NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2421 7.8827 121.4467 61.2166 38.6721 173.7758 17 V 4.3134 8.6864 126.2357 61.8998 32.6452 174.6637 18 G 4.0871 8.5255 114.0696 46.6713 0.0000 173.4617 19 G 4.1705 7.6340 109.7079 44.4640 0.0000 172.6634 20 Y 4.9452 7.8093 116.8355 55.2164 42.1523 174.9793 21 T 4.1701 8.5959 117.4937 64.2004 68.4063 174.9965 22 C 4.2621 8.6243 125.4731 59.9211 35.3511 175.4927 23 G 4.0396 8.4468 105.5155 44.6906 0.0000 172.6713 24 A 4.3286 8.3995 125.3186 53.4901 18.6877 177.1563 25 N 4.3025 8.9432 118.8804 54.3372 36.0845 175.3770 26 T 4.1561 7.7020 108.0066 62.9167 69.7721 175.2216 27 V 4.0595 7.0738 122.2397 60.3079 31.3512 173.6071 28 P 4.4794 0.0000 0.0000 64.1942 32.1773 178.2769 29 Y 4.8908 7.0258 115.9772 57.0671 38.7748 174.5763 30 Q 4.5794 7.4547 123.6257 56.2311 29.5230 175.4954 31 V 4.8345 9.0327 119.4230 59.6905 35.7562 174.2221 32 S 4.9309 8.6814 117.4227 56.6649 64.6072 172.7347 33 L 4.6224 8.4779 127.7675 53.5204 43.1316 175.0941 34 N 5.7264 8.9946 122.5198 49.8834 42.0308 174.8668 *37 S 4.1895 8.3661 120.7062 58.3135 64.0430 174.5546 38 G 3.9607 9.6991 106.9196 45.9672 0.0000 172.3333 39 Y 4.5122 6.6177 115.0021 56.2029 39.8901 172.5427 40 H 4.5364 8.9370 121.8949 56.1669 30.3396 174.7532 41 F 5.0293 7.7786 120.3887 57.0743 39.8549 174.4599 42 C 4.5914 6.7506 114.9957 59.0244 32.6452 173.3745 43 G 4.2617 8.7469 109.5349 45.7012 0.0000 172.3125 44 G 4.5437 8.1254 105.7803 46.3284 0.0000 172.6052 45 S 5.4100 8.8503 115.5539 56.3668 66.6334 173.7270 46 L 4.7433 9.2706 128.2458 55.0522 42.2917 177.1479 47 I 4.4584 8.6685 119.8016 61.1394 38.7649 174.4156 48 N 4.7798 7.5835 117.2379 52.1621 39.4972 174.8447 49 S 4.2743 8.7012 111.6787 60.5119 63.2888 174.9073 50 Q 4.4922 8.9659 120.8366 55.2749 30.0661 174.1806 51 W 5.6912 8.2202 115.6233 55.7363 33.8294 174.1481 52 V 4.9462 9.2113 123.4673 61.1816 34.4198 174.1390 53 V 4.8207 8.8447 127.3953 61.9580 33.0878 174.8033 54 S 5.1100 9.0173 121.2994 57.5503 66.2670 171.8863 55 A 4.6132 8.5006 120.6838 50.7103 20.3063 178.2124 56 A 3.8218 8.4683 124.9316 55.5184 18.3126 179.4277 57 H 4.4233 8.1611 109.3024 57.6106 28.7308 175.9973 58 C 4.4466 7.6727 117.1768 60.6692 28.4102 173.3883 59 Y 4.0942 7.7515 122.1259 57.7563 38.7301 175.0468 60 K 3.7714 6.9024 123.5010 55.7772 34.9497 174.8953 61 S 4.0910 8.0230 115.6527 59.3135 63.2508 173.8539 62 G 3.7357 8.3522 107.4397 46.8218 0.0000 173.7169 63 I 4.1682 7.5641 120.2671 60.2777 38.8801 174.8318 64 Q 4.7931 8.8492 128.4774 54.2015 31.4158 174.2406 65 V 4.3008 8.7102 127.2634 62.0697 33.4375 174.6497 66 R 5.0295 8.9422 127.2901 54.6808 32.3636 174.9859 67 L 4.7700 9.1097 124.8891 52.8293 44.6031 177.8585 *69 G 4.2362 8.3422 108.4405 45.2470 0.0000 172.8235 70 E 4.3459 8.1575 118.6755 55.7406 29.7972 174.0602 71 D 4.8616 7.9326 117.6406 55.3749 44.2492 174.5407 72 N 4.9177 8.9088 121.6386 53.1408 39.0539 176.1317 73 I 3.7881 8.4424 119.9322 62.2146 37.8466 176.2975 74 N 4.7923 8.6089 118.0466 53.1002 39.2796 174.8391 75 V 4.3193 7.3972 117.2180 60.7191 34.4768 175.1246 76 V 4.0450 8.4388 126.6042 62.7461 30.7180 175.0958 77 E 4.3734 9.4667 127.6100 55.7295 30.6804 177.5892 78 G 3.8939 8.0651 105.4594 46.6337 0.0000 173.9383 79 N 4.5415 8.8651 116.2640 52.8888 36.5740 174.3385 80 E 4.5868 7.7127 117.3360 56.3332 30.7533 176.2168 81 Q 4.4966 9.0804 121.1808 54.2355 32.5021 174.1708 82 F 5.5571 8.8545 122.9272 56.0242 40.9012 175.3528 83 I 4.6900 8.8259 124.5041 59.3231 41.1267 175.3212 84 S 4.5569 8.7573 122.6190 58.2336 64.1579 173.4523 85 A 4.4318 8.5341 126.3203 52.3529 18.0089 177.6304 86 S 4.5343 9.0118 117.5435 59.0405 64.8425 174.9088 87 K 4.7168 7.6931 118.6038 54.5759 36.4979 175.7429 88 S 4.9694 8.8883 118.9537 57.2093 65.9990 173.9298 89 I 4.4634 9.3322 127.8723 59.2461 38.5646 175.4343 90 V 4.0808 8.2586 127.0957 62.3669 32.6428 175.1379 91 H 3.8843 8.7510 127.1060 56.0031 29.9852 174.5550 92 P 4.3505 0.0000 0.0000 65.1424 31.3945 177.1976 93 S 4.6764 8.0592 111.9874 58.0085 63.1823 173.2673 94 Y 4.2941 8.0977 123.5592 57.9507 38.8950 174.5386 95 N 4.5079 8.2225 126.0682 51.5152 39.9920 175.0575 96 S 3.9338 7.9198 119.5000 59.0198 63.8464 174.7277 97 N 4.4671 8.0481 118.3383 55.4811 39.0891 176.3003 98 T 3.8458 8.0077 106.1287 61.7501 69.4002 175.5868 99 L 3.7522 7.8863 120.6120 54.9861 39.9235 174.0836 100 N 4.4275 7.7044 117.7671 54.7591 39.5322 174.3085 101 N 4.5035 8.6034 118.4702 53.9502 35.9416 175.6920 102 D 4.6296 7.8981 117.6265 52.9369 39.8122 174.6717 103 I 4.7895 7.1354 120.9787 59.2536 42.2779 172.7907 104 M 5.5009 9.1731 126.9300 54.0772 36.3138 173.2999 105 L 5.4170 9.2805 124.8513 53.2281 44.7073 175.3177 106 I 4.9372 9.1473 124.3848 59.4285 40.1594 174.3753 107 K 3.7108 8.4549 128.8194 54.6130 33.5076 175.6535 108 L 4.4554 8.1806 128.0106 54.2274 41.8857 177.1725 109 K 4.0549 8.8001 124.7481 59.0005 32.6022 177.1766 110 S 4.7015 7.7504 112.7100 55.9148 66.7076 173.2879 111 A 4.3906 8.3832 124.0953 51.8941 18.7051 177.5664 112 A 4.1799 8.7910 124.0972 52.0473 19.5351 177.4646 113 S 4.4937 8.5304 116.5447 57.6636 63.6039 174.0387 114 L 4.6808 8.4261 125.5082 53.7503 42.6204 175.7965 115 N 4.7241 8.6343 118.6620 52.3962 40.0985 175.1307 116 S 4.2041 8.7088 111.9947 61.2486 63.1585 175.2870 117 R 4.1838 8.0518 118.5588 56.7039 30.4941 176.3813 118 V 4.4663 7.8508 116.6472 61.0246 33.5549 173.6595 119 A 5.1307 8.5716 128.2521 50.4215 22.8617 175.4203 120 S 4.9608 8.7427 114.6713 58.1256 64.6284 173.0443 121 I 4.4319 8.1797 121.3608 59.0806 39.7765 175.5416 122 S 4.3898 8.4216 124.4861 58.3830 63.9781 174.0170 123 L 4.2334 8.3511 122.9507 53.6836 42.3291 175.4255 124 P 4.4670 0.0000 0.0000 62.9658 31.5789 176.6483 125 T 4.1782 8.2648 110.0706 62.4924 70.0567 174.7135 *127 S 4.2575 7.5641 114.5271 57.9143 64.0215 174.0023 128 C 4.4224 8.4068 117.8943 56.7311 40.6889 173.4025 129 A 4.4922 7.9689 124.2891 51.3559 19.9601 177.4325 130 S 4.3750 8.0669 115.6851 57.1845 64.6238 173.5215 *132 A 4.2645 8.2193 124.3181 53.5516 19.1977 177.5071 133 G 3.9590 9.0992 111.3168 45.1684 0.0000 174.1152 134 T 3.9816 7.5741 117.6149 63.8505 69.4246 173.5443 135 Q 4.7376 8.5761 125.0264 55.5283 30.1097 175.6950 136 C 5.2428 9.2084 119.6253 55.1872 46.7243 172.3699 137 L 5.1707 9.0915 122.4894 53.5278 43.9994 175.0172 138 I 5.3138 9.0943 127.2919 58.7909 40.0917 174.8394 139 S 4.8741 8.5435 119.4167 56.5392 66.4860 173.0794 140 G 3.7556 7.5617 108.1024 46.3260 0.0000 173.0622 141 W 4.5898 8.6981 116.8362 56.3166 29.3053 177.0742 142 G 4.1519 8.5344 109.6371 44.2455 0.0000 173.4041 143 N 3.6265 8.5557 118.3722 54.2803 38.9179 174.6781 144 T 5.0708 8.1380 113.2157 60.5375 69.5386 174.3279 145 K 4.6358 7.7694 121.5129 54.7558 34.6044 176.3708 146 S 4.3653 8.6192 117.1380 59.8277 63.7139 174.5376 147 S 4.4848 7.8300 114.9170 57.4366 65.2587 174.6292 148 G 3.8615 9.6252 113.3978 44.3392 0.0000 171.6487 149 T 4.8971 7.9753 107.3927 60.2725 72.0646 173.7039 150 S 4.5679 9.1850 119.1073 57.4678 66.1772 171.9485 151 Y 4.9117 8.7195 125.1286 55.5425 39.6194 174.1105 152 P 4.6933 0.0000 0.0000 62.2112 33.0753 176.1707 153 D 4.5187 8.8284 119.3084 57.1621 41.1018 177.1125 154 V 5.3151 7.3967 109.5851 58.5736 34.3543 175.6326 155 L 3.1803 8.3715 123.9035 54.9125 43.0072 175.9519 156 K 4.9168 8.1346 124.6671 54.8899 35.3754 174.5192 157 C 5.2485 8.4195 118.9619 55.2301 43.5667 172.9837 158 L 4.9968 8.6562 122.6080 53.7145 45.5298 174.7765 159 K 5.0771 9.0066 125.4263 55.6929 33.3719 175.9853 160 A 4.8909 9.2888 125.5517 50.1039 23.1143 173.5466 161 P 5.0486 0.0000 0.0000 61.6960 34.0581 175.1256 162 I 4.3788 8.3864 122.8265 61.5075 38.0245 175.8430 163 L 4.8002 8.7180 127.3943 53.2896 43.2452 177.0102 164 S 4.3049 8.4663 115.0289 58.1890 63.8620 174.9534 165 D 4.3870 8.6867 120.9541 57.4005 40.8568 178.8209 166 S 4.1615 7.9941 114.6213 61.5734 63.2437 176.5541 167 S 4.1054 8.1975 118.9782 61.1959 62.5223 175.8355 168 C 4.3439 8.4204 121.3129 59.7899 42.7829 175.8967 169 K 4.0027 8.2328 119.9983 59.3796 31.3594 179.6308 170 S 4.1876 8.1662 114.9750 61.4626 62.7819 176.2051 171 A 3.9969 7.9375 122.7081 53.9560 19.7544 177.4339 172 Y 4.9604 7.9078 113.8325 55.5227 38.4691 173.2183 173 P 4.5948 0.0000 0.0000 63.4954 32.2627 177.9397 174 G 3.9848 9.0289 109.0646 46.0535 0.0000 173.6129 175 Q 4.5242 8.1652 116.1829 55.2429 30.4184 175.2731 176 I 4.4450 7.8565 119.7053 59.7984 38.5139 175.5903 177 T 4.4944 8.2562 116.2570 59.8502 70.5380 175.6108 178 S 4.2916 8.5677 115.3739 60.6499 63.0665 174.5559 179 N 5.0245 8.2243 118.4971 53.2420 38.5425 173.8115 180 M 5.5920 7.9645 116.6206 53.7555 36.1135 174.5693 181 F 5.1211 8.7462 115.1432 55.7329 42.2283 172.5724 182 C 5.4761 8.9480 116.2478 55.8920 39.5642 172.6885 183 A 5.0491 9.4005 122.6501 50.8383 22.4391 174.3051 184A G 4.1440 7.6560 105.5658 44.3630 0.0000 175.1462 184 Y 4.5932 8.5199 122.0193 56.3262 41.3368 175.8975 185 L 4.2713 8.6714 125.2433 56.7865 42.1218 178.3958 186 E 4.0445 8.2125 115.1611 56.7863 30.0948 177.8815 187 G 3.9829 7.4027 104.5661 46.4166 0.0000 173.8300 188A G 3.9476 9.8563 107.8902 44.6194 0.0000 173.4733 188 K 4.8448 7.3525 117.7468 55.4902 35.4670 174.9204 189 D 4.7010 8.8759 123.6174 53.5053 45.5635 174.9179 190 S 4.9266 8.1942 115.1378 58.3510 64.9825 171.6327 191 C 4.7696 9.0615 118.6366 55.4200 44.8174 172.4465 192 Q 4.4349 8.5797 119.3557 57.9108 28.5484 178.2534 193 G 4.3532 9.2686 110.0338 45.6407 0.0000 173.8542 194 D 4.7637 8.2110 118.1729 54.8437 41.7956 176.8744 195 S 4.5534 7.9432 116.1520 60.1876 63.5134 175.3945 196 G 3.9980 8.8147 112.1793 46.4439 0.0000 173.8368 197 G 4.5144 7.8385 107.6379 44.7495 0.0000 171.0996 198 P 5.1253 0.0000 0.0000 62.2725 33.5327 175.6828 199 V 4.5785 8.6963 121.5315 61.4375 34.0938 174.0684 200 V 4.8948 8.7071 128.7660 61.2586 34.1924 173.7235 201 C 5.0853 8.8985 124.6631 55.5865 43.8892 174.5856 202 S 3.4744 9.8880 121.1262 59.6940 60.1266 173.4090 203 G 3.9256 8.4637 104.7633 45.4499 0.0000 173.7841 204 K 4.7737 7.6734 118.1998 53.1736 34.9630 175.4269 *209 L 4.3419 8.2417 123.2949 55.4342 41.9032 175.7157 210 Q 4.4378 8.7662 125.5732 56.6836 30.5472 175.7623 211 G 5.3206 8.0696 104.6868 45.5716 0.0000 171.3620 212 I 5.3089 8.2093 119.9513 58.8156 40.9194 175.2847 213 V 3.8068 8.8637 127.3572 64.1259 31.8041 174.1310 214 S 4.8215 8.4470 120.5965 58.3821 64.2508 173.6642 215 W 4.9204 7.5582 114.0048 55.7317 31.9404 172.2718 216 G 3.9855 8.3696 106.0868 46.1156 0.0000 172.9955 217 S 4.6137 8.7122 115.6942 56.9775 62.8291 173.1936 *219 G 4.3795 8.4561 117.6435 45.5692 0.0000 169.5529 220 C 4.9365 8.0601 112.2848 54.7838 44.5239 173.7751 221A A 3.9225 9.3281 124.8466 53.2614 16.6224 176.9384 221 Q 4.5667 7.3232 118.0077 55.9844 29.8880 175.8671 222 K 4.1335 8.4618 122.1884 58.2284 32.5695 176.2525 223 N 4.3335 9.0886 121.8407 53.9684 36.6508 175.3651 224 K 4.2340 7.6162 117.8884 53.7815 32.6021 173.9826 225 P 4.6603 0.0000 0.0000 61.6922 33.2506 176.7583 226 G 3.6161 8.5183 107.0864 46.1064 0.0000 172.7922 227 V 4.4183 7.5317 121.6183 60.6410 34.2014 174.0681 228 Y 4.9603 8.1285 124.4668 55.9614 42.1517 175.0221 229 T 4.3823 8.6322 120.1852 63.7141 70.1266 174.2065 230 K 5.1310 9.2756 128.0744 55.3530 31.4198 177.2934 231 V 3.9600 8.9445 126.5166 65.6961 31.4326 174.9059 232 C 4.3733 8.3015 112.7882 58.2654 41.4978 174.9785 233 N 4.1742 8.0287 117.3943 54.7741 38.5072 175.6044 234 Y 4.7334 7.9445 117.4801 57.4615 38.7477 177.4393 235 V 3.6894 7.7877 121.2186 66.3421 31.6334 178.0337 236 S 4.1458 8.0942 114.4004 61.2423 62.6788 176.3022 237 W 4.1166 8.3073 130.6865 60.4210 30.4608 177.9477 238 I 3.2528 8.4041 120.1472 64.2195 36.5777 178.5847 239 K 3.7705 8.0379 119.2378 59.5845 31.7442 179.5354 240 Q 3.8842 8.1485 118.5104 59.0927 28.3342 179.0137 241 T 3.5509 7.2304 116.0266 66.3478 68.7071 176.6609 242 I 2.7421 7.2569 121.7118 63.9955 36.7898 178.4147 243 A 4.0107 7.7094 120.4710 54.3007 18.2224 178.7411 244 S 4.5741 7.4163 110.1021 58.4731 63.6547 174.1225 245 N 4.6800 7.9081 125.5076 53.7815 39.1913 173.9888 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 16 I 7.88 4.24 1.78 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 0.56 0.86 0.00 0.00 17 V 8.69 4.31 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 0.98 0.00 0.00 0.93 0.00 0.00 18 G 8.53 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 0.00 0.00 0.00 0.00 19 G 7.63 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 0.00 0.00 0.00 0.00 20 Y 7.81 4.95 0.00 3.02 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 21 T 8.60 4.17 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 1.22 0.00 0.00 22 C 8.62 4.26 0.00 2.73 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 23 G 8.45 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 24 A 8.40 4.33 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 25 N 8.94 4.30 0.00 2.90 2.94 0.00 0.00 7.15 7.54 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 26 T 7.70 4.16 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 1.26 0.00 0.00 27 V 7.07 4.06 1.73 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 0.31 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.48 0.00 2.37 2.39 0.00 3.66 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.99 0.00 29 Y 7.03 4.89 0.00 3.28 3.44 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 30 Q 7.45 4.58 0.00 1.78 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 1.89 2.49 0.00 31 V 9.03 4.83 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 0.92 0.00 0.00 0.99 0.00 0.00 32 S 8.68 4.93 0.00 3.01 3.29 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 33 L 8.48 4.62 0.00 0.46 0.89 0.76 0.12 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 34 N 8.99 5.73 0.00 2.39 2.43 0.00 0.00 6.78 8.48 0.00 0.00 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 S 8.37 4.19 0.00 3.76 3.64 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 38 G 9.70 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 0.00 0.00 0.00 39 Y 6.62 4.51 0.00 3.05 2.95 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 0.00 0.00 0.00 40 H 8.94 4.54 0.00 2.88 3.21 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.78 5.03 0.00 3.00 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 42 C 6.75 4.59 0.00 2.17 2.66 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 43 G 8.75 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 44 G 8.13 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 45 S 8.85 5.41 0.00 3.82 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 46 L 9.27 4.74 0.00 1.87 1.69 1.09 1.06 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 47 I 8.67 4.46 1.91 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 1.57 0.92 0.96 0.00 0.00 48 N 7.58 4.78 0.00 3.00 3.01 0.00 0.00 6.03 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 49 S 8.70 4.27 0.00 4.21 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 0.00 50 Q 8.97 4.49 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.80 0.00 0.00 0.00 0.00 0.00 1.91 2.13 0.00 51 W 8.22 5.69 0.00 3.40 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 52 V 9.21 4.95 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 1.06 0.00 0.00 0.99 0.00 0.00 53 V 8.84 4.82 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 1.03 0.00 0.00 1.03 0.00 0.00 54 S 9.02 5.11 0.00 3.90 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 55 A 8.50 4.61 1.19 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 56 A 8.47 3.82 0.37 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 57 H 8.16 4.42 0.00 3.35 3.47 0.00 5.56 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.67 4.45 0.00 3.21 3.18 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 59 Y 7.75 4.09 0.00 2.99 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 60 K 6.90 3.77 0.00 1.51 1.40 0.00 0.61 0.00 0.00 1.16 0.00 0.00 2.33 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.75 0.99 7.81 61 S 8.02 4.09 0.00 3.77 3.76 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 62 G 8.35 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 63 I 7.56 4.17 1.84 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 1.37 0.75 0.92 0.00 0.00 64 Q 8.85 4.79 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.07 2.20 0.00 65 V 8.71 4.30 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 0.97 0.00 0.00 0.89 0.00 0.00 66 R 8.94 5.03 0.00 1.60 1.83 0.00 2.62 0.00 0.00 2.44 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.12 0.00 67 L 9.11 4.77 0.00 1.66 1.62 1.03 0.61 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 *69 G 8.34 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 0.00 0.00 0.00 0.00 70 E 8.16 4.35 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 2.37 2.05 0.00 71 D 7.93 4.86 0.00 2.78 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 72 N 8.91 4.92 0.00 2.83 2.84 0.00 0.00 7.18 7.35 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 73 I 8.44 3.79 1.45 0.00 0.00 0.51 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 0.54 -0.39 0.00 0.00 74 N 8.61 4.79 0.00 2.84 2.88 0.00 0.00 6.62 7.58 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 75 V 7.40 4.32 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.44 4.05 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 0.82 0.00 0.00 0.95 0.00 0.00 77 E 9.47 4.37 0.00 1.98 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 2.28 2.44 0.00 78 G 8.07 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 79 N 8.87 4.54 0.00 2.97 3.05 0.00 0.00 6.97 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 80 E 7.71 4.59 0.00 1.57 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 2.45 2.47 0.00 81 Q 9.08 4.50 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 82 F 8.85 5.56 0.00 2.81 2.95 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 0.00 0.00 0.00 83 I 8.83 4.69 1.87 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 1.25 0.87 0.93 0.00 0.00 84 S 8.76 4.56 0.00 3.75 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 85 A 8.53 4.43 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 86 S 9.01 4.53 0.00 3.77 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 87 K 7.69 4.72 0.00 1.56 1.72 0.00 1.62 0.00 0.00 1.91 0.00 0.00 2.81 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.41 1.35 7.81 88 S 8.89 4.97 0.00 4.00 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 89 I 9.33 4.46 2.16 0.00 0.00 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 1.25 1.03 1.08 0.00 0.00 90 V 8.26 4.08 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 0.69 0.00 0.00 0.83 0.00 0.00 91 H 8.75 3.88 0.00 2.89 3.08 0.00 5.65 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.35 0.00 2.10 2.15 0.00 3.37 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 93 S 8.06 4.68 0.00 3.89 3.86 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 94 Y 8.10 4.29 0.00 2.99 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 95 N 8.22 4.51 0.00 2.57 2.43 0.00 0.00 6.57 7.74 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 96 S 7.92 3.93 0.00 3.96 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 97 N 8.05 4.47 0.00 2.73 2.77 0.00 0.00 6.97 7.54 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 98 T 8.01 3.85 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 1.11 0.00 0.00 99 L 7.89 3.75 0.00 1.53 1.82 0.17 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.70 4.43 0.00 2.77 2.64 0.00 0.00 7.21 5.99 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 0.00 101 N 8.60 4.50 0.00 2.87 2.52 0.00 0.00 7.22 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 0.00 102 D 7.90 4.63 0.00 3.07 2.66 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 0.00 103 I 7.14 4.79 1.42 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 1.31 1.30 0.05 0.00 0.00 104 M 9.17 5.50 0.00 2.23 1.84 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.65 0.00 105 L 9.28 5.42 0.00 1.84 1.96 1.11 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.15 4.94 1.93 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 1.18 0.93 0.92 0.00 0.00 107 K 8.45 3.71 0.00 0.79 1.06 0.00 1.34 0.00 0.00 1.35 0.00 0.00 2.81 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.72 0.21 7.81 108 L 8.18 4.46 0.00 1.45 1.58 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.80 4.05 0.00 1.81 1.79 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.39 7.81 110 S 7.75 4.70 0.00 3.82 3.67 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 0.00 111 A 8.38 4.39 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 0.00 112 A 8.79 4.18 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 0.00 113 S 8.53 4.49 0.00 3.92 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 0.00 114 L 8.43 4.68 0.00 1.65 1.61 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.63 4.72 0.00 2.89 2.92 0.00 0.00 6.63 8.09 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 0.00 116 S 8.71 4.20 0.00 4.02 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 0.00 117 R 8.05 4.18 0.00 1.97 2.03 0.00 3.17 0.00 0.00 3.16 7.36 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.26 0.00 4.00 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 0.00 128 C 8.41 4.42 0.00 2.94 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 0.00 129 A 7.97 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.07 4.38 0.00 3.84 3.75 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 *132 A 8.22 4.26 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 0.00 133 G 9.10 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 0.00 0.00 0.00 134 T 7.57 3.98 4.16 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 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.58 4.74 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 136 C 9.21 5.24 0.00 2.85 2.99 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 0.00 137 L 9.09 5.17 0.00 1.75 1.57 1.03 1.18 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 0.00 138 I 9.09 5.31 1.87 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.62 0.99 0.00 0.00 139 S 8.54 4.87 0.00 3.56 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 0.00 140 G 7.56 3.76 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 0.00 141 W 8.70 4.59 0.00 3.09 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 0.00 142 G 8.53 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 0.00 143 N 8.56 3.63 0.00 2.23 2.61 0.00 0.00 7.12 7.31 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 0.00 144 T 8.14 5.07 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 1.24 0.00 0.00 145 K 7.77 4.64 0.00 1.79 1.87 0.00 1.72 0.00 0.00 1.88 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.30 1.33 7.81 146 S 8.62 4.37 0.00 4.27 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 0.00 147 S 7.83 4.48 0.00 3.94 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 0.00 148 G 9.63 3.86 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 0.00 0.00 0.00 149 T 7.98 4.90 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 1.31 0.00 0.00 150 S 9.19 4.57 0.00 3.85 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 0.00 151 Y 8.72 4.91 0.00 2.95 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 0.00 152 P 0.00 4.69 0.00 2.45 2.08 0.00 4.15 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.02 0.00 153 D 8.83 4.52 0.00 2.80 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 0.00 154 V 7.40 5.32 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 1.06 0.00 0.00 0.96 0.00 0.00 155 L 8.37 3.18 0.00 1.27 1.22 -0.72 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.13 4.92 0.00 1.64 1.48 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.45 7.81 157 C 8.42 5.25 0.00 1.60 2.20 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 0.00 158 L 8.66 5.00 0.00 1.69 1.46 0.99 1.18 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 0.00 159 K 9.01 5.08 0.00 1.81 1.82 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.52 1.66 7.81 160 A 9.29 4.89 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 0.00 161 P 0.00 5.05 0.00 2.02 2.08 0.00 3.08 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 162 I 8.39 4.38 1.77 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 1.13 0.59 0.82 0.00 0.00 163 L 8.72 4.80 0.00 1.56 1.60 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.47 4.30 0.00 4.00 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 0.00 165 D 8.69 4.39 0.00 2.76 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 0.00 166 S 7.99 4.16 0.00 4.10 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 0.00 167 S 8.20 4.11 0.00 3.91 3.95 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 0.00 0.00 0.00 168 C 8.42 4.34 0.00 3.19 3.30 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 0.00 169 K 8.23 4.00 0.00 1.97 1.89 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.54 1.66 7.81 170 S 8.17 4.19 0.00 3.97 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 0.00 171 A 7.94 4.00 1.09 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 0.00 0.00 0.00 172 Y 7.91 4.96 0.00 3.15 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 0.00 173 P 0.00 4.59 0.00 2.22 2.10 0.00 3.54 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.03 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 0.00 175 Q 8.17 4.52 0.00 2.46 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.61 0.00 0.00 0.00 0.00 0.00 2.27 2.56 0.00 176 I 7.86 4.45 1.98 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.97 1.00 0.00 0.00 177 T 8.26 4.49 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 1.25 0.00 0.00 178 S 8.57 4.29 0.00 4.01 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 0.00 179 N 8.22 5.02 0.00 2.94 3.12 0.00 0.00 6.58 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 0.00 180 M 7.96 5.59 0.00 1.88 2.10 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 181 F 8.75 5.12 0.00 3.08 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 0.00 182 C 8.95 5.48 0.00 2.98 3.09 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 0.00 183 A 9.40 5.05 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 184A G 7.66 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 0.00 184 Y 8.52 4.59 0.00 3.09 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 0.00 185 L 8.67 4.27 0.00 1.73 1.89 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.21 4.04 0.00 2.10 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 0.00 2.31 2.27 0.00 187 G 7.40 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 188A G 9.86 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.35 4.84 0.00 1.37 1.64 0.00 0.76 0.00 0.00 1.05 0.00 0.00 2.56 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.19 7.81 189 D 8.88 4.70 0.00 2.79 2.50 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 0.00 190 S 8.19 4.93 0.00 3.98 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 0.00 191 C 9.06 4.77 0.00 2.96 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 0.00 192 Q 8.58 4.43 0.00 2.34 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.21 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 193 G 9.27 4.35 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 0.00 194 D 8.21 4.76 0.00 3.01 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 0.00 195 S 7.94 4.55 0.00 3.98 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 0.00 196 G 8.81 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 0.00 197 G 7.84 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.13 0.00 2.35 2.40 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 199 V 8.70 4.58 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 0.84 0.00 0.00 0.55 0.00 0.00 200 V 8.71 4.89 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 0.68 0.00 0.00 0.63 0.00 0.00 201 C 8.90 5.09 0.00 2.78 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 0.00 202 S 9.89 3.47 0.00 3.94 3.88 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 0.00 0.00 0.00 203 G 8.46 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 0.00 204 K 7.67 4.77 0.00 1.81 1.64 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.24 4.34 0.00 1.51 1.65 1.02 0.78 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 0.00 210 Q 8.77 4.44 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.43 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 211 G 8.07 5.32 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 0.00 212 I 8.21 5.31 1.92 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 1.30 1.01 0.90 0.00 0.00 213 V 8.86 3.81 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 1.03 0.00 0.00 1.16 0.00 0.00 214 S 8.45 4.82 0.00 3.90 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 0.00 215 W 7.56 4.92 0.00 3.32 2.96 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 0.00 216 G 8.37 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 0.00 217 S 8.71 4.61 0.00 4.26 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 *219 G 8.46 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 0.00 0.00 0.00 0.00 220 C 8.06 4.94 0.00 3.20 3.16 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 0.00 0.00 0.00 0.00 221A A 9.33 3.92 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.32 4.57 0.00 2.31 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 222 K 8.46 4.13 0.00 1.98 1.73 0.00 2.01 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.04 7.81 223 N 9.09 4.33 0.00 2.86 2.85 0.00 0.00 6.78 7.42 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 0.00 224 K 7.62 4.23 0.00 1.82 1.77 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.25 1.40 7.81 225 P 0.00 4.66 0.00 2.13 2.10 0.00 3.54 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 226 G 8.52 3.62 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 0.00 227 V 7.53 4.42 0.67 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 0.34 0.00 0.00 -0.76 0.00 0.00 228 Y 8.13 4.96 0.00 1.43 2.30 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 0.00 229 T 8.63 4.38 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 1.19 0.00 0.00 230 K 9.28 5.13 0.00 2.13 1.92 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.61 7.81 231 V 8.94 3.96 2.35 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 1.22 0.00 0.00 1.07 0.00 0.00 232 C 8.30 4.37 0.00 3.16 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 0.00 233 N 8.03 4.17 0.00 2.43 2.39 0.00 0.00 6.83 7.24 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 0.00 234 Y 7.94 4.73 0.00 3.22 3.21 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 0.00 235 V 7.79 3.69 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 1.09 0.00 0.00 1.08 0.00 0.00 236 S 8.09 4.15 0.00 3.97 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 0.00 237 W 8.31 4.12 0.00 3.51 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 0.00 238 I 8.40 3.25 2.04 0.00 0.00 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 1.70 1.09 0.78 0.00 0.00 239 K 8.04 3.77 0.00 1.73 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.60 7.81 240 Q 8.15 3.88 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 241 T 7.23 3.55 3.31 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 0.76 0.00 0.00 242 I 7.26 2.74 1.41 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.01 0.44 0.00 0.00 243 A 7.71 4.01 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 0.00 244 S 7.42 4.57 0.00 3.95 3.92 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 0.00 0.00 0.00 245 N 7.91 4.68 0.00 3.08 3.04 0.00 0.00 6.76 7.54 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 * Residues marked with a * may have inaccurate shift predictions.