NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4418 8.1927 115.3042 57.6978 62.4540 173.5022 3 L 3.4456 8.4523 131.4098 55.6833 42.1583 177.3633 4 R 4.0179 7.7743 114.4504 57.2286 31.7997 178.1117 5 S 4.1288 7.8230 114.0748 61.2711 62.9287 176.1257 6 D 4.3055 8.3247 122.7259 57.0674 40.5838 178.4570 7 L 3.8597 7.4551 120.6107 58.0307 41.9644 179.1899 8 I 3.2800 7.8548 120.3075 64.0903 36.8090 178.0360 9 N 4.3102 7.6987 115.7127 56.1728 38.4292 176.8652 10 A 4.1019 7.8185 121.0435 55.3277 18.5595 179.0563 11 L 4.0152 7.1629 115.8977 57.9702 43.3342 178.2420 12 Y 4.7928 7.5066 117.0596 57.2698 34.4554 175.8859 *20 V 4.2016 7.0280 118.1612 62.9787 32.9719 174.6994 21 C 4.8152 9.7049 123.6941 55.4917 29.9847 173.8595 22 G 4.2390 7.2180 108.2586 45.9405 0.0000 172.1881 23 I 4.4286 8.4621 120.8438 59.2285 39.1977 174.9767 24 I 4.5489 8.2815 125.6639 59.3972 39.2903 175.2440 25 S 4.6801 8.7393 122.2301 56.8815 64.4924 175.0455 26 A 3.9947 8.5430 123.8932 55.3283 18.2741 179.0578 27 E 3.9599 8.1720 114.5167 58.3374 29.6051 178.1080 28 G 4.0559 8.3655 106.2103 44.6460 0.0000 172.7217 29 K 4.3541 8.0504 119.8171 55.3489 34.8058 175.6681 30 I 4.5982 8.4518 125.6749 60.5777 38.5562 174.3415 31 Y 4.8755 8.9600 126.0039 56.1923 39.7179 173.9798 32 P 4.8284 0.0000 0.0000 61.9246 32.6981 176.1510 33 L 4.2848 8.4207 121.8533 54.6184 43.0233 178.3262 34 G 4.0923 8.3207 115.1660 45.7871 0.0000 174.0448 35 S 4.4926 8.4629 114.3834 57.7756 64.8850 173.9509 36 D 4.2792 8.1002 121.1628 54.9420 41.5146 176.3648 37 T 3.9094 8.7841 118.2868 65.4547 68.4217 176.0685 38 K 4.0519 8.1735 121.7028 59.1866 32.0062 179.2744 39 V 3.6026 7.8253 111.8141 64.2428 31.4453 178.2165 40 L 3.6370 7.4104 117.3942 57.8177 41.7614 179.5892 41 S 4.5709 8.5653 114.1116 62.1174 63.0467 176.2875 42 T 3.8692 7.5689 120.0694 66.5961 68.1763 176.3524 43 I 3.5392 7.9257 121.6355 64.2573 37.1463 178.5418 44 F 4.2592 8.3147 118.9885 60.0455 38.5153 177.2819 45 E 4.0165 8.1077 118.8052 59.2950 29.3297 177.9280 46 L 3.8321 7.4413 118.7578 58.6208 42.0847 178.5221 47 F 4.2837 7.6914 116.0919 60.8768 39.2218 177.7824 48 S 4.3189 8.1924 113.9842 61.6222 62.6991 176.4259 49 R 3.7210 8.1851 121.6279 59.3237 29.7256 176.5396 50 P 4.2607 0.0000 0.0000 65.5581 31.3509 178.5139 51 I 3.6679 7.6875 118.1118 64.4092 37.1133 177.9053 52 I 3.5322 7.6346 120.3435 64.8824 36.9912 177.8936 53 N 4.2566 8.0214 116.7112 56.8406 38.4215 176.9182 54 K 3.9437 8.1936 120.8861 59.1370 32.4499 178.5065 55 I 3.7151 8.2699 119.6569 64.6553 37.2075 178.2925 56 A 4.0966 8.6529 121.4942 55.0792 18.1630 179.1414 57 E 3.8449 8.1318 117.8379 59.5312 29.5645 178.9051 58 K 3.3229 7.9202 117.7640 58.9139 32.0851 176.6569 59 H 4.7204 7.5164 113.0955 54.7700 29.4770 174.3780 60 G 3.8689 8.8304 107.8678 47.3603 0.0000 173.5527 61 Y 4.6256 8.2499 114.7468 55.9138 41.5229 177.0198 62 I 4.1625 7.9768 123.5847 60.2034 38.8774 174.9284 63 V 4.7225 8.2888 126.7013 61.6851 33.3071 175.0696 64 E 4.6724 9.5150 126.3661 54.8717 32.9835 174.8830 65 E 4.5991 8.6817 123.9833 54.0981 30.7754 175.3593 66 P 4.3735 0.0000 0.0000 62.6035 32.2324 177.0755 67 K 4.0964 8.4993 120.7430 58.6025 32.5618 177.7006 68 Q 4.4255 7.4387 114.6779 54.3742 30.2814 174.9773 69 Q 4.0814 8.2551 120.6038 57.1673 30.0257 174.9044 70 N 4.3493 8.9247 118.3419 54.6731 35.0236 174.3638 71 H 5.0432 7.9550 113.0439 54.3649 32.9174 173.5302 72 Y 4.4687 9.1656 125.4212 56.2802 40.3686 172.9910 73 P 4.5428 0.0000 0.0000 61.0620 33.4655 174.3563 74 D 4.3192 8.5990 118.3623 57.2244 41.6576 176.9651 75 F 5.0974 8.4957 116.4373 55.9293 43.2248 173.7572 76 T 5.1366 9.0011 120.3933 61.9174 70.8727 173.4869 77 L 5.7499 8.9134 126.2582 52.1141 45.1263 175.2271 78 Y 5.0175 7.7619 117.6459 56.7484 40.2969 172.9398 79 K 4.2688 8.1992 122.1982 54.7497 33.3086 175.9778 80 P 4.3136 0.0000 0.0000 66.0187 31.0812 177.5963 81 S 4.2916 8.0499 111.9730 60.0626 64.1994 174.7214 82 E 4.5523 7.5880 122.2418 53.7281 28.1397 174.7608 83 P 4.0781 0.0000 0.0000 65.7457 31.8760 178.0683 84 N 4.4439 7.9641 113.1242 53.9252 39.1825 174.9992 85 K 4.6312 7.3832 117.0098 54.9693 30.9284 175.8631 86 K 4.5215 8.6998 122.2112 55.7826 34.8227 177.5745 87 I 4.6003 8.7281 122.4441 59.4469 40.3149 174.4012 88 A 5.0769 8.2619 128.3701 50.1993 21.4038 175.4139 89 I 4.7939 8.4461 122.9082 59.4285 40.7170 174.0650 90 D 5.2944 8.6427 125.9349 52.5080 44.0533 174.6011 91 I 4.8324 9.0453 126.7592 59.9653 38.6116 175.2523 92 K 4.8018 9.1128 126.8907 54.8468 35.1655 175.4625 93 T 5.4274 8.7052 119.6304 62.5092 72.1898 172.7663 94 T 4.8192 8.8344 117.9017 61.2539 71.5331 171.6439 95 Y 4.5084 7.4339 121.3920 55.0870 41.3831 174.3350 96 T 4.5151 8.3834 111.4591 59.9881 70.7551 175.3089 97 N 4.5952 9.0814 122.6905 55.5882 39.2102 175.3920 98 K 4.5599 8.0813 115.7654 55.1009 35.6803 175.0190 99 E 3.8581 8.6429 121.4158 58.5038 29.7774 176.7725 100 N 4.4130 8.8837 119.4411 53.5808 37.4568 173.7704 101 E 3.9495 7.2922 116.4724 55.8605 30.1026 176.9627 102 K 4.2818 8.3235 124.2640 56.6000 31.4250 176.8016 103 I 4.0322 8.1567 120.1013 60.1912 39.7041 174.9533 104 K 4.5247 7.3500 117.8884 56.1974 34.7262 174.5283 105 F 4.9383 9.4388 122.2702 56.0277 42.8583 173.7748 106 T 4.8592 8.6292 114.4457 59.8672 68.7403 174.6400 107 L 4.7090 8.4612 129.8176 54.0418 40.9977 176.2442 108 G 3.8109 8.1862 108.3931 44.8852 0.0000 171.7992 109 G 4.4049 8.1054 106.7939 43.8396 0.0000 173.0656 110 Y 4.4227 7.6690 116.1809 56.8910 38.4145 176.1759 111 T 4.5437 7.2328 115.6754 63.5899 71.9686 174.0711 112 S 4.8404 7.0742 118.9185 57.0214 61.2890 177.5179 113 F 4.5600 8.5907 116.8505 59.9566 37.3347 177.5798 114 I 2.9662 6.7769 120.8920 63.7702 37.0793 177.0108 115 R 4.1594 7.5297 117.0616 58.2655 30.9704 177.0848 116 N 4.2943 8.3458 115.3361 56.9272 39.1279 173.7954 117 N 5.0555 8.3990 114.3527 53.2674 39.5307 175.5959 118 T 4.0086 7.6980 105.6032 61.6436 71.3821 173.9042 119 K 4.1314 8.0925 124.0665 57.6726 32.5538 176.2344 120 N 4.1394 9.0939 121.5867 53.7409 36.1673 172.8914 121 I 4.9376 7.4111 117.4650 58.8263 40.2679 175.5232 122 V 3.7167 8.6735 128.1630 65.6480 31.4775 175.7740 123 Y 4.7899 7.7344 114.3300 54.8965 41.3539 173.5687 124 P 4.5515 0.0000 0.0000 63.1705 32.1505 176.9301 125 F 4.2315 10.1781 126.7056 61.8278 39.3521 176.9418 126 D 4.9411 8.6458 115.0066 54.3808 38.8158 176.4591 127 Q 4.5047 8.1107 117.0714 56.0195 29.8577 174.3514 128 Y 4.7012 7.5275 117.5033 56.7093 38.7989 175.3998 129 I 4.3864 8.8025 118.3490 61.5478 39.1922 175.5145 130 A 4.7452 7.6031 123.1682 50.8979 23.2151 174.9804 131 H 4.9008 8.6423 115.6612 54.1637 31.1306 173.4028 132 W 5.2846 9.0722 124.6161 56.5377 31.4513 175.2500 133 I 4.7871 8.2303 119.3875 60.7371 41.6129 174.1267 134 I 4.4418 8.4736 128.2187 59.3707 39.8314 175.0317 135 G 3.5743 7.3334 112.2041 44.3001 0.0000 170.7413 136 Y 4.9839 9.1631 121.8391 55.8176 41.0224 174.8859 137 V 5.0318 9.0989 123.5537 60.1890 34.4439 173.8773 138 Y 5.4159 7.7594 124.4489 54.5030 42.3358 174.7352 139 T 4.8721 9.3096 117.6916 61.8692 69.5135 174.3367 140 R 4.2781 8.3907 127.4367 57.2824 30.5695 176.0804 *150 T 4.1762 8.3677 121.4807 63.8122 70.0084 172.3033 151 Y 4.8878 9.1645 121.5631 56.1393 42.6776 173.9827 152 N 5.2933 8.4769 115.5879 50.7523 40.2261 175.4504 153 I 3.2374 8.5421 120.1874 64.8727 37.3442 177.3229 154 N 4.5334 8.9979 117.4968 55.0883 38.6186 175.4054 155 E 4.6892 8.6277 117.3353 54.9206 29.9208 176.9926 156 L 3.8679 8.0043 122.4542 59.6521 42.8769 177.1489 157 N 4.8944 7.6945 115.5764 52.0660 36.5570 174.9465 158 E 4.5919 7.4156 111.9354 56.5027 32.9621 175.8239 159 I 3.5748 6.8472 120.6380 58.9943 38.0515 173.8172 160 P 4.2900 0.0000 0.0000 62.1200 31.6080 176.2603 161 K 4.1482 8.2664 123.5276 55.2612 32.8406 175.1859 162 P 4.6778 0.0000 0.0000 62.7542 31.5387 174.8665 163 Y 4.8749 6.6776 116.1565 58.0068 41.0297 172.4010 164 K 4.2671 9.1224 118.2010 56.4872 35.1986 173.2206 165 G 4.0577 8.3487 110.6303 46.3560 0.0000 170.6184 166 V 4.5846 7.8593 121.7018 61.7253 31.9541 175.0660 167 K 4.3980 9.1900 128.3070 56.1868 33.5351 176.6484 168 V 5.2864 8.4209 113.9833 60.1054 35.9912 173.9183 169 F 5.2448 7.5986 115.6130 56.8482 41.1546 172.4806 170 L 4.7637 8.4779 121.2887 53.3955 43.5965 175.1498 171 Q 4.5588 8.9274 126.7916 54.1596 33.3233 173.8168 172 D 4.7328 8.4607 123.8011 53.7790 41.5595 176.5965 173 K 3.7257 8.6690 125.4654 59.9868 31.8269 178.4412 174 W 3.4298 7.8791 116.5675 59.6517 27.9085 177.9479 175 V 2.4088 6.3005 118.8962 64.8932 30.7945 177.5190 176 I 3.8384 7.3206 110.6796 60.8355 38.1399 175.5235 177 A 4.3150 7.2846 123.8292 52.7916 18.7508 177.1527 178 G 4.3440 8.7052 109.9555 44.2309 0.0000 172.7821 179 D 4.4944 8.7031 116.6011 52.6994 39.6989 175.9502 180 L 5.2139 7.8854 120.5670 53.5797 43.3089 176.2443 181 A 4.7137 8.7160 123.3399 52.0622 19.2733 177.0708 182 G 3.6281 9.1658 106.0632 47.4686 0.0000 175.8367 183 S 3.6519 8.0186 116.2222 58.9342 64.2709 173.9199 *187 T 4.1198 7.2728 109.5577 61.7136 68.6894 172.9620 188 N 5.3185 7.5404 120.1577 51.8456 42.4463 176.0336 189 I 3.2161 8.7978 124.4534 61.2065 38.5438 175.2090 190 G 4.6201 7.8509 109.9757 44.4760 0.0000 173.2853 191 S 5.2259 9.3631 118.7794 56.8816 64.6823 173.9161 192 I 3.7430 8.4977 114.8252 61.5285 37.6758 176.3205 193 H 4.9485 8.7548 125.1202 54.5435 27.4852 172.6529 194 A 5.0569 7.4581 123.1106 50.2257 23.4199 175.4196 195 H 4.6071 8.9176 112.0889 55.3548 30.1992 175.7367 196 Y 4.2568 9.0090 124.6852 61.1446 38.4359 179.1953 197 K 3.7932 8.1956 118.4362 59.7054 32.5600 178.4551 198 D 4.1578 8.5410 120.4966 56.7328 40.3390 178.4400 199 F 3.5993 7.6972 118.6595 59.8179 38.6234 178.1006 200 V 3.5355 6.9052 116.6451 65.8546 31.5512 177.5637 201 E 4.0409 8.0733 117.1120 56.6798 29.8580 176.6146 202 G 3.4525 7.1836 106.4992 46.3779 0.0000 175.6630 203 K 4.1063 8.2027 120.2525 54.7622 31.1201 177.1970 204 G 4.3266 7.6617 112.9575 43.2354 0.0000 169.6062 205 I 4.0948 8.1425 117.4561 62.8973 38.6416 176.7086 206 F 4.6298 8.0010 116.9096 58.1910 39.2445 174.9296 207 D 5.0249 9.0452 122.2261 54.8936 42.0794 177.2507 208 S 3.9027 7.5267 112.0566 56.0400 66.2516 176.0117 209 E 3.1652 6.8754 123.2043 59.3203 29.2787 178.8352 210 D 4.3059 7.7806 118.4060 57.0492 40.7576 178.3597 211 E 3.9964 7.7725 119.9649 59.1991 29.8265 178.2467 212 F 2.4830 7.8475 120.6457 61.0721 39.2981 177.0812 213 L 3.4892 8.0560 118.3986 57.7250 41.0984 179.1366 214 D 4.2758 8.0966 117.9565 57.1758 40.6941 177.5441 215 Y 3.1027 7.8390 120.4306 60.4153 38.5601 178.3319 216 W 4.1993 7.5262 118.0388 59.4620 29.1892 178.6653 217 R 4.0329 7.9812 117.5854 58.4657 29.5539 177.7382 218 N 4.7299 7.4401 113.4877 52.1852 39.4174 174.6855 219 Y 3.2083 6.8039 121.7503 57.4798 39.2402 175.0827 220 E 4.0545 7.8368 127.4549 58.6268 30.3042 176.1594 *230 Y 4.7077 7.4479 114.8494 57.1067 38.8842 174.8484 231 N 4.7992 8.3089 119.0245 50.8471 37.9913 174.3499 232 N 4.7197 8.2905 113.4136 52.0755 40.6798 173.6762 233 I 3.7300 8.5921 122.7665 65.0175 37.9557 177.7991 234 S 4.1250 8.3181 114.7705 62.4619 62.5564 176.5227 235 E 4.0731 10.0386 121.8635 59.6652 29.3072 179.0759 236 Y 3.2837 8.1732 119.6966 60.4673 38.5135 178.1533 237 R 3.5480 8.1508 118.3935 59.0872 30.4110 178.4167 238 N 4.5818 8.1091 116.1717 55.7302 38.5693 177.0352 239 W 4.3539 8.7061 129.8132 60.8693 30.6894 177.5507 240 I 3.0086 7.0702 118.8861 63.9234 36.4424 175.4007 241 Y 4.2640 8.0477 122.1264 57.4619 37.8680 174.0064 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 2 S 8.19 4.44 0.00 3.90 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 3 L 8.45 3.45 0.00 1.74 1.72 0.77 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.77 4.02 0.00 1.05 1.43 0.00 2.60 0.00 0.00 3.32 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.31 0.00 5 S 7.82 4.13 0.00 4.04 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 6 D 8.32 4.31 0.00 2.80 2.78 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 7 L 7.46 3.86 0.00 1.86 1.63 0.83 1.06 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 8 I 7.85 3.28 1.70 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 1.11 0.08 0.36 0.00 0.00 9 N 7.70 4.31 0.00 2.83 2.89 0.00 0.00 7.03 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 10 A 7.82 4.10 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.16 4.02 0.00 1.28 1.53 0.59 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.51 4.79 0.00 2.97 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 *20 V 7.03 4.20 2.34 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 0.79 0.00 0.00 0.56 0.00 0.00 21 C 9.70 4.82 0.00 2.94 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 22 G 7.22 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 23 I 8.46 4.43 1.96 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 1.17 0.78 0.97 0.00 0.00 24 I 8.28 4.55 1.88 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 1.48 0.82 0.91 0.00 0.00 25 S 8.74 4.68 0.00 4.42 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.54 3.99 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 27 E 8.17 3.96 0.00 1.96 2.04 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 2.35 2.40 0.00 28 G 8.37 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 29 K 8.05 4.35 0.00 1.66 1.83 0.00 1.05 0.00 0.00 1.51 0.00 0.00 3.17 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.20 0.68 7.81 30 I 8.45 4.60 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.67 0.95 0.00 0.00 31 Y 8.96 4.88 0.00 2.88 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.83 0.00 2.01 1.97 0.00 3.86 0.00 0.00 4.00 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 33 L 8.42 4.28 0.00 1.64 1.59 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.32 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 35 S 8.46 4.49 0.00 3.93 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 36 D 8.10 4.28 0.00 2.71 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.78 3.91 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 38 K 8.17 4.05 0.00 2.15 1.91 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.69 7.81 39 V 7.83 3.60 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.96 0.00 0.00 40 L 7.41 3.64 0.00 1.61 1.34 0.82 0.16 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 41 S 8.57 4.57 0.00 4.14 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.57 3.87 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 1.16 0.00 0.00 43 I 7.93 3.54 1.61 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.50 0.57 0.00 0.00 44 F 8.31 4.26 0.00 3.07 2.39 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 45 E 8.11 4.02 0.00 2.26 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 2.41 2.59 0.00 46 L 7.44 3.83 0.00 1.73 1.37 0.84 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 47 F 7.69 4.28 0.00 3.06 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.19 4.32 0.00 4.12 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 49 R 8.19 3.72 0.00 2.14 2.05 0.00 3.16 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.16 0.00 50 P 0.00 4.26 0.00 2.23 2.09 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 51 I 7.69 3.67 1.91 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 1.68 0.90 0.88 0.00 0.00 52 I 7.63 3.53 1.36 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 1.24 0.52 0.68 0.00 0.00 53 N 8.02 4.26 0.00 3.03 2.89 0.00 0.00 6.77 6.87 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 54 K 8.19 3.94 0.00 1.83 2.00 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 55 I 8.27 3.72 1.85 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 1.61 0.92 0.96 0.00 0.00 56 A 8.65 4.10 1.35 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 57 E 8.13 3.84 0.00 2.26 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 2.31 2.33 0.00 58 K 7.92 3.32 0.00 1.80 1.88 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.44 7.81 59 H 7.52 4.72 0.00 3.59 3.52 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.83 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 61 Y 8.25 4.63 0.00 2.86 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 62 I 7.98 4.16 1.24 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.92 0.61 0.00 0.00 63 V 8.29 4.72 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 1.03 0.00 0.00 0.98 0.00 0.00 64 E 9.51 4.67 0.00 2.11 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 0.00 2.36 2.47 0.00 65 E 8.68 4.60 0.00 1.73 1.63 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 1.56 1.99 0.00 66 P 0.00 4.37 0.00 2.10 1.91 0.00 3.45 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.12 0.00 67 K 8.50 4.10 0.00 1.65 1.79 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.34 7.81 68 Q 7.44 4.43 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.99 0.00 0.00 0.00 0.00 0.00 1.87 1.16 0.00 69 Q 8.26 4.08 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.62 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 70 N 8.92 4.35 0.00 3.00 2.99 0.00 0.00 6.74 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 71 H 7.96 5.04 0.00 3.05 3.16 0.00 5.88 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 9.17 4.47 0.00 2.97 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.54 0.00 1.53 0.49 0.00 3.32 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.75 0.00 74 D 8.60 4.32 0.00 3.06 2.78 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 75 F 8.50 5.10 0.00 2.90 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 76 T 9.00 5.14 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 1.34 0.00 0.00 77 L 8.91 5.75 0.00 1.50 1.24 0.91 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 78 Y 7.76 5.02 0.00 2.85 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 79 K 8.20 4.27 0.00 1.69 1.53 0.00 1.35 0.00 0.00 1.60 0.00 0.00 2.68 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.59 0.95 7.81 80 P 0.00 4.31 0.00 2.16 2.21 0.00 3.61 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 1.93 1.92 0.00 81 S 8.05 4.29 0.00 3.97 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 82 E 7.59 4.55 0.00 1.97 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 2.20 2.16 0.00 83 P 0.00 4.08 0.00 1.96 2.06 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.94 0.00 84 N 7.96 4.44 0.00 2.66 2.84 0.00 0.00 6.70 7.61 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 85 K 7.38 4.63 0.00 1.57 1.71 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.34 7.81 86 K 8.70 4.52 0.00 0.82 1.53 0.00 0.61 0.00 0.00 0.68 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 1.12 7.81 87 I 8.73 4.60 1.45 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.47 -0.13 0.00 0.00 88 A 8.26 5.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.45 4.79 1.98 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 1.22 0.81 1.01 0.00 0.00 90 D 8.64 5.29 0.00 2.92 2.56 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 91 I 9.05 4.83 2.27 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 1.11 0.00 0.00 92 K 9.11 4.80 0.00 1.14 1.66 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.26 1.43 7.81 93 T 8.71 5.43 4.57 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 1.74 0.00 0.00 94 T 8.83 4.82 3.70 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 0.00 0.00 0.63 0.00 0.00 95 Y 7.43 4.51 0.00 2.67 1.86 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 96 T 8.38 4.52 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 97 N 9.08 4.60 0.00 2.88 2.97 0.00 0.00 6.85 7.61 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 98 K 8.08 4.56 0.00 1.91 1.87 0.00 1.34 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.71 1.40 7.81 99 E 8.64 3.86 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 100 N 8.88 4.41 0.00 2.84 2.98 0.00 0.00 7.02 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 0.00 101 E 7.29 3.95 0.00 2.26 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 2.27 2.25 0.00 102 K 8.32 4.28 0.00 1.72 1.79 0.00 1.89 0.00 0.00 1.84 0.00 0.00 3.24 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.55 7.81 103 I 8.16 4.03 1.31 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 0.77 0.00 0.00 104 K 7.35 4.52 0.00 1.79 1.66 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.17 1.36 7.81 105 F 9.44 4.94 0.00 2.96 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 0.00 106 T 8.63 4.86 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 1.31 0.00 0.00 107 L 8.46 4.71 0.00 1.49 1.62 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.19 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 0.00 0.00 0.00 109 G 8.11 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 7.67 4.42 0.00 3.06 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 0.00 111 T 7.23 4.54 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 1.16 0.00 0.00 112 S 7.07 4.84 0.00 4.39 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 0.00 113 F 8.59 4.56 0.00 3.68 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 0.00 114 I 6.78 2.97 1.46 0.00 0.00 0.77 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 -0.06 0.66 0.00 0.00 115 R 7.53 4.16 0.00 1.72 1.91 0.00 3.23 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 116 N 8.35 4.29 0.00 2.67 2.98 0.00 0.00 7.63 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 0.00 117 N 8.40 5.06 0.00 2.98 3.32 0.00 0.00 6.82 7.10 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 0.00 118 T 7.70 4.01 4.32 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 1.30 0.00 0.00 119 K 8.09 4.13 0.00 1.85 1.78 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.53 1.50 7.81 120 N 9.09 4.14 0.00 3.19 2.97 0.00 0.00 6.57 7.23 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 0.00 121 I 7.41 4.94 1.99 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 1.74 1.12 1.30 0.00 0.00 122 V 8.67 3.72 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.93 0.00 0.00 123 Y 7.73 4.79 0.00 2.86 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 0.00 124 P 0.00 4.55 0.00 2.41 2.13 0.00 3.90 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 125 F 10.18 4.23 0.00 3.35 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 0.00 126 D 8.65 4.94 0.00 2.96 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.11 4.50 0.00 1.71 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.88 0.00 0.00 0.00 0.00 0.00 2.21 2.45 0.00 128 Y 7.53 4.70 0.00 2.79 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.80 4.39 1.88 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 1.28 0.52 0.89 0.00 0.00 130 A 7.60 4.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 H 8.64 4.90 0.00 3.12 3.30 0.00 5.62 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 W 9.07 5.28 0.00 3.26 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 0.00 133 I 8.23 4.79 2.03 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 1.27 0.45 0.65 0.00 0.00 134 I 8.47 4.44 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.55 0.58 0.00 0.00 135 G 7.33 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 0.00 0.00 0.00 136 Y 9.16 4.98 0.00 1.85 1.84 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 0.00 137 V 9.10 5.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.18 0.00 0.00 138 Y 7.76 5.42 0.00 3.25 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 0.00 139 T 9.31 4.87 4.36 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 1.36 0.00 0.00 140 R 8.39 4.28 0.00 2.01 2.19 0.00 3.11 0.00 0.00 3.47 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 *150 T 8.37 4.18 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 0.99 0.00 0.00 151 Y 9.16 4.89 0.00 2.70 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 0.00 152 N 8.48 5.29 0.00 3.01 2.84 0.00 0.00 7.39 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 0.00 153 I 8.54 3.24 1.86 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 0.79 0.90 0.00 0.00 154 N 9.00 4.53 0.00 2.90 2.88 0.00 0.00 6.87 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 0.00 155 E 8.63 4.69 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 156 L 8.00 3.87 0.00 1.72 1.68 0.87 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 157 N 7.69 4.89 0.00 2.82 2.81 0.00 0.00 5.77 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 0.00 158 E 7.42 4.59 0.00 2.16 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 0.00 2.22 2.31 0.00 159 I 6.85 3.57 1.56 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.25 0.62 0.00 0.00 160 P 0.00 4.29 0.00 2.03 1.97 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 161 K 8.27 4.15 0.00 1.32 1.11 0.00 1.39 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.37 7.81 162 P 0.00 4.68 0.00 2.22 2.19 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.04 0.00 163 Y 6.68 4.87 0.00 3.17 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 0.00 164 K 9.12 4.27 0.00 1.70 1.68 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.27 1.44 7.81 165 G 8.35 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 0.00 166 V 7.86 4.58 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 1.04 0.00 0.00 1.26 0.00 0.00 167 K 9.19 4.40 0.00 1.35 1.05 0.00 1.28 0.00 0.00 0.61 0.00 0.00 2.56 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.00 1.17 7.81 168 V 8.42 5.29 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.98 0.00 0.00 169 F 7.60 5.24 0.00 2.97 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 0.00 170 L 8.48 4.76 0.00 1.25 1.19 0.61 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 171 Q 8.93 4.56 0.00 2.43 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 172 D 8.46 4.73 0.00 2.57 2.57 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 0.00 173 K 8.67 3.73 0.00 2.01 1.73 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.28 1.49 7.81 174 W 7.88 3.43 0.00 3.29 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 0.00 175 V 6.30 2.41 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 -0.58 0.00 0.00 176 I 7.32 3.84 1.93 0.00 0.00 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 1.79 1.03 0.84 0.00 0.00 177 A 7.28 4.32 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 8.71 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 D 8.70 4.49 0.00 2.60 2.31 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 0.00 180 L 7.89 5.21 0.00 1.95 1.98 1.02 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 181 A 8.72 4.71 1.56 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 0.00 182 G 9.17 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 S 8.02 3.65 0.00 3.98 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 *187 T 7.27 4.12 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 1.12 0.00 0.00 188 N 7.54 5.32 0.00 2.70 2.70 0.00 0.00 6.99 7.48 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 0.00 189 I 8.80 3.22 1.55 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.21 0.37 0.00 0.00 190 G 7.85 4.62 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 0.00 191 S 9.36 5.23 0.00 4.23 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 0.00 192 I 8.50 3.74 1.73 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 -0.00 0.88 0.00 0.00 193 H 8.75 4.95 0.00 3.25 3.29 0.00 5.49 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 0.00 194 A 7.46 5.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 H 8.92 4.61 0.00 3.38 3.28 0.00 5.86 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 Y 9.01 4.26 0.00 3.01 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 0.00 197 K 8.20 3.79 0.00 1.95 2.10 0.00 1.57 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.48 7.81 198 D 8.54 4.16 0.00 2.60 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 F 7.70 3.60 0.00 2.33 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 6.91 3.54 1.82 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 0.76 0.00 0.00 0.31 0.00 0.00 201 E 8.07 4.04 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 202 G 7.18 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.20 4.11 0.00 1.66 1.62 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.27 7.81 204 G 7.66 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 I 8.14 4.09 1.65 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.55 0.07 0.00 0.00 206 F 8.00 4.63 0.00 3.60 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 0.00 207 D 9.05 5.02 0.00 2.92 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 0.00 208 S 7.53 3.90 0.00 3.77 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 0.00 209 E 6.88 3.17 0.00 1.16 1.56 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 2.37 2.45 0.00 210 D 7.78 4.31 0.00 2.77 2.70 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 0.00 0.00 0.00 211 E 7.77 4.00 0.00 2.17 2.34 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 2.71 2.68 0.00 212 F 7.85 2.48 0.00 2.66 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 0.00 213 L 8.06 3.49 0.00 1.81 1.63 1.03 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 214 D 8.10 4.28 0.00 2.92 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 Y 7.84 3.10 0.00 2.50 2.56 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 0.00 216 W 7.53 4.20 0.00 2.80 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 0.00 217 R 7.98 4.03 0.00 1.78 1.95 0.00 3.06 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.76 0.00 218 N 7.44 4.73 0.00 2.69 2.72 0.00 0.00 6.96 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 0.00 219 Y 6.80 3.21 0.00 2.48 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 0.00 0.00 0.00 0.00 220 E 7.84 4.05 0.00 1.78 1.87 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 1.88 1.92 0.00 *230 Y 7.45 4.71 0.00 2.97 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 0.00 231 N 8.31 4.80 0.00 2.72 2.64 0.00 0.00 6.79 7.88 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 0.00 232 N 8.29 4.72 0.00 3.14 2.96 0.00 0.00 5.73 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 0.00 233 I 8.59 3.73 1.50 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.49 0.82 0.00 0.00 234 S 8.32 4.12 0.00 4.05 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 0.00 235 E 10.04 4.07 0.00 2.02 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 0.00 2.38 2.60 0.00 236 Y 8.17 3.28 0.00 1.43 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 0.00 237 R 8.15 3.55 0.00 2.02 1.94 0.00 3.25 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.10 0.00 238 N 8.11 4.58 0.00 2.84 2.92 0.00 0.00 6.60 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 W 8.71 4.35 0.00 3.23 3.37 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 0.00 240 I 7.07 3.01 1.40 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.35 0.06 0.00 0.00 241 Y 8.05 4.26 0.00 2.77 2.70 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.