NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2494 7.8827 121.4451 61.2267 38.6373 173.8058 17 V 4.2886 8.7752 126.3625 61.9591 32.5536 174.5573 18 G 3.8630 8.4921 114.1690 46.7876 0.0000 173.5760 19 G 4.3062 7.7893 109.9470 44.5145 0.0000 172.7670 20 Y 4.9808 8.1324 118.3988 55.2981 42.2006 175.1898 21 T 4.0816 8.5752 117.5865 64.0082 68.4479 175.1515 22 C 4.1831 8.5457 125.3914 59.5531 35.7209 175.5673 23 G 3.9801 8.4428 105.6582 44.9975 0.0000 172.6154 24 A 4.3068 8.4502 125.9557 53.6784 18.6787 176.8601 25 N 4.2741 8.9094 118.9367 54.4725 36.1152 175.3809 26 T 4.1539 7.7088 107.6358 62.9010 69.8673 175.0103 27 V 4.0860 7.0816 121.8676 60.6121 31.3231 173.6605 28 P 4.4513 0.0000 0.0000 63.8592 32.2460 178.0765 29 Y 4.9860 6.9031 116.3386 57.0460 38.8901 174.8073 30 Q 4.5226 7.3728 123.5379 56.3205 29.4756 175.5912 31 V 4.8523 8.9995 119.2161 59.6909 35.8277 174.1948 32 S 4.9445 8.7417 117.2486 56.6745 64.7242 172.6856 33 L 4.7254 8.5585 127.4627 53.3716 43.3112 175.0164 34 N 5.8328 9.0167 122.3333 49.9700 42.0493 174.9726 *37 S 4.1768 8.4562 121.1772 58.2937 64.1385 174.5620 38 G 3.9424 9.3019 108.6837 46.2641 0.0000 172.8559 39 Y 4.5975 6.5539 114.8099 55.9554 40.0916 173.0195 40 H 4.5244 8.8847 121.9949 56.5517 30.3630 174.8569 41 F 5.0823 7.9536 119.2228 56.7156 39.6032 173.7084 42 C 4.7710 6.8804 115.0057 56.1893 44.7409 173.5598 43 G 4.2393 8.7715 109.6816 45.7618 0.0000 172.2294 44 G 4.5589 7.7209 102.5600 46.4283 0.0000 172.6508 45 S 5.3615 8.8069 115.4495 56.4218 66.7684 173.7033 46 L 4.8068 9.2644 128.1703 54.9706 42.3153 177.1078 47 I 4.5370 8.6809 119.9628 61.0996 38.7211 174.5428 48 N 4.7546 7.4982 117.0264 52.5174 39.3660 174.5837 49 S 4.3337 8.7059 111.3643 60.6636 63.4514 174.9873 50 Q 4.4985 8.1472 118.1153 55.1203 30.4290 174.5226 51 W 5.5585 8.0558 117.3000 54.7718 33.5227 174.2777 52 V 4.9153 9.1782 123.7194 61.1775 34.1904 174.1600 53 V 4.7910 8.9082 127.7182 61.8988 33.3756 174.7637 54 S 5.2338 9.0190 121.2800 57.1277 66.6087 172.0297 55 A 4.5437 8.7430 121.0262 50.4392 19.4865 178.6136 56 A 3.8260 8.3015 124.8774 55.2307 18.4298 179.1759 57 H 4.5288 8.4467 110.0663 57.5900 28.6667 175.4517 58 C 4.6668 7.8643 117.0299 57.2836 40.5336 173.3017 59 Y 4.2558 7.6929 122.1197 58.0216 38.7084 175.2760 60 K 3.3592 6.9603 123.4279 55.5856 34.8913 174.8671 61 S 4.2401 7.9508 114.5173 58.8037 63.9135 173.3565 62 G 3.7171 8.4334 106.5816 46.7445 0.0000 173.7237 63 I 4.1413 7.5860 119.8574 60.4411 38.9661 174.8870 64 Q 4.7204 8.9413 128.1315 54.2635 31.3512 174.2523 65 V 4.3322 8.6996 127.2337 62.0491 33.4598 174.6488 66 R 5.0675 8.9932 127.2382 54.6851 32.3567 174.9530 67 L 4.7862 9.2087 124.7794 52.7298 44.8134 177.7955 *69 G 4.0576 8.3337 108.3182 45.2384 0.0000 172.7290 70 E 4.3277 8.1973 118.8231 55.7146 29.7774 174.1225 71 D 4.8776 7.9706 118.6338 55.3429 44.5062 174.4954 72 N 4.9453 9.0776 119.2233 53.1084 39.3003 176.2606 73 I 3.9321 8.4614 120.0683 62.4096 37.9045 176.3000 74 N 4.7365 8.4655 117.8166 53.0847 39.1086 174.8891 75 V 4.3385 7.3642 116.8489 60.6613 34.3823 174.8958 76 V 4.0535 8.4958 126.9102 62.8477 31.3626 175.1290 77 E 4.4272 10.0954 127.3865 55.7760 30.6838 176.1851 78 G 3.6489 7.6932 107.1216 45.4551 0.0000 174.4365 79 N 4.8601 8.1687 116.6646 52.9473 39.1860 174.0395 80 E 4.5157 7.7775 117.7317 56.2837 30.9367 176.1107 81 Q 4.4648 9.1390 120.8818 54.2491 32.3488 174.3255 82 F 5.5764 8.8034 123.0962 56.0412 40.7903 175.3837 83 I 4.6789 8.8439 124.7896 59.3726 41.0015 175.4524 84 S 4.5911 8.7424 122.6571 58.2248 64.1377 173.5020 85 A 4.5724 8.6579 125.9802 52.2628 18.2319 177.7863 86 S 4.5919 8.7747 116.5536 59.6473 64.5307 174.3879 87 K 4.6092 7.4632 117.0986 56.0949 35.2432 174.5893 88 S 5.3047 8.7864 116.6556 57.0055 66.9042 173.8758 89 I 4.6076 9.0904 123.4104 59.6259 40.3033 174.8970 90 V 4.1762 8.4753 127.4887 62.1500 32.6551 175.1944 91 H 3.4524 8.5941 127.0690 55.7860 30.0570 174.5102 92 P 4.3375 0.0000 0.0000 65.0870 31.3327 177.1209 93 S 4.6824 7.9086 113.2276 58.0691 63.3217 173.1677 94 Y 4.3223 8.0491 123.4275 57.8452 38.9627 174.5796 95 N 4.6213 8.3407 125.7675 51.3554 40.0514 175.0803 96 S 3.8708 7.6357 120.3642 59.9384 63.7143 175.6054 97 N 4.3112 8.3112 119.2403 56.1583 38.2508 176.2031 98 T 3.9247 7.7141 104.7192 60.7490 69.7951 174.8914 99 L 3.7081 7.7569 120.5638 55.3598 40.0453 173.9084 100 N 4.3814 7.7540 118.1158 54.8231 39.4368 174.6705 101 N 4.8820 8.7384 121.1414 54.2246 36.1795 175.5947 102 D 4.6425 7.7398 118.0588 53.0231 40.1296 174.2046 103 I 4.8900 7.0556 120.8268 59.4048 42.2342 172.8135 104 M 5.4803 9.1777 126.9478 54.2105 36.2719 173.2621 105 L 5.4062 9.2748 124.5227 53.2358 44.8788 175.4445 106 I 5.0358 9.0693 123.3403 59.4958 40.5692 174.2952 107 K 3.9617 8.7018 128.8555 54.6331 32.4986 175.4660 108 L 4.4675 8.2899 127.4764 54.1552 42.4504 178.3044 109 K 4.2935 8.8398 122.9257 58.8785 32.4884 177.5352 110 S 4.5665 7.4453 110.3862 55.9083 66.0830 173.5565 111 A 4.3645 8.3891 123.7026 51.9170 18.7160 177.4366 112 A 4.2567 8.8657 124.1956 51.9905 19.5372 177.1358 113 S 4.4830 9.0869 116.1177 57.2526 63.0887 173.6409 114 L 4.7611 8.4246 127.8795 53.6580 42.9806 175.9630 115 N 4.7518 8.5258 119.3364 52.6751 39.8113 174.7521 116 S 4.3219 8.7008 111.4619 61.3778 63.5408 175.2728 117 R 4.1797 8.1567 118.6860 57.0886 30.4572 176.5179 118 V 4.5699 7.4962 118.1296 60.8555 34.3582 173.7501 119 A 5.1001 8.6117 127.5222 50.6775 22.8875 175.4070 120 S 5.0282 8.7015 114.5492 57.8858 64.8443 173.0361 121 I 4.3729 8.3355 121.8197 59.0922 39.4216 175.7300 122 S 4.2945 8.4150 124.7175 58.3090 63.4961 174.0067 123 L 4.3086 8.1629 123.9384 53.7945 42.2164 175.2502 124 P 4.5808 0.0000 0.0000 62.8816 32.6666 176.2484 125 T 4.0705 8.2830 115.8182 65.3500 69.3226 175.3697 *127 S 5.0395 7.5126 112.7125 57.9481 64.0687 174.0294 128 C 4.3746 8.3969 118.1103 56.6759 40.5895 173.9010 129 A 4.2508 7.3755 125.0676 51.9874 18.9472 177.3937 130 S 4.3454 8.1338 115.3120 57.2326 64.3438 173.7634 *132 A 4.1844 8.3039 125.9895 53.4201 19.2752 177.1960 133 G 3.9772 8.9175 111.3288 45.3164 0.0000 174.1571 134 T 4.0283 7.5695 117.6284 63.5110 69.4796 173.6755 135 Q 4.5737 8.6038 127.3896 56.1955 30.0940 175.3897 136 C 5.2705 9.2672 122.4037 55.0860 45.6782 172.4194 137 L 5.1408 9.0219 122.8205 53.6615 43.7257 175.0223 138 I 5.2817 9.0608 127.7154 58.9048 39.8912 174.9718 139 S 4.8519 8.4775 119.2012 56.5020 66.4498 173.0938 140 G 3.7524 7.5670 108.5094 46.3486 0.0000 172.9859 141 W 4.5922 8.6077 116.7792 56.2660 29.2142 176.9526 142 G 4.0821 8.5673 109.5728 44.2979 0.0000 173.3546 143 N 3.6142 8.2674 118.2762 54.2743 38.9099 174.5105 144 T 5.0440 8.1685 113.3342 60.5376 69.4457 174.2978 145 K 4.5784 7.6866 121.4935 54.6485 34.4683 176.2466 146 S 4.2611 8.7888 117.9908 60.4189 62.6257 173.9807 147 S 4.4966 8.1876 115.9375 58.9318 64.5544 173.7566 148 G 3.8643 9.6965 113.8907 44.3063 0.0000 171.0158 149 T 4.8339 7.9792 114.2191 62.0870 72.4819 173.9904 150 S 4.5573 9.3384 121.1456 57.4633 66.1133 172.0412 151 Y 4.8607 8.7998 125.2965 55.7151 39.4146 174.1172 152 P 4.7151 0.0000 0.0000 62.1638 33.0636 175.4779 153 D 4.6599 8.6591 117.7083 54.9016 40.4148 176.8920 154 V 5.2540 7.4213 110.9143 58.5999 34.0030 175.8395 155 L 3.2167 8.3978 124.4675 54.9667 42.9487 176.0076 156 K 4.8469 8.1427 125.0373 54.9228 35.1146 174.6034 157 C 5.2102 8.4291 119.3461 55.1543 43.2721 173.0256 158 L 5.0264 8.6444 122.8699 53.7676 45.4845 174.7444 159 K 5.0677 9.0800 125.8154 55.6664 33.2382 176.1059 160 A 4.8917 9.2553 126.2946 49.4148 23.0731 173.4758 161 P 5.0174 0.0000 0.0000 61.8694 33.7313 175.4755 162 I 4.4071 8.4848 123.0771 61.6928 37.9729 175.5953 163 L 4.8871 8.6956 127.1916 53.1029 43.3215 177.0323 164 S 4.2970 8.5357 115.5024 58.4199 63.7639 175.0872 165 D 4.4249 8.8388 122.2574 57.7351 40.5309 179.4240 166 S 4.1941 8.0197 114.5626 61.4458 63.1997 176.5770 167 S 4.1601 8.3698 118.0964 61.0023 62.8804 175.7256 168 C 4.3008 8.4669 122.3064 59.6311 41.4385 175.7533 169 K 4.0133 8.5180 120.5004 59.6181 31.3659 179.6062 170 S 4.1568 8.0984 114.5641 61.4053 62.7707 176.2504 171 A 3.9981 7.7938 122.9205 53.7578 19.7470 177.3250 172 Y 4.8537 7.7135 113.6886 55.4098 38.3215 173.0239 173 P 4.6041 0.0000 0.0000 63.2846 32.3870 177.5257 174 G 4.0264 9.0406 109.7524 46.0008 0.0000 173.7198 175 Q 4.5371 8.1461 116.2352 55.1603 30.9296 175.4582 176 I 4.3407 7.9511 119.4030 60.2512 37.9675 175.5798 177 T 4.5314 8.2732 115.9958 59.7797 70.6923 175.4274 178 S 4.3689 8.5273 115.0408 60.2677 63.2164 174.3595 179 N 4.9970 8.3043 119.0603 53.3601 38.4903 173.8636 180 M 5.5919 7.9414 116.8784 53.7428 36.1092 174.6036 181 F 5.1277 8.7813 115.5660 55.6399 42.1746 172.7066 182 C 5.3973 8.9488 116.5470 55.9965 40.8556 172.5904 183 A 5.0543 9.4269 122.6461 50.8514 22.3871 174.2486 183A G 3.9143 7.3043 106.3616 44.4033 0.0000 175.0435 184 Y 4.5526 8.4985 122.6550 56.1363 41.0306 175.9507 185 L 4.1515 8.6440 125.9576 57.4217 41.9717 178.9050 186 E 4.1005 8.1887 117.8247 57.1259 29.8326 176.6840 187 G 3.8733 7.5768 104.3808 45.5293 0.0000 172.8403 187A G 3.9999 9.6959 106.1039 44.7564 0.0000 173.4601 188 K 5.0474 7.3685 117.4135 55.3317 35.5373 175.1137 189 D 4.7171 8.8042 123.5030 53.4007 45.4782 174.8835 190 S 4.8978 8.2191 114.3169 58.5853 64.5547 171.9659 191 C 4.7821 9.3845 119.4510 55.2148 47.0425 172.6254 192 Q 4.2862 8.6263 119.4266 58.0129 28.4506 178.4968 193 G 4.2188 9.2431 110.7914 45.6514 0.0000 173.9042 194 D 4.6457 8.4047 119.0087 55.7187 41.6114 176.7274 195 S 4.4961 8.1165 115.2798 60.5449 63.4788 175.5467 196 G 4.0975 8.8870 112.6697 46.3900 0.0000 173.6911 197 G 4.5248 7.8907 107.6459 44.7333 0.0000 171.1487 198 P 5.1071 0.0000 0.0000 62.2926 33.4851 175.6152 199 V 4.5512 8.7274 121.8416 61.4495 33.8803 174.1395 200 V 4.8431 8.7549 129.0741 61.3309 33.9009 173.7540 201 C 5.1381 8.7055 124.4956 55.7732 44.1662 174.5378 202 S 3.3790 9.8103 118.9738 59.7432 60.1314 173.3155 203 G 3.9272 8.4931 104.4220 45.7133 0.0000 174.0215 204 K 4.6612 7.6444 117.5815 52.8934 35.6107 175.5970 *209 L 4.3091 8.2699 122.2713 55.4991 42.0867 175.8622 210 Q 4.5986 8.9034 125.7149 56.2494 31.2314 175.8201 211 G 5.2826 8.0626 104.6047 45.6404 0.0000 171.3502 212 I 5.2265 8.2006 119.8298 58.8386 40.9927 175.3131 213 V 4.0016 8.9386 127.3377 64.0051 31.8287 174.2392 214 S 4.7603 8.4087 120.5352 58.4747 64.3365 173.7716 215 W 4.6821 7.1911 114.0156 56.3763 31.6595 172.2288 216 G 3.3842 7.8093 105.3474 46.2545 0.0000 173.1422 217 S 4.4574 8.1915 116.2935 56.4357 63.5621 173.8478 *219 G 4.1247 8.0125 116.8373 45.4594 0.0000 170.1879 220 C 4.9258 8.0725 115.1676 56.2641 44.8456 174.1187 220A A 4.0633 9.4568 126.2894 53.1255 16.5242 176.9937 221 Q 4.5271 7.3467 117.4427 55.9636 29.7377 175.8026 222 K 3.9869 8.4686 121.7856 58.2466 32.5718 176.1408 223 N 4.2730 9.2173 121.6146 54.0945 36.9631 175.4717 224 K 4.3039 7.5433 116.5990 54.0509 32.5536 173.6986 225 P 4.6340 0.0000 0.0000 61.8790 33.2823 177.6484 226 G 3.5264 8.4303 106.7839 46.2140 0.0000 172.7110 227 V 4.3433 7.6481 122.6900 60.6251 34.0430 174.0394 228 Y 4.9479 8.0364 124.4691 55.9669 41.9186 175.0901 229 T 4.3127 8.6207 120.5614 63.7020 70.0400 174.2122 230 K 5.1373 9.3201 128.0132 55.3080 31.3263 177.2351 231 V 3.9730 8.9210 126.4014 65.8680 31.3981 174.9079 232 C 4.3360 8.3139 112.6071 58.2480 41.5224 174.9343 233 N 4.1669 8.0905 117.5238 54.7058 38.4439 175.5295 234 Y 4.7761 7.8904 117.3340 57.5246 38.8733 177.4537 235 V 3.6719 7.8098 120.8089 66.0053 31.6083 177.5790 236 S 4.0806 8.1051 112.3852 61.1630 62.2448 175.7630 237 W 4.1889 8.3175 130.4903 60.5029 30.4533 177.7139 238 I 2.9958 8.2811 120.0416 64.1816 36.6817 178.5657 239 K 3.7686 8.1670 119.4567 59.5392 31.6496 179.4905 240 Q 3.9158 7.8723 117.1910 59.1143 28.9077 178.6976 241 T 3.7235 7.5642 117.1277 66.4525 68.2170 176.7383 242 I 3.1224 7.0630 112.8285 62.8206 37.6425 177.3153 243 A 4.2470 7.4370 120.7855 53.4839 18.3730 177.7663 244 S 4.7054 7.5713 111.1447 57.7912 64.6757 173.9827 245 N 4.6658 8.0505 123.6043 53.7168 39.4802 174.1802 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 4.25 1.79 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 1.38 0.50 0.92 0.00 0.00 17 V 8.78 4.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.94 0.00 0.00 18 G 8.49 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 19 G 7.79 4.31 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 0.00 20 Y 8.13 4.98 0.00 2.94 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 21 T 8.58 4.08 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 1.21 0.00 0.00 22 C 8.55 4.18 0.00 2.72 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 23 G 8.44 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 24 A 8.45 4.31 1.28 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 0.00 0.00 25 N 8.91 4.27 0.00 2.89 2.92 0.00 0.00 7.16 7.56 0.00 0.00 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 7.71 4.15 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 1.31 0.00 0.00 27 V 7.08 4.09 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 0.44 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.45 0.00 2.38 2.39 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 29 Y 6.90 4.99 0.00 3.28 3.41 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 30 Q 7.37 4.52 0.00 1.76 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 1.90 2.48 0.00 31 V 9.00 4.85 2.24 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 0.88 0.00 0.00 1.00 0.00 0.00 32 S 8.74 4.94 0.00 3.08 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 0.00 33 L 8.56 4.73 0.00 0.38 1.01 0.80 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.02 5.83 0.00 2.51 2.46 0.00 0.00 6.60 8.16 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 *37 S 8.46 4.18 0.00 3.67 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 9.30 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 0.00 0.00 0.00 39 Y 6.55 4.60 0.00 3.12 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 40 H 8.88 4.52 0.00 2.91 3.21 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.95 5.08 0.00 3.12 3.26 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 42 C 6.88 4.77 0.00 2.24 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 43 G 8.77 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 44 G 7.72 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.81 5.36 0.00 3.82 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 46 L 9.26 4.81 0.00 1.87 1.69 1.08 1.15 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 47 I 8.68 4.54 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.92 1.01 0.00 0.00 48 N 7.50 4.75 0.00 2.94 3.02 0.00 0.00 6.27 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 49 S 8.71 4.33 0.00 4.21 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.15 4.50 0.00 2.04 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 51 W 8.06 5.56 0.00 3.28 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.18 4.92 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 1.25 0.00 0.00 0.99 0.00 0.00 53 V 8.91 4.79 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 1.11 0.00 0.00 1.01 0.00 0.00 54 S 9.02 5.23 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 8.74 4.54 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 56 A 8.30 3.83 0.26 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 57 H 8.45 4.53 0.00 3.38 3.60 0.00 5.55 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 7.86 4.67 0.00 3.22 3.34 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 59 Y 7.69 4.26 0.00 2.95 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 60 K 6.96 3.36 0.00 1.43 1.28 0.00 0.61 0.00 0.00 1.21 0.00 0.00 2.42 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.70 0.95 7.81 61 S 7.95 4.24 0.00 3.96 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 62 G 8.43 3.72 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 0.00 0.00 0.00 63 I 7.59 4.14 1.88 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 1.40 0.74 0.94 0.00 0.00 64 Q 8.94 4.72 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.92 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 65 V 8.70 4.33 2.19 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 1.08 0.00 0.00 0.91 0.00 0.00 66 R 8.99 5.07 0.00 1.62 1.73 0.00 2.64 0.00 0.00 2.46 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.19 0.00 67 L 9.21 4.79 0.00 1.64 1.63 1.02 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.33 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 70 E 8.20 4.33 0.00 2.17 1.94 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 2.37 2.05 0.00 71 D 7.97 4.88 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 72 N 9.08 4.95 0.00 2.81 2.79 0.00 0.00 7.22 8.80 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 73 I 8.46 3.93 1.41 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 -0.52 0.00 0.00 74 N 8.47 4.74 0.00 2.82 2.88 0.00 0.00 6.65 8.41 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 75 V 7.36 4.34 2.10 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 0.86 0.00 0.00 0.99 0.00 0.00 76 V 8.50 4.05 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 0.90 0.00 0.00 0.99 0.00 0.00 77 E 10.10 4.43 0.00 1.94 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 2.27 2.45 0.00 78 G 7.69 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.17 4.86 0.00 2.74 2.80 0.00 0.00 7.19 7.67 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 80 E 7.78 4.52 0.00 1.45 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 0.00 2.54 2.46 0.00 81 Q 9.14 4.46 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.10 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 82 F 8.80 5.58 0.00 2.77 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 83 I 8.84 4.68 1.87 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 1.24 0.89 0.95 0.00 0.00 84 S 8.74 4.59 0.00 3.75 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 85 A 8.66 4.57 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 86 S 8.77 4.59 0.00 3.80 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 87 K 7.46 4.61 0.00 1.85 1.89 0.00 1.54 0.00 0.00 1.91 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 1.47 7.81 88 S 8.79 5.30 0.00 4.00 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 89 I 9.09 4.61 2.05 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 1.25 1.01 1.16 0.00 0.00 90 V 8.48 4.18 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 0.79 0.00 0.00 0.79 0.00 0.00 91 H 8.59 3.45 0.00 2.75 3.03 0.00 5.64 0.00 0.00 0.00 0.00 6.62 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 4.34 0.00 2.17 2.17 0.00 2.33 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 1.60 1.86 0.00 93 S 7.91 4.68 0.00 3.92 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 94 Y 8.05 4.32 0.00 3.02 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 95 N 8.34 4.62 0.00 2.56 2.44 0.00 0.00 6.50 6.93 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 96 S 7.64 3.87 0.00 3.97 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 97 N 8.31 4.31 0.00 2.73 2.79 0.00 0.00 6.81 7.11 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 98 T 7.71 3.92 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 1.09 0.00 0.00 99 L 7.76 3.71 0.00 1.30 1.80 0.74 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.75 4.38 0.00 2.81 2.66 0.00 0.00 7.24 6.56 0.00 0.00 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 8.74 4.88 0.00 2.94 2.62 0.00 0.00 7.42 8.08 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 0.00 102 D 7.74 4.64 0.00 3.20 2.64 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 0.00 103 I 7.06 4.89 1.44 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 1.37 1.27 0.08 0.00 0.00 104 M 9.18 5.48 0.00 2.14 1.82 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.67 0.00 105 L 9.27 5.41 0.00 1.70 1.81 -0.08 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.07 5.04 1.95 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.96 0.92 0.00 0.00 107 K 8.70 3.96 0.00 0.79 1.13 0.00 1.09 0.00 0.00 1.31 0.00 0.00 2.59 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.70 0.21 7.81 108 L 8.29 4.47 0.00 1.50 1.58 0.96 0.67 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 0.00 109 K 8.84 4.29 0.00 1.65 1.83 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.45 7.81 110 S 7.45 4.57 0.00 3.86 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 0.00 111 A 8.39 4.36 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 0.00 112 A 8.87 4.26 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 0.00 113 S 9.09 4.48 0.00 3.87 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.42 4.76 0.00 1.69 1.61 0.96 1.07 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 0.00 115 N 8.53 4.75 0.00 2.91 2.92 0.00 0.00 6.64 7.20 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 0.00 116 S 8.70 4.32 0.00 4.02 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.16 4.18 0.00 1.85 2.04 0.00 3.24 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 7.51 5.04 0.00 3.98 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 0.00 128 C 8.40 4.37 0.00 2.94 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 0.00 129 A 7.38 4.25 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.13 4.35 0.00 3.84 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 *132 A 8.30 4.18 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 8.92 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 0.00 134 T 7.57 4.03 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 1.16 0.00 0.00 135 Q 8.60 4.57 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 136 C 9.27 5.27 0.00 2.81 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 9.02 5.14 0.00 1.76 1.58 1.04 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.06 5.28 1.86 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.59 0.94 0.00 0.00 139 S 8.48 4.85 0.00 3.54 3.57 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 0.00 0.00 0.00 0.00 140 G 7.57 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 0.00 0.00 0.00 141 W 8.61 4.59 0.00 3.19 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 0.00 142 G 8.57 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 0.00 143 N 8.27 3.61 0.00 2.10 2.56 0.00 0.00 7.08 8.76 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 0.00 144 T 8.17 5.04 4.20 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 1.21 0.00 0.00 145 K 7.69 4.58 0.00 1.94 1.88 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.33 7.81 146 S 8.79 4.26 0.00 3.83 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 0.00 147 S 8.19 4.50 0.00 3.85 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 0.00 148 G 9.70 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 4.83 4.31 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 1.45 0.00 0.00 150 S 9.34 4.56 0.00 3.84 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 0.00 151 Y 8.80 4.86 0.00 2.91 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 0.00 152 P 0.00 4.72 0.00 2.42 2.08 0.00 4.09 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.98 0.00 153 D 8.66 4.66 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 0.00 154 V 7.42 5.25 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 1.19 0.00 0.00 0.96 0.00 0.00 155 L 8.40 3.22 0.00 1.30 1.24 -0.83 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.14 4.85 0.00 1.66 1.50 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 1.41 1.46 7.81 157 C 8.43 5.21 0.00 1.46 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.64 5.03 0.00 1.72 1.47 1.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.08 5.07 0.00 1.80 1.82 0.00 1.86 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.63 1.44 7.81 160 A 9.26 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 5.02 0.00 2.03 2.20 0.00 3.04 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 1.84 1.74 0.00 162 I 8.48 4.41 1.92 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.69 0.83 0.00 0.00 163 L 8.70 4.89 0.00 1.56 1.60 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.54 4.30 0.00 4.01 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 0.00 165 D 8.84 4.42 0.00 2.81 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 0.00 166 S 8.02 4.19 0.00 4.06 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 0.00 167 S 8.37 4.16 0.00 4.07 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 0.00 168 C 8.47 4.30 0.00 3.18 3.36 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 0.00 169 K 8.52 4.01 0.00 1.85 1.90 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.74 7.81 170 S 8.10 4.16 0.00 3.84 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 7.79 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.71 4.85 0.00 3.12 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.60 0.00 2.08 2.03 0.00 3.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 174 G 9.04 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 0.00 175 Q 8.15 4.54 0.00 2.51 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.92 0.00 0.00 0.00 0.00 0.00 2.26 2.49 0.00 176 I 7.95 4.34 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.05 1.00 0.00 0.00 177 T 8.27 4.53 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 1.28 0.00 0.00 178 S 8.53 4.37 0.00 4.02 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.30 5.00 0.00 3.10 3.11 0.00 0.00 6.97 7.78 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 0.00 180 M 7.94 5.59 0.00 1.84 2.11 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 181 F 8.78 5.13 0.00 3.13 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 0.00 182 C 8.95 5.40 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 9.43 5.05 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 183A G 7.30 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 0.00 0.00 0.00 184 Y 8.50 4.55 0.00 3.01 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 0.00 185 L 8.64 4.15 0.00 1.73 1.73 0.92 0.82 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 0.00 186 E 8.19 4.10 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 2.30 2.38 0.00 187 G 7.58 3.87 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 0.00 0.00 0.00 187A G 9.70 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 0.00 188 K 7.37 5.05 0.00 1.43 1.68 0.00 0.82 0.00 0.00 1.18 0.00 0.00 2.54 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.37 1.19 7.81 189 D 8.80 4.72 0.00 2.84 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 8.22 4.90 0.00 4.01 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 0.00 191 C 9.38 4.78 0.00 2.92 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 8.63 4.29 0.00 2.31 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 5.29 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 193 G 9.24 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 0.00 194 D 8.40 4.65 0.00 2.95 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 8.12 4.50 0.00 4.00 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 0.00 196 G 8.89 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.89 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.11 0.00 2.34 2.39 0.00 3.69 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 199 V 8.73 4.55 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 0.95 0.00 0.00 0.53 0.00 0.00 200 V 8.75 4.84 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 0.93 0.00 0.00 0.70 0.00 0.00 201 C 8.71 5.14 0.00 2.80 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 0.00 202 S 9.81 3.38 0.00 3.94 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 0.00 203 G 8.49 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 7.64 4.66 0.00 1.72 1.74 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.40 7.81 *209 L 8.27 4.31 0.00 1.52 1.65 1.03 0.75 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 0.00 210 Q 8.90 4.60 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.38 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 211 G 8.06 5.28 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 0.00 0.00 0.00 212 I 8.20 5.23 1.93 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 1.14 0.99 0.00 0.00 213 V 8.94 4.00 2.38 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 1.14 0.00 0.00 1.22 0.00 0.00 214 S 8.41 4.76 0.00 4.02 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 0.00 215 W 7.19 4.68 0.00 3.33 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 0.00 216 G 7.81 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 0.00 0.00 0.00 217 S 8.19 4.46 0.00 4.15 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 *219 G 8.01 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 0.00 220 C 8.07 4.93 0.00 2.95 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 220A A 9.46 4.06 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 7.35 4.53 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.92 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 222 K 8.47 3.99 0.00 1.72 1.72 0.00 1.92 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.67 7.81 223 N 9.22 4.27 0.00 2.81 2.81 0.00 0.00 6.74 7.63 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 0.00 224 K 7.54 4.30 0.00 1.64 1.77 0.00 1.67 0.00 0.00 1.14 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.48 7.81 225 P 0.00 4.63 0.00 2.12 2.10 0.00 3.62 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 226 G 8.43 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 0.00 227 V 7.65 4.34 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 0.42 0.00 0.00 -0.74 0.00 0.00 228 Y 8.04 4.95 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 8.62 4.31 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 1.21 0.00 0.00 230 K 9.32 5.14 0.00 2.16 1.96 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.61 7.81 231 V 8.92 3.97 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 1.18 0.00 0.00 1.13 0.00 0.00 232 C 8.31 4.34 0.00 3.16 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 0.00 233 N 8.09 4.17 0.00 2.33 2.34 0.00 0.00 7.02 7.73 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 0.00 234 Y 7.89 4.78 0.00 3.27 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 0.00 235 V 7.81 3.67 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 1.22 0.00 0.00 1.10 0.00 0.00 236 S 8.11 4.08 0.00 3.96 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 0.00 237 W 8.32 4.19 0.00 3.53 3.58 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 0.00 238 I 8.28 3.00 1.96 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 1.52 0.95 0.69 0.00 0.00 239 K 8.17 3.77 0.00 1.77 1.78 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.59 7.81 240 Q 7.87 3.92 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 241 T 7.56 3.72 3.43 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 0.71 0.00 0.00 242 I 7.06 3.12 1.01 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.25 -0.67 0.00 0.00 243 A 7.44 4.25 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 0.00 244 S 7.57 4.71 0.00 3.80 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 0.00 245 N 8.05 4.67 0.00 3.00 2.96 0.00 0.00 7.07 7.56 0.00 0.00 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.