NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3007 7.8827 121.4521 61.1756 38.8174 173.7880 17 V 4.4530 8.6749 125.3315 61.6347 33.1287 174.3004 18 G 3.9619 8.4350 113.8803 46.4582 0.0000 173.2361 19 G 4.2033 7.7920 110.0887 43.8932 0.0000 172.5018 20 Y 4.9706 7.8288 116.6364 55.0923 42.2054 174.8405 21 T 4.3151 8.5831 116.9446 63.8756 68.4205 175.4047 22 C 4.3139 8.7423 125.3894 60.4519 35.3359 175.0017 23 G 4.1254 8.6507 106.4171 44.1564 0.0000 172.8725 24 A 4.0650 8.6843 125.5932 54.0326 18.6416 176.7833 25 N 4.2456 8.8506 118.8673 54.3919 36.3611 175.2413 26 T 4.2385 7.5612 106.4685 62.5253 69.9215 175.1049 27 V 4.0934 7.0218 121.9129 60.3221 31.3129 173.6941 28 P 4.4885 0.0000 0.0000 64.3375 32.0779 178.0652 29 Y 5.0825 6.8282 115.8380 56.3563 38.7763 174.6557 30 Q 4.6182 7.3718 123.4506 56.3322 29.3316 175.3622 31 V 4.8605 8.9093 118.4049 59.6395 36.4207 174.1285 32 S 4.9090 8.7786 116.5603 56.5548 65.1069 172.5374 33 L 4.5654 8.4210 127.3361 53.0763 43.4672 174.9204 34 N 5.8416 8.9742 122.7678 50.0180 42.0197 174.9723 *37 S 4.4277 8.4434 120.6470 58.3634 64.1718 174.5098 38 G 4.0148 9.6882 108.7205 46.0079 0.0000 172.8075 39 Y 4.4726 6.6822 115.2402 56.3369 39.9002 172.4068 40 H 4.5571 8.8477 121.5940 55.9376 30.3533 174.6901 41 F 4.9960 7.7625 120.3685 56.9997 39.8043 173.9128 42 C 4.6922 6.8128 115.0026 56.2867 44.8613 172.9975 43 G 4.2139 8.5423 109.0518 45.4955 0.0000 172.1985 44 G 4.5809 7.9034 104.9172 46.4597 0.0000 172.6775 45 S 5.5274 8.6817 115.3243 56.4427 66.9268 173.6038 46 L 4.6991 9.0996 127.3252 54.7362 42.4724 177.0647 47 I 4.4939 8.6009 119.4482 60.9918 39.3332 174.3819 48 N 4.7362 7.5499 117.5164 52.1442 39.6093 174.9050 49 S 4.3672 8.6094 111.6806 60.2310 63.3690 174.5665 50 Q 4.5595 9.2059 121.5110 55.3670 30.8230 174.3543 51 W 5.5677 8.3790 116.6934 55.6192 33.5814 174.3287 52 V 5.1167 9.1047 123.0144 61.0733 34.6357 174.3538 53 V 4.9440 8.8354 126.4280 60.4878 33.6751 174.8731 54 S 5.1138 9.0790 117.5602 57.6750 66.1324 171.7847 55 A 4.7525 8.4902 120.2100 50.3545 20.8719 178.1771 56 A 3.8093 8.3405 124.6239 55.3965 18.4168 179.0542 57 H 4.5749 8.4289 108.7604 56.9884 28.5853 175.2126 58 C 4.7224 7.8082 117.0449 57.0301 40.7057 173.4230 59 Y 4.1333 7.7308 122.2099 57.7500 38.7581 175.1048 60 K 3.6918 6.6216 123.4058 56.2528 34.6862 174.2648 61 S 4.3138 8.1227 114.5371 57.7774 64.9244 173.1585 62 G 3.6426 8.2965 105.7843 46.7050 0.0000 173.6627 63 I 4.4183 7.3726 119.0017 59.5203 39.8454 175.5515 64 Q 4.7631 8.7334 127.5084 54.2126 31.7755 174.0765 65 V 4.4339 8.8105 127.0760 61.6712 33.5995 174.5543 65A R 5.0807 8.8538 127.3213 54.7018 32.3355 175.1724 66 L 4.7269 9.0632 124.8574 52.6966 44.7838 177.1859 *69 G 3.8202 8.2077 105.6421 46.3414 0.0000 172.8262 70 E 4.6844 8.4681 118.6841 55.1168 30.7211 174.2135 71 D 4.7422 7.8004 116.9901 55.1741 43.6362 174.1700 72 N 5.0743 8.8166 119.7669 52.9140 39.2745 176.1068 73 I 3.8157 8.4090 119.6716 62.0760 37.8737 176.2105 74 N 4.7618 8.6918 118.1124 53.0943 39.4689 174.8182 75 V 4.2938 7.4194 117.3905 60.6769 34.1134 174.9774 76 V 4.1166 8.4417 126.9361 62.5246 30.9756 175.1133 77 E 4.3814 9.2001 127.3541 55.4925 30.5538 177.0076 78 G 3.9638 8.3947 106.2291 46.0880 0.0000 173.9894 79 N 4.6275 8.9479 116.8492 52.6293 36.7265 174.5567 80 E 4.5495 7.6139 116.9309 56.4384 30.6916 176.4423 81 Q 4.3936 8.9833 121.0217 54.3877 32.9787 173.9070 82 F 5.5561 8.8674 123.0372 55.9580 41.0153 175.2480 83 I 4.7344 8.9090 124.5903 59.4498 41.2517 175.4257 84 S 4.6377 8.6552 121.5706 58.2199 64.3075 173.2137 85 A 4.3879 8.2315 124.9304 52.1438 18.5102 177.5909 86 S 4.4800 9.1885 117.4745 60.1980 63.4526 174.4268 87 K 4.7437 7.5773 116.3116 55.7137 35.7887 174.8990 88 S 5.2501 8.7831 117.2191 56.9465 66.0551 173.7271 89 I 4.5037 9.3112 125.2930 59.4819 39.2677 174.9104 90 V 4.1444 8.3343 127.3354 62.0176 32.6654 175.3577 91 H 3.8422 8.6077 126.6505 55.8378 30.0739 174.4790 92 P 4.3217 0.0000 0.0000 65.3512 31.3298 177.1712 93 S 4.6981 7.9632 111.8973 58.1428 63.1552 173.2980 94 Y 4.2859 8.0361 123.4315 57.6253 39.0091 174.4025 95 N 4.5154 8.1355 125.8168 51.4291 39.7935 175.0909 96 S 3.8970 7.7488 119.9891 59.3378 63.6026 174.9827 97 N 4.4122 8.5657 119.3694 55.2539 38.7254 176.1189 98 T 3.9813 7.7552 105.3821 60.7577 69.8951 174.8970 99 L 3.7677 7.8866 121.0384 55.5321 39.7900 173.9576 100 N 4.4863 7.7217 117.1229 54.5811 39.6025 174.4892 101 N 4.6368 8.6495 119.3678 54.1074 35.8960 175.6832 102 D 4.7109 7.9073 117.5977 53.0106 39.8173 174.8235 103 I 4.8082 7.1632 120.9504 59.3542 42.3405 172.8652 104 M 5.4173 9.1808 126.4923 54.2197 36.3078 173.2670 105 L 5.4449 9.1834 124.2146 53.1350 45.1424 175.4079 106 I 4.9830 9.2227 123.4277 59.4375 40.6869 174.2359 107 K 3.7534 8.6695 128.4773 54.4058 33.8011 175.4636 108 L 4.5471 8.2283 127.5225 53.9398 42.2276 177.0208 109 K 4.0679 8.7936 124.2301 59.1365 32.5544 177.1985 110 S 4.6830 7.7287 112.4434 56.1210 66.8572 173.2791 111 A 4.4494 8.3196 123.4899 51.9456 18.8934 177.3609 112 A 4.4148 8.8804 122.7318 51.6641 20.0056 177.3556 113 S 4.5694 8.8903 116.5532 57.4220 63.6819 174.4059 114 L 4.6746 8.4953 125.3493 53.9826 43.4016 176.2472 115 N 4.8087 8.8194 118.1888 52.5770 39.5654 174.9285 116 S 4.2985 8.7288 111.4102 61.5062 63.3998 175.2712 117 R 4.1688 8.6520 119.2863 56.9292 30.5742 176.4361 118 V 4.4698 7.8428 116.1106 60.9046 33.7833 173.7859 119 A 5.1137 8.5870 128.2130 50.5244 22.9835 175.1805 120 S 5.1093 8.6836 114.1802 57.6926 64.9777 173.0462 121 I 4.4684 8.1773 120.6648 59.2121 39.8571 175.4046 122 S 4.4583 8.3275 122.9339 57.9452 63.7933 173.8992 123 L 4.3030 8.0997 123.3383 53.3262 42.4819 175.2443 124 P 4.5588 0.0000 0.0000 62.9206 32.4562 176.1013 125 T 4.2691 8.1965 107.7353 61.9475 70.3736 174.2781 *127 S 4.9303 7.5876 114.8518 58.2700 64.0120 173.8980 128 C 4.4895 8.3927 117.9611 56.3631 40.9941 173.2794 129 A 4.5292 7.9285 123.9547 51.1963 20.0904 177.4364 130 S 4.3223 8.0442 115.7952 57.3280 64.5376 173.4967 *132 A 4.2429 8.1399 123.8220 53.4130 19.1590 177.4130 133 G 3.9811 9.1379 109.6403 45.4260 0.0000 174.4527 134 T 3.9632 7.5570 117.5515 63.7337 69.4696 173.2276 135 Q 4.6568 8.5596 127.2368 55.4778 30.3859 175.1633 136 C 5.2944 9.3137 122.6332 55.1290 45.6052 172.2960 137 L 5.2393 9.0580 122.5035 53.5076 44.1259 175.0050 138 I 5.2719 9.0331 127.1793 58.7607 40.0334 174.8522 139 S 4.9261 8.9344 119.6228 56.1941 66.7011 173.1174 140 G 3.8344 7.3489 108.9100 46.0774 0.0000 172.7044 141 W 4.7595 8.4795 117.1696 56.2656 29.4291 177.0702 142 G 4.1473 8.3463 108.9405 44.1509 0.0000 173.5776 143 N 4.0211 8.7180 118.2717 54.4485 38.9518 174.5248 144 T 5.1203 8.2356 112.7998 60.5078 69.5912 174.2336 145 K 4.6070 7.8727 121.7834 54.8021 34.5442 176.2170 146 S 4.4138 8.6651 117.4373 59.8938 63.9511 174.6293 147 S 4.5337 8.1542 116.5307 53.5123 62.3396 171.8447 148 G 4.0900 7.5169 108.9692 43.2369 0.0000 170.3241 149 T 4.5888 8.0547 109.9240 59.6960 70.9344 173.9969 150 S 4.3952 9.1534 120.8506 57.1850 65.6692 171.8253 151 Y 5.0271 8.6697 125.2813 55.6876 39.6518 174.2299 152 P 4.7669 0.0000 0.0000 62.1519 33.2908 175.5104 153 D 4.6303 8.6979 117.9621 55.9800 41.5487 177.1615 154 V 5.5882 7.3895 109.7483 58.3700 34.7121 175.6963 155 L 3.1897 8.3095 123.6473 55.0198 42.8885 175.9600 156 K 4.9059 8.0972 124.8808 54.8895 35.1540 174.5891 157 C 5.2689 8.5497 119.5129 55.2108 44.3691 172.9829 158 L 4.9545 8.5529 122.4724 53.8961 45.6217 174.3534 159 K 5.0833 8.9820 125.4614 55.2024 33.5851 175.7916 160 A 4.8377 9.2038 126.3667 49.7371 23.1046 173.4431 161 P 5.0566 0.0000 0.0000 61.9069 33.9251 175.0522 162 I 4.4471 8.3033 122.4503 61.2808 38.2267 175.9126 163 L 4.8120 8.7618 127.4276 53.2852 43.4458 176.7999 164 S 4.4084 8.4032 114.5785 58.0425 64.0265 175.1402 165 D 4.4604 8.6833 121.8383 57.4953 40.4986 179.2614 166 S 4.1412 8.0097 114.5175 61.6326 63.1222 176.6566 167 S 4.1506 8.0716 118.6076 61.1156 62.5097 175.8328 168 C 4.3021 8.2516 121.2818 59.8647 39.3561 175.9408 169 K 3.9543 8.3651 120.0925 59.4945 31.3270 179.6312 170 S 4.1381 7.9861 114.8575 61.3791 62.7777 176.1472 171 A 4.0088 7.7828 122.8456 53.7571 19.7499 177.3800 172 Y 4.8950 7.9873 113.7222 55.5886 38.3150 173.6099 173 P 4.7478 0.0000 0.0000 63.5755 32.1971 178.0108 174 G 3.9880 8.9883 109.0539 46.0439 0.0000 173.6684 175 Q 4.5244 8.2290 116.7621 55.4904 30.0010 175.2866 176 I 4.4262 7.8318 119.9258 59.9303 38.3890 175.4527 177 T 4.5524 8.2118 115.8408 59.7077 70.9013 175.1581 178 S 4.3831 8.5379 114.6355 60.1646 63.2200 174.2905 179 N 4.9909 8.2144 118.7614 53.3667 38.5398 173.7919 180 M 5.6402 7.8053 116.9842 54.0225 36.4245 174.3853 181 F 5.0593 8.7018 114.0472 56.2108 41.9465 172.3471 182 C 5.5824 9.0687 116.4969 55.5992 42.5786 172.7345 183 A 5.0472 9.3442 122.5988 50.9769 22.5076 176.3369 184 G 3.9490 6.9844 107.1307 44.6832 0.0000 172.2273 184A Y 4.6677 8.3391 119.2609 55.9968 40.7075 176.5189 185 L 4.1478 8.6462 125.6054 57.2991 42.0110 178.8718 186 E 4.0417 8.2160 115.2372 57.0208 29.9321 177.4092 187 G 3.8156 7.7223 107.4034 45.2461 0.0000 172.5413 188 G 4.0727 9.4972 106.2245 44.6726 0.0000 173.5092 188A K 5.0652 7.2777 117.4127 54.9873 35.5062 175.2407 189 D 4.6241 8.8170 123.4732 54.0097 45.7229 174.7625 190 S 4.9591 8.7723 116.4665 57.8441 65.4188 172.9838 191 C 4.7611 9.2712 118.9118 55.2610 46.5209 172.2061 192 Q 4.3757 8.6216 121.1754 57.9598 28.8291 176.7665 193 G 4.2118 9.2573 112.4111 45.8680 0.0000 174.0849 194 D 4.7124 8.3954 118.2777 55.0390 41.7749 176.7358 195 S 4.4899 8.0482 115.5971 60.5557 63.5402 175.3618 196 G 4.0884 8.8580 112.7249 46.4472 0.0000 173.7610 197 G 4.5121 7.8757 107.4549 44.9409 0.0000 171.0490 198 P 5.1749 0.0000 0.0000 62.1604 33.6550 175.7153 199 V 4.5925 8.4834 120.4660 61.4649 34.3735 173.9842 200 V 4.8496 8.8245 128.8948 61.2412 34.1774 173.7077 201 C 5.1140 8.8031 124.4322 55.7109 43.9510 174.5907 202 S 3.7270 9.7800 120.3395 59.7203 60.1406 173.0726 203 G 3.9205 8.3534 103.3268 45.8710 0.0000 173.7550 204 K 4.6688 7.6166 117.6378 52.9123 35.3152 175.5835 *209 L 4.2417 8.2793 122.7949 55.4420 42.1993 175.8224 210 Q 4.5004 8.8643 126.0118 56.6610 30.8971 175.8223 211 G 5.3870 8.0290 104.5518 45.7424 0.0000 171.3806 212 I 5.2190 8.1906 119.5319 58.8756 41.0099 175.4383 213 V 3.7504 8.9399 127.5901 63.8446 31.8015 174.0693 214 S 4.8638 8.4807 120.9450 58.5499 64.4369 174.6460 215 W 5.0412 7.6267 114.4512 56.2233 31.9955 172.5256 216 G 3.8653 8.4244 106.3196 46.7978 0.0000 173.3641 217 S 4.6868 8.4172 116.5552 57.0083 62.7652 173.8601 *219 G 4.1686 7.9625 115.5429 45.5446 0.0000 170.7716 220 C 4.9847 8.1118 115.0016 56.4506 42.8745 173.8531 221 A 3.7325 9.0935 125.8528 53.1931 16.5820 176.9799 221A Q 4.5996 7.2805 114.6692 56.0438 29.9739 176.0323 222 K 4.1563 8.4446 122.0139 57.9779 32.7206 176.0938 223 N 4.2637 9.3019 121.4080 54.0880 37.0325 175.3838 224 K 4.3185 7.5588 116.5472 53.7809 32.2833 173.5693 225 P 4.6182 0.0000 0.0000 62.2087 33.1512 177.3095 226 G 3.7260 8.4401 105.9562 45.8154 0.0000 172.8609 227 V 4.4441 7.5657 121.3196 60.6826 34.2403 174.0950 228 Y 4.9582 8.2282 124.3642 56.0199 42.0954 174.9340 229 T 4.4913 8.5460 119.5871 63.5087 70.0799 174.4812 230 K 5.0950 9.2793 128.2214 55.3507 31.3292 177.1305 231 V 3.9315 8.7593 125.9929 65.9436 31.3860 174.8795 232 C 4.4496 8.3561 112.5453 58.3530 41.4288 174.9027 233 N 4.2371 8.0676 117.1491 54.4738 38.5225 175.0644 234 Y 4.7850 8.0365 117.6699 57.5533 39.1797 177.5443 235 V 3.6836 8.0656 121.3599 66.3896 31.5171 178.0541 236 S 4.1246 8.1045 114.3066 61.1867 62.6395 176.2840 237 W 4.1363 8.2786 130.5891 60.4967 30.4678 177.8323 238 I 3.2119 8.2974 119.9598 64.2629 36.5524 178.5252 239 K 3.7476 8.1373 119.3634 59.6204 31.7520 179.4993 240 Q 3.8732 8.3039 118.6127 59.0833 28.3510 178.9963 241 T 3.5387 7.3345 116.0601 66.4845 68.7728 176.5513 242 I 2.7524 7.2649 121.6476 63.9621 36.7692 178.3976 243 A 4.0254 7.7601 120.6748 54.2132 18.1753 178.7513 244 S 4.6392 7.2713 110.0775 58.2820 63.5413 174.1045 245 N 4.6799 7.9765 125.1358 53.8753 39.2960 174.0245 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 4.30 1.80 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 1.40 0.90 0.90 0.00 0.00 17 V 8.67 4.45 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 1.03 0.00 0.00 0.96 0.00 0.00 18 G 8.44 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 19 G 7.79 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 0.00 0.00 0.00 0.00 20 Y 7.83 4.97 0.00 2.92 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 8.58 4.32 4.30 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 1.22 0.00 0.00 22 C 8.74 4.31 0.00 2.74 3.05 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 23 G 8.65 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 24 A 8.68 4.06 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 8.85 4.25 0.00 2.83 2.88 0.00 0.00 7.29 7.57 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 26 T 7.56 4.24 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 1.30 0.00 0.00 27 V 7.02 4.09 1.75 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 0.28 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.49 0.00 2.39 2.40 0.00 3.66 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 29 Y 6.83 5.08 0.00 3.17 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 30 Q 7.37 4.62 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.53 0.00 0.00 0.00 0.00 0.00 1.97 2.55 0.00 31 V 8.91 4.86 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 0.84 0.00 0.00 0.98 0.00 0.00 32 S 8.78 4.91 0.00 2.98 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.42 4.57 0.00 0.42 0.85 0.79 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.97 5.84 0.00 2.37 2.43 0.00 0.00 6.51 7.14 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 *37 S 8.44 4.43 0.00 3.82 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 38 G 9.69 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 39 Y 6.68 4.47 0.00 3.03 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 40 H 8.85 4.56 0.00 2.83 3.15 0.00 5.86 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 41 F 7.76 5.00 0.00 3.00 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 42 C 6.81 4.69 0.00 2.32 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 43 G 8.54 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 0.00 0.00 0.00 44 G 7.90 4.58 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 0.00 0.00 0.00 45 S 8.68 5.53 0.00 3.83 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 46 L 9.10 4.70 0.00 1.88 1.67 1.08 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.60 4.49 1.90 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 1.57 0.91 1.01 0.00 0.00 48 N 7.55 4.74 0.00 3.00 3.00 0.00 0.00 6.13 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 49 S 8.61 4.37 0.00 4.15 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 9.21 4.56 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.92 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 51 W 8.38 5.57 0.00 3.40 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 52 V 9.10 5.12 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 1.05 0.00 0.00 0.98 0.00 0.00 53 V 8.84 4.94 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 0.77 0.00 0.00 1.01 0.00 0.00 54 S 9.08 5.11 0.00 3.87 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 55 A 8.49 4.75 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 56 A 8.34 3.81 0.27 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 57 H 8.43 4.57 0.00 3.36 3.56 0.00 5.55 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.81 4.72 0.00 3.21 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 7.73 4.13 0.00 2.98 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 6.62 3.69 0.00 1.49 1.32 0.00 0.81 0.00 0.00 1.31 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.64 0.96 7.81 61 S 8.12 4.31 0.00 3.94 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 62 G 8.30 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 0.00 0.00 0.00 63 I 7.37 4.42 1.84 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 1.39 0.88 0.90 0.00 0.00 64 Q 8.73 4.76 0.00 2.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.87 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 65 V 8.81 4.43 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 0.90 0.00 0.00 0.88 0.00 0.00 65A R 8.85 5.08 0.00 1.60 1.66 0.00 2.62 0.00 0.00 2.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.13 0.00 66 L 9.06 4.73 0.00 1.62 1.62 0.95 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.21 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.47 4.68 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.03 0.00 71 D 7.80 4.74 0.00 2.72 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 72 N 8.82 5.07 0.00 2.84 2.83 0.00 0.00 7.22 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 8.41 3.82 1.40 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 1.12 0.54 -0.49 0.00 0.00 74 N 8.69 4.76 0.00 2.81 2.88 0.00 0.00 6.63 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 75 V 7.42 4.29 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 0.73 0.00 0.00 0.99 0.00 0.00 76 V 8.44 4.12 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 0.76 0.00 0.00 0.96 0.00 0.00 77 E 9.20 4.38 0.00 1.99 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 2.46 0.00 78 G 8.39 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 79 N 8.95 4.63 0.00 2.91 3.18 0.00 0.00 6.95 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 7.61 4.55 0.00 1.55 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.48 0.00 81 Q 8.98 4.39 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 82 F 8.87 5.56 0.00 2.78 2.80 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 83 I 8.91 4.73 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 0.73 0.95 0.00 0.00 84 S 8.66 4.64 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 8.23 4.39 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 86 S 9.19 4.48 0.00 3.72 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 87 K 7.58 4.74 0.00 1.86 1.84 0.00 1.59 0.00 0.00 1.92 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.37 7.81 88 S 8.78 5.25 0.00 4.09 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 89 I 9.31 4.50 2.06 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 1.24 0.93 1.09 0.00 0.00 90 V 8.33 4.14 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 0.60 0.00 0.00 0.76 0.00 0.00 91 H 8.61 3.84 0.00 2.82 3.09 0.00 5.65 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.32 0.00 2.07 2.14 0.00 3.12 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 93 S 7.96 4.70 0.00 3.90 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 94 Y 8.04 4.29 0.00 3.03 2.92 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 95 N 8.14 4.52 0.00 2.59 2.45 0.00 0.00 6.54 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 96 S 7.75 3.90 0.00 3.94 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 97 N 8.57 4.41 0.00 2.70 2.78 0.00 0.00 6.79 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.76 3.98 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 1.14 0.00 0.00 99 L 7.89 3.77 0.00 1.45 1.87 0.71 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.72 4.49 0.00 2.79 2.64 0.00 0.00 7.26 7.30 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 0.00 101 N 8.65 4.64 0.00 2.93 2.60 0.00 0.00 7.22 8.26 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 0.00 102 D 7.91 4.71 0.00 3.07 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 0.00 103 I 7.16 4.81 1.45 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.28 0.14 0.00 0.00 104 M 9.18 5.42 0.00 2.12 1.83 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 2.75 2.64 0.00 105 L 9.18 5.44 0.00 1.81 1.88 0.27 0.69 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 0.00 106 I 9.22 4.98 1.92 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 1.20 0.86 0.88 0.00 0.00 107 K 8.67 3.75 0.00 0.79 1.09 0.00 1.33 0.00 0.00 1.34 0.00 0.00 2.62 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.65 0.21 7.81 108 L 8.23 4.55 0.00 1.45 1.55 0.97 0.85 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 0.00 109 K 8.79 4.07 0.00 1.78 1.80 0.00 1.72 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 1.38 7.81 110 S 7.73 4.68 0.00 3.81 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 8.32 4.45 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 8.88 4.41 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 8.89 4.57 0.00 3.76 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 0.00 114 L 8.50 4.67 0.00 1.65 1.62 0.96 1.07 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 8.82 4.81 0.00 2.86 2.93 0.00 0.00 6.74 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.73 4.30 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 0.00 117 R 8.65 4.17 0.00 1.91 2.04 0.00 3.16 0.00 0.00 3.16 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.59 4.93 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 8.39 4.49 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 7.93 4.53 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 8.04 4.32 0.00 3.84 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 *132 A 8.14 4.24 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 0.00 133 G 9.14 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 7.56 3.96 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 1.14 0.00 0.00 135 Q 8.56 4.66 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.89 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 136 C 9.31 5.29 0.00 2.78 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 0.00 137 L 9.06 5.24 0.00 1.75 1.57 1.04 1.16 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 0.00 138 I 9.03 5.27 1.88 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.47 0.98 0.00 0.00 139 S 8.93 4.93 0.00 3.49 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 0.00 140 G 7.35 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 0.00 141 W 8.48 4.76 0.00 3.08 2.91 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 0.00 142 G 8.35 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 8.72 4.02 0.00 2.43 2.69 0.00 0.00 7.03 8.46 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 0.00 144 T 8.24 5.12 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 1.27 0.00 0.00 145 K 7.87 4.61 0.00 1.87 1.69 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.29 1.31 7.81 146 S 8.67 4.41 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 0.00 147 S 8.15 4.53 0.00 3.83 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 0.00 148 G 7.52 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.05 4.59 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 1.25 0.00 0.00 150 S 9.15 4.40 0.00 3.75 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 8.67 5.03 0.00 2.97 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 0.00 152 P 0.00 4.77 0.00 2.43 2.10 0.00 4.19 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.04 0.00 153 D 8.70 4.63 0.00 2.80 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 0.00 154 V 7.39 5.59 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 1.08 0.00 0.00 0.96 0.00 0.00 155 L 8.31 3.19 0.00 1.34 1.25 -0.86 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.10 4.91 0.00 1.68 1.50 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.47 7.81 157 C 8.55 5.27 0.00 1.50 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 0.00 0.00 0.00 158 L 8.55 4.95 0.00 1.71 1.46 1.01 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.98 5.08 0.00 1.82 1.82 0.00 1.85 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.66 7.81 160 A 9.20 4.84 1.17 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 0.00 161 P 0.00 5.06 0.00 2.02 2.27 0.00 3.15 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.76 0.00 162 I 8.30 4.45 1.88 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.79 0.77 0.00 0.00 163 L 8.76 4.81 0.00 1.55 1.61 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.40 4.41 0.00 4.01 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 8.68 4.46 0.00 2.77 2.80 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 0.00 166 S 8.01 4.14 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 8.07 4.15 0.00 4.05 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 8.25 4.30 0.00 3.20 3.33 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 0.00 169 K 8.37 3.95 0.00 1.96 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.68 7.81 170 S 7.99 4.14 0.00 4.06 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 7.78 4.01 1.13 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 0.00 172 Y 7.99 4.89 0.00 3.09 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 0.00 173 P 0.00 4.75 0.00 2.21 2.10 0.00 3.58 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 174 G 8.99 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 0.00 175 Q 8.23 4.52 0.00 2.36 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.06 0.00 0.00 0.00 0.00 0.00 2.31 2.57 0.00 176 I 7.83 4.43 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 1.88 0.97 1.00 0.00 0.00 177 T 8.21 4.55 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 8.54 4.38 0.00 4.00 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 0.00 179 N 8.21 4.99 0.00 3.09 3.11 0.00 0.00 6.61 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 0.00 180 M 7.81 5.64 0.00 1.79 1.99 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 181 F 8.70 5.06 0.00 2.99 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 0.00 182 C 9.07 5.58 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 9.34 5.05 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 0.00 184 G 6.98 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 184A Y 8.34 4.67 0.00 2.99 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 0.00 185 L 8.65 4.15 0.00 1.74 1.73 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.22 4.04 0.00 2.10 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 2.26 0.00 187 G 7.72 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 G 9.50 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.28 5.07 0.00 1.41 1.64 0.00 0.73 0.00 0.00 1.36 0.00 0.00 2.41 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.18 1.12 7.81 189 D 8.82 4.62 0.00 2.80 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 8.77 4.96 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 0.00 191 C 9.27 4.76 0.00 2.95 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.62 4.38 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 5.41 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 193 G 9.26 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 0.00 0.00 0.00 194 D 8.40 4.71 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 8.05 4.49 0.00 3.95 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 0.00 196 G 8.86 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 0.00 197 G 7.88 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 5.17 0.00 2.32 2.36 0.00 3.86 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.22 0.00 199 V 8.48 4.59 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 0.82 0.00 0.00 0.69 0.00 0.00 200 V 8.82 4.85 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 0.72 0.00 0.00 0.63 0.00 0.00 201 C 8.80 5.11 0.00 2.79 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 9.78 3.73 0.00 3.93 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 0.00 203 G 8.35 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 0.00 0.00 0.00 204 K 7.62 4.67 0.00 1.71 1.63 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.28 4.24 0.00 1.52 1.65 1.02 0.76 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 8.86 4.50 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.35 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 211 G 8.03 5.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.19 5.22 1.92 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 1.30 0.91 1.03 0.00 0.00 213 V 8.94 3.75 2.37 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 0.95 0.00 0.00 1.20 0.00 0.00 214 S 8.48 4.86 0.00 3.89 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.63 5.04 0.00 3.36 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 8.42 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 0.00 217 S 8.42 4.69 0.00 4.17 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 *219 G 7.96 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 0.00 220 C 8.11 4.98 0.00 2.95 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 0.00 221 A 9.09 3.73 1.38 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 221A Q 7.28 4.60 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.44 4.16 0.00 1.72 1.71 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.57 7.81 223 N 9.30 4.26 0.00 2.81 2.80 0.00 0.00 6.76 7.84 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 0.00 224 K 7.56 4.32 0.00 1.67 1.79 0.00 1.59 0.00 0.00 1.34 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 225 P 0.00 4.62 0.00 2.14 2.12 0.00 3.63 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.01 0.00 226 G 8.44 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 0.00 0.00 0.00 227 V 7.57 4.44 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 0.40 0.00 0.00 -0.75 0.00 0.00 228 Y 8.23 4.96 0.00 1.43 2.36 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 0.00 229 T 8.55 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 1.20 0.00 0.00 230 K 9.28 5.09 0.00 2.13 1.92 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.64 7.81 231 V 8.76 3.93 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 1.13 0.00 0.00 1.12 0.00 0.00 232 C 8.36 4.45 0.00 3.17 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 8.07 4.24 0.00 2.41 2.39 0.00 0.00 6.95 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 0.00 234 Y 8.04 4.79 0.00 3.19 3.19 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 0.00 235 V 8.07 3.68 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 1.13 0.00 0.00 1.12 0.00 0.00 236 S 8.10 4.12 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 8.28 4.14 0.00 3.49 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 0.00 238 I 8.30 3.21 2.04 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 1.65 1.05 0.76 0.00 0.00 239 K 8.14 3.75 0.00 1.84 1.77 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.60 7.81 240 Q 8.30 3.87 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 241 T 7.33 3.54 3.48 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 0.00 0.00 0.00 0.75 0.00 0.00 242 I 7.26 2.75 1.42 0.00 0.00 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 -0.30 0.14 0.39 0.00 0.00 243 A 7.76 4.03 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 0.00 244 S 7.27 4.64 0.00 3.96 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 7.98 4.68 0.00 3.08 3.04 0.00 0.00 6.75 7.27 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 * Residues marked with a * may have inaccurate shift predictions.