NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 78 R 4.2072 8.2544 120.8602 56.0819 31.2222 174.1949 79 Q 4.4703 8.2530 123.1725 53.9632 31.3794 173.6168 80 Y 4.5861 9.6576 124.1784 57.7560 40.0018 174.0689 81 Q 4.6597 8.8522 119.3176 53.3143 33.5052 176.0311 82 E 3.8794 8.9252 120.3379 60.0088 29.4326 179.2094 83 N 4.5419 8.1535 114.2944 55.2247 39.0078 175.8471 84 D 4.8003 8.9959 120.1719 54.0050 41.2706 178.0782 85 L 4.0304 7.6311 121.2694 57.6205 41.7369 177.5197 86 P 4.2961 0.0000 0.0000 65.6858 31.0033 178.4892 87 D 4.3493 8.0033 116.4416 57.1047 41.1918 177.7142 88 L 4.1877 7.7767 120.5179 58.5517 42.0203 179.1034 89 I 3.6700 7.9231 118.9812 64.3967 36.9861 178.0152 90 A 4.3061 7.9686 118.6277 53.4029 18.1366 178.3615 91 S 4.6735 7.5686 111.8195 56.9155 63.9366 173.6266 92 L 4.8129 7.3703 121.4683 53.3345 44.7511 176.4106 93 D 4.5041 8.8210 122.1895 55.7930 40.2931 176.7099 94 Q 4.5929 7.5408 122.3727 52.1709 29.2280 171.2994 95 P 4.5320 0.0000 0.0000 62.8003 33.2551 174.9694 96 F 5.4887 9.3592 125.6488 56.4740 41.1522 172.9629 97 L 5.1873 9.4628 125.5248 52.4459 45.2376 175.0326 98 L 5.1905 8.2607 122.9788 53.3933 44.7579 174.9654 99 I 4.9325 9.3547 128.2251 59.5249 39.8171 174.4865 100 L 4.6712 8.3232 126.8242 53.1333 42.9880 175.9452 101 D 4.4048 8.7674 125.5089 53.2003 42.1059 176.2236 102 G 4.2906 8.7284 114.9220 46.2545 0.0000 172.8487 103 V 3.7692 7.6320 120.5105 62.3949 30.5008 176.4326 104 T 4.1908 8.2507 117.9998 63.1140 69.5444 175.2989 105 D 4.6162 7.9094 122.1125 52.6760 42.6026 174.9599 106 P 4.2816 0.0000 0.0000 65.8251 31.3703 178.1985 107 H 4.0337 8.7918 117.3655 59.4556 29.7920 177.2027 108 N 4.4425 8.1701 117.7919 56.0219 38.5263 176.9774 109 L 4.0538 7.9918 122.1055 58.1580 42.1511 179.3452 110 G 3.5860 8.1544 105.4318 47.4722 0.0000 175.7204 111 A 4.0343 7.9914 123.1265 55.1941 18.2941 179.5742 112 C 4.1524 8.5280 115.7666 62.8455 28.0901 176.2972 113 L 3.9280 7.8380 120.3538 57.5633 41.1725 179.2781 114 R 3.8758 7.9793 118.1451 59.8633 29.9898 178.5977 115 S 4.2292 8.0251 114.0200 61.3468 62.8014 176.3527 116 A 3.8437 8.2535 123.8889 55.2483 18.0970 179.0286 117 D 4.1560 8.3446 116.2712 57.6569 41.1305 178.1342 118 A 4.0888 7.8483 119.5081 55.4501 18.4214 179.0655 119 A 3.7907 8.1413 117.7406 52.8780 18.6518 178.0509 120 G 3.7842 7.8701 105.1503 45.8982 0.0000 173.9212 121 V 3.3076 7.0893 119.2711 62.4094 32.0185 175.7936 122 H 4.5313 8.4883 124.2531 58.8021 29.4613 175.4794 123 A 4.4979 7.5162 116.6823 50.8777 22.7246 175.5894 124 V 4.4404 8.4711 120.6167 61.3068 33.8470 174.6772 125 I 4.7693 8.4159 129.6225 60.4941 38.9784 175.3755 126 V 4.8002 8.7658 125.1657 60.6609 35.3856 172.3333 127 P 4.8747 0.0000 0.0000 62.0259 32.4295 176.3557 128 K 4.0542 8.9923 122.2621 59.7225 32.3189 177.8303 129 D 4.3866 7.9669 118.4252 55.4869 41.5672 178.6020 130 R 3.7812 8.8197 119.7443 57.8043 29.6027 176.6473 131 S 4.5448 8.4057 113.5981 58.1253 63.2109 174.5977 132 A 4.1964 8.8005 126.3773 52.5135 18.8607 177.1641 133 Q 4.3064 8.4637 118.3919 54.2336 30.4458 176.4820 134 L 4.3568 7.8839 124.7595 54.1176 41.3699 176.7606 135 N 4.7343 7.4616 121.2769 52.5749 41.0674 175.1448 136 A 3.9585 8.5446 119.5333 56.0590 18.5751 179.9442 137 T 3.7381 8.4659 114.3432 66.8382 68.6017 176.4604 138 A 4.0700 8.2665 121.9706 55.4650 18.0933 179.6699 139 K 3.9374 8.0171 116.6941 59.3404 32.0880 179.6019 140 K 3.9709 7.9972 119.8119 59.4971 31.9772 179.2182 141 V 3.5940 7.7743 117.2402 65.5644 31.6652 177.1891 142 A 4.8041 8.1358 120.3844 52.4828 18.5465 177.0494 143 C 4.2250 8.7128 115.0737 61.0003 26.5619 173.0748 144 G 4.1891 7.8233 111.7522 46.4028 0.0000 176.1895 145 A 3.8840 8.3813 122.6808 54.7331 18.4717 179.4368 146 A 3.4500 8.0189 117.5333 54.6536 18.5480 177.9750 147 E 4.4249 8.2688 113.8435 56.9206 30.6069 177.1482 148 S 4.3217 7.9456 112.5908 59.4123 63.1039 173.9411 149 V 4.2309 8.2661 121.3340 59.7929 32.5808 173.2712 150 P 4.3149 0.0000 0.0000 63.0036 32.3343 174.8651 151 L 4.9517 8.5270 124.8825 53.5752 44.0247 175.0837 152 I 4.4727 8.5160 128.0811 59.6176 39.6182 175.1596 153 R 4.8893 8.6385 126.5003 55.3095 30.8829 176.6065 154 V 4.3452 9.1189 118.6231 60.4982 33.7477 177.6569 155 T 3.9773 8.6661 118.3188 65.3870 68.9199 174.9538 156 N 4.7506 7.6625 120.0859 51.0094 40.0241 173.7609 157 L 3.8433 8.7857 126.9478 58.0006 42.2858 178.3449 158 A 3.9396 8.0276 119.2592 55.1253 18.5942 178.5735 159 R 4.0361 7.9389 114.7875 59.9404 30.1335 180.1548 160 T 4.0470 7.8176 114.5587 63.5101 67.5075 174.8132 *162 R 4.1377 7.9816 117.4417 56.2322 32.0641 177.8949 *164 L 4.2811 7.9158 119.5991 55.0443 43.7822 179.4771 165 Q 4.1177 7.7927 116.7760 58.4591 28.9988 177.8553 166 E 4.0244 8.3460 118.3316 58.6601 29.7541 176.9410 167 E 4.3908 8.1148 116.4215 55.5184 29.8040 175.6939 168 N 4.2063 7.7957 114.7949 54.6440 36.5064 174.6350 169 I 4.6119 7.5594 117.4037 59.2748 39.2961 176.9740 170 W 4.6129 9.7996 135.0000 57.3710 32.0681 174.7051 171 I 4.7510 8.2898 128.2007 59.6749 38.8229 174.6066 172 V 4.6060 8.7082 128.2195 60.9683 33.6286 174.4990 173 G 4.5199 8.9008 115.5696 44.4661 0.0000 171.7228 174 T 5.0094 8.7287 114.5831 60.5429 69.9122 174.0762 175 A 4.6158 8.8590 126.8703 50.4166 22.5437 177.4504 176 G 3.5522 8.5171 109.9415 48.1633 0.0000 174.8424 177 E 4.1063 8.0894 115.1227 56.6812 29.8656 176.6324 178 A 4.1635 7.4436 123.2595 52.8774 18.8544 177.0400 179 D 4.9764 8.3520 116.7910 52.9710 40.2731 175.2344 180 H 4.7967 7.5064 114.0712 55.2412 31.1490 172.9073 181 T 4.7690 9.8203 112.6025 60.0708 69.6862 175.8895 182 L 4.2302 8.1302 121.9949 58.4829 40.3062 178.4840 183 Y 4.7165 7.5042 115.8140 59.5011 38.0862 175.9550 184 Q 4.6186 8.4789 118.4432 55.5652 29.3107 175.3437 185 S 5.2159 7.5581 112.1645 56.3413 63.8830 172.8561 186 K 4.4391 8.0847 122.5556 54.5539 33.9603 175.3608 *188 T 3.9907 8.0572 113.0892 62.1356 70.4361 174.8549 189 G 3.8124 8.2686 108.2637 46.6768 0.0000 174.1536 190 R 4.4532 8.3640 122.7485 55.2451 31.3332 175.5351 191 L 5.5518 9.0106 125.6307 53.2079 46.4757 174.8101 192 A 5.2291 9.2311 125.8518 50.1326 21.9551 174.6299 193 L 4.8887 9.5861 126.5464 53.9058 44.0988 175.7435 194 V 5.1435 8.5850 125.6444 60.1550 35.2379 174.0691 *196 G 4.0618 8.4030 109.6916 45.3594 0.0000 172.4656 197 A 4.2179 7.8770 122.0948 51.9443 18.7758 178.6560 198 E 3.9268 8.9577 121.6532 58.7158 29.7328 178.6159 199 G 3.8503 7.6737 106.2668 47.5583 0.0000 174.8383 200 E 3.8954 8.0607 120.0508 58.6976 29.1861 177.5938 201 G 3.9624 7.0764 112.6074 45.3943 0.0000 173.8447 *203 R 4.0967 7.4728 115.0434 54.5316 33.1387 176.2281 204 R 3.8472 8.4277 120.9708 59.9168 29.7219 178.2159 205 L 3.9441 7.9495 117.7039 58.8317 42.1093 178.7270 206 T 3.9945 7.8108 114.8419 66.5992 67.9635 176.5501 207 R 3.8785 8.2033 120.9078 59.4152 29.8741 178.2498 208 E 4.1423 8.3444 117.2951 58.5426 29.6124 177.7243 209 H 4.5007 7.5382 114.4638 55.0823 29.3891 174.9749 210 C 4.3512 6.8790 118.0823 59.2418 29.0010 173.4686 211 D 4.2396 8.1033 122.9120 56.2156 41.2509 176.7255 212 E 4.7013 7.3972 117.7458 54.3301 33.4774 173.9486 213 L 5.2870 8.6006 125.6036 52.9686 44.0965 175.7432 214 I 4.8327 8.7906 116.3635 59.0577 41.4025 174.2967 215 S 5.0578 8.4930 117.1752 56.6498 66.7793 172.8272 216 I 4.4682 7.9603 120.9241 58.5019 38.5583 174.8516 217 P 4.3149 0.0000 0.0000 62.5089 31.6676 175.4228 *219 A 4.4236 8.4186 119.1099 51.8696 21.1569 177.8406 220 G 4.1844 7.6621 103.5074 46.0306 0.0000 175.4761 221 S 4.5261 8.6527 118.3655 58.1412 64.0001 174.6512 222 V 3.8711 7.5886 121.6829 62.6216 31.9186 175.6714 223 S 4.4674 8.5567 120.7469 59.8549 63.8282 173.7557 224 S 4.5500 7.5797 112.9953 57.3666 65.3280 173.1683 225 L 4.6418 8.0321 120.9168 53.0453 43.5850 176.9517 226 N 4.7980 8.2736 119.5552 51.9441 39.5860 176.0936 227 V 3.5324 8.6149 121.7601 66.6849 31.4480 178.4996 228 S 4.0836 8.4916 112.5688 61.3746 62.2391 176.3334 229 V 3.5864 7.9616 120.2955 65.9166 31.3298 177.6809 230 A 4.0247 8.0655 120.6105 55.4260 18.2180 179.7616 231 T 3.9378 8.1697 114.4414 66.5703 68.5181 177.1129 232 G 3.7055 8.1621 107.5836 48.0296 0.0000 175.5426 233 I 3.8308 7.8954 121.9672 64.4062 37.3208 178.0778 234 C 4.3633 8.3857 117.3727 62.6491 28.0201 175.8151 235 L 4.1009 8.5659 122.3832 58.3142 41.7639 178.7912 236 F 3.9697 9.1558 116.9220 59.2654 38.9968 177.1311 237 E 4.1813 8.1668 119.2985 58.4802 29.3973 178.5154 238 A 3.8793 7.8433 120.7518 55.1031 18.4641 179.1580 239 V 3.3395 7.4202 115.3688 66.3019 31.7030 177.9162 240 R 4.0296 8.0569 117.8512 59.7463 29.8641 178.5818 241 Q 4.1047 7.9724 115.8479 58.0854 28.7415 177.9967 242 R 4.2698 7.6494 117.4530 56.8748 30.7425 176.9993 243 S 4.4278 7.7315 119.7185 58.6973 63.0903 173.6586 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 78 R 8.25 4.21 0.00 1.70 1.82 0.00 2.87 0.00 0.00 2.48 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.42 0.00 79 Q 8.25 4.47 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.50 0.00 80 Y 9.66 4.59 0.00 2.91 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 81 Q 8.85 4.66 0.00 2.23 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.60 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 82 E 8.93 3.88 0.00 2.04 1.98 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 2.40 2.46 0.00 83 N 8.15 4.54 0.00 2.74 2.87 0.00 0.00 6.84 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 84 D 9.00 4.80 0.00 2.68 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 85 L 7.63 4.03 0.00 2.04 1.74 0.93 0.93 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 86 P 0.00 4.30 0.00 2.17 2.12 0.00 3.73 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 D 8.00 4.35 0.00 2.69 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 88 L 7.78 4.19 0.00 2.02 2.01 0.83 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.92 3.67 1.89 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 1.47 0.61 0.93 0.00 0.00 90 A 7.97 4.31 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 91 S 7.57 4.67 0.00 4.06 4.11 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 92 L 7.37 4.81 0.00 1.73 1.48 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.82 4.50 0.00 2.78 2.79 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 0.00 0.00 0.00 0.00 94 Q 7.54 4.59 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.08 0.00 0.00 0.00 0.00 0.00 2.26 2.62 0.00 95 P 0.00 4.53 0.00 2.18 2.03 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 96 F 9.36 5.49 0.00 2.94 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 97 L 9.46 5.19 0.00 1.58 1.51 0.95 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 98 L 8.26 5.19 0.00 1.60 1.34 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 99 I 9.35 4.93 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.28 0.93 0.00 0.00 100 L 8.32 4.67 0.00 1.52 1.58 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 101 D 8.77 4.40 0.00 2.70 2.55 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 0.00 102 G 8.73 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 0.00 0.00 0.00 103 V 7.63 3.77 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.92 0.00 0.00 104 T 8.25 4.19 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 1.28 0.00 0.00 105 D 7.91 4.62 0.00 2.73 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 0.00 106 P 0.00 4.28 0.00 2.20 2.09 0.00 3.66 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 107 H 8.79 4.03 0.00 3.19 3.28 0.00 5.59 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 0.00 108 N 8.17 4.44 0.00 2.92 2.86 0.00 0.00 6.71 6.74 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 0.00 109 L 7.99 4.05 0.00 1.78 1.87 0.91 1.10 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 0.00 110 G 8.15 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 0.00 0.00 0.00 0.00 111 A 7.99 4.03 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 0.00 112 C 8.53 4.15 0.00 3.14 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 0.00 113 L 7.84 3.93 0.00 1.88 1.69 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.98 3.88 0.00 1.99 2.14 0.00 3.35 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 115 S 8.03 4.23 0.00 4.00 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 0.00 116 A 8.25 3.84 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 0.00 117 D 8.34 4.16 0.00 2.69 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 0.00 118 A 7.85 4.09 1.62 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 0.00 119 A 8.14 3.79 1.07 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 0.00 120 G 7.87 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 0.00 0.00 0.00 121 V 7.09 3.31 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 0.61 0.00 0.00 -0.06 0.00 0.00 122 H 8.49 4.53 0.00 3.06 3.30 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 7.52 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.47 4.44 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 0.97 0.00 0.00 0.84 0.00 0.00 125 I 8.42 4.77 1.85 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 1.09 0.91 0.90 0.00 0.00 126 V 8.77 4.80 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 0.95 0.00 0.00 0.91 0.00 0.00 127 P 0.00 4.87 0.00 2.20 2.01 0.00 3.90 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 128 K 8.99 4.05 0.00 1.72 1.92 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.64 7.81 129 D 7.97 4.39 0.00 2.69 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 0.00 130 R 8.82 3.78 0.00 2.02 2.03 0.00 3.12 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 131 S 8.41 4.54 0.00 3.93 3.79 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 0.00 0.00 0.00 0.00 132 A 8.80 4.20 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 8.46 4.31 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 7.50 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 134 L 7.88 4.36 0.00 1.60 1.60 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 135 N 7.46 4.73 0.00 3.03 2.96 0.00 0.00 5.99 7.86 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 0.00 136 A 8.54 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 T 8.47 3.74 4.37 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 1.22 0.00 0.00 138 A 8.27 4.07 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 0.00 139 K 8.02 3.94 0.00 2.01 1.87 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.63 7.81 140 K 8.00 3.97 0.00 1.85 1.91 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.43 7.81 141 V 7.77 3.59 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 0.77 0.00 0.00 0.70 0.00 0.00 142 A 8.14 4.80 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 0.00 143 C 8.71 4.23 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 0.00 144 G 7.82 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 0.00 0.00 0.00 145 A 8.38 3.88 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 8.02 3.45 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 0.00 147 E 8.27 4.42 0.00 1.96 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 2.57 2.37 0.00 148 S 7.95 4.32 0.00 3.82 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 0.00 149 V 8.27 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 0.78 0.00 0.00 0.87 0.00 0.00 150 P 0.00 4.31 0.00 1.77 1.79 0.00 3.57 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 1.93 1.51 0.00 151 L 8.53 4.95 0.00 1.59 1.58 0.97 1.00 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 0.00 152 I 8.52 4.47 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.60 0.92 0.00 0.00 153 R 8.64 4.89 0.00 1.69 1.88 0.00 3.20 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 154 V 9.12 4.35 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 0.69 0.00 0.00 0.97 0.00 0.00 155 T 8.67 3.98 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 0.00 156 N 7.66 4.75 0.00 2.64 2.64 0.00 0.00 6.80 6.66 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 0.00 157 L 8.79 3.84 0.00 1.59 1.67 0.90 1.08 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 0.00 158 A 8.03 3.94 1.10 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 0.00 0.00 159 R 7.94 4.04 0.00 1.92 2.11 0.00 3.27 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 160 T 7.82 4.05 4.38 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 1.21 0.00 0.00 *162 R 7.98 4.14 0.00 2.02 2.00 0.00 3.18 0.00 0.00 3.38 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.96 0.00 *164 L 7.92 4.28 0.00 1.74 1.77 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 165 Q 7.79 4.12 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.91 0.00 0.00 0.00 0.00 0.00 2.57 2.34 0.00 166 E 8.35 4.02 0.00 2.09 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 0.00 2.34 2.44 0.00 167 E 8.11 4.39 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 168 N 7.80 4.21 0.00 2.88 2.91 0.00 0.00 6.77 6.82 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 0.00 169 I 7.56 4.61 2.02 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 1.18 0.61 0.98 0.00 0.00 170 W 9.80 4.61 0.00 3.32 3.08 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 0.00 171 I 8.29 4.75 1.63 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 1.07 0.60 0.82 0.00 0.00 172 V 8.71 4.61 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.06 0.00 0.00 173 G 8.90 4.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 T 8.73 5.01 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 1.19 0.00 0.00 175 A 8.86 4.62 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 0.00 176 G 8.52 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 0.00 177 E 8.09 4.11 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 178 A 7.44 4.16 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 0.00 179 D 8.35 4.98 0.00 2.79 2.75 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 0.00 0.00 0.00 0.00 180 H 7.51 4.80 0.00 3.54 3.39 0.00 5.44 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 T 9.82 4.77 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 1.28 0.00 0.00 182 L 8.13 4.23 0.00 1.80 1.82 0.86 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 183 Y 7.50 4.72 0.00 3.05 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 0.00 184 Q 8.48 4.62 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 185 S 7.56 5.22 0.00 3.94 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 0.00 186 K 8.08 4.44 0.00 1.69 1.57 0.00 1.42 0.00 0.00 1.35 0.00 0.00 2.39 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.26 7.81 *188 T 8.06 3.99 4.17 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 0.00 0.00 0.00 1.21 0.00 0.00 189 G 8.27 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 0.00 190 R 8.36 4.45 0.00 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0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 209 H 7.54 4.50 0.00 3.00 3.31 0.00 5.84 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 C 6.88 4.35 0.00 3.01 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 0.00 211 D 8.10 4.24 0.00 1.58 1.54 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 0.00 212 E 7.40 4.70 0.00 2.09 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 213 L 8.60 5.29 0.00 1.51 1.50 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 214 I 8.79 4.83 1.87 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 1.36 0.83 0.89 0.00 0.00 215 S 8.49 5.06 0.00 3.87 4.03 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 0.00 0.00 0.00 216 I 7.96 4.47 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.59 0.86 0.00 0.00 217 P 0.00 4.31 0.00 2.20 2.12 0.00 3.58 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 *219 A 8.42 4.42 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 0.00 220 G 7.66 4.18 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 0.00 0.00 0.00 221 S 8.65 4.53 0.00 3.98 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 0.00 222 V 7.59 3.87 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 0.85 0.00 0.00 0.93 0.00 0.00 223 S 8.56 4.47 0.00 4.01 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 0.00 224 S 7.58 4.55 0.00 3.94 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 0.00 225 L 8.03 4.64 0.00 1.63 1.63 0.92 1.02 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 0.00 226 N 8.27 4.80 0.00 3.09 2.93 0.00 0.00 6.32 7.68 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 0.00 227 V 8.61 3.53 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 1.02 0.00 0.00 0.99 0.00 0.00 228 S 8.49 4.08 0.00 3.95 4.03 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 0.00 0.00 0.00 229 V 7.96 3.59 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 1.07 0.00 0.00 0.93 0.00 0.00 230 A 8.07 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 T 8.17 3.94 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 232 G 8.16 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 0.00 0.00 0.00 233 I 7.90 3.83 2.05 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 1.57 0.80 0.99 0.00 0.00 234 C 8.39 4.36 0.00 3.09 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 0.00 235 L 8.57 4.10 0.00 2.20 1.74 0.83 1.08 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 0.00 236 F 9.16 3.97 0.00 3.37 3.22 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 0.00 237 E 8.17 4.18 0.00 2.26 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 0.00 2.60 2.48 0.00 238 A 7.84 3.88 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 0.00 239 V 7.42 3.34 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 0.78 0.00 0.00 0.48 0.00 0.00 240 R 8.06 4.03 0.00 2.08 2.14 0.00 3.16 0.00 0.00 3.38 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 241 Q 7.97 4.10 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.69 0.00 242 R 7.65 4.27 0.00 1.79 1.80 0.00 2.30 0.00 0.00 2.75 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.54 0.00 243 S 7.73 4.43 0.00 4.10 3.77 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.