NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6549 8.1648 122.9826 52.6479 19.4328 176.1311 2 T 4.2252 7.5388 119.1320 62.3392 70.7131 172.4124 3 K 5.3246 8.8397 123.3250 55.2415 37.5499 174.5871 4 A 5.2591 8.9854 122.5158 51.2746 23.2536 175.3760 5 V 5.0227 8.9052 117.9570 61.0048 35.7870 173.5117 6 C 4.8594 8.9266 121.0169 58.3025 35.6563 172.4819 7 V 4.6673 8.5044 126.1000 61.4601 33.3811 174.0476 8 L 5.0266 8.8904 128.7100 53.6091 43.5127 175.9440 9 K 4.8836 9.1540 122.2011 55.7314 37.3050 175.9668 10 G 4.1271 7.8912 107.8643 46.2363 0.0000 172.4490 11 D 4.5180 8.7669 117.9954 55.8227 41.7329 177.1858 12 G 4.1542 7.6427 109.6016 44.3143 0.0000 171.7020 13 P 4.4933 0.0000 0.0000 63.1629 32.1966 176.1606 14 V 4.1538 7.5672 120.7584 63.2363 32.0014 174.9211 15 Q 5.0483 8.0698 124.2340 56.5197 32.3888 173.7609 16 G 4.1282 7.8460 105.9391 46.4441 0.0000 171.4766 17 I 5.2009 7.9078 119.0397 59.5938 41.2529 175.0331 18 I 4.6524 8.6445 126.9363 59.4335 40.6809 174.3623 19 N 5.1807 8.3478 122.2407 51.2628 42.2330 173.5020 20 F 5.4251 9.0088 119.3668 55.9376 43.6718 173.8691 21 E 5.1332 9.4753 122.7102 55.1939 33.3688 173.5999 22 Q 4.9729 9.2162 127.9173 54.0958 30.6101 175.7274 23 K 4.1419 8.8891 126.0735 58.3045 32.7936 177.5647 24 E 4.7161 7.7856 117.6816 54.2676 33.4194 176.0022 25 S 4.0309 8.7600 118.6821 61.2438 62.4830 175.0961 26 N 4.8392 8.1568 113.7761 52.4137 37.2817 174.5471 27 G 4.0118 8.1727 109.3645 44.0883 0.0000 171.9925 28 P 4.7205 0.0000 0.0000 62.2978 32.6024 176.2515 29 V 4.6542 9.0043 121.8691 61.3105 33.9988 174.5032 30 K 5.1257 9.5202 128.1230 55.2415 34.1155 175.9527 31 V 5.4086 9.2132 124.1058 58.5698 34.3090 174.6557 32 W 5.3523 8.0388 120.7075 54.7887 32.0553 175.1925 33 G 3.8038 7.4642 105.9388 46.0239 0.0000 171.5634 34 S 5.0659 7.7759 113.3947 57.1369 67.0278 173.0932 35 I 5.0974 8.7896 121.2225 59.4211 40.9625 174.7869 36 K 4.8035 9.3644 124.9991 55.5668 36.2909 176.7210 37 G 4.0165 8.8533 106.5187 45.8702 0.0000 173.3204 38 L 4.5285 7.7611 119.5490 52.9227 43.2014 176.5049 39 T 4.3862 8.1454 111.5154 60.8147 69.7392 174.1802 40 E 4.1305 8.6462 124.4073 57.2032 30.4192 175.5568 41 G 3.7361 8.4109 111.2474 43.9018 0.0000 172.1584 42 L 4.7800 8.1395 119.4928 54.7497 42.8032 176.6482 43 H 4.8874 9.1518 119.5410 53.7254 33.1885 173.2692 44 G 4.0800 9.2152 111.1147 46.9031 0.0000 172.3171 45 F 5.5999 9.2632 124.8047 56.5941 42.2876 173.6176 46 R 5.0870 9.0567 124.4316 54.6085 35.4153 174.2358 47 V 4.5812 8.6232 121.2037 61.9854 33.1450 174.7344 48 H 5.1761 9.3589 125.2467 54.1047 30.8677 175.4785 49 E 3.5869 8.7731 122.4486 58.6217 30.1421 177.3957 50 F 5.0253 8.1997 118.2128 55.6730 41.4434 176.1484 51 G 4.6709 8.5212 114.3547 44.4435 0.0000 173.7834 52 D 4.7855 7.9813 118.2373 52.5632 42.5155 174.6094 53 N 5.1652 8.5515 125.0226 53.4389 39.4354 175.3450 54 T 3.9211 8.8434 109.8199 63.4163 69.4791 174.1540 55 A 4.6736 8.3725 124.5815 50.9436 19.7858 175.5762 56 G 3.9874 7.7435 112.5584 46.1966 0.0000 174.4915 57 C 4.5166 8.5542 115.2540 59.0604 34.9560 175.6386 58 T 3.8565 7.4664 117.9553 66.6525 67.8734 176.2851 59 S 4.3773 7.5753 113.8386 60.2697 63.0494 175.8956 60 A 4.7978 7.4358 125.1223 54.2260 18.2121 178.4691 61 G 3.7131 8.2099 105.3830 44.1275 0.0000 171.2347 62 P 4.7497 0.0000 0.0000 62.1652 33.1360 175.5274 63 H 4.4907 8.3727 115.6446 55.3018 29.4065 175.0008 64 F 4.4761 9.3956 123.5502 58.6095 40.5403 174.0036 65 N 4.0544 7.9162 118.2149 52.4961 41.3834 171.8242 66 P 3.9836 0.0000 0.0000 63.3955 29.6318 179.0829 67 L 4.1768 8.5223 132.4033 54.3484 44.0490 175.0701 *78 E 4.1681 8.5501 122.8954 55.2030 31.0368 175.0564 79 R 4.2836 7.7821 117.8247 55.6397 31.0106 175.5209 80 H 4.5218 8.5576 122.7502 55.2370 29.7125 175.9808 81 V 3.3867 8.1519 124.6708 66.2120 31.2719 177.6258 82 G 3.7417 8.1107 106.5220 46.6468 0.0000 172.6807 83 D 4.8024 8.0740 121.3302 54.0561 40.3766 175.9485 84 L 4.6400 8.5797 123.7479 54.2930 43.2440 177.4541 85 G 4.1431 8.2715 108.0237 45.0850 0.0000 174.6187 86 N 5.6606 8.5379 121.0606 51.4032 42.8148 172.7287 87 V 4.4612 8.7360 112.7532 59.8736 35.8016 174.9456 88 T 5.0927 8.2937 118.3612 61.8205 71.6879 172.7166 89 A 5.0144 9.0975 128.9523 50.3739 21.4232 177.3345 90 D 4.6163 8.8627 123.0746 52.3361 41.1953 176.9517 91 K 4.0670 8.5436 117.0728 59.7731 32.6113 177.0888 92 D 4.5774 8.8844 118.8182 53.8990 40.9681 177.1416 93 G 4.3681 8.2817 107.8647 44.8840 0.0000 172.8961 94 V 4.7965 7.7180 119.3461 60.7876 34.0257 174.1134 95 A 5.2756 9.2118 129.5831 49.3877 21.3619 174.4701 96 D 4.8174 8.7040 123.1602 53.2284 42.4414 175.5406 97 V 4.2496 8.7394 126.9269 61.4942 33.7953 174.9693 98 S 4.7451 8.3224 121.8591 58.0173 64.1789 173.1225 99 I 4.8947 9.1856 128.0396 59.6335 42.0853 174.1295 100 E 5.0876 8.7129 123.6846 54.7592 32.4298 174.0693 101 D 4.9980 9.3834 126.0903 52.3357 44.9964 175.6109 102 S 4.8172 8.8184 117.8497 58.2058 63.7082 174.6266 103 V 4.0410 9.5531 122.7521 65.0759 31.9401 176.7171 104 I 4.1135 7.7761 110.9080 61.0220 38.4172 174.4204 105 S 4.6420 8.5140 114.0214 57.5355 65.3919 174.2194 106 L 4.6038 9.0466 123.5057 54.3334 41.5204 176.3342 107 S 4.4371 7.9063 112.8363 58.4476 66.3112 175.6221 108 G 3.8517 8.4756 108.4391 44.9646 0.0000 173.6768 109 D 4.4496 8.7415 117.3517 57.1932 41.2961 176.9332 110 H 5.0418 8.0750 114.6276 55.3805 29.0733 173.6692 111 C 4.4707 8.0079 121.2400 60.0919 31.5995 173.4615 112 I 3.9235 8.3803 119.2311 60.3649 37.7466 175.2872 113 I 3.7768 7.2278 122.7447 62.6674 37.7151 176.2996 114 G 3.8323 9.2328 113.8247 44.9833 0.0000 172.8976 115 R 4.8974 7.3218 118.4888 54.9048 33.5609 174.6958 116 T 5.0312 8.0107 115.5933 62.0339 71.5486 173.6211 117 L 4.9656 8.5671 127.3487 53.5122 44.4256 175.2705 118 V 4.9645 9.1714 125.6250 61.0020 35.3705 174.1209 119 V 5.0117 8.5452 126.8020 60.5066 33.4183 174.6905 120 H 5.1425 9.4020 122.8119 54.4851 29.9137 175.0285 121 E 4.1777 9.4782 123.1784 59.2297 29.8349 177.3079 122 K 4.7473 7.9937 117.0795 54.1213 35.2260 176.0869 123 A 4.3919 8.4180 124.5064 52.2187 18.9629 176.8445 124 D 4.6254 9.9923 121.2796 53.0738 41.5958 176.2067 125 D 4.3529 8.7208 127.0383 56.1151 41.7164 176.3826 126 L 4.2837 7.7199 120.6995 53.3811 41.0285 176.1786 127 G 5.0615 7.0249 117.7724 46.2912 0.0000 173.4236 *141 G 3.8940 7.8024 107.2093 44.1049 0.0000 173.4885 142 S 4.8237 6.2642 111.1287 55.8924 68.0740 175.1140 143 R 4.3643 8.4946 119.9213 55.7176 29.6222 176.6068 144 L 4.2606 8.8360 125.7952 57.5901 42.8801 177.2187 145 A 4.8096 7.7341 117.7261 51.5792 22.8365 173.8210 146 C 5.3355 8.4907 113.6362 56.0083 47.0353 172.6284 147 G 4.7585 8.0275 103.1668 46.3032 0.0000 172.8445 148 V 4.4297 8.3623 121.0281 62.1832 32.9152 175.6474 149 I 4.1976 8.8066 128.9814 60.7692 37.9051 175.4394 150 G 4.3996 8.7909 114.8725 43.9664 0.0000 171.9630 151 I 4.2895 8.2440 121.1958 61.1521 37.4873 175.7977 152 A 4.7648 8.3127 128.5234 49.7580 21.9221 176.3858 153 Q 4.0732 8.4669 118.7017 56.4655 29.2246 175.8591 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 1 A 8.16 4.65 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 2 T 7.54 4.23 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 1.22 0.00 0.00 3 K 8.84 5.32 0.00 1.71 1.73 0.00 1.76 0.00 0.00 2.05 0.00 0.00 2.98 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.53 1.49 7.81 4 A 8.99 5.26 1.12 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 5 V 8.91 5.02 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 0.69 0.00 0.00 0.97 0.00 0.00 6 C 8.93 4.86 0.00 3.14 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 7 V 8.50 4.67 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.89 5.03 0.00 1.67 1.58 0.96 0.36 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 9 K 9.15 4.88 0.00 1.62 1.63 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.89 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 0.00 0.00 0.00 0.00 11 D 8.77 4.52 0.00 2.68 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 12 G 7.64 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 0.00 0.00 0.00 0.00 13 P 0.00 4.49 0.00 2.18 2.17 0.00 3.77 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 2.09 1.94 0.00 14 V 7.57 4.15 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 0.79 0.00 0.00 0.94 0.00 0.00 15 Q 8.07 5.05 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.40 0.00 0.00 0.00 0.00 0.00 2.46 2.13 0.00 16 G 7.85 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 0.00 0.00 0.00 0.00 17 I 7.91 5.20 1.82 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 1.21 1.11 0.83 0.00 0.00 18 I 8.64 4.65 1.81 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 1.25 1.33 0.44 0.00 0.00 19 N 8.35 5.18 0.00 1.44 1.53 0.00 0.00 6.71 8.01 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 20 F 9.01 5.43 0.00 2.87 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 9.48 5.13 0.00 2.50 2.12 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 2.33 2.41 0.00 22 Q 9.22 4.97 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 23 K 8.89 4.14 0.00 1.81 1.89 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.48 1.50 7.81 24 E 7.79 4.72 0.00 1.98 1.78 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 2.30 2.29 0.00 25 S 8.76 4.03 0.00 3.83 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 26 N 8.16 4.84 0.00 2.85 2.86 0.00 0.00 5.91 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.17 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.72 0.00 2.00 2.03 0.00 3.67 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 29 V 9.00 4.65 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 1.28 0.00 0.00 1.07 0.00 0.00 30 K 9.52 5.13 0.00 1.95 1.92 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.45 1.44 7.81 31 V 9.21 5.41 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 0.91 0.00 0.00 0.88 0.00 0.00 32 W 8.04 5.35 0.00 3.50 3.28 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 33 G 7.46 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 0.00 0.00 0.00 34 S 7.78 5.07 0.00 3.94 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 35 I 8.79 5.10 1.80 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 1.27 0.84 0.94 0.00 0.00 36 K 9.36 4.80 0.00 1.71 1.87 0.00 1.33 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.34 7.81 37 G 8.85 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 0.00 0.00 0.00 38 L 7.76 4.53 0.00 1.96 1.56 0.77 0.45 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 39 T 8.15 4.39 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 1.24 0.00 0.00 40 E 8.65 4.13 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 41 G 8.41 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 0.00 0.00 0.00 42 L 8.14 4.78 0.00 1.48 1.57 0.90 0.92 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 43 H 9.15 4.89 0.00 3.04 3.29 0.00 5.63 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 44 G 9.22 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 45 F 9.26 5.60 0.00 3.06 2.98 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 46 R 9.06 5.09 0.00 1.84 1.85 0.00 3.17 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 47 V 8.62 4.58 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.89 0.00 0.00 48 H 9.36 5.18 0.00 3.06 3.40 0.00 5.71 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.77 3.59 0.00 1.67 1.12 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 1.47 1.96 0.00 50 F 8.20 5.03 0.00 3.36 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 51 G 8.52 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.98 4.79 0.00 2.65 2.84 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 53 N 8.55 5.17 0.00 2.68 2.72 0.00 0.00 7.26 7.70 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 54 T 8.84 3.92 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 1.23 0.00 0.00 55 A 8.37 4.67 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 56 G 7.74 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 0.00 0.00 0.00 57 C 8.55 4.52 0.00 2.95 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.47 3.86 4.39 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 1.23 0.00 0.00 59 S 7.58 4.38 0.00 4.21 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 60 A 7.44 4.80 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 61 G 8.21 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 62 P 0.00 4.75 0.00 2.10 2.21 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 63 H 8.37 4.49 0.00 3.02 3.18 0.00 5.55 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.40 4.48 0.00 2.92 2.98 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 65 N 7.92 4.05 0.00 2.39 2.46 0.00 0.00 7.13 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 3.98 0.00 1.97 1.70 0.00 3.16 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.45 0.00 67 L 8.52 4.18 0.00 1.54 1.54 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 *78 E 8.55 4.17 0.00 1.93 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 2.18 2.36 0.00 79 R 7.78 4.28 0.00 1.78 1.81 0.00 3.31 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 80 H 8.56 4.52 0.00 3.35 2.94 0.00 5.72 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.15 3.39 1.42 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 0.56 0.00 0.00 0.37 0.00 0.00 82 G 8.11 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 0.00 0.00 0.00 83 D 8.07 4.80 0.00 2.73 2.63 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 84 L 8.58 4.64 0.00 1.93 1.88 0.83 1.03 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 85 G 8.27 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.54 5.66 0.00 2.58 2.70 0.00 0.00 6.54 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 87 V 8.74 4.46 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 -0.27 0.00 0.00 0.80 0.00 0.00 88 T 8.29 5.09 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 1.25 0.00 0.00 89 A 9.10 5.01 1.30 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 0.00 0.00 0.00 90 D 8.86 4.62 0.00 2.88 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 91 K 8.54 4.07 0.00 1.88 2.11 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.88 4.58 0.00 2.78 2.72 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 0.00 0.00 0.00 0.00 93 G 8.28 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 0.00 0.00 0.00 0.00 94 V 7.72 4.80 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 1.08 0.00 0.00 0.97 0.00 0.00 95 A 9.21 5.28 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 96 D 8.70 4.82 0.00 2.66 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 97 V 8.74 4.25 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 0.69 0.00 0.00 0.60 0.00 0.00 98 S 8.32 4.75 0.00 3.92 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 99 I 9.19 4.89 1.98 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.57 1.01 0.00 0.00 100 E 8.71 5.09 0.00 1.95 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 2.22 2.34 0.00 101 D 9.38 5.00 0.00 2.79 2.52 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 0.00 102 S 8.82 4.82 0.00 4.01 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 0.00 103 V 9.55 4.04 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 0.78 0.00 0.00 0.95 0.00 0.00 104 I 7.78 4.11 1.95 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 1.61 0.82 1.02 0.00 0.00 105 S 8.51 4.64 0.00 3.92 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 0.00 106 L 9.05 4.60 0.00 1.76 1.64 1.03 0.61 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 0.00 107 S 7.91 4.44 0.00 3.89 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 0.00 108 G 8.48 3.85 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 0.00 0.00 0.00 109 D 8.74 4.45 0.00 2.64 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 0.00 110 H 8.07 5.04 0.00 3.21 3.39 0.00 5.65 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.01 4.47 0.00 2.94 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 0.00 112 I 8.38 3.92 1.61 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.24 0.96 0.00 0.00 113 I 7.23 3.78 1.77 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 1.18 0.34 0.88 0.00 0.00 114 G 9.23 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 0.00 0.00 0.00 115 R 7.32 4.90 0.00 1.58 1.79 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.24 0.00 116 T 8.01 5.03 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 0.00 117 L 8.57 4.97 0.00 1.78 1.52 0.43 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 118 V 9.17 4.96 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 0.76 0.00 0.00 0.71 0.00 0.00 119 V 8.55 5.01 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 0.78 0.00 0.00 0.99 0.00 0.00 120 H 9.40 5.14 0.00 3.10 3.33 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.48 4.18 0.00 2.01 2.18 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 2.37 2.36 0.00 122 K 7.99 4.75 0.00 1.77 1.69 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.45 7.81 123 A 8.42 4.39 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 0.00 124 D 9.99 4.63 0.00 2.53 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.72 4.35 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 7.72 4.28 0.00 1.95 1.86 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 127 G 7.02 5.06 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 *141 G 7.80 3.89 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 0.00 0.00 0.00 142 S 6.26 4.82 0.00 3.82 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.49 4.36 0.00 1.68 1.85 0.00 3.18 0.00 0.00 3.17 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 144 L 8.84 4.26 0.00 1.72 1.69 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.73 4.81 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 0.00 146 C 8.49 5.34 0.00 2.95 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 0.00 147 G 8.03 4.76 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 0.00 0.00 0.00 148 V 8.36 4.43 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.98 0.00 0.00 149 I 8.81 4.20 1.78 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.56 0.41 0.00 0.00 150 G 8.79 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.24 4.29 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 1.24 0.54 0.91 0.00 0.00 152 A 8.31 4.76 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 0.00 153 Q 8.47 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.