NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 100 R 4.4098 8.1133 120.9853 56.5976 32.8102 175.0995 101 I 4.1533 7.7466 117.9973 60.7030 38.1800 170.9085 102 V 4.2047 9.5688 127.0771 61.0436 34.6164 173.6319 103 E 4.4296 8.9299 130.7733 56.8864 30.1893 177.3002 104 I 4.4402 8.3086 125.5371 57.8569 37.9999 169.6935 105 P 4.9035 0.0000 0.0000 62.5587 32.7211 176.4836 106 V 4.8373 9.5958 122.7300 59.7016 36.0361 171.3817 107 C 4.9896 8.5774 124.9736 57.5675 32.8612 173.7292 108 Y 4.7603 8.2844 121.0627 57.1291 39.5912 176.1508 109 G 3.9714 8.1824 109.2621 44.7433 0.0000 178.6427 110 G 3.4275 9.0394 109.5922 46.2497 0.0000 176.2906 111 E 3.9827 9.4806 119.6279 58.9472 30.2805 180.5644 112 F 4.3906 7.9828 117.1006 59.6732 39.8603 176.0890 113 G 4.2052 8.3635 108.8268 43.3257 0.0000 171.2652 114 P 4.5749 0.0000 0.0000 64.3056 31.9464 177.4140 115 D 4.8990 8.1990 118.3065 54.3364 41.6978 177.8352 116 L 3.9860 8.4581 125.4074 59.0883 42.1227 179.3077 117 E 4.1600 8.4660 120.1759 62.1933 29.3763 181.3738 118 E 4.2463 8.2838 120.7070 61.6048 29.8467 182.0692 119 V 3.7595 8.5554 120.2586 65.9885 31.6491 180.6554 120 A 4.3134 8.7143 123.9432 55.5332 18.3133 180.1861 121 K 3.8033 8.3339 122.5922 60.2479 31.4982 180.5563 122 I 3.9201 8.0789 120.3728 64.2465 37.2174 178.1187 123 N 4.8189 7.7540 115.4817 54.3728 40.9849 176.2509 124 Q 3.2389 7.9268 116.8678 56.0264 25.7739 176.0362 125 L 4.7345 7.9905 121.1760 52.7541 46.0226 178.5557 126 S 4.6990 8.4036 117.5446 59.5264 64.4583 174.1474 127 P 4.5233 0.0000 0.0000 66.1593 31.1680 179.3637 128 E 4.0798 8.2827 118.7062 61.4156 29.9568 181.3680 129 E 4.3655 8.2044 119.7564 61.1940 29.8203 183.1703 130 V 4.1378 8.1170 118.5020 66.0318 31.9758 183.2636 131 I 3.4915 7.9645 120.7170 64.2993 36.7743 178.3526 132 D 4.3454 7.9738 120.8821 56.7615 40.5175 178.7858 133 I 3.6259 7.1203 117.8797 64.5592 37.3836 177.7598 134 H 4.7680 8.5905 120.5194 59.2416 29.5070 177.5680 135 T 4.3172 8.1247 113.8186 65.1439 68.5065 176.5472 136 N 4.7385 8.9263 122.0079 55.3933 37.7990 179.6474 137 G 3.8059 7.4494 107.6385 45.8717 0.0000 172.8862 138 E 4.4771 7.6250 119.5039 55.0220 31.9682 173.7807 139 Y 4.9930 8.7048 124.3840 56.2655 42.0605 174.8941 140 V 4.8429 9.0733 119.8323 61.2667 35.2149 174.6664 141 V 4.4441 8.9173 128.4324 63.2290 32.2927 174.2631 142 Y 5.2262 8.7168 124.1263 56.4054 41.8390 173.4677 143 M 5.3280 8.6586 119.4184 53.9870 34.8248 175.5861 144 L 4.0795 9.0725 123.7685 55.5675 42.4357 176.3511 145 G 4.2729 8.2819 106.6700 45.7643 0.0000 175.0714 146 F 4.3561 7.8049 113.0389 58.5057 38.2230 175.2146 147 A 4.5581 6.8221 124.5959 48.8196 17.4169 173.8350 148 P 4.1008 0.0000 0.0000 65.1458 32.3696 178.4927 149 G 3.9110 7.5539 111.6867 42.6902 0.0000 172.8951 150 F 4.2814 7.3714 119.3649 56.1240 43.1075 172.9697 151 P 4.3766 0.0000 0.0000 60.7294 30.3439 172.8678 152 F 4.3303 7.8803 123.8817 58.7796 39.5144 174.7414 153 L 4.8665 9.0034 124.6827 54.1274 43.4688 176.3041 154 G 4.5875 9.9093 109.0686 45.3767 0.0000 172.7219 155 G 3.8838 9.5149 110.5760 45.1200 0.0000 173.9629 156 M 4.3577 8.0670 119.6325 55.0301 32.9906 175.7673 157 S 4.3090 8.5449 120.1816 58.6529 63.0308 175.2802 158 K 4.1421 8.6979 128.8324 57.8476 31.5825 180.4134 159 R 4.0707 7.7395 116.0027 59.4827 29.5385 182.5232 160 I 3.7413 7.8293 119.1783 63.2429 38.2484 176.0299 161 A 4.2989 6.8124 119.6749 52.7137 18.9791 176.7713 162 A 4.4551 8.4634 118.3462 50.5509 23.3053 174.6971 163 P 4.7493 0.0000 0.0000 62.7337 33.0473 176.4030 164 R 4.3808 8.4181 120.5705 55.3521 30.3086 175.3255 165 K 3.9924 8.6966 125.8244 55.2114 32.3177 176.9246 166 S 4.3148 8.9461 120.5434 60.7280 62.5571 175.3666 167 S 4.8765 7.7293 116.8895 54.9608 64.2640 174.1638 168 P 4.5933 0.0000 0.0000 61.4767 32.2150 176.3789 169 R 4.1924 8.1064 118.3259 55.3847 30.6123 176.6005 170 P 4.1912 0.0000 0.0000 65.5273 31.5615 176.6660 171 S 4.3225 7.4392 110.5108 57.4994 64.3472 174.3896 172 I 3.9371 8.9103 130.6609 59.9613 38.3954 174.1057 173 P 4.4528 0.0000 0.0000 62.9331 32.3411 175.3383 174 A 4.3013 8.5956 126.7085 53.1662 18.2492 176.1449 175 G 3.7635 9.6339 114.3386 46.0544 0.0000 174.2130 176 S 4.6378 8.0523 116.3022 59.1570 64.4153 173.9839 177 V 4.9592 9.4245 122.2011 61.3103 34.6441 174.6938 178 G 5.0206 9.1423 112.8177 45.0830 0.0000 171.0338 179 I 5.1153 9.0853 120.1338 59.3009 41.2906 175.3315 180 A 4.0771 7.8705 127.4387 51.6289 21.8438 178.4388 181 G 3.7646 10.0814 119.1957 48.2171 0.0000 175.0000 182 L 4.8756 9.1226 117.1701 53.7731 42.4214 177.5211 183 Q 4.8833 7.9479 118.7803 55.5329 30.9397 174.5908 184 T 5.6110 7.3482 114.6351 59.9282 72.0395 172.5375 185 G 4.4420 8.5676 110.3801 46.2941 0.0000 172.2006 186 V 4.8321 6.9101 117.2034 61.6376 34.6491 173.9146 187 Y 3.9892 8.9694 126.7858 56.9801 38.0092 174.9821 188 P 4.1249 0.0000 0.0000 65.3970 31.8154 177.5595 189 I 4.6944 7.3165 115.2601 58.1172 38.6475 177.4270 190 S 4.7510 8.8433 120.4899 59.3068 63.1167 174.0889 191 T 4.3144 7.7817 117.1709 60.2656 72.1589 171.1355 192 P 4.7304 0.0000 0.0000 62.1703 32.9474 175.1282 193 G 4.4169 7.6238 111.9971 44.9985 0.0000 173.0906 194 G 4.4757 8.1247 110.0623 45.1093 0.0000 173.5393 195 W 4.5711 8.3413 119.4020 56.1427 30.3329 176.2727 196 Q 4.2201 9.3591 126.0674 55.9550 29.5155 174.6405 197 L 5.0564 8.5921 127.8987 54.0483 43.1447 177.2388 198 I 4.5436 10.0627 115.6474 59.6453 39.4409 175.4604 199 G 3.9989 6.9761 112.8888 45.1913 0.0000 171.1044 200 K 4.8619 8.1745 120.2101 54.6032 35.1875 174.8042 201 T 5.1872 8.7951 120.1792 59.5751 68.5468 172.2728 202 P 4.7029 0.0000 0.0000 62.7054 31.6233 175.2818 203 L 4.4371 7.2758 118.7434 53.1825 42.8705 176.3573 204 A 4.0627 8.5354 125.9353 52.6135 18.5260 176.9395 205 L 4.4011 8.5061 125.2561 56.7321 44.1497 178.5910 *206 F 4.1688 7.6341 117.3430 55.6794 36.2493 179.2647 *216 L 3.9765 7.5630 123.5825 55.4943 42.4272 177.9641 217 R 4.5563 8.1679 121.6745 53.6130 31.7355 172.5823 218 A 4.0944 8.3714 121.7361 54.2340 18.6968 178.8694 219 G 4.0633 8.8434 108.0334 45.8645 0.0000 174.2139 220 D 4.6956 7.6017 119.7543 54.5160 42.4529 175.2155 221 I 5.0510 8.1390 120.7529 58.9557 39.6021 174.8517 222 V 4.9012 8.2981 126.4605 60.3184 34.0616 174.3253 223 K 4.6655 8.2568 125.4730 54.8106 35.8653 175.3700 224 F 5.6996 8.9270 126.0620 55.6699 38.7535 175.1166 225 V 3.9372 8.2254 122.7744 61.6619 32.6571 175.5060 226 R 4.9452 8.7540 126.9809 56.0394 30.0105 172.7670 227 I 4.7920 8.8255 118.6747 58.9998 41.0479 176.0713 228 S 4.4099 8.8625 122.0591 58.1950 62.9937 176.7337 229 E 4.0456 8.7142 117.5563 60.2454 29.6033 179.7275 230 K 4.0608 8.0460 120.2513 58.0861 32.2050 181.7032 *231 D 4.5101 7.5704 120.2808 53.8015 40.4265 179.5798 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 100 R 8.11 4.41 0.00 1.52 2.01 0.00 3.21 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.24 0.00 101 I 7.75 4.15 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 1.22 1.05 0.89 0.00 0.00 102 V 9.57 4.20 1.99 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 0.89 0.00 0.00 0.94 0.00 0.00 103 E 8.93 4.43 0.00 1.86 1.86 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 2.29 2.30 0.00 104 I 8.31 4.44 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 1.28 0.84 0.91 0.00 0.00 105 P 0.00 4.90 0.00 2.12 2.23 0.00 3.60 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 106 V 9.60 4.84 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 0.72 0.00 0.00 0.93 0.00 0.00 107 C 8.58 4.99 0.00 2.49 1.86 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 0.00 108 Y 8.28 4.76 0.00 2.92 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 0.00 109 G 8.18 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 0.00 0.00 0.00 110 G 9.04 3.43 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 0.00 111 E 9.48 3.98 0.00 2.00 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 2.24 1.92 0.00 112 F 7.98 4.39 0.00 3.16 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 0.00 113 G 8.36 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 0.00 0.00 0.00 114 P 0.00 4.57 0.00 2.18 2.15 0.00 3.72 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 115 D 8.20 4.90 0.00 3.10 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 0.00 116 L 8.46 3.99 0.00 1.97 1.70 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.47 4.16 0.00 2.01 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 2.32 1.97 0.00 118 E 8.28 4.25 0.00 1.97 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 2.31 1.94 0.00 119 V 8.56 3.76 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 0.73 0.00 0.00 0.93 0.00 0.00 120 A 8.71 4.31 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 0.00 121 K 8.33 3.80 0.00 1.72 1.85 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.38 7.81 122 I 8.08 3.92 2.06 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 1.52 1.10 0.91 0.00 0.00 123 N 7.75 4.82 0.00 2.74 2.83 0.00 0.00 7.28 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 0.00 124 Q 7.93 3.24 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.15 0.00 125 L 7.99 4.73 0.00 1.62 1.40 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 126 S 8.40 4.70 0.00 3.72 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 0.00 127 P 0.00 4.52 0.00 2.16 2.20 0.00 3.57 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 128 E 8.28 4.08 0.00 1.97 1.95 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 2.31 1.94 0.00 129 E 8.20 4.37 0.00 1.97 1.99 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 2.31 1.94 0.00 130 V 8.12 4.14 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 0.76 0.00 0.00 0.93 0.00 0.00 131 I 7.96 3.49 1.83 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 1.17 0.59 0.37 0.00 0.00 132 D 7.97 4.35 0.00 2.68 2.68 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 0.00 0.00 0.00 0.00 133 I 7.12 3.63 1.91 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 1.42 0.59 0.97 0.00 0.00 134 H 8.59 4.77 0.00 3.37 3.33 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 8.12 4.32 4.37 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 1.30 0.00 0.00 136 N 8.93 4.74 0.00 2.80 2.77 0.00 0.00 7.00 5.29 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 0.00 137 G 7.45 3.81 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 0.00 0.00 0.00 138 E 7.63 4.48 0.00 1.85 1.68 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 0.00 2.15 2.32 0.00 139 Y 8.70 4.99 0.00 2.87 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 0.00 140 V 9.07 4.84 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 1.10 0.00 0.00 0.98 0.00 0.00 141 V 8.92 4.44 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 0.94 0.00 0.00 0.95 0.00 0.00 142 Y 8.72 5.23 0.00 3.12 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 0.00 143 M 8.66 5.33 0.00 1.93 2.05 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 2.51 2.76 0.00 144 L 9.07 4.08 0.00 0.86 1.39 -0.16 1.05 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 0.00 145 G 8.28 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 0.00 0.00 0.00 0.00 146 F 7.80 4.36 0.00 3.11 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 0.00 147 A 6.82 4.56 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 0.00 148 P 0.00 4.10 0.00 2.20 2.13 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 149 G 7.55 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 0.00 0.00 0.00 150 F 7.37 4.28 0.00 2.57 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 0.00 0.00 0.00 0.00 151 P 0.00 4.38 0.00 1.83 1.89 0.00 2.20 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.54 0.00 152 F 7.88 4.33 0.00 2.00 2.48 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 0.00 153 L 9.00 4.87 0.00 1.88 1.78 0.92 0.75 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 0.00 154 G 9.91 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.51 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 0.00 156 M 8.07 4.36 0.00 2.20 2.41 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.67 0.00 157 S 8.54 4.31 0.00 3.90 3.80 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 0.00 158 K 8.70 4.14 0.00 1.72 1.80 0.00 1.85 0.00 0.00 1.85 0.00 0.00 2.86 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.44 1.00 7.81 159 R 7.74 4.07 0.00 1.82 1.82 0.00 3.26 0.00 0.00 3.15 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.44 0.00 160 I 7.83 3.74 1.94 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.27 1.02 0.00 0.00 161 A 6.81 4.30 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 0.00 162 A 8.46 4.46 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 0.00 163 P 0.00 4.75 0.00 2.07 2.07 0.00 3.75 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 1.97 1.96 0.00 164 R 8.42 4.38 0.00 1.85 1.75 0.00 3.30 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.19 0.00 165 K 8.70 3.99 0.00 1.75 1.67 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.30 7.81 166 S 8.95 4.31 0.00 3.62 3.81 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 0.00 167 S 7.73 4.88 0.00 3.59 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 0.00 168 P 0.00 4.59 0.00 2.19 2.17 0.00 3.74 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 2.00 2.01 0.00 169 R 8.11 4.19 0.00 1.88 1.85 0.00 3.08 0.00 0.00 3.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 170 P 0.00 4.19 0.00 2.02 2.10 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 171 S 7.44 4.32 0.00 3.80 3.68 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 0.00 0.00 0.00 0.00 172 I 8.91 3.94 1.41 0.00 0.00 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 1.00 0.65 0.37 0.00 0.00 173 P 0.00 4.45 0.00 2.02 1.98 0.00 3.49 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 174 A 8.60 4.30 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 0.00 175 G 9.63 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 0.00 176 S 8.05 4.64 0.00 3.75 3.82 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 0.00 177 V 9.42 4.96 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 0.73 0.00 0.00 0.90 0.00 0.00 178 G 9.14 5.02 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 0.00 179 I 9.09 5.12 1.85 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 1.17 0.64 0.96 0.00 0.00 180 A 7.87 4.08 -0.20 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 0.00 181 G 10.08 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 0.00 182 L 9.12 4.88 0.00 1.65 1.51 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 183 Q 7.95 4.88 0.00 1.71 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.64 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 184 T 7.35 5.61 4.42 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 1.29 0.00 0.00 185 G 8.57 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 6.91 4.83 1.89 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 0.81 0.00 0.00 1.03 0.00 0.00 187 Y 8.97 3.99 0.00 2.91 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 0.00 188 P 0.00 4.12 0.00 1.99 2.02 0.00 3.56 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.81 0.00 189 I 7.32 4.69 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 1.23 0.75 0.91 0.00 0.00 190 S 8.84 4.75 0.00 3.85 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 0.00 191 T 7.78 4.31 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 0.00 192 P 0.00 4.73 0.00 2.04 2.23 0.00 3.83 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 1.98 1.97 0.00 193 G 7.62 4.42 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 0.00 194 G 8.12 4.48 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 0.00 195 W 8.34 4.57 0.00 3.31 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 0.00 196 Q 9.36 4.22 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.93 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 197 L 8.59 5.06 0.00 1.66 1.59 0.85 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 198 I 10.06 4.54 1.93 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 1.20 1.06 0.98 0.00 0.00 199 G 6.98 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 0.00 0.00 0.00 200 K 8.17 4.86 0.00 1.88 1.66 0.00 1.92 0.00 0.00 1.80 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.41 7.81 201 T 8.80 5.19 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 1.27 0.00 0.00 202 P 0.00 4.70 0.00 2.20 2.09 0.00 3.90 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 1.94 1.94 0.00 203 L 7.28 4.44 0.00 1.60 1.60 0.93 0.72 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 0.00 204 A 8.54 4.06 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 0.00 205 L 8.51 4.40 0.00 1.56 1.61 0.82 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 *206 F 7.63 4.17 0.00 2.30 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 0.00 0.00 0.00 *216 L 7.56 3.98 0.00 1.52 1.60 0.75 0.82 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 0.00 217 R 8.17 4.56 0.00 1.72 1.78 0.00 3.28 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.17 0.00 218 A 8.37 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 G 8.84 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 0.00 220 D 7.60 4.70 0.00 2.66 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 I 8.14 5.05 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 2.11 0.99 0.00 0.00 222 V 8.30 4.90 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 0.41 0.00 0.00 0.75 0.00 0.00 223 K 8.26 4.67 0.00 1.63 1.65 0.00 1.78 0.00 0.00 1.93 0.00 0.00 2.85 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.41 1.38 7.81 224 F 8.93 5.70 0.00 3.03 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 0.00 225 V 8.23 3.94 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 0.67 0.00 0.00 0.93 0.00 0.00 226 R 8.75 4.95 0.00 1.59 1.74 0.00 3.18 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 227 I 8.83 4.79 2.01 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 1.19 1.06 0.93 0.00 0.00 228 S 8.86 4.41 0.00 3.68 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 0.00 229 E 8.71 4.05 0.00 1.98 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 2.23 1.88 0.00 230 K 8.05 4.06 0.00 1.77 1.76 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 1.00 7.81 *231 D 7.57 4.51 0.00 2.48 2.50 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.