NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 44 Q 4.3426 8.3293 118.8364 55.9854 29.7792 173.7332 45 H 3.8719 8.9935 112.9044 56.1415 28.4950 172.3446 46 I 4.3228 8.4421 124.0911 59.0167 41.2786 175.7122 47 V 4.1181 7.9254 129.1366 61.0043 32.6510 173.0452 48 P 5.4536 0.0000 0.0000 62.6071 32.6027 175.2246 49 C 5.3805 8.9009 121.9890 58.1813 32.3180 173.0838 50 T 4.8016 8.4040 108.0702 59.7216 71.2035 174.9937 51 I 3.6691 8.9674 125.0773 64.7901 36.5858 178.8513 52 S 4.1140 8.3958 115.2036 61.8192 62.3547 176.7216 53 Q 4.3031 7.9394 121.9814 58.2844 28.5859 177.7187 54 L 4.1590 8.3144 121.0735 56.6217 41.5408 179.2536 55 L 3.8361 7.6289 120.6756 57.8595 42.0369 179.6434 56 S 4.2659 8.1670 113.3038 60.7085 63.5127 174.0345 57 A 4.1989 7.0521 124.0053 50.7680 19.4510 176.5309 58 T 4.7325 8.5039 111.1532 59.9371 70.8063 175.0120 59 L 4.9959 8.0945 120.7775 54.3864 40.8550 176.2937 60 V 3.4449 7.6968 120.2134 63.5701 31.6591 174.6676 61 D 4.9087 9.0751 117.3385 53.8977 38.0382 173.9045 62 E 3.4747 7.2439 113.6225 56.4330 26.8796 174.1707 63 V 4.1509 6.3531 121.5427 62.6777 36.6714 169.2319 64 F 5.4338 8.0998 121.4460 55.7060 42.4265 174.7091 65 R 4.9412 9.4497 122.4473 54.7234 33.5681 174.2915 66 I 4.4404 9.0967 126.7176 59.7322 38.8249 175.9878 67 G 4.0986 9.0721 116.4744 47.1712 0.0000 173.8092 68 N 4.9132 8.9597 120.8023 51.8923 37.7991 173.7537 69 V 3.9366 8.1453 120.7965 62.3895 32.2296 174.1348 70 E 5.6564 9.0062 128.6210 54.6992 30.5591 174.9192 71 I 4.3511 8.4719 120.4359 60.8138 39.5461 172.9428 72 S 4.4302 9.0136 119.6552 59.3701 63.8149 175.2376 73 Q 4.7459 8.9016 115.7904 55.4448 31.6431 175.7253 74 V 4.9560 8.6979 113.2329 61.6404 37.0473 172.8988 75 T 5.6976 8.4258 110.5497 59.4402 72.7667 172.7258 76 I 4.7098 7.9343 113.9021 59.9646 40.7051 173.3420 77 V 4.7231 7.8337 123.9839 61.4784 34.2131 174.3493 78 G 4.0629 8.2912 111.0436 46.3265 0.0000 171.7068 79 I 4.1650 8.1645 121.1441 58.8998 40.3853 174.5896 80 I 4.2409 7.9714 129.1552 61.2755 37.3123 176.6729 81 R 4.0737 9.2956 127.3006 58.0278 31.2972 176.4910 82 H 5.0387 8.0324 116.1486 54.8136 33.8772 172.2076 83 A 5.0639 8.6039 123.8865 50.7558 22.2688 175.3167 84 E 4.6260 8.9091 121.7829 54.3012 33.1858 175.2648 85 K 4.3813 8.7202 123.8486 55.8713 32.9698 176.2142 86 A 4.9635 7.8338 129.4097 50.3289 21.2370 173.3381 87 P 4.6619 0.0000 0.0000 63.6314 31.2927 175.7556 88 T 4.6655 7.4456 112.5219 62.0978 69.5279 173.2459 89 N 4.6691 7.6299 116.4713 52.8622 40.0709 173.8943 90 I 4.3777 8.8930 122.0618 60.6257 39.7234 175.5903 91 V 4.3367 8.3032 123.1214 61.8786 34.2001 173.4750 92 Y 5.2982 9.0794 126.5732 56.3771 40.7283 175.2221 93 K 4.7566 9.0485 123.0386 55.1228 34.3392 175.3249 94 I 4.8190 8.5472 126.5776 59.4349 39.9044 174.1738 95 D 5.2088 9.3846 127.3283 52.3168 43.2593 176.0602 96 D 5.0201 8.3250 122.4666 52.7066 38.9976 177.0983 97 M 3.3788 9.0043 120.0340 56.7553 31.5539 179.0275 98 T 4.1816 9.1362 108.9790 64.1285 69.5146 173.9269 99 A 4.3187 7.0481 121.9298 51.3966 21.4009 175.0163 100 A 4.2597 8.4722 118.0556 51.1759 19.3376 176.0184 101 P 4.5615 0.0000 0.0000 63.5858 31.8025 175.7962 102 M 4.5623 8.5741 120.8033 54.0922 33.9649 174.7490 103 D 5.1912 8.4966 120.0321 53.9619 42.7169 175.4274 104 V 4.8415 8.9836 123.2281 61.1086 34.7243 174.1808 105 R 5.1699 9.2362 126.8523 54.4218 32.9455 174.4034 106 Q 4.8881 8.7352 124.8161 53.8621 32.1448 174.0649 107 W 5.0311 9.1397 135.0000 57.0819 31.0196 175.2584 108 V 4.0374 7.5714 126.6240 60.0194 32.6472 175.8186 109 D 4.6001 8.0127 123.0213 54.3074 42.3040 177.2769 110 T 4.6586 7.8600 109.0426 61.2345 69.3240 173.0047 111 D 4.6410 7.8435 121.9507 54.5616 40.7465 177.8263 *117 N 4.5032 7.9671 116.5284 52.8542 40.2160 174.6361 118 T 4.0758 7.6846 108.9669 61.1349 67.9604 174.2505 119 V 4.0382 7.9088 126.8499 61.8463 32.6737 175.7026 120 V 3.8626 8.8403 125.7358 61.6043 31.6000 174.5053 121 P 4.4111 0.0000 0.0000 62.1610 31.8035 174.5044 122 P 4.4959 0.0000 0.0000 63.6045 31.8448 175.6771 123 E 3.7416 9.4766 118.4549 57.7558 27.4334 174.6005 124 T 4.7290 7.4278 107.1412 60.0217 72.6278 171.9973 125 Y 4.6833 8.4470 120.9610 57.3663 39.7187 174.9220 126 V 4.8766 8.6845 116.9740 59.4687 35.9895 175.0846 127 K 4.8003 8.6380 124.8172 55.7523 34.8126 175.9419 128 V 4.6154 8.1289 122.7955 61.7306 34.1527 173.4160 129 A 4.5049 8.5135 129.5771 51.1177 20.1995 177.5639 130 G 3.3882 6.6997 105.8732 46.2582 0.0000 171.0259 131 H 5.1374 7.7153 113.3507 53.5538 32.3638 172.8016 132 L 4.1770 7.8564 123.2979 55.3044 42.6724 176.1643 133 R 4.5337 8.9401 127.3475 54.5288 32.3257 174.0640 134 S 4.8738 8.9976 121.8154 57.8779 63.6535 173.9978 135 F 4.6680 8.4002 129.5414 58.0333 40.2177 173.5340 136 Q 3.1763 8.2934 129.5376 57.7315 25.4830 174.0081 137 N 4.1311 8.0725 111.5388 53.4730 37.1775 174.6342 138 K 4.6010 7.3230 116.4376 54.6198 35.3331 174.6576 139 K 4.2420 8.0700 119.1758 57.6035 33.1852 176.6026 140 S 4.7335 9.0174 118.2827 57.2694 68.5525 172.3256 141 L 5.0103 8.8956 122.6740 53.3924 44.8738 174.9842 142 V 4.6022 8.1975 125.7645 61.5413 33.3351 174.7153 143 A 4.9211 8.8094 131.3084 49.7851 17.2843 176.5572 144 F 4.2693 9.4438 117.4831 60.2959 38.6906 175.3708 145 K 4.6784 7.9619 117.5513 55.3310 36.0111 175.3040 146 I 4.6723 8.1381 123.6598 61.0063 39.5991 173.4372 147 M 4.6947 8.4535 126.7969 52.8181 34.4329 174.1945 148 P 4.9216 0.0000 0.0000 61.9461 32.9452 175.6635 149 L 4.4268 8.7385 123.1813 54.0399 42.5640 177.0470 150 E 4.1449 8.8157 121.1615 57.3510 30.7593 175.4991 151 D 4.7714 7.7099 119.5643 52.2206 42.1744 176.0878 152 M 4.2843 8.5199 126.9492 57.2284 31.9062 178.0058 153 N 4.4174 9.0590 118.1028 56.0012 38.6593 176.7178 154 E 3.9827 8.2411 121.1629 58.9339 29.4204 178.6142 155 F 4.1821 7.7967 119.9889 61.5544 39.6253 176.9650 156 T 3.2706 7.5171 114.6044 66.8964 68.3514 176.3392 157 T 3.7886 8.3387 117.7813 67.0704 68.0888 175.8409 158 H 3.9764 8.0434 119.7547 59.3977 29.8972 177.0145 159 I 3.6862 7.2037 121.3955 64.5901 36.8471 178.3951 160 L 3.8846 7.5456 118.7882 57.8312 41.6094 178.9738 161 E 3.8525 8.5463 118.8474 59.6552 29.3064 179.3516 162 V 3.7776 8.5919 120.0878 65.7398 31.5495 178.1182 163 I 3.6901 7.8286 119.2026 64.2148 36.9720 178.0020 164 N 4.2020 8.8077 118.1983 56.5808 38.7986 176.4576 165 A 3.9394 8.3289 122.4062 55.8956 18.4324 179.4703 166 H 4.1178 8.4491 114.4512 58.8188 28.4262 177.8935 167 M 3.9907 7.6570 119.1897 58.5883 32.2209 178.1177 168 V 3.7310 7.4920 116.8361 65.9599 32.1894 177.6694 169 L 4.1049 8.2576 118.9408 58.1735 41.3410 179.4774 170 S 4.4376 7.9585 116.2922 60.6907 62.8576 175.6210 171 K 4.0569 7.1349 125.1119 54.5218 33.8818 177.0592 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 44 Q 8.33 4.34 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 45 H 8.99 3.87 0.00 3.38 3.36 0.00 5.47 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 46 I 8.44 4.32 1.86 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.82 0.91 0.00 0.00 47 V 7.93 4.12 2.00 0.00 0.00 0.00 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 0.82 0.00 0.00 48 P 0.00 5.45 0.00 2.01 2.17 0.00 3.77 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 1.78 0.00 49 C 8.90 5.38 0.00 2.84 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 50 T 8.40 4.80 4.34 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 0.00 0.00 1.24 0.00 0.00 51 I 8.97 3.67 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 1.57 0.56 0.96 0.00 0.00 52 S 8.40 4.11 0.00 4.03 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 0.00 53 Q 7.94 4.30 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 54 L 8.31 4.16 0.00 1.78 1.56 0.88 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 55 L 7.63 3.84 0.00 1.62 1.76 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.17 4.27 0.00 4.09 4.12 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 57 A 7.05 4.20 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 58 T 8.50 4.73 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 1.24 0.00 0.00 59 L 8.09 5.00 0.00 1.12 1.50 0.88 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 60 V 7.70 3.44 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 0.98 0.00 0.00 0.91 0.00 0.00 61 D 9.08 4.91 0.00 2.91 2.75 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 62 E 7.24 3.47 0.00 1.85 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 2.24 2.22 0.00 63 V 6.35 4.15 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 0.99 0.00 0.00 1.06 0.00 0.00 64 F 8.10 5.43 0.00 3.30 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 65 R 9.45 4.94 0.00 1.71 1.85 0.00 3.12 0.00 0.00 3.19 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 66 I 9.10 4.44 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.83 0.97 0.00 0.00 67 G 9.07 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 68 N 8.96 4.91 0.00 2.81 2.88 0.00 0.00 5.81 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 69 V 8.15 3.94 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 0.99 0.00 0.00 0.97 0.00 0.00 70 E 9.01 5.66 0.00 2.07 1.90 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 2.33 2.36 0.00 71 I 8.47 4.35 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.88 0.94 0.00 0.00 72 S 9.01 4.43 0.00 4.00 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 73 Q 8.90 4.75 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.67 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 74 V 8.70 4.96 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 0.97 0.00 0.00 0.84 0.00 0.00 75 T 8.43 5.70 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 1.16 0.00 0.00 76 I 7.93 4.71 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.33 0.94 0.00 0.00 77 V 7.83 4.72 2.23 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 1.13 0.00 0.00 0.79 0.00 0.00 78 G 8.29 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 79 I 8.16 4.17 0.56 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.65 0.62 0.00 0.00 80 I 7.97 4.24 1.85 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.43 1.03 0.00 0.00 81 R 9.30 4.07 0.00 1.74 1.97 0.00 3.26 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 82 H 8.03 5.04 0.00 3.17 3.05 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 83 A 8.60 5.06 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 84 E 8.91 4.63 0.00 1.81 1.76 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 2.19 2.16 0.00 85 K 8.72 4.38 0.00 1.59 1.69 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.40 7.81 86 A 7.83 4.96 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 87 P 0.00 4.66 0.00 2.19 2.17 0.00 3.74 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 88 T 7.45 4.67 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 1.24 0.00 0.00 89 N 7.63 4.67 0.00 3.16 3.08 0.00 0.00 6.25 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 90 I 8.89 4.38 1.53 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 0.98 0.86 0.33 0.00 0.00 91 V 8.30 4.34 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 0.95 0.00 0.00 0.92 0.00 0.00 92 Y 9.08 5.30 0.00 2.93 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 93 K 9.05 4.76 0.00 1.75 1.76 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.54 1.41 7.81 94 I 8.55 4.82 1.85 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.20 0.89 0.00 0.00 95 D 9.38 5.21 0.00 2.70 2.41 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 96 D 8.32 5.02 0.00 2.95 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 97 M 9.00 3.38 0.00 2.36 2.34 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 2.53 2.54 0.00 98 T 9.14 4.18 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 1.39 0.00 0.00 99 A 7.05 4.32 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 0.00 100 A 8.47 4.26 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 0.00 101 P 0.00 4.56 0.00 2.07 2.13 0.00 3.50 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 102 M 8.57 4.56 0.00 2.15 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 2.52 2.50 0.00 103 D 8.50 5.19 0.00 2.65 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 0.00 104 V 8.98 4.84 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 1.16 0.00 0.00 0.99 0.00 0.00 105 R 9.24 5.17 0.00 1.78 1.83 0.00 3.11 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 106 Q 8.74 4.89 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 107 W 9.14 5.03 0.00 3.31 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 0.00 108 V 7.57 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 0.66 0.00 0.00 0.80 0.00 0.00 109 D 8.01 4.60 0.00 2.40 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 0.00 110 T 7.86 4.66 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 1.18 0.00 0.00 111 D 7.84 4.64 0.00 2.79 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 *117 N 7.97 4.50 0.00 2.72 2.92 0.00 0.00 7.03 7.54 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 0.00 118 T 7.68 4.08 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 0.00 119 V 7.91 4.04 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 0.95 0.00 0.00 120 V 8.84 3.86 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 0.73 0.00 0.00 0.87 0.00 0.00 121 P 0.00 4.41 0.00 2.08 1.99 0.00 3.74 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 2.04 2.14 0.00 122 P 0.00 4.50 0.00 2.02 2.12 0.00 3.80 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 2.02 2.15 0.00 123 E 9.48 3.74 0.00 1.98 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 2.19 2.34 0.00 124 T 7.43 4.73 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 1.33 0.00 0.00 125 Y 8.45 4.68 0.00 2.94 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 0.00 126 V 8.68 4.88 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 0.74 0.00 0.00 0.74 0.00 0.00 127 K 8.64 4.80 0.00 1.85 1.65 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.30 7.81 128 V 8.13 4.62 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 0.85 0.00 0.00 0.85 0.00 0.00 129 A 8.51 4.50 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 0.00 130 G 6.70 3.39 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 0.00 131 H 7.72 5.14 0.00 3.41 3.41 0.00 5.27 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 7.86 4.18 0.00 1.40 1.07 0.80 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 133 R 8.94 4.53 0.00 1.76 1.77 0.00 3.33 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 134 S 9.00 4.87 0.00 4.49 4.18 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 0.00 135 F 8.40 4.67 0.00 3.08 3.01 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 0.00 136 Q 8.29 3.18 0.00 1.75 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.40 0.00 0.00 0.00 0.00 0.00 1.68 1.16 0.00 137 N 8.07 4.13 0.00 2.76 2.74 0.00 0.00 7.09 6.68 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 0.00 138 K 7.32 4.60 0.00 2.04 1.71 0.00 1.78 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.52 1.31 7.81 139 K 8.07 4.24 0.00 1.62 1.76 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.47 1.62 7.81 140 S 9.02 4.73 0.00 3.76 3.73 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 0.00 141 L 8.90 5.01 0.00 1.68 1.46 0.85 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 142 V 8.20 4.60 1.90 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 1.09 0.00 0.00 0.93 0.00 0.00 143 A 8.81 4.92 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 0.00 144 F 9.44 4.27 0.00 2.90 3.07 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 0.00 145 K 7.96 4.68 0.00 1.95 1.68 0.00 1.65 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.52 7.81 146 I 8.14 4.67 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.53 0.73 0.00 0.00 147 M 8.45 4.69 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 148 P 0.00 4.92 0.00 1.93 1.95 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 149 L 8.74 4.43 0.00 1.62 1.62 1.05 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 150 E 8.82 4.14 0.00 2.05 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 2.23 2.35 0.00 151 D 7.71 4.77 0.00 2.74 2.57 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 0.00 152 M 8.52 4.28 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 153 N 9.06 4.42 0.00 3.06 2.86 0.00 0.00 6.52 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 0.00 154 E 8.24 3.98 0.00 2.07 2.16 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 2.34 2.34 0.00 155 F 7.80 4.18 0.00 2.84 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 0.00 156 T 7.52 3.27 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 1.07 0.00 0.00 157 T 8.34 3.79 4.33 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 1.18 0.00 0.00 158 H 8.04 3.98 0.00 3.41 3.39 0.00 5.81 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 0.00 159 I 7.20 3.69 1.79 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 1.22 0.39 0.83 0.00 0.00 160 L 7.55 3.88 0.00 1.81 1.65 0.85 0.90 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 0.00 161 E 8.55 3.85 0.00 1.98 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 2.30 2.48 0.00 162 V 8.59 3.78 2.19 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 1.31 0.00 0.00 0.82 0.00 0.00 163 I 7.83 3.69 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.11 0.90 0.00 0.00 164 N 8.81 4.20 0.00 2.76 2.96 0.00 0.00 7.06 8.50 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 0.00 165 A 8.33 3.94 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 0.00 166 H 8.45 4.12 0.00 3.17 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 M 7.66 3.99 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 168 V 7.49 3.73 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 0.89 0.00 0.00 0.92 0.00 0.00 169 L 8.26 4.10 0.00 1.69 1.70 0.86 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 170 S 7.96 4.44 0.00 3.93 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 0.00 171 K 7.13 4.06 0.00 1.96 1.70 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.17 0.98 7.81 * Residues marked with a * may have inaccurate shift predictions.