NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 3.9787 7.8827 121.3606 61.3296 38.8467 173.5311 3 S 5.0053 8.2935 122.4526 56.4233 63.9235 171.3570 4 Y 5.1606 8.4285 123.3772 56.6541 42.7493 173.5331 5 E 5.1486 8.6778 116.4453 55.9007 32.2856 174.2806 6 F 5.0841 8.5975 122.7217 56.8848 43.5043 172.7304 7 Q 4.6073 7.4732 124.4845 54.6287 32.0507 173.9291 8 T 4.5930 8.1278 118.8284 61.4754 71.5410 171.5250 9 H 5.0219 8.7214 117.7513 53.7840 32.4604 173.7721 *25 K 4.1883 8.2622 118.3939 56.6425 32.0906 174.8329 26 E 4.5629 8.2873 124.8251 54.0473 32.7479 173.9433 27 L 5.0543 8.2922 127.4893 53.5927 44.3851 174.1892 28 Y 4.9151 9.0787 127.9754 55.8228 41.5054 174.4068 29 V 4.8486 7.4320 124.7778 61.3902 35.5373 173.8908 30 Q 5.0731 8.4535 124.7219 55.1419 32.8846 172.7856 31 A 5.3968 9.4130 126.7544 50.7929 23.6521 175.4183 32 T 4.8747 8.5602 114.9975 62.8380 72.3330 173.4596 33 H 4.9748 8.8448 124.2708 55.2310 30.2877 174.8033 34 F 4.8299 8.5564 118.3246 56.0243 43.3160 174.7268 35 N 4.5392 9.0598 118.9659 55.8928 38.3010 176.1056 36 N 4.7499 7.8401 112.7305 53.2866 38.9660 173.9107 37 T 4.3737 7.3345 111.6970 61.6450 70.9118 171.9892 38 I 4.7841 7.8623 126.4062 60.0763 40.6674 175.0034 39 L 4.6105 8.1818 123.7139 54.6227 44.5412 173.5276 40 L 5.2396 9.1964 129.8119 53.3494 44.8618 174.8534 41 Q 5.1304 9.2628 124.9576 54.2760 31.9230 174.7534 42 I 4.7603 9.2257 124.0823 59.9073 40.1110 174.5210 43 R 5.2089 9.3171 127.0841 54.3316 33.0954 175.5315 44 L 4.9107 8.6807 124.4519 53.3813 44.5369 176.2650 45 N 4.1830 10.0041 126.6262 54.4182 36.7121 176.1986 46 G 3.9916 8.3547 103.8874 45.4345 0.0000 173.4690 47 E 4.5793 7.7389 119.7328 55.2070 31.1268 174.9846 48 M 4.9064 8.1972 120.0747 54.8406 35.1028 174.0311 49 D 4.8434 8.9743 122.1122 53.3984 43.1454 175.1315 50 S 4.9461 8.1397 115.2123 57.1614 67.4872 173.2224 51 T 4.8606 8.5351 118.5730 62.3973 72.3508 172.5650 52 Y 5.1915 8.8676 124.2567 56.0018 41.7878 174.4542 53 E 4.7760 9.1711 124.0569 54.6199 32.0912 175.4799 54 V 4.4476 8.2760 129.8662 61.3711 30.5199 174.5468 55 S 5.2638 8.0138 119.4181 56.6841 66.0236 173.9057 56 S 5.2117 8.5094 115.3534 56.1093 65.3968 174.5092 57 K 4.2910 8.6062 118.5518 56.8895 32.6486 178.4844 58 G 3.8225 8.4029 111.8856 45.8790 0.0000 175.5693 59 L 4.2175 8.5421 119.3354 54.4519 42.2573 176.2500 *95 Y 4.9056 7.4065 114.6560 58.7489 39.4261 176.2964 96 Q 4.7612 8.2490 121.3394 55.0365 30.4134 173.1775 97 V 4.0079 8.0491 122.1096 62.7076 32.8242 174.9165 98 V 4.5421 8.9251 126.7270 61.4515 35.2503 174.0767 99 T 4.7279 8.5862 123.9554 62.9750 69.4285 175.2039 100 K 4.2373 8.9615 126.8867 58.0162 33.6930 177.4368 101 L 4.2980 7.4556 122.1285 53.1819 45.1972 175.9633 102 G 3.4429 8.2007 114.2136 45.1498 0.0000 171.9192 103 D 4.6074 8.3869 121.6582 53.3968 39.9165 177.8244 104 S 4.5366 8.8637 118.9029 58.6815 63.3881 174.8020 105 A 4.5446 8.0237 122.9449 51.7845 19.8365 176.1080 106 D 4.4270 7.9638 118.0911 53.4254 41.3695 175.3393 107 P 4.3128 0.0000 0.0000 65.0549 31.9881 178.2868 108 K 3.8999 8.3625 119.3209 59.9202 31.7216 178.0694 109 V 3.2278 7.4952 118.8232 64.9509 31.1906 175.5763 110 P 4.1799 0.0000 0.0000 64.7939 31.5654 178.8614 111 V 3.4571 7.3686 117.2796 65.8916 31.6990 177.6106 112 V 3.3689 7.0446 117.8716 66.2068 31.1323 177.7071 113 C 4.0494 7.7896 116.0753 63.0375 28.1614 176.4575 114 V 3.5835 7.7703 119.5203 65.7916 31.0436 177.6086 115 Q 3.9851 8.1932 118.1765 59.1569 28.6227 178.6476 116 I 3.7574 8.0473 120.0618 64.7996 37.0085 178.3911 117 A 4.1274 8.4056 121.6587 55.0161 17.7975 179.7015 118 E 4.0077 7.9791 116.2035 59.5784 29.7637 178.5242 119 L 4.0075 7.7641 118.9920 56.9852 42.4328 178.4496 120 Y 3.9343 9.2212 116.1249 59.6934 36.9936 179.8882 121 R 3.6105 5.8400 123.8523 58.7744 31.8721 175.8037 122 R 4.7003 7.8000 114.6569 54.3773 30.7930 174.8881 123 V 4.3595 6.9585 118.4956 62.9527 34.6454 171.7571 124 I 4.2842 7.8924 117.3141 61.6425 39.5181 175.1529 125 L 4.4806 7.9731 120.2632 52.8669 41.8351 174.8758 126 P 4.6396 0.0000 0.0000 60.8893 30.2308 174.7763 *138 Q 4.3844 8.0840 123.6953 56.2698 30.9876 175.8469 139 F 4.8612 7.7752 120.4196 57.0221 43.3853 173.0567 140 S 4.4405 7.0440 119.0758 57.2439 65.6259 172.5601 141 L 4.8072 8.0451 127.7202 53.0050 45.6901 174.7846 142 L 5.1619 8.1447 123.2254 52.9815 45.1179 175.4753 143 I 5.0241 9.1878 124.6050 59.5868 40.5739 174.7787 144 S 5.3255 9.1328 122.1028 56.9910 66.2001 173.1047 145 M 5.9399 9.1108 121.0172 53.4874 35.4040 173.9349 146 S 4.5797 8.6800 115.0557 58.1917 63.1233 175.1376 147 S 4.4037 9.2042 123.1956 61.0836 63.1423 176.2657 148 K 4.0050 8.1586 119.1519 58.3659 31.9361 177.7058 149 I 3.4516 7.0482 119.6170 62.8249 37.0550 176.3953 150 W 5.0325 7.3961 118.9889 54.6387 32.6173 174.2127 *161 N 4.5800 8.4473 118.9023 53.8600 37.7607 173.8845 162 D 5.1585 9.1336 116.7540 54.6349 41.3021 174.7991 163 F 4.8656 8.1244 118.5313 59.4932 41.0969 176.7720 164 G 3.8544 8.3932 104.8445 47.8805 0.0000 175.1820 165 K 3.9696 8.2635 121.2794 59.3079 32.5825 178.2411 166 L 4.2669 8.4924 120.1488 58.6510 41.7668 179.2600 167 V 3.5246 7.7551 118.0236 65.5750 31.3769 177.8550 168 F 4.0154 8.1213 120.4240 61.3257 39.3429 177.1268 169 V 3.6636 8.0155 117.8947 66.2996 31.1808 178.0337 170 L 4.0264 7.8916 118.1119 57.4533 41.3810 179.3346 171 K 3.8405 7.9953 119.7815 59.3123 31.8693 178.6381 172 C 4.1268 7.9948 116.8826 62.8418 28.4370 175.8613 173 I 3.8439 7.8217 121.4075 64.2323 36.6978 178.5268 174 K 3.9384 7.6356 118.9718 58.5631 31.6394 178.1998 175 D 3.9887 7.1438 117.0118 54.5546 40.6117 176.2672 176 M 4.5969 6.8096 115.1197 54.1108 31.9119 175.3447 177 Y 3.2665 7.6355 113.6605 58.4856 36.4157 170.5711 178 A 4.0250 7.3537 127.6280 52.7723 19.2634 178.1207 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 2 I 7.88 3.98 1.84 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 1.14 0.58 0.63 0.00 0.00 3 S 8.29 5.01 0.00 3.90 3.64 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 0.00 0.00 0.00 0.00 4 Y 8.43 5.16 0.00 2.86 2.99 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 5 E 8.68 5.15 0.00 1.94 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 2.29 2.44 0.00 6 F 8.60 5.08 0.00 3.01 2.78 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 7 Q 7.47 4.61 0.00 2.14 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.50 0.00 0.00 0.00 0.00 0.00 2.10 2.22 0.00 8 T 8.13 4.59 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 1.22 0.00 0.00 9 H 8.72 5.02 0.00 3.13 3.19 0.00 5.98 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *25 K 8.26 4.19 0.00 1.71 1.78 0.00 1.70 0.00 0.00 2.23 0.00 0.00 2.79 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.36 7.81 26 E 8.29 4.56 0.00 1.53 1.64 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 0.00 2.18 2.03 0.00 27 L 8.29 5.05 0.00 1.86 1.61 0.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 9.08 4.92 0.00 3.05 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 29 V 7.43 4.85 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 0.94 0.00 0.00 0.91 0.00 0.00 30 Q 8.45 5.07 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.44 0.00 0.00 0.00 0.00 0.00 2.54 2.67 0.00 31 A 9.41 5.40 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 32 T 8.56 4.87 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 1.06 0.00 0.00 33 H 8.84 4.97 0.00 3.14 3.31 0.00 5.63 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 F 8.56 4.83 0.00 3.06 2.95 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 35 N 9.06 4.54 0.00 2.77 2.93 0.00 0.00 6.77 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.84 4.75 0.00 2.77 2.91 0.00 0.00 5.77 7.71 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 37 T 7.33 4.37 4.08 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 0.00 0.00 0.00 0.95 0.00 0.00 38 I 7.86 4.78 1.44 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 0.79 0.29 0.60 0.00 0.00 39 L 8.18 4.61 0.00 1.71 1.77 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.20 5.24 0.00 1.76 1.47 1.06 0.88 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 41 Q 9.26 5.13 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.51 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 42 I 9.23 4.76 1.99 0.00 0.00 1.00 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 1.14 0.99 0.00 0.00 43 R 9.32 5.21 0.00 1.90 1.77 0.00 3.04 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 44 L 8.68 4.91 0.00 1.66 1.45 0.80 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 45 N 10.00 4.18 0.00 2.89 2.79 0.00 0.00 6.61 8.71 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 46 G 8.35 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 0.00 0.00 0.00 47 E 7.74 4.58 0.00 2.22 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 2.25 2.45 0.00 48 M 8.20 4.91 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 49 D 8.97 4.84 0.00 2.66 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 50 S 8.14 4.95 0.00 3.82 3.57 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 51 T 8.54 4.86 4.08 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 0.00 0.00 0.00 1.20 0.00 0.00 52 Y 8.87 5.19 0.00 2.90 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 53 E 9.17 4.78 0.00 2.00 1.81 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 2.18 2.17 0.00 54 V 8.28 4.45 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 0.67 0.00 0.00 0.90 0.00 0.00 55 S 8.01 5.26 0.00 4.08 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 56 S 8.51 5.21 0.00 4.12 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 57 K 8.61 4.29 0.00 1.78 1.89 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.52 7.81 58 G 8.40 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 0.00 0.00 0.00 59 L 8.54 4.22 0.00 1.64 1.66 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 *95 Y 7.41 4.91 0.00 2.98 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 96 Q 8.25 4.76 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 97 V 8.05 4.01 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 0.78 0.00 0.00 0.90 0.00 0.00 98 V 8.93 4.54 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 1.02 0.00 0.00 0.98 0.00 0.00 99 T 8.59 4.73 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 1.28 0.00 0.00 100 K 8.96 4.24 0.00 1.62 1.78 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.47 7.81 101 L 7.46 4.30 0.00 1.63 1.34 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 102 G 8.20 3.44 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 0.00 103 D 8.39 4.61 0.00 2.77 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 0.00 104 S 8.86 4.54 0.00 4.08 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 0.00 105 A 8.02 4.54 1.29 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 0.00 0.00 106 D 7.96 4.43 0.00 2.92 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 0.00 107 P 0.00 4.31 0.00 2.18 2.14 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 108 K 8.36 3.90 0.00 2.11 1.55 0.00 1.56 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.42 7.81 109 V 7.50 3.23 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 -0.07 0.00 0.00 0.77 0.00 0.00 110 P 0.00 4.18 0.00 2.12 2.04 0.00 3.67 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 111 V 7.37 3.46 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 0.94 0.00 0.00 0.88 0.00 0.00 112 V 7.04 3.37 1.81 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 0.91 0.00 0.00 -0.17 0.00 0.00 113 C 7.79 4.05 0.00 2.88 2.87 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 0.00 114 V 7.77 3.58 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 1.30 0.00 0.00 1.04 0.00 0.00 115 Q 8.19 3.99 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.50 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 116 I 8.05 3.76 2.06 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.11 1.12 0.00 0.00 117 A 8.41 4.13 0.79 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 0.00 118 E 7.98 4.01 0.00 2.22 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 2.77 2.53 0.00 119 L 7.76 4.01 0.00 1.60 1.89 0.83 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 9.22 3.93 0.00 3.40 2.92 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 0.00 121 R 5.84 3.61 0.00 1.88 1.95 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.10 0.00 122 R 7.80 4.70 0.00 1.72 1.82 0.00 3.18 0.00 0.00 3.09 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 123 V 6.96 4.36 2.04 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 0.67 0.00 0.00 0.90 0.00 0.00 124 I 7.89 4.28 1.78 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.59 0.72 0.00 0.00 125 L 7.97 4.48 0.00 1.70 1.71 1.18 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.64 0.00 2.16 2.09 0.00 3.80 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 1.91 1.94 0.00 *138 Q 8.08 4.38 0.00 2.25 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.53 0.00 139 F 7.78 4.86 0.00 3.24 2.95 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 0.00 140 S 7.04 4.44 0.00 3.78 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 0.00 141 L 8.05 4.81 0.00 1.40 1.25 0.71 0.23 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 0.00 142 L 8.14 5.16 0.00 1.66 1.45 0.81 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 143 I 9.19 5.02 2.02 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.73 1.03 0.00 0.00 144 S 9.13 5.33 0.00 3.75 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 0.00 145 M 9.11 5.94 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.58 0.00 146 S 8.68 4.58 0.00 4.15 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 0.00 147 S 9.20 4.40 0.00 4.15 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 0.00 148 K 8.16 4.01 0.00 1.72 1.88 0.00 1.89 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.49 7.81 149 I 7.05 3.45 0.56 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.25 -0.85 0.00 0.00 150 W 7.40 5.03 0.00 3.24 3.32 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 *161 N 8.45 4.58 0.00 2.87 2.91 0.00 0.00 6.19 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 0.00 162 D 9.13 5.16 0.00 2.99 3.09 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 0.00 0.00 0.00 0.00 163 F 8.12 4.87 0.00 3.19 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 0.00 164 G 8.39 3.85 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 0.00 0.00 0.00 165 K 8.26 3.97 0.00 2.09 2.10 0.00 1.45 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.12 1.37 7.81 166 L 8.49 4.27 0.00 1.85 1.73 0.79 0.63 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 0.00 167 V 7.76 3.52 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 0.98 0.00 0.00 0.70 0.00 0.00 168 F 8.12 4.02 0.00 3.25 3.18 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 0.00 169 V 8.02 3.66 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 1.11 0.00 0.00 1.03 0.00 0.00 170 L 7.89 4.03 0.00 2.03 1.64 1.01 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 171 K 8.00 3.84 0.00 1.85 1.55 0.00 1.54 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.23 1.34 7.81 172 C 7.99 4.13 0.00 3.06 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 0.00 173 I 7.82 3.84 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.06 0.82 0.00 0.00 174 K 7.64 3.94 0.00 1.53 1.59 0.00 1.52 0.00 0.00 1.51 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.25 1.26 7.81 175 D 7.14 3.99 0.00 1.64 1.54 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 0.00 176 M 6.81 4.60 0.00 2.33 2.44 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 2.54 2.62 0.00 177 Y 7.64 3.27 0.00 3.00 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 0.00 178 A 7.35 4.02 0.92 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.