NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8170 8.1676 115.8782 57.1575 40.1958 176.7277 11 H 3.9984 5.2900 117.2595 54.0861 29.0401 170.4067 12 E 4.2935 9.4293 123.1036 57.5622 30.0121 176.8201 13 M 4.5251 7.1097 114.6487 55.0433 32.3284 176.4563 14 R 4.5706 7.6832 116.9314 55.6656 32.6308 175.6973 15 E 4.0582 7.9773 117.2071 55.0631 30.2359 174.6148 16 P 4.0733 0.0000 0.0000 62.9281 32.3405 175.0753 17 R 4.1219 7.3699 112.5289 55.5649 32.9213 173.7483 18 I 4.3675 8.5098 121.9758 60.7553 38.2443 174.9855 19 E 4.4837 8.6869 128.7015 54.4547 31.3739 171.6764 20 K 4.5886 8.7281 132.8329 55.4546 34.2131 174.7384 21 V 4.5480 7.8658 120.0098 61.2197 34.7326 173.9094 22 V 4.5394 8.2918 128.9894 61.7325 33.1557 174.8797 23 V 5.0071 8.3886 121.7580 59.1687 33.6868 174.2803 24 H 5.1240 8.5758 124.7900 54.5560 33.5250 172.0985 25 M 4.5017 8.4812 124.3865 53.2078 33.1848 175.4083 26 G 4.0638 7.9044 113.0805 46.0452 0.0000 171.3997 27 I 4.1115 7.4499 124.1527 60.5544 39.6915 176.6196 28 G 4.0616 7.7824 112.1311 45.4661 0.0000 172.5107 29 H 4.5061 7.8755 117.3167 55.4466 30.0708 173.4503 *35 A 4.1732 7.0584 123.4335 51.8375 19.3801 176.3814 36 N 4.3583 8.7591 113.3026 56.4871 36.6215 176.6376 37 A 3.8366 8.0106 122.5811 54.7292 18.3500 178.8502 38 E 3.8905 8.7076 117.9381 59.9601 29.4540 179.0319 39 D 4.4432 7.5787 118.4904 57.7712 40.9370 179.5645 40 I 3.9271 7.5341 113.1630 64.0111 37.5576 178.1974 41 L 4.1380 7.8926 120.4773 57.4268 41.4665 179.4567 42 G 3.6108 8.3636 106.1768 47.8101 0.0000 175.6558 43 E 4.0372 7.8075 119.8328 59.0576 29.7230 178.8025 44 I 3.9032 8.1615 118.2883 63.7657 38.0254 176.6650 45 T 4.5033 8.6134 108.9711 63.1117 69.8105 174.2911 46 G 3.5284 6.8734 111.0020 44.0053 0.0000 173.0947 47 Q 4.5731 7.5778 116.7832 54.1602 31.6893 174.4136 48 M 3.9287 8.5606 118.4693 55.9722 32.4162 174.7895 49 P 4.8317 0.0000 0.0000 61.8518 33.4115 175.2126 50 V 4.4632 8.3057 120.4017 60.8342 34.3125 175.3741 51 R 4.3872 8.7223 125.7418 57.2396 31.2318 176.8220 52 T 4.5143 8.6025 117.1397 61.4365 70.3299 174.0262 53 K 5.3551 8.7730 124.7016 55.7597 33.3137 175.4908 54 A 4.8900 8.5661 122.3280 50.2310 22.1978 175.7373 55 K 4.4939 8.4297 117.5122 55.5952 34.9699 175.4516 56 R 4.2212 8.4786 121.6973 56.4481 29.5481 175.9109 57 T 4.5590 8.2452 117.2216 62.4916 69.9715 174.6077 58 V 4.5504 9.0085 125.4351 60.5676 35.0150 176.0088 59 G 3.8429 8.9416 113.2087 48.7774 0.0000 174.8863 60 E 4.2565 8.1047 118.6047 58.3467 28.2110 176.1134 61 F 4.1683 7.7326 112.7349 60.3787 38.8334 174.9452 62 D 4.9446 7.9383 117.7870 51.8323 40.3422 175.4689 63 I 4.0351 7.6619 114.4353 61.0992 39.5051 177.3466 64 R 3.8511 7.9170 121.6211 56.1687 29.4374 174.8218 65 E 3.9278 8.1941 128.8730 58.4933 30.3030 176.1276 66 G 3.8960 7.8833 110.2514 46.5242 0.0000 171.9121 67 D 4.5440 8.2844 121.5718 51.5634 42.3962 173.5193 68 P 4.6132 0.0000 0.0000 62.6058 31.8999 176.4046 69 I 4.6103 8.9386 127.2290 59.4272 38.8777 174.9199 70 G 4.2482 7.6073 106.7788 43.2376 0.0000 172.4962 71 A 5.8575 8.1654 121.0548 49.2857 23.3544 174.8806 72 K 5.1458 8.2231 116.6140 55.0825 37.1546 175.5136 73 V 4.5610 7.9921 119.6543 61.9554 34.7253 172.8468 74 T 4.7184 8.5345 119.0921 60.4122 69.9316 173.8286 75 L 4.7183 8.4904 127.1091 52.9709 43.9438 176.0542 76 R 4.8141 8.0617 120.9194 54.5715 34.0364 176.5155 77 D 4.4114 8.9160 120.4399 55.7271 38.9724 176.5502 78 E 3.9817 8.9249 124.1403 60.9333 27.8374 178.2889 79 M 3.9865 8.2605 117.8945 58.4976 31.8970 178.5296 80 A 4.3686 7.9066 120.5283 54.9747 18.8019 179.3269 81 E 3.9593 8.0625 116.6712 59.5404 29.5785 179.0406 82 E 4.0978 8.3454 118.6059 59.0630 29.9017 179.0963 83 F 4.4095 7.5711 120.3016 60.7629 39.8925 177.6444 84 L 4.1883 8.1706 118.1057 57.2821 41.0574 178.8609 85 Q 4.0872 8.0798 116.0551 56.5100 28.3182 176.1413 86 T 4.5184 7.6116 108.9886 61.7809 74.0081 175.6059 87 A 3.9478 7.7131 124.3224 54.5477 18.2719 179.1168 88 L 3.5043 7.8910 116.0510 57.7522 41.6382 178.0635 89 P 4.1872 0.0000 0.0000 65.4499 31.2348 177.5539 90 L 4.4146 7.9729 115.2945 53.8473 41.9627 176.1714 91 A 4.8447 7.8429 121.8856 50.4698 21.9002 175.0509 92 E 4.4307 8.2526 116.6610 58.4776 31.7929 176.5201 93 L 3.6877 6.7138 116.5210 52.1974 43.7196 175.6978 94 A 4.5030 8.6294 122.6089 52.6069 21.2897 174.6594 95 T 3.1532 8.7319 110.6130 62.9262 69.4018 173.8025 96 S 3.8910 8.7034 120.5795 60.3882 63.1930 173.2158 97 Q 4.4891 10.5152 118.1743 55.8819 28.4848 174.9400 98 F 4.8946 7.6864 114.8455 55.2894 41.1478 175.0175 99 D 4.6904 9.9120 123.4206 54.4011 41.6827 175.8725 100 D 4.7023 8.5350 119.5314 55.3058 41.2723 177.5746 101 T 4.5812 7.1992 113.3638 62.2207 68.8830 174.4642 102 G 3.9300 8.2935 108.7285 46.8204 0.0000 173.0481 103 N 5.2436 7.7989 115.6126 51.1580 42.1088 173.2921 104 F 4.2243 7.6664 109.8226 56.1881 41.1337 173.0289 105 S 5.0834 8.7495 116.0078 56.4993 65.2714 172.6037 106 F 4.8906 8.5673 120.2553 55.5558 41.5810 172.7324 107 G 4.2215 8.8901 102.2709 44.4995 0.0000 173.4554 *128 L 4.0041 8.4791 123.5273 55.1919 43.6453 176.4206 129 D 4.8655 8.7085 126.2171 53.0245 43.8451 176.3619 130 V 4.2761 7.8960 120.7091 62.0426 34.4806 173.7795 131 T 4.7236 8.8057 125.5772 61.6043 71.0601 173.9475 132 V 4.3664 7.8027 124.3885 61.0670 34.4484 173.5789 133 N 5.1029 8.6270 126.9204 52.2543 40.2894 173.5402 134 L 5.3506 8.1552 125.7500 53.2229 44.8458 175.7697 135 V 4.2505 7.9154 120.0647 61.2288 35.2434 171.7259 136 R 4.4407 8.4539 117.1474 55.1294 31.3785 177.3719 137 P 4.0946 0.0000 0.0000 65.4408 32.0022 177.7261 138 G 4.1179 7.7400 105.3659 46.1117 0.0000 175.4071 139 Y 4.2820 8.1551 122.8657 60.0871 38.9596 176.0207 140 R 3.8376 8.2454 119.4160 59.3737 29.9742 178.2171 141 V 3.5486 7.5308 116.2420 65.0860 31.1859 176.7731 142 A 4.8533 7.6726 119.6420 51.1627 19.7020 177.1875 143 K 4.2031 7.4255 114.7637 56.1997 33.7409 176.5842 144 R 4.2376 7.6717 115.4008 55.8229 30.5639 176.0984 145 D 4.5345 8.4314 116.5530 56.6150 41.5368 177.7182 146 K 4.0286 7.8752 118.4045 57.4312 32.6985 176.8027 147 A 4.0026 8.7564 123.4726 52.4335 16.3256 177.0468 148 S 4.5266 7.2296 113.2265 61.0024 63.6969 173.4977 149 R 4.6247 8.8033 119.5515 55.1753 33.7393 173.9027 150 S 4.5180 8.5238 119.0692 57.7480 63.4278 173.8268 151 I 3.9395 8.2560 127.3652 60.3762 37.7722 174.4282 152 P 4.4200 0.0000 0.0000 62.5800 32.1525 177.2265 153 T 3.9124 8.8078 112.9000 65.3329 68.0420 176.6223 154 K 4.0022 7.9857 119.5911 59.2999 32.2879 177.7925 155 H 4.5813 7.8848 115.0598 55.9227 30.0837 175.1337 156 R 4.2577 7.4104 119.0562 56.4184 30.5758 175.0856 157 L 4.5846 8.1548 120.3318 53.7301 43.8070 175.4019 158 N 4.7913 8.1554 122.9008 51.4904 41.2375 174.5650 159 P 4.3279 0.0000 0.0000 66.1190 31.4517 178.5224 160 A 3.8640 7.9663 118.7257 55.3649 18.4848 179.0625 161 D 4.4198 8.2092 116.0091 56.8800 40.8749 179.1864 162 A 4.2216 7.6979 121.1022 54.9525 18.8764 179.3051 163 V 3.1626 7.5843 116.5675 66.6079 31.3566 177.4147 164 A 3.8789 7.9804 119.7649 55.1883 17.8726 178.9079 165 F 4.0906 7.8910 117.0020 61.6731 39.6336 177.8684 166 I 3.5024 7.6097 117.3958 64.3646 37.2500 177.4467 167 E 4.5923 8.4347 121.8019 58.6461 29.1003 178.2419 168 S 4.6674 8.1304 111.8503 57.8278 64.5471 175.0779 169 T 4.7687 7.9037 112.9182 62.6486 70.5904 173.2085 170 Y 3.4181 8.0011 116.5699 58.0911 35.2663 169.0038 171 D 4.4141 6.9441 117.3262 54.0455 43.6651 175.2478 172 V 4.7308 8.0441 117.0731 61.2132 35.6801 178.1418 173 E 4.3452 9.0162 121.8363 56.6428 28.6941 177.3301 174 V 4.0146 7.6711 116.5282 63.8754 31.8199 175.0838 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 10 F 8.17 4.82 0.00 3.36 3.37 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 11 H 5.29 4.00 0.00 3.06 2.22 0.00 5.62 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 12 E 9.43 4.29 0.00 1.65 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 2.07 2.17 0.00 13 M 7.11 4.53 0.00 2.21 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 14 R 7.68 4.57 0.00 1.77 1.97 0.00 3.43 0.00 0.00 3.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 15 E 7.98 4.06 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 2.34 2.29 0.00 16 P 0.00 4.07 0.00 0.98 1.63 0.00 3.65 0.00 0.00 3.79 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 17 R 7.37 4.12 0.00 1.80 1.81 0.00 2.73 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.43 0.00 18 I 8.51 4.37 1.98 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.90 0.98 0.00 0.00 19 E 8.69 4.48 0.00 1.85 1.70 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 2.19 2.22 0.00 20 K 8.73 4.59 0.00 2.10 1.98 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.31 7.81 21 V 7.87 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 1.02 0.00 0.00 0.97 0.00 0.00 22 V 8.29 4.54 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.85 0.00 0.00 23 V 8.39 5.01 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 0.53 0.00 0.00 0.69 0.00 0.00 24 H 8.58 5.12 0.00 3.17 2.97 0.00 5.62 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 25 M 8.48 4.50 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 26 G 7.90 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.45 4.11 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 1.21 0.74 0.76 0.00 0.00 28 G 7.78 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 7.88 4.51 0.00 3.15 3.34 0.00 5.76 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 *35 A 7.06 4.17 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 36 N 8.76 4.36 0.00 2.92 3.14 0.00 0.00 5.86 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.01 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 38 E 8.71 3.89 0.00 1.95 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 2.32 2.48 0.00 39 D 7.58 4.44 0.00 2.74 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 40 I 7.53 3.93 1.88 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 1.79 1.15 0.91 0.00 0.00 41 L 7.89 4.14 0.00 1.91 1.72 0.92 0.87 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 42 G 8.36 3.61 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 0.00 0.00 0.00 43 E 7.81 4.04 0.00 1.93 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 2.35 2.50 0.00 44 I 8.16 3.90 2.02 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.88 1.07 0.00 0.00 45 T 8.61 4.50 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 0.93 0.00 0.00 46 G 6.87 3.53 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 0.00 47 Q 7.58 4.57 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.68 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 48 M 8.56 3.93 0.00 2.01 2.06 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 2.60 2.58 0.00 49 P 0.00 4.83 0.00 1.90 1.94 0.00 3.59 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 50 V 8.31 4.46 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 1.03 0.00 0.00 0.91 0.00 0.00 51 R 8.72 4.39 0.00 1.72 1.85 0.00 3.35 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 52 T 8.60 4.51 4.36 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 1.21 0.00 0.00 53 K 8.77 5.36 0.00 1.63 1.74 0.00 1.73 0.00 0.00 2.36 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.28 7.81 54 A 8.57 4.89 1.24 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 0.00 0.00 0.00 55 K 8.43 4.49 0.00 1.72 1.70 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.41 7.81 56 R 8.48 4.22 0.00 1.99 2.01 0.00 3.20 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 57 T 8.25 4.56 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 58 V 9.01 4.55 2.11 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 1.02 0.00 0.00 0.94 0.00 0.00 59 G 8.94 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 60 E 8.10 4.26 0.00 2.14 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 2.31 2.34 0.00 61 F 7.73 4.17 0.00 3.03 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 62 D 7.94 4.94 0.00 2.97 2.54 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 63 I 7.66 4.04 1.93 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 1.45 0.85 1.05 0.00 0.00 64 R 7.92 3.85 0.00 1.77 2.08 0.00 3.20 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 65 E 8.19 3.93 0.00 1.97 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 2.29 2.30 0.00 66 G 7.88 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 0.00 0.00 0.00 67 D 8.28 4.54 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 68 P 0.00 4.61 0.00 1.94 2.03 0.00 3.60 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 2.01 2.11 0.00 69 I 8.94 4.61 1.96 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 1.14 0.75 0.92 0.00 0.00 70 G 7.61 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 71 A 8.17 5.86 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 72 K 8.22 5.15 0.00 1.74 1.87 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.22 7.81 73 V 7.99 4.56 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 0.93 0.00 0.00 0.86 0.00 0.00 74 T 8.53 4.72 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 1.16 0.00 0.00 75 L 8.49 4.72 0.00 1.49 1.54 0.54 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.06 4.81 0.00 1.63 1.78 0.00 3.31 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 77 D 8.92 4.41 0.00 2.89 2.28 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 78 E 8.92 3.98 0.00 2.02 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 2.42 2.42 0.00 79 M 8.26 3.99 0.00 2.02 2.28 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.58 0.00 80 A 7.91 4.37 1.39 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 0.00 0.00 0.00 81 E 8.06 3.96 0.00 2.15 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 2.45 2.63 0.00 82 E 8.35 4.10 0.00 2.03 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 2.53 0.00 83 F 7.57 4.41 0.00 3.37 3.27 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 L 8.17 4.19 0.00 1.95 1.80 1.10 1.09 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 85 Q 8.08 4.09 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.73 0.00 0.00 0.00 0.00 0.00 2.18 2.44 0.00 86 T 7.61 4.52 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 1.14 0.00 0.00 87 A 7.71 3.95 1.20 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 0.00 0.00 88 L 7.89 3.50 0.00 1.69 1.68 0.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.19 0.00 2.10 2.12 0.00 3.65 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 90 L 7.97 4.41 0.00 1.75 1.73 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.84 4.84 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.25 4.43 0.00 1.94 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 2.20 2.29 0.00 93 L 6.71 3.69 0.00 1.75 1.84 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.63 4.50 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 95 T 8.73 3.15 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 1.11 0.00 0.00 96 S 8.70 3.89 0.00 4.24 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 0.00 97 Q 10.52 4.49 0.00 2.15 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.73 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 98 F 7.69 4.89 0.00 2.99 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 99 D 9.91 4.69 0.00 2.83 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 8.54 4.70 0.00 2.72 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 0.00 101 T 7.20 4.58 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 0.00 102 G 8.29 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 0.00 103 N 7.80 5.24 0.00 2.96 2.81 0.00 0.00 6.57 8.13 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 0.00 104 F 7.67 4.22 0.00 2.49 1.61 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 0.00 105 S 8.75 5.08 0.00 3.71 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 0.00 106 F 8.57 4.89 0.00 3.16 3.17 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 0.00 107 G 8.89 4.22 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 0.00 *128 L 8.48 4.00 0.00 1.75 1.61 0.94 1.16 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 0.00 129 D 8.71 4.87 0.00 2.71 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 0.00 130 V 7.90 4.28 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 0.00 0.00 0.90 0.00 0.00 0.93 0.00 0.00 131 T 8.81 4.72 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 1.07 0.00 0.00 132 V 7.80 4.37 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 1.09 0.00 0.00 0.75 0.00 0.00 133 N 8.63 5.10 0.00 2.80 2.90 0.00 0.00 6.54 6.39 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 0.00 134 L 8.16 5.35 0.00 1.73 1.51 1.30 1.14 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 0.00 135 V 7.92 4.25 1.57 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 0.19 0.00 0.00 0.71 0.00 0.00 136 R 8.45 4.44 0.00 1.83 2.10 0.00 2.91 0.00 0.00 3.01 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.43 0.00 137 P 0.00 4.09 0.00 2.27 2.12 0.00 3.63 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 138 G 7.74 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 Y 8.16 4.28 0.00 3.17 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 0.00 140 R 8.25 3.84 0.00 1.93 1.94 0.00 3.24 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 141 V 7.53 3.55 2.16 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 0.85 0.00 0.00 0.95 0.00 0.00 142 A 7.67 4.85 1.03 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 0.00 0.00 143 K 7.43 4.20 0.00 1.63 1.79 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.81 1.31 7.81 144 R 7.67 4.24 0.00 1.90 1.94 0.00 3.12 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.55 0.00 145 D 8.43 4.53 0.00 2.67 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 0.00 146 K 7.88 4.03 0.00 1.80 1.71 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.76 4.00 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 0.00 148 S 7.23 4.53 0.00 3.77 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 0.00 149 R 8.80 4.62 0.00 1.84 1.72 0.00 3.12 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 150 S 8.52 4.52 0.00 3.91 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 0.00 151 I 8.26 3.94 1.98 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 1.43 1.14 1.05 0.00 0.00 152 P 0.00 4.42 0.00 2.22 1.99 0.00 3.66 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.81 3.91 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 154 K 7.99 4.00 0.00 1.77 1.95 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.58 7.81 155 H 7.88 4.58 0.00 3.16 3.46 0.00 5.95 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.41 4.26 0.00 2.08 1.90 0.00 3.41 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.75 0.00 157 L 8.15 4.58 0.00 1.66 1.71 0.89 0.53 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 0.00 158 N 8.16 4.79 0.00 3.20 2.72 0.00 0.00 6.66 7.91 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 0.00 159 P 0.00 4.33 0.00 2.15 2.25 0.00 3.62 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.45 0.00 160 A 7.97 3.86 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 0.00 161 D 8.21 4.42 0.00 2.71 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 0.00 162 A 7.70 4.22 1.60 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 0.00 0.00 163 V 7.58 3.16 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 0.61 0.00 0.00 0.27 0.00 0.00 164 A 7.98 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 0.00 165 F 7.89 4.09 0.00 3.08 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 0.00 166 I 7.61 3.50 1.84 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 1.63 1.08 0.88 0.00 0.00 167 E 8.43 4.59 0.00 1.97 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 2.25 2.19 0.00 168 S 8.13 4.67 0.00 3.83 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 0.00 169 T 7.90 4.77 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 1.17 0.00 0.00 170 Y 8.00 3.42 0.00 3.01 3.13 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 0.00 0.00 0.00 171 D 6.94 4.41 0.00 2.87 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 V 8.04 4.73 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 0.83 0.00 0.00 0.89 0.00 0.00 173 E 9.02 4.35 0.00 1.97 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.20 0.00 174 V 7.67 4.01 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 1.05 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.