.00 2.11 1.71 0.85 0.21 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 0.00 117 V 8.05 3.73 2.29 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 1.13 0.00 0.00 1.07 0.00 0.00 118 T 7.98 3.88 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 1.22 0.00 0.00 119 R 7.96 3.96 0.00 2.03 1.97 0.00 3.12 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 120 I 7.95 3.79 2.07 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 1.54 0.88 0.95 0.00 0.00 121 Q 8.52 4.01 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 122 T 8.14 3.85 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 1.21 0.00 0.00 123 A 7.75 4.02 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 0.00 124 V 8.11 3.50 2.24 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 0.99 0.00 0.00 1.02 0.00 0.00 125 K 8.17 3.88 0.00 1.87 1.94 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.45 7.81 126 S 7.94 4.05 0.00 3.96 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 0.00 127 V 8.06 3.54 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 0.95 0.00 0.00 1.00 0.00 0.00 128 A 8.60 4.00 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 0.00 129 N 8.69 4.40 0.00 2.69 2.88 0.00 0.00 7.09 7.98 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 0.00 130 S 7.95 4.18 0.00 3.97 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 0.00 131 Q 7.92 4.41 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 132 D 7.49 4.37 0.00 2.75 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 0.00 133 I 8.13 4.37 1.87 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 1.29 0.70 0.97 0.00 0.00 134 D 8.69 4.77 0.00 2.55 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 0.00 135 L 7.63 4.48 0.00 1.72 1.45 0.92 0.81 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 0.00 136 V 8.49 4.75 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 0.84 0.00 0.00 0.93 0.00 0.00 137 V 8.54 4.35 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 0.86 0.00 0.00 0.92 0.00 0.00 138 D 8.60 4.77 0.00 2.71 2.56 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 0.00 139 A 9.14 3.99 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 0.00 140 N 8.36 4.44 0.00 2.86 2.95 0.00 0.00 6.79 7.32 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 0.00 141 A 8.09 4.58 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 0.00 142 V 7.75 4.31 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 0.82 0.00 0.00 0.96 0.00 0.00 143 A 8.48 4.48 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 0.00 144 Y 7.48 4.70 0.00 2.87 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 0.00 145 N 7.10 4.63 0.00 2.62 2.56 0.00 0.00 6.14 7.64 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 0.00 146 S 8.18 4.34 0.00 4.05 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 0.00 147 S 8.41 4.11 0.00 3.98 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 0.00 148 D 7.60 4.37 0.00 2.77 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 0.00 149 V 7.22 4.40 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 0.85 0.00 0.00 0.90 0.00 0.00 150 K 8.34 4.09 0.00 1.86 1.64 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.42 7.81 151 D 8.63 5.17 0.00 2.69 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 0.00 152 I 8.65 4.34 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 1.46 0.54 0.90 0.00 0.00 153 T 8.52 3.85 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 1.22 0.00 0.00 154 A 7.94 3.98 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 0.00 155 D 7.96 4.30 0.00 2.81 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 0.00 156 V 8.02 3.69 2.22 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 0.97 0.00 0.00 0.93 0.00 0.00 157 L 8.05 3.90 0.00 1.86 1.82 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 158 K 7.69 4.07 0.00 1.88 1.86 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.69 7.81 159 Q 8.06 4.48 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.48 0.00 160 V 7.18 3.43 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 0.69 0.00 0.00 0.98 0.00 0.00 161 K 8.70 4.25 0.00 1.99 1.67 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.24 0.99 7.81 * Residues marked with a * may have inaccurate shift predictions.