NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4043 8.3049 118.1873 54.7071 32.7130 174.6693 2 T 3.6804 8.0955 116.2354 63.3268 69.3350 170.2356 3 E 4.9338 9.2579 126.6253 54.6417 32.8698 174.6640 4 Y 4.7499 8.7528 121.4558 56.2700 40.8027 175.3531 5 K 4.7973 9.6542 126.2534 55.5729 32.8775 175.8012 6 L 5.0351 8.7493 125.8359 52.8116 44.5482 176.0159 7 V 4.6441 8.2273 122.0990 61.0703 34.7303 174.1933 8 V 4.6000 8.5982 128.1785 61.7383 32.8259 174.9986 9 V 4.5389 9.9661 120.8847 58.9298 35.9334 175.1812 10 G 4.0180 8.2894 109.4579 43.6388 0.0000 172.4376 11 A 4.3108 7.9329 123.0348 51.6013 18.9679 177.4628 12 G 3.6566 8.5147 109.1341 47.0326 0.0000 174.2695 13 G 3.9262 8.8545 110.7908 45.9098 0.0000 174.7611 14 V 3.7936 7.2832 111.8723 62.0586 32.0499 177.1159 15 G 4.2452 8.3026 109.3229 45.6625 0.0000 176.1010 16 K 3.9212 8.4671 120.7606 59.4063 32.0068 179.1289 17 S 4.2267 8.0256 114.6361 61.5071 62.8282 176.4014 18 A 3.9594 7.9580 123.0215 55.0473 18.1427 179.5722 19 L 3.9633 8.0113 117.4635 58.2488 41.6739 179.8377 20 T 3.6977 7.8194 115.3427 66.7675 68.3329 176.8167 21 I 3.3639 7.7696 121.8560 64.1880 37.0242 178.4927 22 Q 3.9865 7.9215 118.9055 58.8826 28.3580 178.6863 23 L 3.7528 7.4177 119.8291 57.9928 42.1117 178.8148 24 I 3.8459 7.5406 118.6115 63.9347 37.4813 177.6241 25 Q 4.3452 8.3173 115.3863 54.2898 30.3545 174.8945 26 N 4.3676 7.7629 118.3391 53.4211 37.6619 173.0807 27 H 4.6083 7.2507 109.6452 54.8085 31.2932 173.8187 28 F 4.5513 8.8487 124.6008 57.1875 39.4027 175.2395 29 V 3.6759 7.9269 128.9092 62.2187 31.7559 175.6384 30 D 4.5103 7.8064 128.2313 51.1286 40.5407 174.1825 31 E 4.6234 7.2633 117.2454 54.7301 32.5047 175.4437 32 Y 4.1433 8.5243 122.0208 57.8598 38.8566 175.7950 33 D 4.6933 7.8482 127.4400 51.6952 42.0231 172.0715 34 P 4.0594 0.0000 0.0000 63.0911 32.2884 176.3446 35 T 4.4372 8.2329 118.9910 62.8264 69.8732 174.0712 36 I 4.1355 7.8786 124.7269 61.2669 38.6180 175.7280 37 E 4.9197 7.2593 116.1475 55.8083 32.1561 174.3539 38 D 5.0942 8.7705 127.1729 52.3489 45.1519 175.0668 39 S 5.1482 8.2099 114.8774 56.7652 66.2103 172.7253 40 Y 4.7264 9.3102 119.9987 56.2543 41.3006 174.4897 41 R 5.1570 8.7563 122.6112 54.2842 32.7864 175.3078 42 K 4.6162 8.9009 124.4919 54.8529 36.0435 174.8558 43 Q 4.7448 8.7589 126.4711 55.7433 29.6264 175.5147 44 V 4.5739 9.0879 116.5165 59.8955 37.1960 174.1433 45 V 4.6965 8.3185 121.0967 61.4275 33.5766 174.7727 46 I 4.0391 8.3194 129.3961 60.2648 38.8373 175.7080 47 D 4.4243 9.6303 126.6135 55.3808 38.1395 175.1591 48 G 3.9130 8.4251 106.3490 45.2788 0.0000 173.4693 49 E 4.4253 7.8461 121.9554 54.7193 30.6709 174.7055 50 T 4.8169 8.4092 117.3074 61.6318 69.8252 173.5230 51 C 4.8450 9.2527 119.9440 57.0569 34.0064 172.2540 52 L 5.0495 8.7800 122.2678 53.3716 44.0130 175.0935 53 L 4.6374 8.9784 127.7968 54.1218 43.1014 175.5579 54 D 5.1928 9.1138 125.7587 52.8790 42.5624 174.5111 55 I 4.9032 9.0693 127.9023 59.4903 39.7379 174.6069 56 L 4.9605 8.8894 129.6294 53.4235 44.1521 174.4397 57 D 5.1011 9.4927 128.1285 53.4217 42.4654 175.9404 58 T 4.7281 7.8898 115.1419 59.9857 71.3406 173.8521 59 A 4.5487 8.4739 124.3708 51.3230 19.7651 177.8311 60 G 3.8735 8.6752 112.0926 47.5144 0.0000 175.2205 61 Q 4.0059 8.1072 121.2979 55.2049 28.5183 181.5551 62 E 3.9477 8.8360 121.1673 56.5887 28.7723 175.0895 *67 M 4.4932 8.5501 125.7612 53.9133 33.9300 175.9889 68 R 2.6361 7.6670 118.8575 61.7979 29.6130 183.5535 69 D 4.5164 7.9934 121.5622 58.0643 40.3653 179.8458 70 Q 4.0375 7.9423 120.3856 60.5921 27.8082 180.0913 71 Y 4.2690 7.4240 118.9420 59.7569 38.0249 177.7246 72 M 4.7020 8.0435 120.3803 58.1955 32.0899 178.2445 73 R 4.1182 8.0930 118.8511 59.2146 30.4035 177.9323 74 T 4.3813 7.5024 107.0877 61.6708 69.7482 175.4153 75 G 3.5493 7.4084 111.5132 45.6905 0.0000 173.3895 76 E 4.3630 8.8120 123.0581 57.7028 30.7726 176.9871 77 G 4.3007 7.4536 104.6273 44.5352 0.0000 171.7092 78 F 5.3581 9.1641 120.3358 55.2527 43.0997 173.9529 79 L 4.7888 8.9395 125.6789 53.9038 43.6321 175.1064 80 C 4.8814 9.0688 126.3876 58.6212 29.0585 173.0175 81 V 4.9694 8.6316 125.2955 61.1268 33.5965 174.5576 82 F 5.1359 8.7225 120.6572 55.3573 42.3273 172.7037 83 A 5.1327 8.8352 121.2827 49.9826 20.8811 178.0879 84 I 4.1024 8.7018 115.5570 62.4249 37.7662 176.8805 85 N 4.9579 8.0900 117.5241 52.4599 37.4557 174.8599 86 N 4.8596 8.3598 117.7395 51.5924 40.4929 174.3182 87 T 3.9645 8.1449 122.0171 66.3208 68.6598 175.9920 88 K 3.9978 8.1778 121.2004 59.6376 32.0549 178.7694 89 S 4.3694 8.1811 112.8615 61.4636 63.0052 175.8585 90 F 4.0528 8.0394 124.3292 61.1510 39.2456 177.1215 91 E 3.7597 8.4052 118.1869 59.2471 29.2608 179.0017 92 D 4.5490 8.4885 119.1036 56.8668 40.7991 178.4270 93 I 3.8272 7.4165 121.0786 64.9165 37.0939 177.2506 94 H 4.2137 7.6560 118.6119 58.8122 29.6083 177.0040 95 Q 3.8541 7.9912 119.3531 59.1564 28.4818 178.6652 96 Y 3.8476 7.8598 116.9706 61.0329 37.9756 178.2795 97 R 3.6981 8.0204 119.5021 59.5641 30.1146 178.3186 98 E 3.7826 8.0729 118.2540 59.4313 29.4176 179.2010 99 Q 3.8828 7.9902 119.5774 59.0222 29.0386 178.3386 100 I 3.4904 7.7546 121.0313 64.0797 37.1060 178.4952 101 K 4.0449 8.0001 120.8684 58.8209 31.3563 179.3357 102 R 3.8037 7.9117 118.8647 59.5059 29.7985 178.7928 103 V 3.6288 7.6172 116.7066 65.4503 31.6278 177.1960 104 K 4.3230 7.9948 115.1178 55.1941 32.5185 176.0844 105 D 4.4272 7.7160 117.1532 54.9677 38.9891 173.6088 106 S 4.6757 7.8637 110.6599 56.8163 65.7573 174.0721 107 D 4.5130 8.7523 126.0423 55.5089 41.2002 176.1200 108 D 4.8226 7.9406 117.6256 51.2852 41.0282 175.2342 109 V 4.4220 8.1424 123.0482 59.6626 34.7122 172.9430 110 P 4.4101 0.0000 0.0000 63.7219 32.0114 174.8055 111 M 5.4371 8.5011 122.9402 54.3749 35.6168 173.7938 112 V 4.5388 8.7151 123.3625 61.0491 35.4738 173.7464 113 L 4.9945 9.0104 130.0957 54.1225 43.7996 175.0592 114 V 4.5519 9.2940 127.0977 61.1093 34.2172 174.5243 115 G 3.3833 8.5339 116.3896 44.7245 0.0000 172.3996 116 N 5.0184 8.3233 126.2267 51.4011 41.7053 174.7259 117 K 4.1541 8.7294 117.1721 57.8408 28.9086 177.7512 118 C 4.3562 8.0370 113.2554 59.6524 29.2420 174.0466 119 D 4.4443 7.8022 120.4141 55.1981 39.7289 176.3618 120 L 4.2133 7.6474 120.0813 54.3688 42.2469 176.8804 121 A 4.1470 8.4586 124.4169 54.3289 19.6031 178.1899 122 A 4.3476 7.6721 119.7693 51.6739 17.5831 177.8921 123 R 4.2610 7.6624 122.2938 56.4902 31.1833 175.8547 124 T 4.3950 8.8180 114.0746 61.0167 70.4683 173.9826 125 V 4.0434 7.5087 121.6630 60.5753 32.8652 174.7879 126 E 4.1301 8.3212 127.4535 56.1486 30.3112 178.3683 127 S 4.2113 8.8045 118.8848 61.9193 62.8891 177.0628 128 R 3.9320 7.9443 120.7622 59.3333 29.7918 178.4342 129 Q 3.8534 7.7478 117.3417 58.9735 28.7297 178.7039 130 A 3.9114 7.4551 121.1519 54.9083 18.2606 179.2725 131 Q 3.7465 8.0923 118.4851 59.2986 29.1732 178.1543 132 D 4.2727 8.0488 119.8829 57.2318 40.9773 178.4354 133 L 3.5759 7.6704 120.3383 58.1221 42.0658 178.7236 134 A 4.0253 8.1562 120.9346 55.3669 18.0565 179.5819 135 R 3.9007 8.0012 116.6570 59.5507 30.2280 178.6759 136 S 4.2566 7.7732 113.1457 61.3559 63.2517 175.6104 137 Y 4.6843 7.8704 120.0779 58.4562 37.4805 176.5209 138 G 3.8264 8.2757 107.4788 46.1647 0.0000 172.9339 139 I 4.7581 7.5748 110.6290 57.6362 40.9490 172.9937 140 P 4.6407 0.0000 0.0000 62.7016 32.6835 174.6241 141 Y 5.4002 8.5666 123.0090 56.0556 41.3308 174.8428 142 I 4.3037 8.2416 126.4108 59.5132 41.3772 174.0267 143 E 4.7336 8.3648 126.4424 55.3670 30.7358 175.3274 144 T 4.8193 8.7502 113.1507 60.3193 73.5143 172.8329 145 S 4.4335 8.6610 115.8518 57.1614 64.6017 174.6411 146 A 4.0269 8.4060 130.3829 54.6509 18.6553 178.7503 147 K 2.5464 7.6902 116.7094 59.1480 32.1982 177.9607 148 T 3.9800 7.3793 106.3231 61.7263 69.2219 175.5920 149 R 3.9658 8.3445 122.2622 56.0136 29.7414 175.0685 150 Q 3.9241 7.6409 118.7681 57.5223 29.5272 177.3329 151 G 3.8513 8.8304 111.8091 46.2315 0.0000 175.2907 152 V 3.5613 7.1203 119.3657 66.3252 31.4839 177.6676 153 E 3.6042 7.8813 117.5371 59.0032 29.2772 178.6838 154 D 4.1894 7.9101 117.4341 57.2990 41.3494 178.0042 155 A 3.8640 8.1670 121.3210 55.3431 18.5051 179.6862 156 F 4.0874 8.0048 115.8108 60.9815 38.9266 177.6850 157 Y 4.3465 8.6747 116.8661 61.3540 37.5635 178.5433 158 T 3.8813 8.2311 116.8881 66.5208 68.5513 176.3883 159 L 3.9232 7.8237 121.8046 58.0712 42.0841 179.2343 160 V 3.2419 7.6007 117.9135 66.0183 31.2116 178.3201 161 R 3.9092 7.9315 116.7276 59.1409 29.9791 178.6154 162 E 4.1496 8.3336 118.8084 59.4000 29.4056 179.3963 163 I 3.8004 7.7570 119.9647 64.4315 36.9440 178.6830 164 R 4.1061 7.9589 117.9957 58.5980 29.9439 178.0381 165 Q 4.4849 7.3974 115.1969 55.8300 29.3124 175.1225 166 H 4.3690 7.9935 125.2195 56.3739 29.9156 174.6373 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 1 M 8.30 4.40 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 2 T 8.10 3.68 4.05 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 0.45 0.00 0.00 3 E 9.26 4.93 0.00 1.71 1.76 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 2.15 2.38 0.00 4 Y 8.75 4.75 0.00 2.89 2.82 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 5 K 9.65 4.80 0.00 1.65 1.75 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.50 7.81 6 L 8.75 5.04 0.00 1.67 1.58 1.12 0.52 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 7 V 8.23 4.64 1.82 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 0.97 0.00 0.00 0.77 0.00 0.00 8 V 8.60 4.60 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 0.86 0.00 0.00 1.03 0.00 0.00 9 V 9.97 4.54 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 0.94 0.00 0.00 0.95 0.00 0.00 10 G 8.29 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 0.00 0.00 0.00 0.00 11 A 7.93 4.31 1.44 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 12 G 8.51 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 13 G 8.85 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.28 3.79 2.10 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 0.79 0.00 0.00 0.95 0.00 0.00 15 G 8.30 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 0.00 0.00 0.00 0.00 16 K 8.47 3.92 0.00 1.80 1.86 0.00 1.79 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.51 7.81 17 S 8.03 4.23 0.00 3.84 3.90 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 18 A 7.96 3.96 1.40 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 0.00 0.00 0.00 19 L 8.01 3.96 0.00 1.96 1.89 0.83 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.82 3.70 4.20 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 0.77 0.00 0.00 21 I 7.77 3.36 1.77 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 1.31 0.74 0.69 0.00 0.00 22 Q 7.92 3.99 0.00 2.35 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.69 0.00 23 L 7.42 3.75 0.00 1.22 1.37 0.67 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.54 3.85 1.57 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.55 0.90 0.00 0.00 25 Q 8.32 4.35 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.64 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 26 N 7.76 4.37 0.00 2.81 2.80 0.00 0.00 6.95 7.92 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 27 H 7.25 4.61 0.00 3.23 3.21 0.00 5.77 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.85 4.55 0.00 2.89 3.06 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 29 V 7.93 3.68 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 0.71 0.00 0.00 0.81 0.00 0.00 30 D 7.81 4.51 0.00 2.14 2.38 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 31 E 7.26 4.62 0.00 2.09 1.83 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 2.11 2.26 0.00 32 Y 8.52 4.14 0.00 2.96 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 33 D 7.85 4.69 0.00 2.58 2.44 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 34 P 0.00 4.06 0.00 2.01 1.88 0.00 3.61 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.35 0.00 35 T 8.23 4.44 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 1.23 0.00 0.00 36 I 7.88 4.14 1.88 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 1.32 0.56 0.93 0.00 0.00 37 E 7.26 4.92 0.00 1.94 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 2.04 2.17 0.00 38 D 8.77 5.09 0.00 2.61 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 0.00 0.00 0.00 0.00 39 S 8.21 5.15 0.00 3.75 3.71 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 40 Y 9.31 4.73 0.00 2.79 2.82 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 41 R 8.76 5.16 0.00 1.66 1.83 0.00 3.15 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 42 K 8.90 4.62 0.00 1.83 1.57 0.00 1.51 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.45 7.81 43 Q 8.76 4.74 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 44 V 9.09 4.57 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 0.73 0.00 0.00 0.92 0.00 0.00 45 V 8.32 4.70 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 0.85 0.00 0.00 0.92 0.00 0.00 46 I 8.32 4.04 1.65 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.61 0.40 0.00 0.00 47 D 9.63 4.42 0.00 2.75 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 48 G 8.43 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 49 E 7.85 4.43 0.00 2.04 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 2.26 0.00 50 T 8.41 4.82 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 51 C 9.25 4.85 0.00 3.18 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 52 L 8.78 5.05 0.00 1.74 1.52 0.94 1.09 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 53 L 8.98 4.64 0.00 1.87 1.62 1.03 0.89 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 54 D 9.11 5.19 0.00 2.72 2.57 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 55 I 9.07 4.90 1.99 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.47 1.06 0.00 0.00 56 L 8.89 4.96 0.00 1.69 1.43 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 57 D 9.49 5.10 0.00 2.99 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 58 T 7.89 4.73 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 0.44 0.00 0.00 59 A 8.47 4.55 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.68 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 0.00 0.00 0.00 61 Q 8.11 4.01 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 7.08 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 62 E 8.84 3.95 0.00 1.98 1.83 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 2.23 1.88 0.00 *67 M 8.55 4.49 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.11 0.00 68 R 7.67 2.64 0.00 1.81 1.96 0.00 3.25 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.00 69 D 7.99 4.52 0.00 2.65 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 70 Q 7.94 4.04 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.00 0.00 71 Y 7.42 4.27 0.00 3.20 3.30 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 72 M 8.04 4.70 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.82 0.00 73 R 8.09 4.12 0.00 1.97 2.14 0.00 3.26 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 74 T 7.50 4.38 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 75 G 7.41 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 E 8.81 4.36 0.00 2.00 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 0.00 2.32 2.26 0.00 77 G 7.45 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 0.00 0.00 0.00 0.00 78 F 9.16 5.36 0.00 3.04 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 79 L 8.94 4.79 0.00 1.58 1.42 0.61 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 80 C 9.07 4.88 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 81 V 8.63 4.97 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 0.89 0.00 0.00 0.89 0.00 0.00 82 F 8.72 5.14 0.00 3.15 3.20 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 83 A 8.84 5.13 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 84 I 8.70 4.10 1.92 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 1.33 1.24 0.91 0.00 0.00 85 N 8.09 4.96 0.00 2.95 2.92 0.00 0.00 5.77 8.04 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 86 N 8.36 4.86 0.00 2.84 2.81 0.00 0.00 7.22 6.76 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 87 T 8.14 3.96 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 88 K 8.18 4.00 0.00 1.88 1.88 0.00 1.78 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.74 1.55 7.81 89 S 8.18 4.37 0.00 4.24 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 0.00 90 F 8.04 4.05 0.00 2.81 3.20 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 91 E 8.41 3.76 0.00 2.18 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 2.36 2.70 0.00 92 D 8.49 4.55 0.00 3.02 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 93 I 7.42 3.83 1.80 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.04 1.04 0.00 0.00 94 H 7.66 4.21 0.00 3.28 3.31 0.00 5.84 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 95 Q 7.99 3.85 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 96 Y 7.86 3.85 0.00 3.23 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 97 R 8.02 3.70 0.00 1.59 1.76 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.30 0.00 98 E 8.07 3.78 0.00 1.98 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 2.19 2.13 0.00 99 Q 7.99 3.88 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 100 I 7.75 3.49 1.70 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 0.94 0.41 0.15 0.00 0.00 101 K 8.00 4.04 0.00 1.84 1.84 0.00 1.50 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.28 7.81 102 R 7.91 3.80 0.00 1.91 2.01 0.00 3.05 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 103 V 7.62 3.63 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 0.94 0.00 0.00 0.96 0.00 0.00 104 K 7.99 4.32 0.00 1.81 1.85 0.00 2.20 0.00 0.00 1.80 0.00 0.00 3.20 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.62 7.81 105 D 7.72 4.43 0.00 2.82 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 0.00 106 S 7.86 4.68 0.00 3.84 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 0.00 107 D 8.75 4.51 0.00 2.71 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 0.00 108 D 7.94 4.82 0.00 2.78 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 0.00 109 V 8.14 4.42 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 1.07 0.00 0.00 0.93 0.00 0.00 110 P 0.00 4.41 0.00 2.31 2.04 0.00 3.80 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 2.16 2.10 0.00 111 M 8.50 5.44 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 112 V 8.72 4.54 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 0.95 0.00 0.00 0.94 0.00 0.00 113 L 9.01 4.99 0.00 2.09 2.01 1.28 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.29 4.55 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 0.71 0.00 0.00 0.78 0.00 0.00 115 G 8.53 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 0.00 0.00 0.00 116 N 8.32 5.02 0.00 2.69 2.56 0.00 0.00 7.11 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 0.00 117 K 8.73 4.15 0.00 2.01 1.91 0.00 2.18 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.35 7.81 118 C 8.04 4.36 0.00 3.03 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 0.00 119 D 7.80 4.44 0.00 2.76 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 0.00 120 L 7.65 4.21 0.00 1.73 1.63 0.94 0.58 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 0.00 121 A 8.46 4.15 1.27 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 0.00 122 A 7.67 4.35 1.28 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 0.00 0.00 0.00 123 R 7.66 4.26 0.00 1.79 1.84 0.00 3.18 0.00 0.00 3.41 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 124 T 8.82 4.39 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 1.28 0.00 0.00 125 V 7.51 4.04 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 -0.10 0.00 0.00 0.87 0.00 0.00 126 E 8.32 4.13 0.00 1.97 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 2.36 2.27 0.00 127 S 8.80 4.21 0.00 3.91 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 0.00 128 R 7.94 3.93 0.00 1.85 1.88 0.00 3.16 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 129 Q 7.75 3.85 0.00 1.96 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 130 A 7.46 3.91 0.54 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 0.00 0.00 131 Q 8.09 3.75 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 132 D 8.05 4.27 0.00 2.81 2.64 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 0.00 133 L 7.67 3.58 0.00 1.67 1.71 0.36 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 134 A 8.16 4.03 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.00 3.90 0.00 1.92 2.09 0.00 3.27 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 136 S 7.77 4.26 0.00 4.04 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 0.00 137 Y 7.87 4.68 0.00 3.23 2.93 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 0.00 0.00 0.00 138 G 8.28 3.83 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 0.00 0.00 0.00 139 I 7.57 4.76 2.20 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.96 1.06 0.00 0.00 140 P 0.00 4.64 0.00 2.14 2.04 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 141 Y 8.57 5.40 0.00 2.95 3.04 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 0.00 142 I 8.24 4.30 1.69 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 1.12 0.54 0.74 0.00 0.00 143 E 8.36 4.73 0.00 1.67 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 1.94 2.02 0.00 144 T 8.75 4.82 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 1.08 0.00 0.00 145 S 8.66 4.43 0.00 3.78 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 0.00 146 A 8.41 4.03 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.69 2.55 0.00 0.79 1.38 0.00 1.46 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.01 0.45 7.81 148 T 7.38 3.98 4.15 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 1.09 0.00 0.00 149 R 8.34 3.97 0.00 1.96 2.09 0.00 3.18 0.00 0.00 3.06 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.49 0.00 150 Q 7.64 3.92 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.60 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 151 G 8.83 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 0.00 152 V 7.12 3.56 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 1.08 0.00 0.00 0.91 0.00 0.00 153 E 7.88 3.60 0.00 1.68 1.12 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 2.09 2.17 0.00 154 D 7.91 4.19 0.00 2.61 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 0.00 0.00 0.00 155 A 8.17 3.86 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 0.00 156 F 8.00 4.09 0.00 3.07 3.16 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 0.00 0.00 0.00 0.00 157 Y 8.67 4.35 0.00 2.99 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 0.00 158 T 8.23 3.88 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 1.22 0.00 0.00 159 L 7.82 3.92 0.00 1.73 1.85 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 160 V 7.60 3.24 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 0.14 0.00 0.00 0.79 0.00 0.00 161 R 7.93 3.91 0.00 1.94 1.97 0.00 3.24 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 162 E 8.33 4.15 0.00 2.19 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 0.00 2.54 2.53 0.00 163 I 7.76 3.80 2.01 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.34 1.11 0.00 0.00 164 R 7.96 4.11 0.00 2.01 2.04 0.00 3.10 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.81 0.00 165 Q 7.40 4.48 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 166 H 7.99 4.37 0.00 3.29 3.33 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 * Residues marked with a * may have inaccurate shift predictions.