NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 55 N 4.7920 8.5245 117.7916 52.0984 39.9637 177.0254 56 M 4.6187 7.7507 115.7572 53.4990 32.7380 177.3742 57 L 4.3911 8.4050 123.7998 54.9908 41.1349 179.7615 58 K 4.6720 8.2460 130.6229 53.8415 32.4022 174.3625 59 M 4.6292 7.7396 119.3409 54.3625 33.9881 177.3653 60 S 4.3055 8.3339 115.9666 57.9496 65.3137 174.7563 61 A 3.9850 8.6898 126.8286 55.2959 18.0408 178.4949 62 P 4.5118 0.0000 0.0000 65.9300 30.9596 178.7899 63 G 3.6187 7.4677 103.5713 47.4819 0.0000 175.2888 64 L 4.1780 8.2558 123.0519 58.1099 42.1533 178.6641 65 D 4.2983 8.6827 119.1983 57.4406 40.7286 178.6360 66 F 4.3039 8.4982 121.2444 61.3338 39.3060 177.2353 67 L 3.8068 8.0549 118.7475 57.4852 40.8957 179.5530 68 K 4.2123 7.8539 118.1675 59.3287 31.7853 178.8674 69 C 4.9543 8.2356 119.4673 62.0292 31.6333 175.2792 70 A 3.8071 7.4195 120.7925 54.6974 17.9272 178.9500 71 F 4.7041 7.5622 114.0520 58.6743 41.0716 177.2102 72 A 4.7428 7.3081 120.9314 50.5101 18.0669 176.3008 73 S 4.3958 8.2879 118.6207 60.6198 63.4902 174.6695 74 P 4.4386 0.0000 0.0000 64.4211 31.4308 176.0459 75 D 4.5060 7.7020 118.1876 53.0689 39.3441 175.2420 76 F 5.0665 7.4303 117.1501 55.9197 42.8857 175.2041 77 S 4.3768 8.8807 117.0848 61.7906 62.7729 175.3145 78 T 4.6844 7.4784 113.6599 61.4716 72.4847 172.9052 79 D 4.5088 8.8519 124.1403 54.2064 41.6269 175.3251 80 P 3.9681 0.0000 0.0000 64.6704 31.6068 176.2972 81 G 4.0249 8.0289 102.7181 46.1373 0.0000 171.5878 82 K 4.6120 7.7786 119.9712 54.4147 36.5540 177.7520 83 G 3.8804 8.4471 110.6176 45.3225 0.0000 172.3397 84 I 2.9396 8.0573 120.7554 60.5533 37.6380 175.6707 85 P 4.4311 0.0000 0.0000 62.3626 30.2281 173.9306 86 D 4.9228 7.1675 117.0236 51.4585 42.7338 176.6339 87 K 3.9667 8.8007 118.1551 59.5540 31.9466 177.7070 88 F 4.2244 7.5363 120.5024 58.8281 39.4198 174.5973 89 Q 4.2128 7.7950 126.3573 55.3526 29.7207 175.9509 90 G 3.4845 5.3800 107.8495 44.1134 0.0000 173.1889 91 L 4.1100 8.2065 121.3561 54.7297 42.4833 176.3967 92 V 4.5362 8.1449 124.3485 61.0390 34.7075 174.7236 93 L 4.4579 8.2018 126.7472 52.2608 41.8642 172.6810 94 P 4.3667 0.0000 0.0000 61.6065 31.5013 176.0572 95 K 4.3032 8.3415 124.7953 54.4003 33.5145 176.4395 96 K 4.2663 8.0624 126.3622 54.9482 31.1035 175.4952 97 H 4.1066 7.7592 119.6922 55.6250 29.3999 175.1455 98 C 4.5996 8.0330 121.1237 58.5497 34.1280 172.6988 99 L 4.6513 9.1429 129.4665 53.7524 42.6559 175.5002 100 T 4.5330 8.5515 123.5787 61.9214 69.2582 173.3864 101 Q 4.5257 8.3294 126.4303 54.0491 32.2449 174.7293 102 S 4.5668 8.5831 119.8459 57.4583 63.3031 173.6633 103 I 4.2102 8.0578 126.2074 59.4797 39.0303 175.6016 104 T 4.3329 7.8237 120.2515 61.4578 70.0488 173.8529 105 F 4.2997 8.5585 126.2073 56.9901 39.3687 175.7172 106 T 3.9910 8.6648 122.8799 62.6920 68.4409 172.0655 107 P 4.3832 0.0000 0.0000 64.1701 31.9420 176.6577 108 G 4.0625 9.8851 109.7708 45.1472 0.0000 172.6724 109 K 4.9507 7.4019 116.0437 54.7602 36.5755 175.2794 110 Q 4.7934 9.0900 120.2307 54.8533 30.7892 174.9387 111 T 5.2271 8.5223 113.1029 60.2679 71.3224 173.0592 112 M 4.2977 9.4124 126.5133 54.2615 33.7811 175.3367 113 L 4.9238 8.3893 123.2525 52.7393 43.4743 174.9732 114 L 4.0566 8.9412 126.7497 53.8420 42.8242 175.8690 115 V 4.1716 8.2616 127.7923 61.8785 31.0671 174.6922 116 A 4.6937 8.1133 130.0029 49.2941 21.8925 175.4272 117 P 4.0214 0.0000 0.0000 62.0541 29.1119 176.1494 118 I 4.2470 6.8944 121.1111 60.9710 38.3985 175.9240 119 P 3.5088 0.0000 0.0000 64.4652 32.5851 177.2481 120 G 4.0293 7.6149 108.6455 48.0796 0.0000 173.1454 121 I 4.2446 7.3393 120.0351 60.8820 37.4329 176.2819 122 A 2.8780 8.4475 130.2451 54.0786 18.4212 177.0840 123 C 4.6605 7.4546 107.1523 57.3863 33.7894 171.6501 124 L 5.1515 8.7912 118.7682 52.7559 44.1881 175.9821 125 K 5.5874 9.1531 124.1100 54.1035 35.6367 174.5185 126 A 4.9906 8.1920 124.6021 51.0979 22.4543 174.9202 127 E 5.4819 8.9590 119.8962 54.9217 32.9101 175.2467 128 A 4.6523 8.8162 122.4216 50.3179 23.1615 175.7237 129 N 4.6065 8.6559 116.9007 52.9140 40.1034 175.0272 130 V 3.6019 7.5459 120.9816 64.7136 31.8577 176.9807 131 G 3.8295 8.8947 114.3488 45.5047 0.0000 173.1786 132 A 4.2475 7.6972 122.8515 51.3663 19.5323 176.4502 133 S 4.4663 7.9884 113.2146 56.8032 65.3547 174.3080 *135 F 5.0049 8.5313 121.4978 57.8162 39.3520 174.4659 136 S 4.4110 7.8709 118.3930 60.3878 64.1951 176.4847 137 G 3.7918 7.8056 108.1519 44.4474 0.0000 173.5078 138 V 3.7950 7.6113 120.5780 61.4291 31.3312 173.8488 139 P 4.3240 0.0000 0.0000 62.7448 31.8251 175.7841 140 L 4.6691 8.2881 120.9655 53.3923 42.5952 175.9159 141 A 4.4923 8.6071 127.1872 50.9293 20.3045 176.4527 142 S 4.4920 8.5306 116.5024 58.2780 64.3570 174.0919 143 V 4.1711 8.7575 124.8252 60.8576 32.4174 174.5770 144 E 4.4827 8.4654 126.6785 56.0411 30.2648 176.9603 145 F 4.7732 8.9063 121.5829 56.2984 39.9185 174.1827 146 P 4.4177 0.0000 0.0000 64.1179 31.5373 175.7588 147 G 4.3101 8.7875 105.7789 47.9788 0.0000 176.2640 148 F 4.0517 8.5386 122.5832 61.1799 39.7256 176.7847 149 D 4.8655 8.4319 119.2097 56.6301 40.9252 177.8145 150 Q 4.3711 7.7438 116.2801 56.0777 29.2342 176.5086 151 L 3.9858 7.4800 117.9564 56.0002 44.1300 176.8682 152 F 4.7297 7.3188 114.2979 55.5743 38.9822 176.7151 153 G 4.1720 7.8753 111.5403 44.4019 0.0000 175.0697 154 T 3.9306 8.4696 108.4251 64.4578 68.9778 175.5284 155 S 4.5245 7.4225 116.0077 56.4640 64.3972 173.4294 156 A 4.9634 8.3468 120.7139 52.2176 18.1976 178.0258 157 T 4.5518 7.4887 111.6955 64.3206 68.9938 174.8944 158 D 4.9295 7.7352 119.9243 53.3457 40.5531 176.9100 159 T 4.8810 8.6792 118.0059 67.0894 68.5869 175.6797 160 A 5.1509 8.0363 121.2779 51.8016 19.5306 178.5035 161 A 4.2030 8.2273 124.9530 56.1587 19.1076 179.3111 162 N 4.6396 8.0303 110.9009 53.8114 40.1592 175.6520 163 V 4.4506 7.4266 116.7164 61.3297 34.3012 175.6833 164 T 4.2063 8.6733 122.2547 64.8721 69.5554 174.5741 165 A 4.7993 7.5881 120.8833 50.5840 22.2971 174.1139 166 F 5.0650 7.6812 113.5502 55.5090 41.2560 174.1980 167 R 4.4986 8.1935 113.3462 55.6799 31.4196 173.8593 168 Y 4.3271 9.0663 119.8962 57.3539 38.9927 175.0275 169 A 4.7682 8.6343 126.4227 53.3429 20.8162 176.8175 170 S 4.7000 7.7832 107.0379 57.9523 65.6345 173.7230 171 M 4.7976 8.3319 120.0004 54.4861 35.7042 174.2132 172 A 4.6799 8.4344 124.6846 51.3441 22.3729 174.7676 173 A 4.7918 8.2176 120.9646 51.1165 22.2025 176.3289 174 G 3.9458 8.3450 107.9607 44.0079 0.0000 172.6620 175 V 4.0446 7.8641 122.5478 61.0559 32.7682 174.8835 176 Y 4.4467 8.2591 126.1514 55.3212 37.5975 173.6193 177 P 4.4233 0.0000 0.0000 63.1716 31.8507 176.8482 178 T 4.6386 8.5093 112.1513 61.4697 69.2460 174.0171 179 S 4.8238 8.3294 116.7201 57.4235 64.5529 173.2405 180 N 4.8880 8.4119 119.6085 51.3059 39.0653 175.7543 181 L 4.4744 8.4931 114.3279 56.2131 41.1328 177.3757 182 M 4.7778 8.0159 116.2241 54.9586 32.8157 175.5266 183 Q 4.4768 8.4327 114.0263 55.7205 30.6873 175.2645 184 F 4.4427 8.3249 112.9373 55.8335 38.8914 174.3700 185 A 4.4450 8.6243 126.4151 52.0108 20.8506 175.9778 186 G 3.9313 8.0391 108.8968 43.7425 0.0000 172.6086 187 S 4.7122 8.1056 112.8596 56.4477 66.0719 173.1609 188 I 4.4244 8.1990 121.3570 59.5896 39.3692 175.1767 189 Q 4.7093 8.6113 123.7831 53.9086 31.6774 175.1242 190 V 4.5432 8.2343 120.6585 61.3146 34.4841 173.8342 191 Y 4.9289 8.1832 122.8978 55.9661 40.8348 173.6995 192 K 4.4420 8.4878 118.6732 54.4927 35.1133 175.8778 193 I 4.4516 8.0011 123.6573 59.1155 39.3331 174.9622 194 P 4.5997 0.0000 0.0000 61.1947 29.9467 175.1453 195 L 4.1928 7.5010 123.0117 55.4341 42.7432 177.1181 196 K 4.6270 8.1186 120.7589 54.7116 36.1566 175.6709 197 Q 4.3252 8.5112 123.5390 55.4376 29.9662 175.0325 198 V 4.4308 7.9705 122.5840 61.1963 34.8587 174.7619 199 L 4.4991 8.2306 125.9541 53.4100 41.4004 175.4617 200 N 4.7385 8.3404 122.0567 52.2875 39.8291 174.8376 201 S 4.8096 8.1531 115.0604 57.0769 64.5467 172.8455 202 Y 4.8346 7.6792 120.7496 56.3106 40.0420 173.6441 203 S 4.7357 8.7333 117.8062 56.8280 64.9355 173.4619 204 Q 4.7197 8.5194 125.0523 54.4690 31.4382 174.4108 205 T 4.4363 8.4666 121.1534 62.0202 69.8650 174.1400 206 V 3.9865 8.1832 126.0935 61.1723 33.0011 175.4595 *501 A 4.4418 8.4329 128.1093 52.6212 18.7158 175.9862 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 55 N 8.52 4.79 0.00 2.76 2.80 0.00 0.00 6.34 6.77 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 56 M 7.75 4.62 0.00 2.05 1.89 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.17 0.00 57 L 8.41 4.39 0.00 1.66 1.54 0.92 0.76 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 58 K 8.25 4.67 0.00 1.76 1.70 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.28 1.01 7.81 59 M 7.74 4.63 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 60 S 8.33 4.31 0.00 4.04 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 61 A 8.69 3.98 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 62 P 0.00 4.51 0.00 2.26 2.32 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 63 G 7.47 3.62 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 0.00 0.00 0.00 64 L 8.26 4.18 0.00 1.89 1.84 0.92 1.51 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 65 D 8.68 4.30 0.00 2.97 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 66 F 8.50 4.30 0.00 3.10 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 67 L 8.05 3.81 0.00 1.97 1.85 1.01 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.85 4.21 0.00 1.78 1.62 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.69 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.57 7.81 69 C 8.24 4.95 0.00 3.08 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 70 A 7.42 3.81 0.39 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 71 F 7.56 4.70 0.00 3.19 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 72 A 7.31 4.74 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 73 S 8.29 4.40 0.00 3.94 4.01 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 0.00 0.00 0.00 74 P 0.00 4.44 0.00 2.18 2.22 0.00 3.72 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 1.99 2.03 0.00 75 D 7.70 4.51 0.00 2.24 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.43 5.07 0.00 3.18 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 77 S 8.88 4.38 0.00 3.92 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 78 T 7.48 4.68 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 1.22 0.00 0.00 79 D 8.85 4.51 0.00 2.80 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 80 P 0.00 3.97 0.00 2.14 2.20 0.00 3.84 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 1.61 1.76 0.00 81 G 8.03 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 0.00 0.00 0.00 0.00 82 K 7.78 4.61 0.00 1.71 1.66 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.32 1.41 7.81 83 G 8.45 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 84 I 8.06 2.94 1.76 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.33 0.63 0.00 0.00 85 P 0.00 4.43 0.00 2.09 2.00 0.00 2.20 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 86 D 7.17 4.92 0.00 2.75 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.80 3.97 0.00 1.79 1.98 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.48 7.81 88 F 7.54 4.22 0.00 3.12 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 89 Q 7.79 4.21 0.00 1.80 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.11 2.38 0.00 90 G 5.38 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.21 4.11 0.00 1.59 1.62 0.90 0.79 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 92 V 8.14 4.54 2.18 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 0.92 0.00 0.00 1.17 0.00 0.00 93 L 8.20 4.46 0.00 1.56 1.51 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.37 0.00 2.19 2.06 0.00 3.76 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 1.95 1.93 0.00 95 K 8.34 4.30 0.00 1.55 1.43 0.00 1.58 0.00 0.00 1.46 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.98 1.25 7.81 96 K 8.06 4.27 0.00 1.70 1.70 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.37 7.81 97 H 7.76 4.11 0.00 2.02 1.31 0.00 5.93 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 C 8.03 4.60 0.00 2.91 2.79 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 99 L 9.14 4.65 0.00 1.81 1.66 1.07 0.86 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 0.00 100 T 8.55 4.53 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 0.00 101 Q 8.33 4.53 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.89 0.00 0.00 0.00 0.00 0.00 2.19 2.33 0.00 102 S 8.58 4.57 0.00 3.88 3.78 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 0.00 103 I 8.06 4.21 1.43 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 1.26 0.46 -0.03 0.00 0.00 104 T 7.82 4.33 4.17 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 1.22 0.00 0.00 105 F 8.56 4.30 0.00 3.09 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 0.00 106 T 8.66 3.99 4.38 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 1.24 0.00 0.00 107 P 0.00 4.38 0.00 2.20 2.10 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 108 G 9.89 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 0.00 109 K 7.40 4.95 0.00 1.79 1.89 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.41 7.81 110 Q 9.09 4.79 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 111 T 8.52 5.23 4.40 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 1.40 0.00 0.00 112 M 9.41 4.30 0.00 1.53 1.34 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 2.14 0.00 113 L 8.39 4.92 0.00 1.47 1.57 1.10 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.94 4.06 0.00 1.57 1.45 0.75 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.26 4.17 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 0.79 0.00 0.00 0.88 0.00 0.00 116 A 8.11 4.69 1.13 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 0.00 117 P 0.00 4.02 0.00 1.42 1.41 0.00 3.59 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.77 0.00 118 I 6.89 4.25 1.84 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 1.38 1.08 0.85 0.00 0.00 119 P 0.00 3.51 0.00 1.46 1.56 0.00 3.33 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.80 0.00 120 G 7.61 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 0.00 0.00 0.00 121 I 7.34 4.24 1.84 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.39 0.90 0.00 0.00 122 A 8.45 2.88 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 C 7.45 4.66 0.00 2.92 2.89 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 0.00 124 L 8.79 5.15 0.00 1.48 1.50 0.85 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 125 K 9.15 5.59 0.00 1.72 1.57 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.21 7.81 126 A 8.19 4.99 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 0.00 127 E 8.96 5.48 0.00 1.90 1.92 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 2.30 2.34 0.00 128 A 8.82 4.65 0.56 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 0.00 129 N 8.66 4.61 0.00 2.59 2.71 0.00 0.00 6.53 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 0.00 130 V 7.55 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 0.72 0.00 0.00 0.93 0.00 0.00 131 G 8.89 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 0.00 0.00 0.00 132 A 7.70 4.25 1.16 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 0.00 133 S 7.99 4.47 0.00 3.99 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 *135 F 8.53 5.00 0.00 3.07 3.12 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 0.00 136 S 7.87 4.41 0.00 3.99 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 0.00 137 G 7.81 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 0.00 0.00 0.00 138 V 7.61 3.79 2.31 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 1.03 0.00 0.00 0.96 0.00 0.00 139 P 0.00 4.32 0.00 2.21 2.04 0.00 3.83 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 140 L 8.29 4.67 0.00 1.50 1.60 0.85 0.66 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 0.00 141 A 8.61 4.49 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 0.00 142 S 8.53 4.49 0.00 3.78 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 0.00 143 V 8.76 4.17 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 0.88 0.00 0.00 0.86 0.00 0.00 144 E 8.47 4.48 0.00 1.91 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 1.99 2.20 0.00 145 F 8.91 4.77 0.00 3.31 2.90 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 0.00 146 P 0.00 4.42 0.00 2.25 2.15 0.00 4.27 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 147 G 8.79 4.31 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 0.00 148 F 8.54 4.05 0.00 3.20 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 0.00 149 D 8.43 4.87 0.00 2.84 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 0.00 150 Q 7.74 4.37 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 151 L 7.48 3.99 0.00 1.08 0.30 0.43 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 152 F 7.32 4.73 0.00 2.30 2.79 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 0.00 153 G 7.88 4.17 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 0.00 154 T 8.47 3.93 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 1.26 0.00 0.00 155 S 7.42 4.52 0.00 3.87 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 0.00 156 A 8.35 4.96 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 0.00 157 T 7.49 4.55 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 1.23 0.00 0.00 158 D 7.74 4.93 0.00 2.74 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 0.00 159 T 8.68 4.88 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 1.31 0.00 0.00 160 A 8.04 5.15 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 0.00 161 A 8.23 4.20 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 0.00 162 N 8.03 4.64 0.00 2.67 2.76 0.00 0.00 6.59 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 0.00 163 V 7.43 4.45 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 1.17 0.00 0.00 0.82 0.00 0.00 164 T 8.67 4.21 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 0.00 165 A 7.59 4.80 1.11 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 0.00 0.00 166 F 7.68 5.06 0.00 3.04 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 0.00 167 R 8.19 4.50 0.00 1.81 1.80 0.00 2.89 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.59 0.00 168 Y 9.07 4.33 0.00 3.04 3.04 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 0.00 169 A 8.63 4.77 1.41 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 0.00 170 S 7.78 4.70 0.00 3.91 3.77 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 0.00 171 M 8.33 4.80 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.70 0.00 172 A 8.43 4.68 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 0.00 173 A 8.22 4.79 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 0.00 174 G 8.35 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 0.00 0.00 0.00 175 V 7.86 4.04 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 0.95 0.00 0.00 0.93 0.00 0.00 176 Y 8.26 4.45 0.00 3.07 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 0.00 177 P 0.00 4.42 0.00 2.00 1.99 0.00 3.63 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 1.96 2.06 0.00 178 T 8.51 4.64 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 1.33 0.00 0.00 179 S 8.33 4.82 0.00 4.01 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 0.00 180 N 8.41 4.89 0.00 2.92 3.00 0.00 0.00 5.97 6.67 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 0.00 181 L 8.49 4.47 0.00 1.75 1.89 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 182 M 8.02 4.78 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 183 Q 8.43 4.48 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.65 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 184 F 8.32 4.44 0.00 3.17 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 0.00 185 A 8.62 4.45 1.15 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 0.00 186 G 8.04 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 0.00 187 S 8.11 4.71 0.00 3.91 3.78 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 0.00 188 I 8.20 4.42 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 1.22 0.56 0.84 0.00 0.00 189 Q 8.61 4.71 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 190 V 8.23 4.54 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 0.85 0.00 0.00 0.92 0.00 0.00 191 Y 8.18 4.93 0.00 3.07 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 0.00 192 K 8.49 4.44 0.00 1.71 1.66 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.27 1.42 7.81 193 I 8.00 4.45 1.75 0.00 0.00 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 1.40 0.18 0.89 0.00 0.00 194 P 0.00 4.60 0.00 2.17 2.08 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 195 L 7.50 4.19 0.00 1.61 1.61 0.86 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 196 K 8.12 4.63 0.00 1.67 1.64 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.35 7.81 197 Q 8.51 4.33 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 198 V 7.97 4.43 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 0.94 0.00 0.00 199 L 8.23 4.50 0.00 1.61 1.58 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 200 N 8.34 4.74 0.00 2.82 2.79 0.00 0.00 6.99 7.57 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 0.00 201 S 8.15 4.81 0.00 3.80 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 0.00 202 Y 7.68 4.83 0.00 3.01 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 0.00 203 S 8.73 4.74 0.00 3.91 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 0.00 204 Q 8.52 4.72 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 205 T 8.47 4.44 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 1.22 0.00 0.00 206 V 8.18 3.99 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 1.03 0.00 0.00 0.95 0.00 0.00 *501 A 8.43 4.44 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 * Residues marked with a * may have inaccurate shift predictions.