NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 47 E 4.4265 8.4444 120.1902 55.9549 31.7721 176.8365 48 V 3.3892 9.1264 123.3305 62.1384 32.6228 172.3041 49 N 5.1888 9.2153 125.9044 49.2618 38.6566 173.0977 50 P 4.8470 0.0000 0.0000 62.4114 30.6311 175.5895 51 D 4.6406 8.3292 119.6541 54.5449 44.8849 176.3342 52 I 4.6051 7.7711 119.2980 59.4459 40.1160 175.0600 53 I 4.4444 8.2057 124.2408 61.9881 38.2849 178.5390 54 K 4.5035 8.0993 117.5807 57.0762 32.8410 176.1550 55 D 4.9410 9.5637 123.7475 54.4362 40.8151 179.3841 56 E 3.9212 9.1958 123.9194 57.3383 29.5649 176.5261 57 V 4.0833 7.6446 119.3804 62.3329 32.7242 175.2368 58 F 4.6523 8.1761 120.4202 56.1319 43.0416 174.8635 59 D 4.6514 8.0200 125.6203 53.9853 41.0242 176.7876 60 F 5.2286 7.4767 117.3658 55.1899 44.1523 175.7635 61 V 3.6093 8.5234 122.0623 65.9786 31.5125 177.8971 62 I 3.3760 7.9111 118.0002 64.4213 37.7291 177.7771 63 V 3.4988 7.6891 118.2575 65.9351 31.2477 177.5795 64 N 4.4129 7.8227 115.0172 55.6908 38.5842 176.8610 65 R 4.0544 8.4198 119.9309 57.4519 30.5918 175.9823 66 V 4.1382 7.1445 114.6010 64.2386 33.9870 176.9237 67 L 3.8513 8.3013 119.7575 57.9146 41.5710 179.9382 68 K 4.1139 7.7030 115.0520 58.1474 32.1654 177.8582 69 K 4.3474 7.6489 117.0709 55.9726 32.1461 176.2190 70 I 4.1282 7.2952 121.3520 60.1605 37.1294 175.6871 71 K 3.9983 9.0067 125.9494 59.2670 32.6637 177.2209 72 D 4.9723 7.7828 115.9825 51.7600 41.1620 175.5589 73 L 4.1380 7.9304 124.4905 58.0257 42.8640 178.7935 74 K 4.1146 8.1322 118.8295 58.8572 32.4907 177.8240 75 H 3.8121 8.3557 118.5317 58.6126 29.6758 175.1263 76 Y 4.5650 7.5585 113.9371 56.7925 38.4742 175.2509 77 D 4.4820 7.9527 118.6835 54.4533 38.7150 170.8902 78 P 4.6159 0.0000 0.0000 62.0980 32.0543 175.8316 *80 I 3.9740 8.0187 117.4950 61.5846 37.3325 174.5505 81 E 4.5821 8.4587 125.4677 54.8377 31.6003 175.3742 82 K 4.6855 9.1292 124.6707 54.9052 34.2636 175.3368 83 I 4.6878 9.6116 127.5543 58.1913 38.9254 175.4347 84 F 5.0081 10.1140 121.5815 56.3858 38.0482 171.3517 85 D 4.1973 7.8030 123.2365 54.0015 38.5530 172.1643 86 E 4.6699 8.3458 119.3231 55.9512 31.6943 175.6230 87 K 4.1536 8.8323 119.7319 55.8092 31.5963 176.0697 88 G 4.0647 7.5078 106.6914 45.3060 0.0000 172.3403 89 K 4.2976 8.5760 115.3518 56.2275 32.8609 170.0549 90 E 3.6255 9.4512 128.2808 55.2773 27.9896 174.3764 *92 G 3.8230 8.0098 110.6702 46.0183 0.0000 169.2953 93 L 4.9089 8.0554 120.6579 52.9305 45.7546 174.6490 94 N 5.2138 9.0249 124.5734 52.0214 41.2104 172.7471 95 V 4.6103 8.7212 127.2655 60.9374 34.5989 174.0164 96 E 5.0591 8.5766 127.0244 54.5998 32.8492 173.8172 97 I 4.6521 9.2009 128.0582 59.6019 40.3797 174.8007 98 Q 4.6928 9.0265 126.3921 55.2977 28.5748 176.1806 99 I 4.1046 9.0157 126.8104 63.1101 38.1820 176.2084 100 N 5.0007 8.2700 121.1638 50.6827 38.3794 172.4449 101 P 4.5483 0.0000 0.0000 63.5573 31.8715 178.1476 102 E 4.0276 8.1523 118.9577 58.3600 29.7394 176.6863 103 V 4.2044 7.7993 118.1702 59.7498 32.0028 173.5900 104 K 3.9293 8.4838 126.1217 58.0379 32.3524 176.2493 105 D 4.6090 8.9787 123.3815 55.0101 38.6453 174.5952 106 F 4.2519 8.5887 124.4201 60.6861 39.7202 174.2998 107 F 6.1713 8.4093 123.2079 56.9353 41.4243 173.1624 108 T 5.1794 8.7067 115.6920 59.5813 72.7684 172.3781 109 F 5.4292 9.5474 124.8024 56.4795 42.2585 173.9465 110 K 4.8810 8.2104 124.8973 54.5092 35.7914 175.1698 111 S 4.8817 8.9124 117.7515 56.7134 65.9586 172.4514 112 I 4.7694 8.7582 128.2667 59.8682 39.0811 174.6717 113 S 5.2319 9.0067 124.2169 56.8933 65.3912 173.5890 114 T 4.6931 9.0325 113.3068 61.1875 72.3583 176.7297 115 T 3.4550 7.4845 114.8465 64.5413 69.9945 173.7573 116 N 4.7824 8.0994 117.3901 54.3214 40.9199 175.6079 117 K 4.5024 7.2191 118.0513 55.6470 34.5509 174.7039 118 Q 5.0238 8.1988 119.0611 54.6576 32.1305 173.7977 119 R 4.6507 9.2051 124.6811 54.5121 33.8347 173.9098 120 C 5.2935 7.7875 117.5743 55.2191 44.3973 173.0933 121 F 5.3802 8.6933 119.7161 55.8383 43.4032 173.6450 122 L 5.5842 9.5464 121.6308 53.2090 45.5597 175.6480 123 S 5.2252 9.2051 118.3405 56.6840 66.5144 172.7812 124 L 4.1707 7.8643 126.5653 52.8046 44.3225 176.6797 125 R 3.7215 8.8038 128.1501 57.2585 27.7945 176.9680 126 G 4.0014 8.1161 105.7220 45.2590 0.0000 172.8434 127 E 4.3581 7.8324 120.9796 55.3455 30.0410 174.9858 128 T 5.2353 8.3796 123.0507 62.3979 70.5717 174.3916 129 R 4.7402 8.9639 123.4146 54.5101 34.5271 174.5178 130 E 4.3568 8.9804 124.5480 56.2425 29.3369 175.4952 131 I 4.5851 8.8865 124.9321 58.5636 42.0974 174.1832 132 L 3.8839 8.5959 129.6597 55.5586 42.0181 177.3828 133 C 4.2575 8.6149 123.9067 57.1610 40.6161 172.7150 134 D 4.5433 7.4561 124.2407 50.3711 43.6594 175.1798 135 N 4.4649 8.7270 116.6615 56.4569 36.5069 177.0335 136 K 3.8828 7.9096 119.2080 59.2366 32.2301 178.4946 137 L 3.9879 7.5258 119.3795 58.0727 42.2027 178.0641 138 Y 4.5941 7.5303 116.8182 61.2049 37.8128 178.9416 139 N 4.7463 8.1368 115.4554 53.6783 38.6123 177.1746 *141 L 3.7344 7.8854 122.0525 54.7475 43.7876 179.4393 142 L 4.1013 8.2060 118.4301 57.3992 41.2755 178.9430 143 A 3.9156 8.1355 120.5210 55.4069 18.3744 179.6924 144 V 4.2093 7.2665 116.8991 65.5363 31.6485 178.1133 145 F 4.3690 7.6198 115.7775 59.8429 38.8013 176.0208 146 N 4.9319 9.1335 116.7986 53.1482 38.6010 175.5149 147 S 4.7084 7.9617 111.9935 57.7967 63.7640 173.3387 148 Y 3.9356 8.1505 122.6574 57.7117 39.0607 174.7906 149 D 4.1924 6.7656 122.2560 52.8852 43.4062 174.9143 150 P 3.5976 0.0000 0.0000 65.3483 31.2394 176.9513 151 N 4.5531 7.9937 114.2097 54.1933 39.3428 174.5414 152 D 4.7539 8.6147 118.6901 51.6780 41.4903 175.5971 153 L 3.9578 7.7691 123.0672 57.6843 42.1271 179.1196 154 L 3.9319 7.8089 119.7972 57.9447 42.2752 178.6620 155 K 3.8480 7.9062 119.4534 59.8623 32.1750 177.7326 156 H 4.4576 7.7504 119.2513 59.0579 29.7905 177.0017 157 I 3.7154 8.2473 121.5749 64.4088 36.8932 178.3908 158 S 4.1147 8.0107 114.3217 61.6502 62.2847 176.3977 159 T 3.9370 7.7426 112.1200 64.4892 68.4932 176.6312 160 V 3.6017 7.8260 121.1340 66.1971 31.6249 178.0454 161 E 4.0959 8.3081 117.8846 59.2553 29.2335 179.3225 162 S 4.1813 7.9192 113.1333 61.0826 62.3247 175.9191 163 L 4.0744 8.0522 123.2732 57.9084 41.9654 179.0307 164 K 3.8576 8.0609 118.3958 59.0798 31.7038 178.9159 165 K 4.0265 7.7778 118.5588 59.8148 32.4273 178.1400 166 I 3.8634 7.8966 119.8045 65.1865 37.0605 177.2748 167 F 3.8656 8.5419 120.4742 62.0215 38.8170 176.4189 168 Y 4.1628 7.5736 117.7141 60.7990 38.2740 178.3346 169 T 4.3146 8.1158 115.4599 63.3313 69.1896 174.9692 170 I 3.8615 7.2400 123.4899 61.0326 37.6030 175.4328 171 T 4.5315 8.2573 114.8240 59.8452 71.1386 173.1523 172 C 4.5606 8.5369 121.7043 58.3753 28.9707 173.0249 173 E 4.7378 8.5642 123.2380 54.3091 32.6875 174.8368 174 A 4.6775 8.3608 122.8460 50.2297 22.1102 175.5874 175 V 4.2259 7.9214 118.8118 61.8091 32.7815 175.4148 176 Y 4.1757 8.6489 123.3740 58.1858 37.9649 175.4390 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 47 E 8.44 4.43 0.00 2.20 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 2.34 2.35 0.00 48 V 9.13 3.39 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 1.07 0.00 0.00 1.09 0.00 0.00 49 N 9.22 5.19 0.00 2.94 2.83 0.00 0.00 6.38 7.75 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 50 P 0.00 4.85 0.00 2.11 2.04 0.00 3.74 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 2.11 2.17 0.00 51 D 8.33 4.64 0.00 2.73 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 52 I 7.77 4.61 1.90 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 1.43 0.70 0.96 0.00 0.00 53 I 8.21 4.44 1.85 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.04 0.89 0.00 0.00 54 K 8.10 4.50 0.00 1.88 1.93 0.00 1.53 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.50 7.81 55 D 9.56 4.94 0.00 2.71 1.72 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 56 E 9.20 3.92 0.00 1.68 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 2.24 1.86 0.00 57 V 7.64 4.08 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 0.79 0.00 0.00 0.90 0.00 0.00 58 F 8.18 4.65 0.00 3.01 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 59 D 8.02 4.65 0.00 2.43 2.25 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 60 F 7.48 5.23 0.00 3.08 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 61 V 8.52 3.61 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 0.97 0.00 0.00 1.00 0.00 0.00 62 I 7.91 3.38 2.09 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.35 0.85 0.00 0.00 63 V 7.69 3.50 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 0.84 0.00 0.00 0.63 0.00 0.00 64 N 7.82 4.41 0.00 2.76 2.84 0.00 0.00 6.97 7.16 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 65 R 8.42 4.05 0.00 1.51 1.05 0.00 3.18 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.46 0.00 66 V 7.14 4.14 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 0.99 0.00 0.00 0.70 0.00 0.00 67 L 8.30 3.85 0.00 1.89 1.61 0.88 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.70 4.11 0.00 1.92 1.85 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.41 7.81 69 K 7.65 4.35 0.00 1.74 1.82 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.35 7.81 70 I 7.30 4.13 1.90 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.59 0.89 0.00 0.00 71 K 9.01 4.00 0.00 1.81 1.94 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.49 7.81 72 D 7.78 4.97 0.00 2.76 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 73 L 7.93 4.14 0.00 1.73 1.68 0.79 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.13 4.11 0.00 1.82 1.76 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.40 7.81 75 H 8.36 3.81 0.00 2.95 2.73 0.00 5.97 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.56 4.57 0.00 3.08 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 77 D 7.95 4.48 0.00 2.83 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 78 P 0.00 4.62 0.00 2.13 2.06 0.00 3.39 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 *80 I 8.02 3.97 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.61 0.82 0.00 0.00 81 E 8.46 4.58 0.00 1.91 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 2.27 2.23 0.00 82 K 9.13 4.69 0.00 1.63 1.39 0.00 1.24 0.00 0.00 1.51 0.00 0.00 3.17 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.99 1.35 7.81 83 I 9.61 4.69 1.96 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 1.28 0.71 0.97 0.00 0.00 84 F 10.11 5.01 0.00 3.24 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 85 D 7.80 4.20 0.00 2.33 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 86 E 8.35 4.67 0.00 1.92 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 2.12 2.27 0.00 87 K 8.83 4.15 0.00 1.79 2.28 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.27 1.43 7.81 88 G 7.51 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 89 K 8.58 4.30 0.00 1.66 1.71 0.00 1.86 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.33 7.81 90 E 9.45 3.63 0.00 2.42 2.73 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 2.32 2.40 0.00 *92 G 8.01 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 93 L 8.06 4.91 0.00 1.13 0.64 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 94 N 9.02 5.21 0.00 2.77 2.71 0.00 0.00 6.41 7.26 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 95 V 8.72 4.61 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 0.88 0.00 0.00 0.80 0.00 0.00 96 E 8.58 5.06 0.00 1.99 1.71 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 2.25 2.26 0.00 97 I 9.20 4.65 2.10 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 1.32 0.71 0.81 0.00 0.00 98 Q 9.03 4.69 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 7.03 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 99 I 9.02 4.10 1.37 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.42 0.66 0.00 0.00 100 N 8.27 5.00 0.00 3.02 2.97 0.00 0.00 6.99 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 0.00 101 P 0.00 4.55 0.00 2.04 2.06 0.00 3.84 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 102 E 8.15 4.03 0.00 2.16 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 0.00 2.29 2.38 0.00 103 V 7.80 4.20 2.09 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 1.06 0.00 0.00 0.78 0.00 0.00 104 K 8.48 3.93 0.00 1.77 1.76 0.00 1.95 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.52 7.81 105 D 8.98 4.61 0.00 2.94 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 F 8.59 4.25 0.00 3.17 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 0.00 107 F 8.41 6.17 0.00 3.14 2.94 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 0.00 0.00 0.00 108 T 8.71 5.18 4.30 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 1.28 0.00 0.00 109 F 9.55 5.43 0.00 3.08 3.05 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 0.00 0.00 0.00 0.00 110 K 8.21 4.88 0.00 1.65 1.51 0.00 1.50 0.00 0.00 1.47 0.00 0.00 2.72 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.25 1.27 7.81 111 S 8.91 4.88 0.00 3.77 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.76 4.77 1.93 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 1.20 0.69 0.88 0.00 0.00 113 S 9.01 5.23 0.00 3.05 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 0.00 114 T 9.03 4.69 4.29 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 1.21 0.00 0.00 115 T 7.48 3.46 4.29 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 1.26 0.00 0.00 116 N 8.10 4.78 0.00 2.69 2.86 0.00 0.00 6.84 7.61 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 0.00 117 K 7.22 4.50 0.00 1.99 1.96 0.00 1.29 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.38 7.81 118 Q 8.20 5.02 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.74 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 119 R 9.21 4.65 0.00 1.78 1.56 0.00 3.17 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 120 C 7.79 5.29 0.00 3.03 3.11 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 0.00 0.00 0.00 0.00 121 F 8.69 5.38 0.00 2.89 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 0.00 122 L 9.55 5.58 0.00 1.94 2.00 1.15 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 123 S 9.21 5.23 0.00 3.79 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 0.00 124 L 7.86 4.17 0.00 0.27 0.13 -0.32 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.80 3.72 0.00 1.78 1.88 0.00 3.01 0.00 0.00 3.11 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.54 0.00 126 G 8.12 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 0.00 127 E 7.83 4.36 0.00 2.13 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 2.36 0.00 128 T 8.38 5.24 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 0.00 129 R 8.96 4.74 0.00 1.46 1.55 0.00 2.21 0.00 0.00 2.62 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.35 0.00 130 E 8.98 4.36 0.00 2.02 1.80 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 2.07 1.95 0.00 131 I 8.89 4.59 1.85 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 1.07 1.11 0.97 0.00 0.00 132 L 8.60 3.88 0.00 1.54 1.51 0.86 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 133 C 8.61 4.26 0.00 3.03 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 0.00 134 D 7.46 4.54 0.00 2.72 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.73 4.46 0.00 3.00 3.24 0.00 0.00 5.94 6.90 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 0.00 136 K 7.91 3.88 0.00 1.88 1.85 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.45 7.81 137 L 7.53 3.99 0.00 1.46 1.41 0.84 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 138 Y 7.53 4.59 0.00 3.19 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 0.00 139 N 8.14 4.75 0.00 2.78 2.82 0.00 0.00 7.03 6.02 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 *141 L 7.89 3.73 0.00 1.86 1.61 0.22 -0.06 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 0.00 142 L 8.21 4.10 0.00 1.69 1.74 0.99 1.28 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 0.00 143 A 8.14 3.92 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 0.00 144 V 7.27 4.21 1.52 0.00 0.00 0.00 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 0.77 0.00 0.00 145 F 7.62 4.37 0.00 2.88 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 0.00 146 N 9.13 4.93 0.00 2.83 2.89 0.00 0.00 6.88 7.45 0.00 0.00 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 7.96 4.71 0.00 4.00 4.19 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 0.00 148 Y 8.15 3.94 0.00 2.82 2.90 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 0.00 0.00 0.00 149 D 6.77 4.19 0.00 2.64 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 0.00 0.00 0.00 0.00 150 P 0.00 3.60 0.00 2.16 2.14 0.00 3.63 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.99 0.00 151 N 7.99 4.55 0.00 2.81 2.86 0.00 0.00 6.60 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 0.00 152 D 8.61 4.75 0.00 2.59 2.42 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 0.00 153 L 7.77 3.96 0.00 1.73 1.74 0.94 0.41 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 0.00 154 L 7.81 3.93 0.00 1.75 1.83 0.93 0.37 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 0.00 155 K 7.91 3.85 0.00 1.95 1.80 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.46 7.81 156 H 7.75 4.46 0.00 3.50 3.50 0.00 5.90 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 0.00 157 I 8.25 3.72 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.99 0.95 0.00 0.00 158 S 8.01 4.11 0.00 3.99 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 0.00 159 T 7.74 3.94 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 1.22 0.00 0.00 160 V 7.83 3.60 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 1.22 0.00 0.00 0.89 0.00 0.00 161 E 8.31 4.10 0.00 2.07 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 0.00 2.56 2.49 0.00 162 S 7.92 4.18 0.00 3.91 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 L 8.05 4.07 0.00 1.94 1.99 0.90 0.41 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 0.00 164 K 8.06 3.86 0.00 1.86 1.77 0.00 1.90 0.00 0.00 1.37 0.00 0.00 2.72 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.04 1.68 7.81 165 K 7.78 4.03 0.00 2.03 2.03 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.15 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.61 7.81 166 I 7.90 3.86 2.07 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 1.41 0.39 0.93 0.00 0.00 167 F 8.54 3.87 0.00 3.11 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 0.00 168 Y 7.57 4.16 0.00 3.19 3.12 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 0.00 169 T 8.12 4.31 4.40 0.00 0.00 0.00 0.00 0.00 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 0.00 170 I 7.24 3.86 1.62 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.60 0.83 0.00 0.00 171 T 8.26 4.53 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 1.19 0.00 0.00 172 C 8.54 4.56 0.00 2.96 2.90 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 0.00 0.00 0.00 173 E 8.56 4.74 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 174 A 8.36 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 V 7.92 4.23 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 0.86 0.00 0.00 0.91 0.00 0.00 176 Y 8.65 4.18 0.00 2.98 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 * Residues marked with a * may have inaccurate shift predictions.