NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *90 D 4.6589 8.3649 119.5555 53.2253 41.4976 178.1025 91 M 4.5118 8.7564 115.8008 53.8317 34.2348 172.0613 92 E 4.3089 9.1705 124.3036 54.4603 30.0335 174.9314 93 I 3.8414 8.0331 126.7027 61.6374 38.2938 175.1107 94 A 5.1523 7.9719 126.7820 51.4473 22.7370 174.3899 95 Y 4.8389 8.7769 115.3465 55.8071 42.6493 173.4257 96 P 4.8874 0.0000 0.0000 62.6490 32.5538 175.3143 97 I 5.0612 8.8291 116.7062 59.4042 41.7575 173.8203 98 T 5.3997 8.9688 111.7519 60.8978 73.0342 172.7299 99 C 4.7392 9.2761 122.1035 58.2185 34.7975 173.7603 100 G 3.7780 8.9107 117.0747 47.4181 0.0000 173.4446 101 E 4.6081 8.9674 123.0501 55.7732 29.8413 175.1098 102 S 4.9795 8.1782 116.1099 56.9824 64.6510 173.1977 103 K 5.4040 8.7471 122.4744 55.0974 34.8927 175.0261 104 A 4.7548 8.7414 123.8998 51.2746 23.6222 174.5451 105 I 4.7823 8.3921 118.3769 59.6065 40.7656 175.0404 106 L 4.6737 8.9066 130.0856 53.9400 43.6379 175.5332 107 L 4.6096 8.9443 128.1478 53.7133 41.8824 177.4734 108 W 4.4871 9.0955 135.0000 60.7825 30.5229 178.0220 109 K 2.8860 7.9064 115.7154 58.1893 31.5177 178.5100 110 K 4.3436 7.5835 116.6213 56.5345 33.6381 177.6919 111 F 4.8339 7.9291 123.6009 57.0795 37.7170 173.0039 112 V 4.3523 7.4485 123.6170 59.9881 33.4533 174.6652 113 C 2.4500 7.8018 126.5032 58.8113 31.8297 171.2100 114 P 4.0300 0.0000 0.0000 61.9969 31.5237 178.1425 115 G 4.1167 7.9776 115.4072 47.2875 0.0000 176.1112 116 I 2.5595 7.6690 120.3160 63.4604 37.7697 177.0391 117 N 4.7722 7.7798 113.6109 52.7668 39.0915 174.0188 118 V 4.0619 7.3505 119.6092 61.5162 33.2327 175.4239 119 K 4.3688 8.6887 127.7634 56.3258 31.5699 176.1282 120 C 4.8388 8.5332 116.8185 57.4563 32.6943 173.0369 121 V 4.6473 8.2383 120.9886 61.1920 33.8222 174.0874 122 K 4.8488 9.1972 130.2815 55.3512 33.7466 175.0865 123 F 5.1103 9.0038 130.1190 56.7468 42.5857 174.3095 124 N 3.7935 9.3066 125.0270 54.5830 35.8136 174.0185 125 D 4.4337 8.3315 111.2489 54.8508 40.1712 172.1582 126 Q 4.5422 7.7486 117.5599 53.4603 31.5412 173.8284 127 L 4.9415 8.4991 127.1911 54.3075 42.8811 175.2423 128 I 4.9126 9.0938 119.8211 58.9263 41.7797 174.6225 129 S 5.4187 8.2969 116.1502 56.3709 64.5013 173.6344 130 P 4.2872 0.0000 0.0000 65.5226 30.9303 178.8946 131 K 3.8884 7.6084 118.0643 59.9036 32.0152 178.6726 132 H 4.3710 8.1080 116.3013 58.6342 28.6264 177.4986 133 F 4.1093 8.5198 122.7966 61.4149 39.1927 177.3010 134 V 3.2342 8.0486 118.0323 66.0532 31.2555 177.4826 135 H 4.5439 8.0214 119.2294 58.9377 29.5863 177.3896 136 L 4.0332 8.0044 119.2999 57.3690 41.5206 178.6263 137 A 4.1394 7.5119 118.7123 52.2787 18.4941 178.0116 138 G 3.7645 7.8402 105.2934 45.8211 0.0000 174.1869 139 K 4.5680 7.9543 117.0210 55.8802 32.9241 178.7676 140 S 4.2578 8.1068 118.5592 61.6369 62.8593 176.2723 141 T 4.1190 7.7942 108.6152 63.1058 68.6603 174.8604 142 L 4.0873 7.7441 123.5629 55.6288 42.4462 176.2920 143 K 3.9440 7.7032 116.4932 56.7456 30.3601 176.1620 144 D 4.7217 7.6114 114.6033 51.7380 42.8702 174.7931 145 W 4.3936 8.6284 122.2361 59.2714 28.2100 178.3514 146 K 3.4688 7.0753 118.2186 58.2322 31.1614 178.5429 147 R 4.1826 7.6969 116.4863 57.1456 30.7832 178.1097 148 A 4.1227 7.7966 119.9063 53.8342 19.1151 177.6442 149 I 4.4613 7.6201 118.4158 60.9766 38.7535 175.8783 150 R 5.1205 9.2805 124.9500 54.2588 34.4433 174.5267 151 L 4.6050 8.7151 123.5406 53.4733 44.9169 176.5619 152 G 3.6451 9.7575 115.2201 46.6089 0.0000 174.1353 153 G 3.9611 8.5367 108.0703 44.8794 0.0000 174.2366 154 I 4.3068 7.2664 121.2569 59.4580 38.8845 175.2247 155 M 4.3800 8.4950 123.9546 55.6677 32.5138 177.1080 156 L 3.8566 8.8481 125.3141 58.2620 42.0251 179.1126 157 R 3.6952 7.9805 118.6717 59.7058 29.9034 178.6231 158 K 3.9429 7.9026 117.6766 59.6717 32.1458 179.3844 159 M 4.0703 7.8760 118.5278 58.2992 31.8863 178.6724 160 M 4.1705 8.1040 120.5857 58.0241 31.9977 178.5419 161 D 4.4173 8.1101 118.1057 57.1444 41.0158 178.6357 162 S 4.2722 7.9598 113.7371 59.4558 63.2053 175.5356 163 G 4.0421 8.0626 110.3918 45.5973 0.0000 174.5667 164 Q 4.1319 7.7485 118.0318 58.2430 29.3141 176.6705 165 I 4.5052 7.6333 117.0509 59.7397 37.6324 173.0172 166 D 4.7180 7.8630 120.5826 52.0189 43.8487 175.2470 167 F 4.2472 7.8982 118.8881 57.5316 39.2448 174.6246 168 Y 4.0115 8.5974 126.1396 58.9263 38.8968 175.8652 169 Q 3.3421 8.4966 125.2520 56.8712 26.1493 175.2617 170 H 4.5618 8.3031 119.2756 58.5937 30.0299 176.6843 171 D 4.2317 8.1255 117.2844 54.9163 39.4748 176.7789 172 K 4.3424 7.5166 116.9224 55.6490 34.1258 175.9105 173 V 4.2025 8.0826 119.0438 61.1995 32.1967 173.6787 174 C 4.6855 8.2060 126.2092 58.1379 34.3332 173.6888 175 S 4.3871 8.5021 118.7954 57.9206 63.5647 174.4664 176 N 4.3921 8.3495 117.0718 54.2583 34.4883 174.3293 177 T 4.6509 7.6699 106.0366 61.1682 69.7037 175.2953 178 C 4.3215 8.3903 119.5806 60.9658 30.2216 174.3846 179 R 4.2760 7.3548 123.9826 56.2303 29.2227 181.1379 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 *90 D 8.36 4.66 0.00 2.71 1.62 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 91 M 8.76 4.51 0.00 2.02 1.96 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 2.49 2.57 0.00 92 E 9.17 4.31 0.00 1.89 1.87 0.00 0.00 0.00 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 2.37 0.00 93 I 8.03 3.84 2.09 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 1.33 1.21 0.80 0.00 0.00 94 A 7.97 5.15 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 95 Y 8.78 4.84 0.00 2.90 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 96 P 0.00 4.89 0.00 2.10 2.07 0.00 3.85 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 97 I 8.83 5.06 2.01 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.80 0.95 0.00 0.00 98 T 8.97 5.40 4.39 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 1.28 0.00 0.00 99 C 9.28 4.74 0.00 2.73 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 0.00 0.00 0.00 0.00 100 G 8.91 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 0.00 0.00 0.00 101 E 8.97 4.61 0.00 1.97 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 0.00 2.23 2.30 0.00 102 S 8.18 4.98 0.00 3.89 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 0.00 103 K 8.75 5.40 0.00 1.74 1.78 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.50 7.81 104 A 8.74 4.75 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.39 4.78 1.85 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 1.10 0.75 0.89 0.00 0.00 106 L 8.91 4.67 0.00 1.65 1.69 0.67 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.94 4.61 0.00 1.65 1.63 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 108 W 9.10 4.49 0.00 3.63 3.46 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 0.00 109 K 7.91 2.89 0.00 1.43 1.08 0.00 1.58 0.00 0.00 1.19 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.30 1.28 7.81 110 K 7.58 4.34 0.00 1.92 1.88 0.00 1.52 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.47 7.81 111 F 7.93 4.83 0.00 3.22 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 0.00 112 V 7.45 4.35 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 0.87 0.00 0.00 0.94 0.00 0.00 113 C 7.80 2.45 0.00 2.11 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 0.00 114 P 0.00 4.03 0.00 2.27 2.16 0.00 3.68 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 1.93 1.88 0.00 115 G 7.98 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 0.00 0.00 0.00 116 I 7.67 2.56 1.78 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.85 0.84 0.00 0.00 117 N 7.78 4.77 0.00 2.63 2.68 0.00 0.00 6.77 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 0.00 118 V 7.35 4.06 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 1.00 0.00 0.00 0.83 0.00 0.00 119 K 8.69 4.37 0.00 1.68 1.79 0.00 1.75 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.42 7.81 120 C 8.53 4.84 0.00 3.04 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 0.00 121 V 8.24 4.65 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 0.42 0.00 0.00 0.86 0.00 0.00 122 K 9.20 4.85 0.00 1.82 1.65 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.38 7.81 123 F 9.00 5.11 0.00 2.90 2.91 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 0.00 124 N 9.31 3.79 0.00 2.52 2.64 0.00 0.00 7.12 8.06 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 0.00 125 D 8.33 4.43 0.00 2.76 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 0.00 126 Q 7.75 4.54 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 127 L 8.50 4.94 0.00 1.69 1.58 0.95 1.03 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 0.00 128 I 9.09 4.91 2.00 0.00 0.00 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 1.54 0.64 1.04 0.00 0.00 129 S 8.30 5.42 0.00 3.95 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 0.00 130 P 0.00 4.29 0.00 1.33 2.08 0.00 3.63 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 1.92 2.12 0.00 131 K 7.61 3.89 0.00 1.77 1.65 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.49 7.81 132 H 8.11 4.37 0.00 3.43 3.37 0.00 5.70 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.52 4.11 0.00 2.93 3.17 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 0.00 134 V 8.05 3.23 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 1.02 0.00 0.00 1.07 0.00 0.00 135 H 8.02 4.54 0.00 3.44 3.46 0.00 5.88 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 0.00 136 L 8.00 4.03 0.00 1.76 1.89 1.20 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 137 A 7.51 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 7.84 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 0.00 0.00 0.00 139 K 7.95 4.57 0.00 1.69 1.73 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.25 1.43 7.81 140 S 8.11 4.26 0.00 3.92 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 0.00 141 T 7.79 4.12 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 0.00 142 L 7.74 4.09 0.00 1.64 1.87 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 143 K 7.70 3.94 0.00 1.98 1.89 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.38 7.81 144 D 7.61 4.72 0.00 2.62 2.46 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 0.00 145 W 8.63 4.39 0.00 3.73 3.38 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 0.00 146 K 7.08 3.47 0.00 1.45 1.41 0.00 1.27 0.00 0.00 1.39 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.30 0.21 7.81 147 R 7.70 4.18 0.00 1.84 1.93 0.00 3.24 0.00 0.00 3.18 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.72 0.00 148 A 7.80 4.12 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 0.00 149 I 7.62 4.46 2.05 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.08 1.07 0.00 0.00 150 R 9.28 5.12 0.00 1.70 1.78 0.00 3.07 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 151 L 8.72 4.60 0.00 1.56 1.40 0.57 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 152 G 9.76 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 0.00 0.00 0.00 153 G 8.54 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 0.00 0.00 0.00 154 I 7.27 4.31 1.95 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 1.27 0.61 0.87 0.00 0.00 155 M 8.49 4.38 0.00 2.01 1.96 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 2.66 2.70 0.00 156 L 8.85 3.86 0.00 1.84 1.78 0.80 1.14 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 0.00 157 R 7.98 3.70 0.00 1.85 1.82 0.00 3.06 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.76 0.00 158 K 7.90 3.94 0.00 1.94 1.79 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.42 7.81 159 M 7.88 4.07 0.00 1.87 2.10 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 2.57 2.63 0.00 160 M 8.10 4.17 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.52 0.00 161 D 8.11 4.42 0.00 2.72 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 0.00 162 S 7.96 4.27 0.00 4.01 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 0.00 163 G 8.06 4.04 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 0.00 0.00 0.00 164 Q 7.75 4.13 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.26 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 165 I 7.63 4.51 1.65 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.76 0.49 0.00 0.00 166 D 7.86 4.72 0.00 2.81 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 0.00 167 F 7.90 4.25 0.00 2.89 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 0.00 168 Y 8.60 4.01 0.00 2.22 2.62 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 0.00 169 Q 8.50 3.34 0.00 1.93 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.64 0.00 0.00 0.00 0.00 0.00 1.64 1.16 0.00 170 H 8.30 4.56 0.00 3.51 3.39 0.00 5.65 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 D 8.13 4.23 0.00 2.82 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 K 7.52 4.34 0.00 1.47 1.79 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.29 7.81 173 V 8.08 4.20 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 0.87 0.00 0.00 0.84 0.00 0.00 174 C 8.21 4.69 0.00 2.93 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 0.00 175 S 8.50 4.39 0.00 3.96 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 N 8.35 4.39 0.00 2.91 3.00 0.00 0.00 6.72 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 0.00 177 T 7.67 4.65 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 0.00 178 C 8.39 4.32 0.00 3.44 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 0.00 179 R 7.35 4.28 0.00 2.02 1.72 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.42 0.00 * Residues marked with a * may have inaccurate shift predictions.