NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 I 4.1350 8.0244 120.7973 60.9484 37.9640 173.5305 29 Y 4.6040 8.3434 127.4116 54.7884 40.9865 173.1336 30 A 4.2859 8.9734 131.5483 50.3615 20.2928 175.9411 31 E 3.7238 8.3832 122.6048 55.6003 29.8503 176.4094 32 P 4.4670 0.0000 0.0000 64.7727 31.7333 176.4781 33 E 4.6622 7.2277 116.9375 54.3921 31.1227 175.7356 34 N 4.7273 8.4801 119.5949 53.6485 39.1410 174.3091 35 F 4.9707 8.7652 115.2611 56.2185 41.9156 173.1757 36 L 4.6312 8.4319 121.5747 54.4406 44.5921 173.9619 37 E 4.8373 9.4321 127.0294 54.6304 32.0855 175.1041 38 I 5.0952 8.2156 123.2045 59.6386 41.5407 173.4330 39 E 4.9979 9.2277 127.9326 54.7395 33.7386 173.7246 40 V 5.0944 9.2134 125.3414 61.8319 33.6876 174.2676 41 H 4.7037 9.5546 123.6737 56.0441 31.7248 171.8006 42 N 4.1439 8.6670 111.6462 54.4831 36.9155 173.4045 43 P 4.4079 0.0000 0.0000 62.9671 32.8531 176.2642 44 K 4.5190 8.3365 118.8242 55.2738 36.7595 175.0740 45 T 4.7888 8.2483 120.5730 62.1561 70.3725 173.6099 46 H 4.7224 8.5771 122.6307 54.0054 32.9083 173.2053 47 I 4.1721 7.8036 121.4941 58.9973 37.6646 174.8076 48 P 4.1291 0.0000 0.0000 65.8657 31.6857 177.2115 49 N 4.4858 8.0817 114.2265 52.8405 37.8684 176.0956 50 G 3.9359 8.3354 107.3217 46.4227 0.0000 173.7159 51 M 4.5040 9.3040 118.5018 56.0369 34.0462 175.4967 52 D 4.9699 7.8458 115.8734 50.9483 42.8918 176.1326 53 S 4.2559 8.4545 112.2908 59.1291 62.9669 173.9039 54 K 4.0977 7.7101 124.2605 58.1308 32.0166 176.8537 55 G 4.0136 9.0284 113.9002 45.4840 0.0000 172.6896 56 M 4.3471 7.7949 119.6752 56.4327 32.6013 175.4533 57 F 5.4229 8.5424 118.6517 56.4894 41.9951 172.7482 58 T 5.1918 9.0518 116.3145 61.9143 70.8484 173.3588 59 D 5.4619 8.8641 123.9034 52.0072 43.5927 173.8429 60 Y 5.0846 9.6999 116.2241 56.2185 42.4679 174.1690 61 E 4.9947 9.2156 123.0542 55.2580 31.7535 174.6942 62 I 4.9541 9.1836 128.5154 59.7198 39.6132 174.2616 63 I 4.9520 8.6569 127.7216 59.2985 40.7408 173.7686 64 C 5.3686 9.2327 128.6380 57.8214 35.5108 172.5631 65 R 5.1526 8.9267 124.1828 54.8033 33.0628 174.5670 66 T 4.1485 8.7645 117.2080 61.1877 71.4557 173.2579 67 N 4.8718 7.3119 117.3767 51.8431 38.9201 174.5392 68 L 4.0777 7.3219 119.6952 54.1965 42.1159 176.5471 69 P 4.3760 0.0000 0.0000 65.5658 31.3301 177.8594 70 S 4.1817 8.1181 114.5027 60.8673 63.0766 174.5527 71 F 4.3072 8.0235 117.6980 57.1135 39.5491 175.3204 72 H 4.8594 9.2272 119.5996 55.7540 29.3963 174.9317 73 K 4.6154 7.5001 116.9487 55.4946 35.3873 175.9233 74 R 4.3624 8.6927 120.2353 58.4527 31.1317 176.0247 75 V 5.0391 7.7923 117.9669 60.9372 33.6531 174.5949 76 S 4.8732 9.1930 122.7410 56.4277 66.0514 173.2362 77 K 5.0087 8.6958 121.5254 54.9533 34.9035 175.6773 78 V 4.6340 8.8680 117.5917 59.5888 36.5194 174.6845 79 R 5.2642 8.4808 119.7642 54.8769 32.9374 175.7946 80 R 4.9205 9.5982 121.2949 54.7205 34.9656 175.1930 81 R 5.0464 9.5212 121.6834 55.4878 31.7696 177.2536 82 Y 4.2580 9.1269 120.7671 61.1379 38.7089 178.6741 83 S 4.7001 8.3511 115.7798 60.7205 63.1020 176.1361 84 D 4.6205 8.3319 123.0609 57.5272 40.5586 178.4559 85 F 3.8795 8.4196 117.7666 60.5619 38.7390 177.3871 86 E 3.7604 8.1482 118.1802 59.3172 29.0414 179.2717 87 F 4.3896 8.4354 119.7764 61.3595 39.6053 176.4933 88 F 4.2783 8.7294 119.5201 61.3460 39.1607 176.7566 89 R 3.7523 8.0307 118.4259 59.0082 29.8074 178.8963 90 K 4.0920 7.4248 114.1439 57.2491 31.6610 178.3121 *92 L 4.0251 7.7861 122.6716 55.1442 43.5602 178.8984 93 I 3.6513 7.6517 117.9678 64.2030 37.0588 178.1235 94 K 4.0478 8.1060 120.4735 59.3055 32.1655 178.4523 95 E 3.8813 8.0547 119.1292 59.4534 29.0572 178.4122 96 I 3.7782 8.0521 120.1830 64.8066 36.8934 178.3146 97 S 4.1484 7.8081 113.5239 61.3850 62.0297 175.6128 98 M 4.3457 7.7720 119.3306 56.6117 31.8527 176.7964 99 L 4.3211 7.2064 117.3658 53.6934 42.4345 176.1272 100 N 4.0959 7.5585 114.2272 55.1877 37.6612 174.0404 101 H 5.0395 7.2847 112.8374 54.2471 30.2233 173.7792 102 P 4.3477 0.0000 0.0000 64.3609 31.2772 176.7890 103 K 4.5229 7.7786 116.3185 55.9432 33.8463 176.2703 104 V 4.0061 7.7329 119.6393 61.0061 32.3769 175.5008 105 M 4.6897 8.3431 122.0078 53.3972 34.8763 175.0292 106 V 4.1758 8.0188 121.6574 60.0393 33.1412 173.9880 107 P 4.3880 0.0000 0.0000 62.7456 31.8133 175.8188 108 H 4.6059 8.0102 115.4015 55.1369 29.3964 175.1547 109 L 3.6934 8.0526 120.7871 53.3355 42.2780 175.4346 110 P 4.2897 0.0000 0.0000 66.7306 30.8838 175.5422 111 G 4.0476 7.5303 102.1531 42.3919 0.0000 173.6173 112 K 3.9723 8.1550 122.1866 56.1986 32.7948 176.6468 113 I 4.5972 7.5019 120.7662 58.8395 41.1946 175.4108 114 L 4.0142 8.3977 123.6412 55.8390 40.9777 177.6361 115 L 3.6829 8.5687 125.9197 58.1582 42.9992 177.9617 116 S 3.9767 8.2286 111.7568 61.6786 62.4747 175.4640 117 N 4.3230 8.9056 126.2674 55.8681 37.7937 177.5531 118 R 3.4332 7.2846 118.3827 58.7720 29.9582 176.6944 119 F 4.9945 7.7571 113.6265 57.0881 39.6142 176.2072 120 S 4.5763 8.5364 117.9574 57.7724 65.2148 173.6905 121 N 4.1722 8.7626 119.8399 57.2705 38.5585 176.2229 122 E 3.8853 8.2134 119.6476 59.6022 29.6804 179.4341 123 V 3.5878 7.4249 117.6385 66.0457 31.5582 178.1660 124 I 3.8656 7.8361 119.6861 64.2096 36.9185 178.1072 125 E 3.9643 8.5027 120.4986 59.3111 29.4831 178.5301 126 E 3.9457 8.3276 119.4345 59.2482 29.6697 178.7180 127 R 3.7872 8.0474 118.8813 59.1547 30.0606 178.3781 128 R 3.6611 8.2622 118.7018 59.6589 30.1752 178.4733 129 Q 4.1546 8.2704 117.8545 58.9137 28.6163 179.2047 130 G 3.6225 8.2078 106.8137 47.8579 0.0000 175.8120 131 L 3.8262 8.1730 122.0814 57.1432 41.5127 179.0335 132 N 4.3619 8.5511 117.4580 57.1423 39.0798 176.9992 133 T 3.9101 8.0026 116.9561 66.3703 68.5818 176.3852 134 W 4.0752 8.4717 130.3240 60.7335 30.6866 177.6777 135 M 4.1940 8.7767 118.4605 58.9366 31.8230 178.2299 136 Q 4.0252 8.3089 118.2161 58.8035 28.5812 178.8075 137 S 3.9941 7.6726 113.2978 61.1988 62.6363 176.1176 138 V 3.4143 7.4113 120.6252 65.9203 31.0870 177.8085 139 A 4.3152 8.1823 118.7261 53.9128 18.3043 178.6257 140 G 3.9763 7.4056 102.3260 43.8385 0.0000 173.0022 141 H 4.4271 7.6651 122.5387 54.6148 30.4977 173.5711 142 P 4.2218 0.0000 0.0000 66.1376 31.1400 178.4081 143 L 4.0167 8.0102 116.7865 57.8167 41.5123 179.5458 144 L 3.9884 7.9027 118.5207 57.8229 41.4550 179.3211 145 Q 4.1298 8.2983 117.6623 58.4667 28.6586 178.2061 146 S 4.5928 7.8957 113.9516 59.7080 63.9788 175.7719 147 G 4.1610 8.1114 106.3139 43.4392 0.0000 173.7220 148 S 4.7933 7.7524 118.1058 56.6277 63.0396 174.5193 149 K 3.8775 8.9872 130.4589 59.4649 31.9358 179.5224 150 V 3.7760 8.2819 118.1054 66.0363 31.4020 177.6348 151 L 4.1808 8.1236 120.0581 58.1522 41.9666 179.1850 152 V 3.0260 7.2153 117.7761 65.7538 31.4413 177.8721 153 R 3.9224 7.9455 118.4893 59.5652 29.7205 178.1713 154 F 3.5106 8.0412 119.1587 61.0918 39.2073 176.7376 155 I 3.8181 7.4266 117.7459 63.0119 37.1000 177.0803 156 E 4.4189 7.9634 117.8468 56.5728 31.1084 176.8108 157 A 4.1444 7.4115 120.7501 51.8785 19.2157 176.9841 158 E 4.0851 8.9798 122.8721 58.5854 29.9433 177.3541 159 K 4.6523 7.7802 115.7291 54.6405 35.2264 175.3406 160 F 4.5004 9.0266 125.7110 60.4932 40.2602 175.8262 161 V 3.7316 8.0636 122.6803 61.7172 31.0213 170.4218 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 28 I 8.02 4.13 1.90 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 1.33 1.38 0.95 0.00 0.00 29 Y 8.34 4.60 0.00 2.91 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 30 A 8.97 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.38 3.72 0.00 2.22 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 32 P 0.00 4.47 0.00 2.06 2.14 0.00 3.66 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 2.13 2.13 0.00 33 E 7.23 4.66 0.00 2.16 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 2.29 2.28 0.00 34 N 8.48 4.73 0.00 2.71 2.70 0.00 0.00 6.77 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 35 F 8.77 4.97 0.00 3.05 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.43 4.63 0.00 1.37 1.46 0.52 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 37 E 9.43 4.84 0.00 1.98 1.85 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 2.26 2.37 0.00 38 I 8.22 5.10 1.88 0.00 0.00 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 1.31 1.01 0.95 0.00 0.00 39 E 9.23 5.00 0.00 2.05 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.47 0.00 40 V 9.21 5.09 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 1.03 0.00 0.00 1.18 0.00 0.00 41 H 9.55 4.70 0.00 3.28 3.58 0.00 5.48 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.67 4.14 0.00 2.39 2.74 0.00 0.00 6.85 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 43 P 0.00 4.41 0.00 2.01 1.94 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 44 K 8.34 4.52 0.00 1.57 1.43 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.26 1.52 7.81 45 T 8.25 4.79 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 0.90 0.00 0.00 46 H 8.58 4.72 0.00 2.21 2.90 0.00 5.56 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 7.80 4.17 1.81 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.03 0.89 0.00 0.00 48 P 0.00 4.13 0.00 2.12 2.20 0.00 3.71 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 49 N 8.08 4.49 0.00 2.82 2.94 0.00 0.00 6.01 7.00 0.00 0.00 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 G 8.34 3.94 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 0.00 51 M 9.30 4.50 0.00 1.94 2.19 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.42 0.00 52 D 7.85 4.97 0.00 2.76 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 53 S 8.45 4.26 0.00 3.98 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 54 K 7.71 4.10 0.00 1.78 1.85 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.42 7.81 55 G 9.03 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 56 M 7.79 4.35 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 1.47 0.00 57 F 8.54 5.42 0.00 3.32 3.33 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 58 T 9.05 5.19 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 0.91 0.00 0.00 59 D 8.86 5.46 0.00 3.01 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 60 Y 9.70 5.08 0.00 3.16 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 61 E 9.22 4.99 0.00 2.12 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 2.35 2.47 0.00 62 I 9.18 4.95 1.79 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 1.07 0.60 0.95 0.00 0.00 63 I 8.66 4.95 2.08 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 1.13 1.66 0.88 0.00 0.00 64 C 9.23 5.37 0.00 2.98 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 65 R 8.93 5.15 0.00 1.86 1.96 0.00 3.23 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 66 T 8.76 4.15 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 67 N 7.31 4.87 0.00 2.64 2.45 0.00 0.00 6.05 7.79 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 68 L 7.32 4.08 0.00 1.77 1.69 0.82 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.38 0.00 2.18 2.19 0.00 3.76 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 70 S 8.12 4.18 0.00 4.03 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 71 F 8.02 4.31 0.00 3.06 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 72 H 9.23 4.86 0.00 3.14 3.33 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 K 7.50 4.62 0.00 1.85 1.77 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.48 7.81 74 R 8.69 4.36 0.00 1.93 1.97 0.00 3.20 0.00 0.00 3.27 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 75 V 7.79 5.04 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 0.92 0.00 0.00 0.96 0.00 0.00 76 S 9.19 4.87 0.00 3.97 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.70 5.01 0.00 1.62 1.76 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.46 7.81 78 V 8.87 4.63 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 0.84 0.00 0.00 0.74 0.00 0.00 79 R 8.48 5.26 0.00 1.70 1.89 0.00 3.19 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 80 R 9.60 4.92 0.00 1.52 1.50 0.00 2.83 0.00 0.00 2.94 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.56 0.00 81 R 9.52 5.05 0.00 2.17 2.07 0.00 3.11 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.49 0.00 82 Y 9.13 4.26 0.00 3.14 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 83 S 8.35 4.70 0.00 4.19 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.33 4.62 0.00 3.21 3.01 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 0.00 0.00 0.00 85 F 8.42 3.88 0.00 2.78 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 86 E 8.15 3.76 0.00 2.23 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 2.15 1.99 0.00 87 F 8.44 4.39 0.00 3.07 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 F 8.73 4.28 0.00 1.95 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 89 R 8.03 3.75 0.00 1.83 1.93 0.00 3.15 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 90 K 7.42 4.09 0.00 1.89 1.77 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.44 7.81 *92 L 7.79 4.03 0.00 0.98 1.39 0.78 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.65 3.65 2.01 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 0.66 0.87 0.00 0.00 94 K 8.11 4.05 0.00 1.79 1.74 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.42 7.81 95 E 8.05 3.88 0.00 2.04 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 0.00 2.37 2.40 0.00 96 I 8.05 3.78 2.01 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.08 0.88 0.00 0.00 97 S 7.81 4.15 0.00 3.82 3.98 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 98 M 7.77 4.35 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.56 0.00 99 L 7.21 4.32 0.00 1.69 1.66 0.98 0.96 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 0.00 100 N 7.56 4.10 0.00 2.79 2.69 0.00 0.00 6.83 7.77 0.00 0.00 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 H 7.28 5.04 0.00 3.28 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.35 0.00 2.16 2.17 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 103 K 7.78 4.52 0.00 1.72 1.83 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.38 7.81 104 V 7.73 4.01 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 0.68 0.00 0.00 0.76 0.00 0.00 105 M 8.34 4.69 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.46 0.00 106 V 8.02 4.18 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 0.84 0.00 0.00 0.80 0.00 0.00 107 P 0.00 4.39 0.00 2.31 2.01 0.00 3.59 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 108 H 8.01 4.61 0.00 3.30 3.39 0.00 5.53 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 8.05 3.69 0.00 1.39 1.24 0.31 -0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.29 0.00 2.14 2.20 0.00 3.37 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.90 0.00 111 G 7.53 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 0.00 0.00 0.00 0.00 112 K 8.16 3.97 0.00 1.73 1.70 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.19 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.54 7.81 113 I 7.50 4.60 1.65 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.68 0.79 0.00 0.00 114 L 8.40 4.01 0.00 1.78 1.77 0.91 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.57 3.68 0.00 1.59 1.74 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.23 3.98 0.00 3.91 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 0.00 117 N 8.91 4.32 0.00 2.84 3.09 0.00 0.00 5.54 7.66 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 0.00 118 R 7.28 3.43 0.00 1.63 1.94 0.00 2.95 0.00 0.00 2.96 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 119 F 7.76 4.99 0.00 3.14 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 0.00 120 S 8.54 4.58 0.00 4.03 4.01 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 0.00 0.00 0.00 121 N 8.76 4.17 0.00 2.86 2.83 0.00 0.00 6.51 7.65 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 0.00 122 E 8.21 3.89 0.00 2.08 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 0.00 2.39 2.40 0.00 123 V 7.42 3.59 2.30 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 0.91 0.00 0.00 0.94 0.00 0.00 124 I 7.84 3.87 2.04 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 1.77 0.77 1.01 0.00 0.00 125 E 8.50 3.96 0.00 2.11 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 0.00 2.33 2.39 0.00 126 E 8.33 3.95 0.00 2.08 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 2.29 2.31 0.00 127 R 8.05 3.79 0.00 1.85 2.02 0.00 3.17 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.49 0.00 128 R 8.26 3.66 0.00 2.29 2.20 0.00 3.31 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.94 0.00 129 Q 8.27 4.15 0.00 2.32 2.16 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 2.41 2.57 0.00 130 G 8.21 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 0.00 0.00 0.00 131 L 8.17 3.83 0.00 1.47 1.22 -0.26 -0.68 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 0.00 132 N 8.55 4.36 0.00 3.07 3.02 0.00 0.00 7.21 6.79 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 0.00 133 T 8.00 3.91 4.45 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 1.26 0.00 0.00 134 W 8.47 4.08 0.00 3.50 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 0.00 135 M 8.78 4.19 0.00 2.37 2.57 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.91 0.00 136 Q 8.31 4.03 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.57 2.64 0.00 137 S 7.67 3.99 0.00 3.83 3.94 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 0.00 138 V 7.41 3.41 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 -0.34 0.00 0.00 139 A 8.18 4.32 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 0.00 140 G 7.41 3.98 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 0.00 0.00 0.00 141 H 7.67 4.43 0.00 3.06 3.19 0.00 5.63 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.22 0.00 2.12 2.09 0.00 3.31 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 143 L 8.01 4.02 0.00 1.68 1.58 0.80 0.59 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 0.00 144 L 7.90 3.99 0.00 1.80 1.70 0.81 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 8.30 4.13 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 146 S 7.90 4.59 0.00 4.00 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 0.00 147 G 8.11 4.16 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 0.00 0.00 0.00 148 S 7.75 4.79 0.00 3.89 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 0.00 149 K 8.99 3.88 0.00 1.94 1.84 0.00 1.74 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.58 7.81 150 V 8.28 3.78 2.30 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 1.37 0.00 0.00 1.10 0.00 0.00 151 L 8.12 4.18 0.00 1.88 1.87 1.12 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 152 V 7.22 3.03 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 0.52 0.00 0.00 0.21 0.00 0.00 153 R 7.95 3.92 0.00 2.03 2.32 0.00 3.22 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.78 0.00 154 F 8.04 3.51 0.00 1.84 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 0.00 155 I 7.43 3.82 2.13 0.00 0.00 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 1.57 0.84 1.07 0.00 0.00 156 E 7.96 4.42 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 157 A 7.41 4.14 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 0.00 158 E 8.98 4.09 0.00 1.94 2.00 0.00 0.00 0.00 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 2.34 0.00 159 K 7.78 4.65 0.00 1.74 1.67 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.32 7.81 160 F 9.03 4.50 0.00 2.86 3.19 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 0.00 161 V 8.06 3.73 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 0.51 0.00 0.00 0.82 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.