NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 L 4.1383 8.1844 122.4907 54.1812 43.1845 175.7243 11 E 3.7048 8.7469 123.8658 56.1264 29.4189 175.4121 12 R 4.1815 9.2156 127.4035 56.1440 31.8068 175.6995 13 S 4.8314 8.3335 116.4987 56.5400 66.8841 172.9738 14 L 4.7249 8.1973 122.1229 53.4996 44.3881 176.1208 15 N 4.8081 8.4363 123.8298 52.2143 39.5827 171.9310 16 R 4.7844 8.1716 122.8083 54.1382 33.3313 174.0888 17 V 4.4929 8.5272 119.0078 59.7982 34.9742 174.2898 18 H 5.0441 8.7719 120.7930 54.0575 30.9849 173.2957 19 L 4.8293 8.8375 123.6610 52.8960 45.9230 175.9053 20 L 5.2790 7.5661 123.2240 54.9611 44.9037 174.7685 21 G 4.4289 8.2668 112.7326 47.1496 0.0000 170.7831 22 R 5.3057 8.1670 118.4451 54.4218 32.4776 176.3292 23 V 4.2092 9.0820 124.9947 63.2984 31.9732 176.7726 24 G 3.8198 9.5846 115.8563 47.8105 0.0000 173.7149 25 Q 4.8099 7.7021 114.2644 54.3166 32.0306 174.7301 26 D 4.4969 8.6807 121.3553 53.5552 41.4498 174.5244 27 P 4.6957 0.0000 0.0000 63.4764 32.4839 175.8952 28 V 4.4441 8.6682 116.9409 59.5314 34.1361 175.0477 29 L 4.3584 8.5657 126.0525 54.5005 41.8518 176.4617 30 R 4.6202 8.6287 123.1436 54.3871 33.8358 175.5315 31 Q 4.5203 8.1576 120.7421 54.5611 31.4772 174.3617 32 V 3.6996 8.4703 128.0518 63.1423 31.8931 176.5453 33 E 3.4673 9.0747 126.9116 57.8151 27.9036 176.2601 34 G 3.6298 8.8537 112.3172 48.8569 0.0000 173.5158 35 K 4.4979 7.4295 121.3613 54.7191 34.9742 175.7728 36 N 4.4883 8.1005 117.4193 52.2988 40.9476 170.8178 37 P 4.6984 0.0000 0.0000 62.2170 32.9365 175.5235 38 V 4.4036 8.5035 123.2048 61.4933 35.4503 173.6711 39 T 5.1019 8.3051 122.5134 61.9121 71.5807 173.3995 40 I 5.6309 8.7456 124.8414 58.6049 41.5380 174.4812 41 F 5.3791 8.2901 119.9611 55.7985 42.0810 172.7162 42 S 5.4744 8.9450 112.3102 56.6129 66.3866 172.7980 43 L 5.4120 8.9310 122.4740 53.5640 45.7232 174.6889 44 A 4.5533 8.9265 128.6745 50.6794 20.5030 176.0268 45 T 4.9612 8.7243 112.9326 59.8996 72.3209 172.7774 46 N 5.4297 8.4640 118.9023 51.6636 40.3709 173.2767 47 E 4.8129 8.8653 120.0008 54.7908 33.1731 174.9805 48 M 4.5812 8.6943 122.1606 53.5152 34.0701 174.9538 49 W 4.8251 8.6379 135.0000 55.7381 32.7846 175.9337 50 R 3.6829 7.9943 123.4735 55.0694 27.5263 175.3411 51 S 3.4827 6.5603 116.7502 58.7909 64.0070 173.6404 *65 K 4.1333 7.5309 118.3354 56.6747 33.7916 174.2295 66 T 4.8469 8.5530 122.0113 62.2665 70.2780 174.2503 67 T 4.5007 8.9723 123.5348 61.6026 70.9180 173.3525 68 W 5.1658 8.7867 126.4199 55.4999 30.8679 175.1394 69 H 5.0249 9.6495 122.5511 53.9450 31.4798 173.3628 70 R 4.8235 8.5186 122.6416 55.3944 31.8989 174.7778 71 I 4.7003 8.7876 127.1980 59.4628 40.5252 174.5692 72 S 4.8909 8.3855 121.4857 56.7925 65.8127 173.3687 73 V 4.4643 8.5721 126.2076 61.5433 31.5739 175.8938 74 F 4.6660 8.8348 126.0932 57.9615 39.8750 177.1418 75 R 3.9600 8.2237 119.8495 56.1574 30.2356 175.2982 76 P 4.2859 0.0000 0.0000 65.2048 31.9857 177.6597 77 G 3.9821 8.0085 102.9505 46.0185 0.0000 174.9242 78 L 4.0662 8.0160 122.3731 58.0781 42.0544 179.2051 79 R 4.0577 8.1882 116.0424 59.1006 29.2969 178.7123 80 D 4.2972 8.0309 119.1876 57.2522 41.0341 178.2687 81 V 3.7572 7.9388 119.4488 65.5582 31.4902 177.9761 82 A 4.2500 8.1791 119.7564 54.6202 17.9543 179.1406 83 Y 3.9123 7.5234 117.4149 60.9779 38.8730 177.2687 84 Q 3.7178 8.0204 119.0073 58.7686 28.5778 177.9787 85 Y 4.6934 7.8102 115.2449 57.0341 38.7770 176.0105 86 V 3.7610 7.1671 121.1598 61.8903 32.2829 175.2373 87 K 4.7150 8.0965 125.6183 53.7489 35.3901 175.5023 88 K 3.9772 8.3696 123.0648 58.0718 32.4344 177.6730 89 G 4.0276 9.6529 114.0743 45.6109 0.0000 174.1207 90 S 4.3189 7.6308 116.1243 58.7196 64.3548 173.2590 91 R 4.9574 8.6244 123.3851 55.6736 31.5547 175.1251 92 I 4.6616 9.2000 126.6304 59.5389 41.7754 173.5444 93 Y 5.3371 8.1132 125.4263 55.9241 41.4893 174.4184 94 L 4.9786 8.3533 125.1163 54.4338 44.5507 174.2739 95 E 4.9956 8.7600 119.7031 55.1154 33.2943 175.7012 96 G 4.5376 8.3895 108.8576 45.5280 0.0000 171.3013 97 K 5.0555 8.4047 118.3499 54.8156 35.4292 175.9682 98 I 4.2418 8.2709 123.7877 61.3216 38.1837 175.0275 99 D 4.6026 8.7409 125.1689 52.8462 43.8728 175.5261 100 Y 4.3215 8.8725 122.6644 57.6953 39.3209 176.1906 101 G 4.2626 7.9052 105.6296 44.8751 0.0000 173.5217 102 E 5.0973 8.7777 118.4018 56.2934 29.9802 176.3846 103 Y 4.9521 8.3444 121.1971 55.6557 42.1969 173.9366 104 M 4.7334 8.6768 121.0779 54.2505 32.2643 176.0070 105 D 4.6316 8.4812 124.7443 56.2818 40.3116 177.3408 106 K 4.3367 7.9167 115.6515 56.6206 34.3174 174.1471 107 N 4.1722 8.7086 116.3934 53.6816 38.1631 172.7279 108 N 4.9263 7.5836 113.6853 51.2104 41.8485 173.8046 109 V 3.9826 8.4476 126.5859 63.3427 32.3678 174.8049 110 R 4.6070 8.5455 126.2590 54.9050 34.2059 173.4207 111 R 5.0439 8.4363 120.4506 53.9465 33.3366 175.9852 112 Q 4.8376 8.4018 123.5894 54.6621 28.3533 174.0464 113 A 4.7939 7.9424 121.9439 51.9889 19.7716 177.9389 114 T 4.8541 9.2279 117.5500 60.3942 71.7000 172.6404 115 T 4.7401 8.1636 117.2399 60.0966 70.8608 173.8890 116 I 4.3873 8.5088 128.9073 60.9002 37.9639 175.3957 117 I 4.5035 8.5284 129.1610 61.0816 37.3460 175.5981 118 A 4.5740 8.9371 128.3209 53.0088 20.7112 176.3806 119 D 4.9758 7.6383 113.4426 52.9316 45.1123 174.9721 120 N 5.0254 8.5601 119.2022 53.4484 40.6932 173.0225 121 I 4.2825 8.9752 128.3038 59.4188 38.9288 174.9869 122 I 3.8567 8.0806 128.7297 60.4881 37.7945 177.2811 123 F 5.1970 7.3153 127.4121 54.5079 37.0857 174.0886 124 L 4.3590 7.5741 120.1549 55.8461 43.0709 175.6129 125 S 4.0506 8.4102 112.4114 58.8538 62.2498 173.4498 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 L 8.18 4.14 0.00 1.62 1.64 0.92 0.60 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 11 E 8.75 3.70 0.00 2.05 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 2.30 2.40 0.00 12 R 9.22 4.18 0.00 1.85 1.84 0.00 3.37 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 13 S 8.33 4.83 0.00 3.80 3.74 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 14 L 8.20 4.72 0.00 1.55 1.50 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.44 4.81 0.00 2.67 2.65 0.00 0.00 6.81 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 16 R 8.17 4.78 0.00 1.77 1.69 0.00 3.17 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.54 0.00 17 V 8.53 4.49 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 0.63 0.00 0.00 0.88 0.00 0.00 18 H 8.77 5.04 0.00 2.97 3.26 0.00 5.83 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.84 4.83 0.00 1.31 1.36 0.68 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.57 5.28 0.00 1.92 1.65 1.35 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.27 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 0.00 0.00 0.00 0.00 22 R 8.17 5.31 0.00 1.75 1.90 0.00 3.34 0.00 0.00 3.58 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 23 V 9.08 4.21 2.21 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 0.97 0.00 0.00 0.93 0.00 0.00 24 G 9.58 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 7.70 4.81 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 26 D 8.68 4.50 0.00 2.57 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 27 P 0.00 4.70 0.00 2.00 2.17 0.00 3.53 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.99 0.00 28 V 8.67 4.44 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 0.97 0.00 0.00 1.01 0.00 0.00 29 L 8.57 4.36 0.00 1.27 1.41 0.21 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.63 4.62 0.00 1.60 1.73 0.00 3.20 0.00 0.00 3.04 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 31 Q 8.16 4.52 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.93 0.00 0.00 0.00 0.00 0.00 2.22 2.52 0.00 32 V 8.47 3.70 2.26 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 0.88 0.00 0.00 1.04 0.00 0.00 33 E 9.07 3.47 0.00 2.16 1.65 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 2.22 2.30 0.00 34 G 8.85 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 0.00 0.00 0.00 35 K 7.43 4.50 0.00 1.69 1.70 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.39 7.81 36 N 8.10 4.49 0.00 2.84 2.93 0.00 0.00 7.17 7.71 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 37 P 0.00 4.70 0.00 2.11 1.91 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 38 V 8.50 4.40 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.35 0.00 0.00 39 T 8.31 5.10 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 1.43 0.00 0.00 40 I 8.75 5.63 1.85 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.23 0.91 0.00 0.00 41 F 8.29 5.38 0.00 3.12 3.03 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 42 S 8.94 5.47 0.00 4.23 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 43 L 8.93 5.41 0.00 1.91 1.55 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.93 4.55 0.15 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 45 T 8.72 4.96 4.23 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 1.21 0.00 0.00 46 N 8.46 5.43 0.00 2.79 2.65 0.00 0.00 5.87 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 47 E 8.87 4.81 0.00 1.87 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 0.00 2.23 2.37 0.00 48 M 8.69 4.58 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 49 W 8.64 4.83 0.00 3.29 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 50 R 7.99 3.68 0.00 1.59 1.49 0.00 3.17 0.00 0.00 3.03 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.37 0.00 51 S 6.56 3.48 0.00 3.53 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 *65 K 7.53 4.13 0.00 1.86 1.80 0.00 1.66 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.58 7.81 66 T 8.55 4.85 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 0.53 0.00 0.00 67 T 8.97 4.50 4.13 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 1.04 0.00 0.00 68 W 8.79 5.17 0.00 3.16 3.12 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 69 H 9.65 5.02 0.00 3.02 3.14 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.52 4.82 0.00 1.89 1.77 0.00 3.07 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 71 I 8.79 4.70 0.57 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.28 0.65 0.00 0.00 72 S 8.39 4.89 0.00 3.76 3.23 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 73 V 8.57 4.46 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 1.08 0.00 0.00 1.07 0.00 0.00 74 F 8.83 4.67 0.00 2.94 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 75 R 8.22 3.96 0.00 1.90 1.94 0.00 3.35 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 76 P 0.00 4.29 0.00 2.05 2.16 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 77 G 8.01 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 78 L 8.02 4.07 0.00 1.77 1.75 1.04 0.97 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 79 R 8.19 4.06 0.00 2.10 2.40 0.00 2.79 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.68 0.00 80 D 8.03 4.30 0.00 2.90 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 81 V 7.94 3.76 2.32 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 1.41 0.00 0.00 1.07 0.00 0.00 82 A 8.18 4.25 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.52 3.91 0.00 3.06 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 84 Q 8.02 3.72 0.00 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.44 0.00 0.00 0.00 0.00 0.00 2.12 2.37 0.00 85 Y 7.81 4.69 0.00 2.83 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 86 V 7.17 3.76 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 0.60 0.00 0.00 87 K 8.10 4.72 0.00 1.81 1.60 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.36 1.36 7.81 88 K 8.37 3.98 0.00 1.87 1.73 0.00 2.03 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.57 7.81 89 G 9.65 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 0.00 0.00 0.00 90 S 7.63 4.32 0.00 3.81 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 91 R 8.62 4.96 0.00 1.99 2.00 0.00 3.20 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 92 I 9.20 4.66 1.93 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.22 0.94 0.00 0.00 93 Y 8.11 5.34 0.00 3.37 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.35 4.98 0.00 1.80 1.64 0.90 0.70 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 95 E 8.76 5.00 0.00 1.91 1.79 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 2.25 2.08 0.00 96 G 8.39 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.40 5.06 0.00 1.77 1.84 0.00 1.27 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.32 7.81 98 I 8.27 4.24 1.56 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 1.02 0.60 0.42 0.00 0.00 99 D 8.74 4.60 0.00 2.65 2.40 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 0.00 100 Y 8.87 4.32 0.00 3.07 3.03 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 0.00 101 G 7.91 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 0.00 0.00 0.00 0.00 102 E 8.78 5.10 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 2.50 2.28 0.00 103 Y 8.34 4.95 0.00 2.96 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 0.00 104 M 8.68 4.73 0.00 1.92 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 105 D 8.48 4.63 0.00 2.88 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 7.92 4.34 0.00 1.78 1.72 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.38 7.81 107 N 8.71 4.17 0.00 2.81 2.85 0.00 0.00 6.98 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 0.00 108 N 7.58 4.93 0.00 2.92 2.80 0.00 0.00 6.85 7.59 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 0.00 109 V 8.45 3.98 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 0.77 0.00 0.00 0.89 0.00 0.00 110 R 8.55 4.61 0.00 1.39 0.66 0.00 2.87 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.44 0.00 111 R 8.44 5.04 0.00 1.74 2.00 0.00 3.53 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 112 Q 8.40 4.84 0.00 2.37 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.01 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 113 A 7.94 4.79 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 0.00 114 T 9.23 4.85 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 1.25 0.00 0.00 115 T 8.16 4.74 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 116 I 8.51 4.39 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.58 1.01 0.00 0.00 117 I 8.53 4.50 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.65 0.95 0.00 0.00 118 A 8.94 4.57 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 0.00 119 D 7.64 4.98 0.00 2.82 2.60 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 0.00 120 N 8.56 5.03 0.00 2.76 2.71 0.00 0.00 6.94 7.94 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 0.00 121 I 8.98 4.28 1.96 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 1.27 0.60 0.97 0.00 0.00 122 I 8.08 3.86 1.76 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 1.24 0.41 0.83 0.00 0.00 123 F 7.32 5.20 0.00 3.28 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 0.00 124 L 7.57 4.36 0.00 1.67 1.65 0.86 0.60 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 0.00 125 S 8.41 4.05 0.00 3.78 3.68 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 * Residues marked with a * may have inaccurate shift predictions.