NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 38 V 3.9883 8.0544 120.3857 62.7215 32.1023 174.3032 39 Q 4.1857 8.4659 128.9453 54.1198 30.1017 172.9500 40 S 4.7850 8.0709 118.0415 56.7221 66.8348 172.4163 41 S 4.7377 8.3249 117.0789 56.6366 65.7514 173.4343 42 V 4.5275 8.2584 121.3917 61.2361 33.9932 174.7850 43 S 4.7341 8.4197 119.0051 56.5441 65.3666 172.9232 44 W 5.0678 8.5015 135.0000 54.8811 33.6649 172.6193 45 P 3.0283 0.0000 0.0000 61.7807 31.8374 175.5447 46 Q 4.3942 7.3730 117.2387 55.5791 32.0548 175.6280 47 N 4.0378 9.7795 118.2640 54.4363 36.1080 175.3544 48 G 3.8374 8.4176 103.8153 45.5809 0.0000 173.8809 49 S 4.7223 7.6707 113.8342 56.2476 64.6035 174.1720 50 L 4.2401 8.2885 125.5810 55.1844 42.7745 176.1081 51 N 4.1797 7.6692 113.9531 53.4735 38.8897 174.9267 52 S 4.3034 8.6051 118.6371 58.6643 63.6810 174.0948 53 V 4.5297 7.7161 114.9827 59.6896 35.0924 175.5692 54 S 4.3678 8.7215 120.1425 58.1363 63.8958 174.8343 55 A 4.7552 8.1600 128.2039 49.8082 18.2880 174.0426 56 P 4.4167 0.0000 0.0000 61.7903 32.6461 177.1287 57 L 4.3436 8.1456 122.1769 54.1945 43.3472 175.5557 *59 S 4.5189 8.3496 115.5472 58.7806 64.2464 172.0229 60 Y 4.6517 7.0985 116.6153 57.0603 40.8650 172.4520 61 T 4.9523 8.6132 117.0988 61.3807 69.8007 173.5215 62 P 4.7263 0.0000 0.0000 61.9973 32.8292 176.2669 63 I 4.0824 8.3822 120.8212 64.3720 37.2433 176.7051 64 S 5.0156 7.8985 114.1536 56.9954 66.6194 172.4077 65 F 5.4252 9.2582 123.3656 56.5021 42.5785 173.4275 66 D 5.1526 8.3414 124.0833 51.6979 42.9854 174.0820 67 A 5.0110 8.6817 122.1663 50.0373 23.4357 174.8246 68 K 4.9349 9.2637 118.9288 54.6735 35.5860 175.5927 69 I 4.6092 9.0360 126.1265 58.5605 40.6244 173.6208 70 P 4.6753 0.0000 0.0000 62.9267 31.8643 178.2809 71 V 3.7537 8.5178 115.9603 63.6735 31.5115 178.4941 72 A 4.0440 8.0974 120.4095 54.8570 18.0454 179.1731 73 S 4.1050 8.0754 114.1369 62.1463 62.6619 177.1048 74 V 3.6348 7.8802 119.6581 65.2703 31.3262 176.7901 75 D 4.7775 7.7850 115.7145 54.1762 41.4078 176.8616 76 K 4.7873 7.6233 118.3385 55.0626 32.6713 175.7724 77 L 4.4336 7.7320 119.1382 54.6710 42.1553 177.3805 78 R 4.0957 8.9255 122.0315 56.2354 31.4286 176.1043 79 K 3.9081 8.5937 123.3210 57.3961 32.8694 176.0810 80 D 4.5333 8.9112 124.9912 55.2241 38.4082 173.3053 81 Q 4.6104 7.8841 117.0195 54.2706 32.1956 174.9491 82 D 5.0397 8.4967 119.3893 52.2273 41.7346 175.1341 83 L 4.5230 7.8106 123.2114 55.0669 42.4382 176.9436 84 I 4.0264 8.9336 128.9318 63.7145 38.3098 176.8469 85 L 4.7468 7.7841 123.4643 53.9046 45.4191 174.7823 86 G 4.8105 9.9995 112.9143 44.8957 0.0000 172.6470 87 T 4.9715 7.9208 114.3189 62.1171 70.7233 174.6042 88 L 4.7277 7.6440 120.3340 51.5516 45.5178 174.5456 89 P 3.4462 0.0000 0.0000 62.2885 31.9052 177.1844 90 A 3.8637 8.2556 123.4960 55.2703 18.3500 178.7099 91 N 4.5327 7.9708 110.5197 54.2388 38.4202 175.0915 92 S 3.7443 7.2660 112.5401 56.5794 63.2836 173.2051 93 E 3.6761 8.9899 126.3831 58.0950 29.2512 177.2431 94 D 4.1394 8.5912 118.8271 55.1305 39.3300 173.7813 95 A 3.9565 7.9479 128.4556 54.8179 19.0886 180.5139 96 G 3.5940 8.0628 102.8309 48.4940 0.0000 174.1968 97 A 4.3248 7.4363 120.2820 52.9928 19.2880 177.8877 98 R 3.9249 8.0158 113.6026 56.7802 32.8377 176.0876 99 G 4.0712 8.0349 104.6750 44.5962 0.0000 172.0673 100 L 5.0218 7.3898 120.7624 53.1590 44.5402 175.1098 101 F 5.2212 8.9989 123.6362 55.8752 43.6328 173.5499 102 V 4.7560 9.2701 124.2392 61.3993 33.4191 174.4719 103 R 5.3215 9.4166 127.1617 54.2819 34.0144 174.5313 104 A 5.3051 8.9223 124.5453 50.3813 21.8030 174.7359 105 N 4.7870 8.7034 120.5120 52.0129 39.2541 174.2554 106 D 4.5213 9.0043 115.3589 57.3520 41.0470 176.7759 107 D 4.9978 8.4265 118.0990 53.9511 42.7213 176.6838 108 G 4.0774 8.4500 108.2727 44.0722 0.0000 175.2034 109 L 5.3545 9.8603 126.9469 53.0435 45.3669 174.2663 110 Q 5.1371 9.4207 124.8188 54.2090 32.2964 174.2341 111 I 4.9852 8.8749 125.1612 59.8552 39.7884 174.6182 112 T 5.0453 9.0869 121.2037 60.3432 71.0620 172.4718 113 S 4.6356 8.9597 122.8027 56.8649 65.5410 173.3700 114 H 4.1435 9.4612 129.3742 57.2645 28.4135 175.8109 115 G 4.0020 8.1956 105.2707 45.9010 0.0000 173.2719 116 E 4.2037 7.9730 120.6799 54.7988 29.7489 175.5727 117 L 4.4311 8.6267 126.9162 55.6076 42.2379 176.2586 118 V 4.3518 8.5214 126.2742 62.2341 33.6521 176.1485 119 L 4.8853 7.6992 122.3579 53.2973 45.7601 174.6396 120 D 5.8397 8.5889 124.4234 51.1130 42.0995 174.2992 121 L 5.1202 8.5549 123.3633 52.6571 44.8944 176.7646 122 S 4.8016 8.8803 117.7118 57.3117 64.5295 175.2926 123 K 3.9291 8.6623 120.0729 59.9673 31.4011 179.3343 124 R 3.9301 7.8944 115.3730 59.4353 29.4387 178.2400 125 E 3.9558 8.1290 118.5649 59.0307 29.5094 178.9354 126 L 4.0839 8.4767 120.3806 58.1615 41.9982 178.9444 127 A 4.0045 7.8652 119.4967 54.9443 18.3339 178.9614 128 Q 4.0359 7.6778 117.0447 57.4615 29.5700 176.4547 129 L 3.9965 6.9880 119.2229 54.3221 42.3957 175.3823 130 P 4.2816 0.0000 0.0000 62.6361 31.8719 177.3034 131 A 3.9539 8.7409 124.9591 54.8652 18.3545 178.0513 132 D 4.7376 7.9190 112.1870 52.8386 40.0607 176.1104 133 A 4.1455 7.8771 122.5243 53.4657 19.7873 177.2143 134 T 4.9873 8.3741 115.6808 61.7826 72.5517 173.0373 135 I 4.7031 8.9973 127.4384 60.4024 38.9507 174.5023 136 A 5.2204 9.1066 129.3625 50.2059 21.6461 175.2887 137 I 5.1321 8.5530 122.3034 59.6406 41.6467 174.9820 138 S 4.8302 9.2917 120.4164 57.1539 65.9239 172.3840 139 A 5.1664 10.2040 131.2416 49.9016 20.9676 174.9208 140 T 5.1055 8.6544 114.1124 60.2032 71.5065 173.7160 141 E 4.0856 8.8573 120.4485 59.2325 29.9511 178.6153 142 D 4.6331 8.0336 117.5350 56.1341 41.8951 176.0155 143 E 5.0838 7.8414 113.6112 55.5619 33.4431 174.3864 144 T 5.1307 8.3576 118.2800 62.2962 71.1214 173.4795 145 T 4.9911 9.3189 120.2230 60.2739 70.8509 172.4115 146 A 5.1228 8.9314 129.2375 50.5224 23.1969 175.3590 147 G 4.0779 8.3692 106.6762 46.0849 0.0000 171.8380 148 I 4.6991 7.8073 120.5855 60.0530 38.4582 175.9689 149 E 3.9813 9.1215 127.1104 58.2611 29.6432 178.0576 150 G 3.8052 8.8956 110.7850 45.7733 0.0000 172.9949 151 D 4.6854 7.7996 120.4540 52.6747 40.4583 176.0004 152 D 4.6872 8.4157 124.3805 54.9824 41.2770 177.3400 153 S 4.5823 7.8799 113.8731 58.5656 63.0989 174.5258 154 T 4.5431 7.6188 113.9363 61.8982 68.8145 174.2681 155 T 4.2569 7.8810 111.1813 61.6326 69.6745 173.0375 156 E 4.7144 9.3891 125.3250 54.5991 32.9100 174.1640 157 T 4.8832 8.5008 120.6106 60.2929 70.0057 173.0025 158 V 4.0185 8.4857 130.0974 61.2008 32.5819 176.3433 159 E 4.5538 8.4303 131.7925 56.2660 29.3001 175.7969 160 R 4.5946 7.3283 115.6512 54.3019 34.7782 174.9672 161 D 4.7049 8.4377 118.1625 53.4582 40.5762 175.7222 162 V 4.4934 7.9611 127.8738 62.4479 32.4425 175.5703 163 R 4.1441 7.8048 117.1869 54.8016 30.5203 175.2096 164 P 4.6387 0.0000 0.0000 62.2937 32.0135 176.0177 165 I 4.0892 8.3971 121.5803 61.6040 38.4550 175.2691 166 I 4.2731 8.4457 126.4133 59.4120 41.6244 174.4255 *168 G 4.0439 8.1308 108.5347 46.3442 0.0000 170.8185 169 I 4.9371 7.7139 119.6054 59.6120 39.6226 175.0719 170 Y 4.8146 9.4023 124.9636 56.4961 41.2805 174.7302 171 T 4.9719 8.5529 116.0252 60.6106 70.9989 172.8536 172 E 4.7516 8.9175 124.7648 55.9849 31.1849 175.9922 173 L 4.4093 7.9054 120.5467 54.7833 42.3716 177.1132 174 E 4.1828 8.8351 121.0919 56.0840 30.5330 177.8593 175 S 4.2036 8.9741 119.0881 61.9769 62.9367 176.2611 176 N 4.4951 8.1178 113.5417 54.3223 37.1321 175.6045 177 A 4.2794 8.1449 120.8513 52.7573 18.6136 178.7731 178 A 3.8750 7.7405 120.6344 55.4791 18.5024 179.9621 179 A 4.0097 7.8861 118.0719 55.1215 18.5512 179.4381 180 D 4.2895 7.9965 116.9078 57.5801 41.1687 178.8985 181 L 3.9959 7.8412 119.3116 57.8573 41.6611 179.5920 182 L 4.0264 8.3656 119.3529 57.9241 41.3244 179.3760 183 N 4.4090 8.2304 115.1765 55.5642 38.5097 176.2420 184 A 4.4918 7.4852 119.5210 51.8378 19.1795 177.6527 185 G 3.9052 7.8462 106.2293 44.6830 0.0000 173.6292 186 L 4.2187 7.3154 121.3331 55.7417 42.5377 176.1265 187 N 4.8220 8.8066 122.0724 52.6460 43.0309 172.7913 188 A 4.9083 8.5776 126.4628 50.3303 22.3425 174.7590 189 H 4.8052 9.0017 122.0010 54.3470 33.0487 172.2110 190 V 4.8200 8.4066 125.4110 59.8206 33.7139 174.4763 191 E 4.6449 9.1371 125.5321 54.3868 31.9059 174.3925 192 I 4.7008 8.3466 126.9167 59.4237 39.0154 174.4796 193 N 4.7426 8.5681 124.9489 51.7512 39.3511 175.4775 194 S 4.3148 8.6280 122.9944 61.0308 63.2192 174.8828 195 R 3.9585 7.4166 120.9076 55.2295 30.0932 175.1517 196 F 5.1367 7.4168 119.4990 54.4086 41.0970 175.1393 197 T 4.0912 8.7410 109.5110 62.1563 68.4664 174.0242 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 38 V 8.05 3.99 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 0.93 0.00 0.00 0.92 0.00 0.00 39 Q 8.47 4.19 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 40 S 8.07 4.78 0.00 3.78 3.65 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 41 S 8.32 4.74 0.00 3.99 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 42 V 8.26 4.53 2.14 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 0.90 0.00 0.00 0.99 0.00 0.00 43 S 8.42 4.73 0.00 3.85 3.70 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 44 W 8.50 5.07 0.00 3.27 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 45 P 0.00 3.03 0.00 1.50 1.14 0.00 3.28 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.62 0.00 46 Q 7.37 4.39 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.29 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 47 N 9.78 4.04 0.00 2.85 2.88 0.00 0.00 7.09 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 48 G 8.42 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.67 4.72 0.00 3.86 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 50 L 8.29 4.24 0.00 1.63 1.76 0.64 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 51 N 7.67 4.18 0.00 2.90 2.87 0.00 0.00 6.98 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 52 S 8.61 4.30 0.00 3.85 3.70 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 53 V 7.72 4.53 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.02 0.00 0.00 54 S 8.72 4.37 0.00 3.87 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 55 A 8.16 4.76 1.26 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 0.00 0.00 0.00 56 P 0.00 4.42 0.00 2.24 2.10 0.00 3.90 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 57 L 8.15 4.34 0.00 1.72 1.74 1.02 1.06 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 *59 S 8.35 4.52 0.00 3.77 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 60 Y 7.10 4.65 0.00 3.00 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 61 T 8.61 4.95 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 1.24 0.00 0.00 62 P 0.00 4.73 0.00 2.56 2.27 0.00 3.93 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 63 I 8.38 4.08 1.96 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 1.30 0.68 0.93 0.00 0.00 64 S 7.90 5.02 0.00 3.88 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 65 F 9.26 5.43 0.00 3.15 2.86 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 0.00 0.00 0.00 66 D 8.34 5.15 0.00 2.67 2.61 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 67 A 8.68 5.01 1.23 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 0.00 0.00 68 K 9.26 4.93 0.00 1.66 1.68 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.49 7.81 69 I 9.04 4.61 1.90 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 1.28 0.70 0.94 0.00 0.00 70 P 0.00 4.68 0.00 2.18 1.99 0.00 3.61 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 71 V 8.52 3.75 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 0.82 0.00 0.00 0.94 0.00 0.00 72 A 8.10 4.04 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 73 S 8.08 4.10 0.00 3.91 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 74 V 7.88 3.63 2.19 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 0.84 0.00 0.00 0.99 0.00 0.00 75 D 7.78 4.78 0.00 2.71 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 76 K 7.62 4.79 0.00 1.90 1.78 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.34 7.81 77 L 7.73 4.43 0.00 1.52 1.62 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.93 4.10 0.00 2.03 1.87 0.00 3.25 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 79 K 8.59 3.91 0.00 1.77 1.72 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.48 7.81 80 D 8.91 4.53 0.00 2.87 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 81 Q 7.88 4.61 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 82 D 8.50 5.04 0.00 2.85 2.86 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 0.00 0.00 0.00 83 L 7.81 4.52 0.00 1.76 1.65 1.11 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.93 4.03 2.06 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 1.15 0.70 0.96 0.00 0.00 85 L 7.78 4.75 0.00 1.76 1.54 1.06 1.08 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 86 G 10.00 4.81 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 0.00 0.00 0.00 87 T 7.92 4.97 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 0.92 0.00 0.00 88 L 7.64 4.73 0.00 1.72 1.47 0.95 0.95 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 89 P 0.00 3.45 0.00 1.96 1.66 0.00 3.51 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.78 0.00 90 A 8.26 3.86 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 91 N 7.97 4.53 0.00 2.77 2.90 0.00 0.00 5.93 7.64 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 92 S 7.27 3.74 0.00 3.72 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 93 E 8.99 3.68 0.00 1.95 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 2.30 2.36 0.00 94 D 8.59 4.14 0.00 2.72 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 95 A 7.95 3.96 1.34 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 0.00 0.00 96 G 8.06 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 0.00 0.00 0.00 0.00 97 A 7.44 4.32 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 98 R 8.02 3.92 0.00 1.77 1.78 0.00 3.07 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 99 G 8.03 4.07 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 0.00 0.00 0.00 100 L 7.39 5.02 0.00 1.32 0.88 0.65 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 101 F 9.00 5.22 0.00 2.96 2.86 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 0.00 0.00 0.00 102 V 9.27 4.76 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 1.08 0.00 0.00 0.99 0.00 0.00 103 R 9.42 5.32 0.00 1.73 1.77 0.00 3.09 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 104 A 8.92 5.31 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.70 4.79 0.00 2.78 2.73 0.00 0.00 7.03 7.39 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 0.00 106 D 9.00 4.52 0.00 2.68 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 0.00 107 D 8.43 5.00 0.00 2.63 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 0.00 108 G 8.45 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 0.00 109 L 9.86 5.35 0.00 1.71 1.48 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 9.42 5.14 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 111 I 8.87 4.99 1.90 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 1.15 0.99 0.94 0.00 0.00 112 T 9.09 5.05 4.32 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 1.40 0.00 0.00 113 S 8.96 4.64 0.00 3.79 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 0.00 114 H 9.46 4.14 0.00 3.40 3.26 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.20 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 0.00 116 E 7.97 4.20 0.00 2.14 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 2.32 2.39 0.00 117 L 8.63 4.43 0.00 1.59 1.62 0.99 1.12 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 0.00 118 V 8.52 4.35 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 0.78 0.00 0.00 0.95 0.00 0.00 119 L 7.70 4.89 0.00 1.76 1.50 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.59 5.84 0.00 2.66 2.59 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 0.00 121 L 8.55 5.12 0.00 1.65 1.59 0.93 0.87 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 0.00 122 S 8.88 4.80 0.00 4.05 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 0.00 123 K 8.66 3.93 0.00 1.82 1.93 0.00 1.67 0.00 0.00 1.87 0.00 0.00 3.07 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.76 7.81 124 R 7.89 3.93 0.00 2.04 2.18 0.00 2.98 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 125 E 8.13 3.96 0.00 2.04 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 2.33 0.00 126 L 8.48 4.08 0.00 1.98 1.84 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.87 4.00 1.34 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 0.00 0.00 128 Q 7.68 4.04 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 129 L 6.99 4.00 0.00 1.86 1.62 0.97 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 0.00 130 P 0.00 4.28 0.00 2.17 1.98 0.00 3.61 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 2.12 2.10 0.00 131 A 8.74 3.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 D 7.92 4.74 0.00 2.79 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.88 4.15 1.34 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 0.00 0.00 134 T 8.37 4.99 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 1.26 0.00 0.00 135 I 9.00 4.70 2.00 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 1.18 0.60 0.95 0.00 0.00 136 A 9.11 5.22 1.21 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 0.00 0.00 137 I 8.55 5.13 2.04 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.80 1.11 0.00 0.00 138 S 9.29 4.83 0.00 3.85 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 0.00 139 A 10.20 5.17 1.31 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 0.00 0.00 140 T 8.65 5.11 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 1.24 0.00 0.00 141 E 8.86 4.09 0.00 2.04 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 2.38 2.34 0.00 142 D 8.03 4.63 0.00 2.69 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 0.00 143 E 7.84 5.08 0.00 2.15 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 2.21 2.30 0.00 144 T 8.36 5.13 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 1.32 0.00 0.00 145 T 9.32 4.99 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 1.23 0.00 0.00 146 A 8.93 5.12 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.37 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 7.81 4.70 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 1.35 1.02 0.92 0.00 0.00 149 E 9.12 3.98 0.00 2.02 1.94 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 2.36 2.30 0.00 150 G 8.90 3.81 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 0.00 0.00 0.00 151 D 7.80 4.69 0.00 2.72 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 0.00 152 D 8.42 4.69 0.00 2.71 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 0.00 153 S 7.88 4.58 0.00 3.95 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 0.00 154 T 7.62 4.54 4.42 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 1.34 0.00 0.00 155 T 7.88 4.26 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 0.00 156 E 9.39 4.71 0.00 1.98 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 2.19 2.22 0.00 157 T 8.50 4.88 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 1.22 0.00 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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 1.08 0.91 0.85 0.00 0.00 *168 G 8.13 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 I 7.71 4.94 1.76 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.00 0.93 0.00 0.00 170 Y 9.40 4.81 0.00 2.91 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 0.00 171 T 8.55 4.97 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 1.24 0.00 0.00 172 E 8.92 4.75 0.00 2.10 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 2.28 2.50 0.00 173 L 7.91 4.41 0.00 1.66 1.64 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 174 E 8.84 4.18 0.00 2.16 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 0.00 2.58 2.29 0.00 175 S 8.97 4.20 0.00 3.91 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 0.00 176 N 8.12 4.50 0.00 2.83 2.95 0.00 0.00 5.98 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 0.00 177 A 8.14 4.28 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 0.00 178 A 7.74 3.88 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 0.00 179 A 7.89 4.01 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 0.00 180 D 8.00 4.29 0.00 2.74 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 0.00 181 L 7.84 4.00 0.00 1.98 1.72 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 182 L 8.37 4.03 0.00 1.70 1.71 0.92 0.67 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 0.00 183 N 8.23 4.41 0.00 2.95 2.88 0.00 0.00 6.98 6.87 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 0.00 184 A 7.49 4.49 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 0.00 185 G 7.85 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 0.00 186 L 7.32 4.22 0.00 1.77 1.67 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 187 N 8.81 4.82 0.00 2.75 2.53 0.00 0.00 6.41 8.32 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 0.00 188 A 8.58 4.91 1.21 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 0.00 0.00 189 H 9.00 4.81 0.00 3.13 3.42 0.00 5.54 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 V 8.41 4.82 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.10 0.00 0.00 191 E 9.14 4.64 0.00 2.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 192 I 8.35 4.70 1.73 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.76 0.62 0.00 0.00 193 N 8.57 4.74 0.00 2.78 2.70 0.00 0.00 7.22 7.63 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 0.00 194 S 8.63 4.31 0.00 3.86 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 0.00 195 R 7.42 3.96 0.00 1.75 1.94 0.00 3.14 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.50 0.00 196 F 7.42 5.14 0.00 3.10 3.02 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 0.00 197 T 8.74 4.09 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 1.30 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.