NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 57 S 4.4055 8.1776 115.2793 57.4595 63.3946 174.4901 58 P 4.2254 0.0000 0.0000 64.2089 31.6187 175.3960 59 G 4.0766 8.8216 108.4949 45.5977 0.0000 173.8581 60 I 4.8602 7.2973 121.1998 60.1659 38.7166 175.0784 61 W 5.0719 9.1184 125.4144 54.8628 33.5979 173.9375 62 Q 5.2879 9.3368 123.1111 54.4135 31.6528 174.0688 63 L 5.2707 9.2390 127.6413 53.5760 44.9154 174.5794 64 D 4.2132 8.8253 128.7327 53.7513 46.8540 174.4458 *66 T 4.3766 8.5389 118.7704 63.4181 69.0821 172.7014 67 H 5.4501 8.5466 120.9130 54.1497 32.2171 173.4554 68 L 4.3753 8.9402 122.0703 55.4869 45.4963 175.1487 69 E 3.7615 9.8635 125.1982 57.6206 27.0826 175.5045 70 G 3.9225 8.2995 102.1210 46.0219 0.0000 173.5914 71 K 4.6076 8.2563 119.1456 54.2918 35.0552 174.8226 72 V 4.7013 7.9476 120.0842 61.2253 33.9922 174.2492 73 I 4.8888 8.5953 128.7759 59.3764 39.4632 174.8087 74 L 4.2942 9.0673 130.4985 54.1965 43.4833 175.4065 75 V 4.8884 8.8250 126.1985 60.9820 34.6205 173.7566 76 A 5.5304 9.2152 129.7053 50.2092 22.0345 175.0361 77 V 4.8176 9.1002 121.8709 61.2489 34.9618 174.0548 78 H 3.3479 8.9940 128.9925 55.1360 28.2911 175.3760 79 V 3.4416 7.8211 127.0971 66.2067 31.2921 178.3891 80 A 4.1651 7.7086 121.1171 54.1279 18.3924 178.0227 81 S 4.4383 7.3442 108.2068 57.6182 64.6767 175.5829 82 G 3.9130 8.4998 108.7197 44.8717 0.0000 172.8212 83 Y 4.4662 7.7208 122.0293 57.6324 39.6951 174.8518 84 I 5.6854 8.0799 118.7403 58.2647 41.1589 174.4400 85 E 4.9043 8.6785 120.5466 54.8261 33.6625 174.5230 86 A 5.3763 8.6806 123.3668 50.7458 23.0614 174.7662 87 E 4.7615 9.0498 119.0156 54.8304 33.8082 174.0410 88 V 4.7547 8.5201 126.3435 61.5372 32.6770 174.8075 89 I 4.5920 8.7189 121.5011 58.6041 40.5416 175.1755 90 P 4.1949 0.0000 0.0000 65.0703 31.4184 176.6635 91 A 4.7681 7.4138 117.7750 50.0792 22.4729 176.3725 92 E 4.3156 8.6051 121.2471 55.8870 27.7069 176.5470 93 T 4.7880 7.4867 113.2314 59.4714 73.1752 175.7412 94 G 3.6931 8.4929 108.6151 48.0667 0.0000 176.1221 95 Q 4.0974 8.0652 119.8847 58.8731 28.7772 178.4635 96 E 4.1296 8.2906 119.7410 59.6166 29.4851 179.5565 97 T 3.9667 8.0274 115.3542 66.5795 68.5836 176.5568 98 A 4.0479 8.2222 122.7126 55.3350 18.4042 179.0155 99 Y 4.0662 7.9932 117.4685 60.8834 38.9505 178.0127 100 F 3.8478 8.4206 121.5392 61.3343 39.4237 177.0796 101 L 4.0313 8.2943 118.6228 57.5524 41.4958 179.1502 102 L 3.9183 7.9578 120.3121 58.0591 41.7742 179.2295 103 K 3.6703 7.2708 117.0226 59.2004 32.2091 178.6661 104 L 3.8242 7.4336 120.2120 58.1862 41.6693 179.0025 105 A 4.0274 8.2717 121.0346 54.6807 18.0833 178.9846 106 G 3.6052 7.6469 101.3110 45.7176 0.0000 174.0629 107 R 4.0782 7.0683 119.9346 56.1368 31.8932 175.6818 108 W 4.9899 7.7388 115.3782 53.9734 32.4566 174.1624 109 P 4.4885 0.0000 0.0000 61.8530 29.3900 174.1367 110 V 4.0689 7.9200 124.4450 63.3058 31.6239 175.2884 111 K 4.5654 9.2353 128.0971 58.1352 33.9576 177.0203 112 T 5.8714 7.7825 107.6221 59.3562 72.7091 172.9856 113 V 5.1486 8.4152 121.1320 61.7613 34.8559 173.6459 114 H 5.2732 9.6738 126.6750 55.0903 33.3195 172.0492 115 T 4.8809 7.5034 114.5688 61.2304 69.9330 173.0992 116 D 4.5228 9.2705 124.6621 54.7979 41.5080 176.8202 117 N 4.7221 7.5633 117.9570 50.7783 39.7483 174.3409 118 G 3.5771 8.4392 114.8298 48.1040 0.0000 173.5791 119 S 4.2722 7.9426 113.6593 60.3774 63.3056 175.8104 120 N 4.2370 7.8802 118.8449 55.9500 38.2465 175.6294 121 F 5.1491 7.7996 113.8983 57.5332 39.2361 176.6910 122 T 4.2183 7.7660 112.2871 63.2636 69.3671 176.0716 123 S 4.3782 7.9684 118.2221 58.5331 65.0242 175.0847 124 T 3.9774 8.4068 113.7879 65.0711 68.8123 176.9668 125 T 3.8655 7.8874 118.2513 66.5727 68.3290 176.5260 126 V 3.6473 7.4964 118.2659 66.0199 31.6847 177.9304 127 K 4.1285 8.0379 116.8619 59.3437 32.1092 178.9070 128 A 4.3718 8.5225 121.5182 54.9031 18.2199 179.7298 129 A 4.3205 7.8406 116.1007 52.6205 18.1243 179.1449 *131 W 4.7197 7.9200 131.7669 58.7446 32.5026 177.3512 132 W 3.0600 8.6539 126.3124 60.1082 30.0727 176.7915 133 A 3.9618 8.3145 118.6538 52.4628 18.1577 177.0262 134 G 3.6384 7.3625 103.3080 46.5746 0.0000 173.6460 135 I 4.6266 7.6995 118.8047 59.3652 39.1952 175.9905 136 K 4.7316 8.9396 125.2778 54.4790 35.5111 175.1766 137 Q 4.5640 8.4980 123.2712 56.3278 28.9292 175.9500 *154 M 4.4645 8.6853 123.8888 55.0283 34.3969 177.3168 155 N 4.6267 8.2385 116.6138 56.2645 38.6452 177.0902 156 K 3.9309 7.9203 119.0619 59.6287 32.2956 178.3823 157 E 3.8579 8.2276 118.9026 59.4536 29.4585 178.1477 158 L 3.9230 9.3801 120.0387 58.4952 42.0899 179.4834 159 K 4.0850 8.2765 118.1954 59.1899 31.8082 179.1991 160 K 3.9199 8.4761 120.4193 59.5224 32.3006 178.6146 161 I 4.2164 8.0820 121.7093 64.0403 37.0736 178.3665 162 I 3.8333 8.3473 120.7794 64.3415 36.6676 178.7137 163 G 3.6312 8.0483 105.8577 47.9754 0.0000 175.4646 164 Q 4.1681 8.4373 120.7847 58.0852 28.8911 178.3091 165 V 4.2317 7.6622 110.9802 61.1531 32.3415 177.5630 166 R 3.9150 7.7261 119.9999 59.6232 29.5449 177.8683 167 D 4.4503 7.9542 116.7334 56.0048 39.9278 177.3179 168 Q 3.9667 7.9889 119.6774 57.6473 29.2585 175.7340 169 A 4.7740 7.1172 119.1988 50.0037 20.9948 176.5345 170 E 4.0337 8.8521 121.9862 58.7958 30.0963 177.6792 171 H 5.0495 7.6488 114.0662 53.1850 33.2599 174.5157 172 L 3.9594 8.4417 124.3513 58.1363 41.9201 178.9932 173 K 3.8335 8.1928 119.1348 60.2885 31.9964 178.6198 174 T 3.9232 7.9483 114.8567 66.4789 68.3501 176.4917 175 A 3.9986 8.0500 122.8378 55.0196 18.3180 179.8263 176 V 3.5362 8.1972 117.1589 66.4501 31.6481 178.4252 177 Q 4.0742 8.0134 117.2107 58.9867 28.3952 178.6080 178 M 4.0181 8.1365 119.8809 58.1956 31.9925 178.5410 179 A 4.0144 8.3192 121.2419 55.0995 18.4802 179.7843 180 V 3.5173 8.0358 116.8540 66.0643 31.6252 177.7981 181 F 3.9740 8.3727 120.2768 61.4599 39.1267 176.8857 182 I 3.8445 8.2905 119.5183 64.9027 36.7759 177.8576 183 H 4.1227 8.4988 117.6622 59.5332 29.9631 176.8369 184 N 4.4777 8.5732 118.3378 56.0443 38.1475 176.4538 185 H 4.6438 7.8399 115.6983 55.2153 29.4097 175.3106 186 K 3.9536 7.4908 123.3030 56.4638 32.2910 176.1236 187 R 4.4751 8.3986 125.7304 55.4016 30.8223 177.5622 188 K 3.9048 8.4964 123.1957 57.6199 32.3843 177.9278 189 G 3.9549 7.4338 103.1579 47.2383 0.0000 173.6408 190 G 3.8039 8.4459 105.6226 43.9751 0.0000 172.3324 191 I 3.6740 7.9020 118.9708 64.7559 36.5378 175.7242 192 G 3.9569 8.7526 122.1376 43.9970 0.0000 172.8463 193 G 3.6624 7.1105 112.4336 45.8288 0.0000 171.8064 194 Y 4.7656 8.2823 122.4151 55.9245 40.2837 176.0343 195 S 5.3934 9.0075 119.6591 56.2225 66.3473 175.3070 196 A 4.1841 8.4446 123.3703 55.3475 18.1075 180.0786 197 G 3.6932 8.4483 104.3952 47.9970 0.0000 175.9076 198 E 4.1611 7.9974 121.0576 59.2008 29.4572 179.4947 199 R 3.8731 8.2879 118.4163 59.2443 30.0697 178.9757 200 I 3.4063 7.8862 118.5234 63.9738 37.8508 178.1109 201 V 3.6684 7.3429 117.7956 65.9315 31.2469 177.5606 202 D 4.2801 8.1159 117.8153 57.3919 41.1844 178.2133 203 I 3.6645 7.8975 120.5214 64.5240 36.8792 178.5934 204 I 3.7800 7.7823 119.2908 64.2772 37.0204 177.9419 205 A 4.1054 8.2050 120.9825 55.6428 18.3353 179.1516 206 T 3.9294 8.0725 113.4178 66.9386 68.7064 174.4186 207 D 4.6007 7.8198 122.5166 54.5301 41.4422 175.5740 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 57 S 8.18 4.41 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 58 P 0.00 4.23 0.00 2.34 2.17 0.00 3.80 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 2.01 2.16 0.00 59 G 8.82 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 0.00 0.00 0.00 0.00 60 I 7.30 4.86 1.79 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 1.26 0.73 0.94 0.00 0.00 61 W 9.12 5.07 0.00 3.38 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 62 Q 9.34 5.29 0.00 2.21 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 63 L 9.24 5.27 0.00 1.81 1.79 0.79 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.83 4.21 0.00 2.58 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 *66 T 8.54 4.38 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 1.24 0.00 0.00 67 H 8.55 5.45 0.00 3.03 3.16 0.00 5.78 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 68 L 8.94 4.38 0.00 1.70 1.46 0.93 1.09 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 69 E 9.86 3.76 0.00 2.11 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 2.24 2.29 0.00 70 G 8.30 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 0.00 0.00 0.00 71 K 8.26 4.61 0.00 1.83 1.71 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.42 7.81 72 V 7.95 4.70 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 0.83 0.00 0.00 0.92 0.00 0.00 73 I 8.60 4.89 1.83 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 1.11 0.76 0.96 0.00 0.00 74 L 9.07 4.29 0.00 1.54 1.12 0.74 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.82 4.89 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 0.90 0.00 0.00 0.89 0.00 0.00 76 A 9.22 5.53 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 0.00 0.00 0.00 0.00 0.00 77 V 9.10 4.82 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 0.99 0.00 0.00 0.95 0.00 0.00 78 H 8.99 3.35 0.00 1.40 2.65 0.00 5.67 0.00 0.00 0.00 0.00 6.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.82 3.44 1.88 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 0.76 0.00 0.00 0.90 0.00 0.00 80 A 7.71 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.34 4.44 0.00 3.98 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 82 G 8.50 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 83 Y 7.72 4.47 0.00 3.08 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 84 I 8.08 5.69 1.95 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 1.12 1.46 0.80 0.00 0.00 85 E 8.68 4.90 0.00 2.20 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 2.51 2.58 0.00 86 A 8.68 5.38 1.24 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 0.00 0.00 87 E 9.05 4.76 0.00 2.50 1.91 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 2.45 2.44 0.00 88 V 8.52 4.75 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 0.93 0.00 0.00 0.95 0.00 0.00 89 I 8.72 4.59 1.90 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 1.22 1.04 1.04 0.00 0.00 90 P 0.00 4.19 0.00 2.06 2.15 0.00 3.63 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 2.02 2.08 0.00 91 A 7.41 4.77 1.19 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 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.61 4.32 0.00 1.97 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 2.28 0.00 93 T 7.49 4.79 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 1.25 0.00 0.00 94 G 8.49 3.69 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 0.00 0.00 0.00 95 Q 8.07 4.10 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 96 E 8.29 4.13 0.00 2.23 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 0.00 2.36 2.69 0.00 97 T 8.03 3.97 4.50 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 1.41 0.00 0.00 98 A 8.22 4.05 1.48 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 99 Y 7.99 4.07 0.00 3.17 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 0.00 100 F 8.42 3.85 0.00 3.33 3.23 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 0.00 101 L 8.29 4.03 0.00 1.94 1.69 0.78 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.96 3.92 0.00 1.92 1.53 0.97 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 103 K 7.27 3.67 0.00 1.39 1.49 0.00 1.45 0.00 0.00 1.04 0.00 0.00 2.50 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.83 0.90 7.81 104 L 7.43 3.82 0.00 1.50 1.55 0.65 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 105 A 8.27 4.03 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 0.00 106 G 7.65 3.61 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 0.00 0.00 0.00 107 R 7.07 4.08 0.00 1.44 1.75 0.00 3.31 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 108 W 7.74 4.99 0.00 3.22 3.23 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 0.00 109 P 0.00 4.49 0.00 2.26 2.15 0.00 4.15 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 2.13 2.06 0.00 110 V 7.92 4.07 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 0.76 0.00 0.00 0.59 0.00 0.00 111 K 9.24 4.57 0.00 1.85 1.88 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.42 7.81 112 T 7.78 5.87 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 1.27 0.00 0.00 113 V 8.42 5.15 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 1.18 0.00 0.00 1.03 0.00 0.00 114 H 9.67 5.27 0.00 3.31 3.31 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 7.50 4.88 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 0.68 0.00 0.00 116 D 9.27 4.52 0.00 2.85 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 0.00 117 N 7.56 4.72 0.00 2.60 2.51 0.00 0.00 6.94 7.69 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 0.00 118 G 8.44 3.58 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 0.00 0.00 0.00 119 S 7.94 4.27 0.00 4.01 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 0.00 120 N 7.88 4.24 0.00 2.42 2.71 0.00 0.00 6.88 7.20 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 0.00 121 F 7.80 5.15 0.00 3.01 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 0.00 122 T 7.77 4.22 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 1.31 0.00 0.00 123 S 7.97 4.38 0.00 4.11 4.09 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 0.00 124 T 8.41 3.98 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 1.21 0.00 0.00 125 T 7.89 3.87 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 1.25 0.00 0.00 126 V 7.50 3.65 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 0.75 0.00 0.00 1.09 0.00 0.00 127 K 8.04 4.13 0.00 2.03 1.91 0.00 2.03 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.57 7.81 128 A 8.52 4.37 1.46 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 0.00 0.00 129 A 7.84 4.32 1.43 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 *131 W 7.92 4.72 0.00 3.39 3.56 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 0.00 132 W 8.65 3.06 0.00 3.46 3.23 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 0.00 133 A 8.31 3.96 1.43 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 0.00 134 G 7.36 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 0.00 0.00 0.00 135 I 7.70 4.63 1.86 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 1.49 0.64 0.90 0.00 0.00 136 K 8.94 4.73 0.00 1.66 1.72 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.52 7.81 137 Q 8.50 4.56 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.63 0.00 0.00 0.00 0.00 0.00 2.53 2.79 0.00 *154 M 8.69 4.46 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.50 0.00 155 N 8.24 4.63 0.00 2.80 2.87 0.00 0.00 7.16 7.97 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 0.00 156 K 7.92 3.93 0.00 1.84 1.85 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.55 7.81 157 E 8.23 3.86 0.00 2.08 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 2.44 2.48 0.00 158 L 9.38 3.92 0.00 1.77 1.71 0.90 0.68 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 0.00 159 K 8.28 4.08 0.00 2.28 1.85 0.00 1.86 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.45 7.81 160 K 8.48 3.92 0.00 1.85 1.99 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 161 I 8.08 4.22 2.02 0.00 0.00 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 1.57 2.12 0.95 0.00 0.00 162 I 8.35 3.83 2.07 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.92 0.00 0.00 163 G 8.05 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.44 4.17 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.63 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 165 V 7.66 4.23 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 1.02 0.00 0.00 1.00 0.00 0.00 166 R 7.73 3.91 0.00 2.08 1.95 0.00 3.14 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 167 D 7.95 4.45 0.00 2.82 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 0.00 168 Q 7.99 3.97 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 169 A 7.12 4.77 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 0.00 170 E 8.85 4.03 0.00 1.82 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 2.25 2.31 0.00 171 H 7.65 5.05 0.00 3.14 3.16 0.00 5.63 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 0.00 172 L 8.44 3.96 0.00 1.94 1.69 0.93 0.49 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 0.00 173 K 8.19 3.83 0.00 1.88 1.84 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.58 7.81 174 T 7.95 3.92 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 1.21 0.00 0.00 175 A 8.05 4.00 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 0.00 176 V 8.20 3.54 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 1.13 0.00 0.00 0.97 0.00 0.00 177 Q 8.01 4.07 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 178 M 8.14 4.02 0.00 2.04 2.25 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 2.65 2.44 0.00 179 A 8.32 4.01 1.39 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 0.00 180 V 8.04 3.52 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 1.13 0.00 0.00 1.01 0.00 0.00 181 F 8.37 3.97 0.00 3.19 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 0.00 182 I 8.29 3.84 2.11 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 1.51 1.41 0.98 0.00 0.00 183 H 8.50 4.12 0.00 3.08 3.45 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 N 8.57 4.48 0.00 2.80 2.94 0.00 0.00 7.03 8.94 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 0.00 185 H 7.84 4.64 0.00 3.04 3.23 0.00 5.86 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 K 7.49 3.95 0.00 1.93 1.67 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 187 R 8.40 4.48 0.00 1.88 1.77 0.00 3.14 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.57 0.00 188 K 8.50 3.90 0.00 1.87 1.90 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.42 7.81 189 G 7.43 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 0.00 190 G 8.45 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 0.00 0.00 0.00 191 I 7.90 3.67 1.88 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 1.35 0.85 0.91 0.00 0.00 192 G 8.75 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 0.00 193 G 7.11 3.66 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 0.00 0.00 0.00 194 Y 8.28 4.77 0.00 3.06 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 0.00 195 S 9.01 5.39 0.00 4.29 4.14 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 0.00 0.00 0.00 0.00 196 A 8.44 4.18 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 0.00 197 G 8.45 3.69 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 0.00 0.00 0.00 198 E 8.00 4.16 0.00 2.29 2.15 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 2.38 2.37 0.00 199 R 8.29 3.87 0.00 2.08 1.93 0.00 3.07 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 200 I 7.89 3.41 1.41 0.00 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.75 0.41 0.00 0.00 201 V 7.34 3.67 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 1.04 0.00 0.00 1.08 0.00 0.00 202 D 8.12 4.28 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 0.00 203 I 7.90 3.66 1.88 0.00 0.00 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 1.47 0.70 0.89 0.00 0.00 204 I 7.78 3.78 2.00 0.00 0.00 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 1.68 0.99 1.04 0.00 0.00 205 A 8.20 4.11 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 0.00 206 T 8.07 3.93 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 1.19 0.00 0.00 207 D 7.82 4.60 0.00 2.81 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 * Residues marked with a * may have inaccurate shift predictions.