NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 M 4.3446 8.3044 120.3487 55.3893 33.3349 174.1252 13 E 4.5238 8.4518 124.3268 53.5275 32.3229 171.3961 14 E 4.7382 9.0815 122.2703 54.4702 33.6916 173.6013 15 E 4.7372 8.5427 123.5958 54.4467 33.4582 174.4390 16 E 4.6085 8.6253 123.1349 54.8220 31.5892 174.6948 17 V 4.9470 8.3787 125.9665 61.1428 34.2857 174.2832 18 E 4.5739 9.3029 126.5723 54.7859 33.1118 174.6551 19 T 4.7155 8.0934 120.4147 61.8133 70.5882 173.9257 20 F 4.6008 8.6069 124.4046 55.1693 42.6450 174.5208 21 A 4.5265 8.3927 123.0209 51.5361 19.4570 177.3753 22 F 4.7449 8.7410 119.9972 56.9908 40.1287 175.6184 23 Q 4.1289 9.4499 123.9903 56.7053 29.3812 177.1106 24 A 4.0392 9.1401 127.7403 55.9225 18.3664 180.0397 25 E 4.1659 8.3315 115.6987 58.9965 29.5671 179.4850 26 I 3.4348 7.6498 119.7358 64.1196 37.1689 177.9440 27 A 3.8205 7.9574 121.6389 55.2482 18.1877 179.7673 28 Q 3.9216 7.6794 116.2319 58.7557 28.7468 178.6351 29 L 3.8551 7.8203 121.4301 58.5043 42.2751 178.9435 30 M 3.9889 8.0974 118.9329 58.3775 31.8396 179.0839 31 S 4.0880 7.8086 115.1326 61.4115 63.0138 176.2140 32 L 3.9872 7.8083 123.0106 58.3998 41.5388 179.2364 33 I 4.1748 7.6410 118.5829 64.5453 37.2272 178.2395 34 I 4.0681 7.6728 118.7860 63.0905 37.0695 176.4706 35 N 4.9637 7.9114 113.8648 52.9071 39.6837 174.2802 36 T 4.5005 7.3488 113.9084 61.2879 71.1511 173.5908 37 F 4.3426 8.3621 127.4675 58.0128 40.2065 173.9372 38 Y 4.3802 6.8694 123.0529 55.8873 41.9290 173.8132 39 S 5.5560 8.8381 126.5951 59.3399 64.1175 176.4957 40 N 3.9445 7.5617 133.4673 54.2467 38.6320 176.2153 41 K 4.1157 8.2098 119.8970 59.0645 32.6718 178.3657 42 E 4.1932 8.3401 117.5534 58.4503 29.5007 178.5519 43 I 3.5646 7.4584 114.0165 63.0171 37.5610 177.7503 44 F 4.2588 8.0240 118.7031 59.3640 37.3399 177.2137 45 L 3.2440 6.0540 120.0884 57.3788 41.6346 178.8042 46 R 3.7469 7.4560 118.2522 59.2546 30.0332 178.2012 47 E 3.8744 7.7832 117.8760 59.4360 29.4920 179.2655 48 L 3.9727 7.5514 118.3902 57.9952 41.6950 179.7818 49 I 3.7118 7.8528 119.7166 64.3021 36.9888 178.7154 50 S 4.1225 8.3647 116.4235 61.7884 62.6911 176.5503 51 N 4.3744 8.2637 119.1070 56.2561 38.0893 177.7099 52 S 4.2776 8.1851 118.0612 61.1751 62.9422 176.6448 53 S 4.2077 8.6149 116.0651 61.5343 62.0600 176.0242 54 D 4.3903 8.3288 121.5014 57.2179 40.5955 178.5380 55 A 3.9978 8.0331 121.2855 54.9354 18.3709 179.7215 56 L 3.7769 7.5334 117.6259 57.7132 41.6592 179.1188 57 D 4.6121 8.1573 118.9108 57.5993 40.7524 179.0936 58 K 4.1289 8.3177 118.8314 59.4660 31.7452 179.4975 59 I 3.6966 7.5503 118.9859 64.4560 36.9851 178.1689 60 R 4.0088 7.8446 118.4341 59.4254 29.7798 178.6509 61 Y 4.2266 8.2562 116.3878 60.4701 38.0340 177.4265 62 E 3.9457 8.6079 120.5582 59.1350 29.3752 178.7198 63 S 4.3305 7.3818 112.7049 61.1261 62.3805 175.1757 64 L 4.1713 8.0698 121.6415 56.9845 41.5519 177.7734 65 T 4.4380 7.6640 106.0351 61.9636 70.1157 174.8816 66 D 4.7227 8.0245 121.9978 50.9745 42.3027 173.1136 67 P 4.4034 0.0000 0.0000 65.0241 31.5942 177.5832 68 S 4.3109 8.1649 112.6978 61.4798 62.7145 176.4933 69 K 3.9315 8.1903 121.9611 59.3704 31.5064 178.9817 70 L 4.0709 7.7608 118.4237 57.6643 41.5409 178.4169 71 D 4.6061 7.7262 116.0961 53.8684 41.1054 176.2447 72 S 4.3284 7.4070 115.2711 57.8767 62.9525 174.4336 73 G 3.7838 8.5294 115.4294 46.9788 0.0000 174.2915 74 K 4.0199 7.4511 120.5393 56.4062 32.4544 176.4704 75 E 4.1151 8.5117 123.4369 55.7442 30.1773 176.6669 76 L 4.1240 8.3768 124.1726 54.6083 40.6590 175.2879 77 H 5.1386 8.7300 119.0864 54.6157 33.0391 172.1534 78 I 5.0623 9.1119 118.9415 59.6418 40.3097 174.6622 79 N 5.6101 9.4462 124.6537 51.4560 41.7512 173.4863 80 L 5.1416 9.5286 123.3017 53.2206 44.7303 175.7382 81 I 5.0106 8.8302 124.1750 58.8205 39.9969 172.1669 82 P 4.9335 0.0000 0.0000 62.1755 32.7811 175.3999 83 N 4.8548 9.1995 122.0415 51.7711 40.8041 174.9584 84 K 4.1212 8.8585 126.7983 59.0440 32.8261 178.9074 85 Q 4.0797 8.3160 119.2809 59.0466 29.0272 176.5215 86 D 4.5602 8.9678 114.9007 53.7735 41.7126 176.1340 87 R 3.8734 8.0734 119.3349 57.8329 28.9259 175.0167 88 T 5.1932 7.6723 104.7398 59.4914 72.8899 172.4711 89 L 5.1328 8.7340 124.6171 53.7241 45.2001 175.0345 90 T 5.1125 8.7223 122.7866 61.8106 71.7710 173.2016 91 I 4.7451 8.7580 127.1953 59.7672 39.6139 174.5617 92 V 4.8862 8.8547 128.6638 60.9788 33.4988 174.3317 93 D 5.6343 9.2172 126.5029 50.2662 43.2329 175.5923 94 T 4.4168 8.1287 107.3477 61.5652 68.6685 174.5653 95 G 3.8843 8.3544 113.9503 45.7049 0.0000 174.3601 96 I 3.4465 7.7657 118.9403 62.1816 37.9961 177.8391 97 G 3.9354 8.4669 105.6921 44.9222 0.0000 171.7378 98 M 4.8402 8.1821 117.3277 52.7293 35.2076 176.7050 99 T 4.2339 8.4397 114.4672 60.8033 71.2784 175.1443 100 K 3.1309 8.2799 120.5186 59.4589 32.0168 178.2048 101 A 3.9193 7.8824 120.3577 55.4231 18.1952 179.0932 102 D 4.2541 7.8556 116.7165 57.4181 40.8868 179.1163 103 L 3.7894 7.7233 119.3131 57.7552 41.6609 179.7008 104 I 3.6433 7.6163 119.5101 64.5270 36.5764 178.3143 105 N 4.3240 8.5929 117.5960 55.9900 38.2142 176.5014 106 N 4.4808 8.0434 114.8265 53.0877 39.3875 175.2942 107 L 4.5253 8.9739 120.9559 51.9260 42.7827 177.1997 108 G 4.3960 8.0839 117.5587 46.7847 0.0000 175.8717 109 T 4.1416 7.6726 115.1574 63.8053 67.7224 174.7103 110 I 4.3469 7.0571 120.9316 59.1499 38.5423 175.4957 111 A 4.1300 8.5466 127.2430 52.3791 18.9957 176.8626 112 K 4.6236 8.3915 120.7146 54.3301 34.2064 177.5568 113 S 4.3472 8.9324 118.5173 59.9844 63.2759 174.8439 114 G 4.3652 7.8177 108.7709 45.4260 0.0000 175.5255 115 T 3.9568 7.9332 117.5821 66.9458 68.3976 176.3032 116 K 3.9210 8.0621 119.0507 59.4344 32.2571 178.9129 117 A 4.0530 8.1888 120.5625 55.4080 18.1694 179.3118 118 F 3.3550 8.3484 118.8186 61.5262 39.3232 177.2901 119 M 3.6784 7.8981 118.2232 58.1713 31.4177 178.7174 120 E 3.8782 8.0442 118.1118 59.0785 29.8669 178.7438 121 A 4.0936 8.2791 121.0945 55.3252 18.4912 179.4325 122 L 3.6953 7.4790 117.5599 58.3018 41.4250 179.9610 123 Q 4.1050 7.6812 115.8876 57.8909 28.5770 177.3147 124 A 4.6076 7.8221 121.1431 51.4235 19.1043 177.2489 125 G 3.7880 7.8825 106.2397 47.4138 0.0000 174.7300 126 A 4.2371 7.7824 121.1988 51.1395 19.3912 177.7988 127 D 4.5082 8.4995 119.9355 53.7618 42.1077 177.2530 128 I 3.9155 8.5011 125.8117 64.2551 37.5008 177.5447 129 S 4.1360 8.3744 113.0038 61.0221 62.2961 175.1935 130 M 4.3486 8.6474 120.5580 56.4684 31.7730 177.6013 131 I 2.3978 7.7896 120.4036 63.7219 38.0710 177.5837 132 G 3.5717 7.9060 107.8393 48.8329 0.0000 174.9607 133 Q 4.1366 7.6754 116.6374 56.9151 28.8136 176.7020 134 F 4.2060 8.0966 116.9671 57.1067 39.6656 177.2317 135 G 4.1694 8.6587 108.7665 45.5043 0.0000 174.0331 136 V 4.7654 7.4147 112.0321 60.5861 32.9391 177.9653 137 G 3.6719 8.3692 110.8232 48.3060 0.0000 176.3762 138 F 3.8800 8.1382 121.5859 61.0867 39.3967 175.7701 139 Y 4.4489 7.6228 114.0688 58.9133 37.5995 177.4739 140 S 4.2457 7.8693 116.4171 60.8155 63.0639 175.9976 141 A 3.7792 7.6473 124.7472 54.9762 17.6523 178.1330 142 Y 4.4200 7.2687 112.1478 58.7834 38.0789 177.1756 143 L 4.2463 8.1910 121.9213 56.7467 42.1380 177.9087 144 V 4.1974 7.4004 108.7526 60.2692 33.6938 174.6152 145 A 5.1389 7.3173 123.2133 50.0575 20.8634 176.0890 146 E 4.4539 8.7861 120.5268 57.9723 30.9684 176.7934 147 K 4.9833 7.8455 120.9633 55.0221 36.3514 174.5167 148 V 4.9650 8.8454 125.9119 61.4882 34.6740 174.0059 149 T 5.3581 8.8515 124.3249 61.8806 71.3301 173.3958 150 V 4.8100 9.5228 126.5011 61.3773 33.9848 174.0389 151 I 4.9857 8.8325 130.3216 60.3232 38.9923 175.0990 152 T 4.9123 8.8866 120.8318 60.3543 71.6326 172.5422 153 K 4.8342 9.6066 128.3716 55.2807 35.4550 174.2328 154 H 5.3329 8.8302 127.1420 54.3218 32.2812 174.6409 155 N 4.3229 8.9001 121.7091 56.7886 38.5069 176.5040 156 D 4.5143 8.5028 115.8286 56.6299 41.1854 174.8853 157 D 4.7435 7.8012 116.2917 52.8390 44.2090 173.7645 158 E 4.2489 9.2774 120.6317 55.5714 30.8199 175.5054 159 Q 4.5347 7.9303 120.4551 55.8275 30.6623 173.9948 160 Y 5.3785 8.8826 121.9579 56.1417 42.9277 174.0406 161 A 5.3850 9.2164 122.4934 50.1019 22.2414 175.0418 162 W 5.3884 9.7565 133.3469 56.0694 34.0390 174.3019 163 E 5.6326 7.9739 123.7361 56.2132 33.3934 173.9629 164 S 4.6989 8.5427 120.4084 57.2072 65.9579 174.0156 165 S 4.9950 8.9308 122.3592 58.3011 63.3472 175.8623 166 A 3.5808 8.3456 123.2956 53.7747 16.5289 180.1087 167 G 3.8634 8.6116 108.1372 46.4447 0.0000 173.4955 168 G 4.2332 9.2855 109.8122 44.8968 0.0000 173.4445 169 S 5.0170 7.6465 111.7257 56.9462 66.8247 173.0820 170 F 4.9142 8.1631 113.0212 55.6299 41.1152 173.5457 171 T 5.0174 8.2071 110.6394 60.2077 71.7467 173.2361 172 V 5.1409 9.0267 123.4034 61.3017 34.6328 174.5190 173 R 5.9517 9.2288 122.9961 53.5904 33.5581 174.2867 174 T 4.3110 8.5743 111.1877 61.4843 69.4776 173.4630 175 D 4.6199 8.5514 128.1257 53.7295 41.6785 175.9784 176 T 4.4682 8.7196 115.2041 61.2921 69.3421 175.2581 177 G 3.8313 8.2385 112.1268 44.7597 0.0000 172.4842 178 E 3.8462 8.7957 120.1365 55.9845 29.6712 175.9904 179 P 4.5797 0.0000 0.0000 62.9903 31.9144 176.0257 180 M 4.4475 8.7556 117.3389 53.7776 32.4895 176.5907 181 G 3.9235 7.7370 108.7212 44.1426 0.0000 172.8163 182 R 3.8537 8.1942 117.6500 56.8526 30.7056 174.8705 183 G 3.9236 7.5054 109.1731 44.6253 0.0000 172.0722 184 T 5.0791 8.4617 114.6055 61.6292 73.0815 173.0697 185 K 4.9346 9.8551 127.7390 54.6435 35.1844 174.6087 186 V 4.6907 8.6804 127.9940 61.4320 33.6461 174.2762 187 I 4.5954 8.9039 129.7950 59.6975 39.4677 174.6456 188 L 4.5703 8.9407 128.8034 53.5788 43.5201 175.9575 189 H 4.9476 8.7887 122.7791 54.3384 29.1987 174.7408 190 L 4.6558 8.3786 124.4224 54.1579 42.2139 178.0421 191 K 4.3158 8.7875 123.2465 56.2080 32.7000 177.9575 192 E 3.9972 8.8364 119.7589 59.2507 29.3979 177.5084 193 D 4.7185 8.0575 116.1768 53.4657 40.1694 176.3359 194 Q 4.6705 8.0428 118.8147 56.1912 29.3187 177.3548 195 T 4.1031 7.8846 109.6974 63.4483 69.1034 175.7435 196 E 3.8751 7.8560 120.6673 59.3255 29.7276 177.7591 197 Y 4.6173 7.3679 114.7148 58.6067 37.7036 175.8535 198 L 4.5704 7.5670 119.4240 55.1145 43.1580 177.2699 199 E 4.2934 7.9364 119.7588 55.5142 31.1849 177.4986 200 E 4.0041 8.7656 122.0225 59.5370 29.7094 179.4983 201 R 3.8940 7.9111 119.2689 59.0858 30.3831 178.2611 202 R 3.9125 7.9038 118.1437 59.3755 29.9726 178.3531 203 I 3.7942 7.9457 119.6363 64.4996 37.2301 178.6335 204 K 3.9797 8.0554 119.2802 59.1315 31.9235 178.9352 205 E 3.9039 8.2428 119.9640 59.4566 29.6626 179.1211 206 I 3.8841 7.7033 112.1535 63.3995 37.6095 178.4424 207 V 3.4819 7.4651 120.5252 65.9232 31.2697 177.8179 208 K 3.8842 7.6395 117.6844 59.2653 31.9744 178.0274 209 K 4.0711 7.6153 118.4154 58.2085 32.3243 176.8724 210 H 4.9229 8.2388 113.0330 55.2907 30.8651 173.8974 211 S 4.7588 8.1680 115.9098 58.0074 63.8209 175.5442 212 Q 3.8706 8.0160 120.7978 58.7299 28.5515 176.3660 213 F 4.9245 7.3045 115.5000 57.2942 39.2081 175.4216 214 I 4.0283 7.6428 122.1321 60.9360 37.4151 176.8206 215 G 3.4015 8.6213 113.5593 47.2222 0.0000 172.8147 216 Y 4.7902 7.2890 116.4427 55.0814 40.8399 173.5718 217 P 4.5128 0.0000 0.0000 63.0087 32.7723 175.3616 218 I 5.0712 8.3389 123.4725 59.8731 39.9834 174.9226 219 T 4.5784 9.2778 123.6920 61.4993 71.8960 172.6322 220 L 5.0176 8.3326 127.2382 53.4301 43.9291 175.1512 221 F 4.7371 9.1235 125.6017 55.7910 40.5879 175.3470 222 V 4.3213 8.5605 124.0057 61.8526 34.0572 172.3594 223 E 4.2580 9.3516 131.0870 56.1898 25.8088 175.9505 *224 K 4.1054 8.6319 121.0345 54.1963 32.4708 178.0345 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 12 M 8.30 4.34 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 13 E 8.45 4.52 0.00 2.00 1.80 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 2.18 2.41 0.00 14 E 9.08 4.74 0.00 1.90 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 2.18 2.32 0.00 15 E 8.54 4.74 0.00 1.95 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 2.25 2.26 0.00 16 E 8.63 4.61 0.00 2.10 1.85 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 2.24 2.25 0.00 17 V 8.38 4.95 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 0.87 0.00 0.00 0.94 0.00 0.00 18 E 9.30 4.57 0.00 2.11 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 2.09 2.27 0.00 19 T 8.09 4.72 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 1.03 0.00 0.00 20 F 8.61 4.60 0.00 1.51 2.44 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 21 A 8.39 4.53 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 22 F 8.74 4.74 0.00 3.24 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 23 Q 9.45 4.13 0.00 2.47 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.64 0.00 24 A 9.14 4.04 1.36 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 0.00 0.00 25 E 8.33 4.17 0.00 2.07 1.99 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 2.40 2.62 0.00 26 I 7.65 3.43 1.95 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.97 0.21 0.00 0.00 27 A 7.96 3.82 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 28 Q 7.68 3.92 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.66 0.00 29 L 7.82 3.86 0.00 1.75 1.73 1.05 0.77 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 30 M 8.10 3.99 0.00 1.72 1.79 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 31 S 7.81 4.09 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 32 L 7.81 3.99 0.00 2.02 1.74 0.82 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.64 4.17 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.83 1.06 0.00 0.00 34 I 7.67 4.07 2.07 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 1.65 0.60 0.95 0.00 0.00 35 N 7.91 4.96 0.00 2.80 2.81 0.00 0.00 6.79 7.17 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 36 T 7.35 4.50 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 0.86 0.00 0.00 37 F 8.36 4.34 0.00 2.92 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 38 Y 6.87 4.38 0.00 2.74 2.60 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 0.00 0.00 0.00 0.00 39 S 8.84 5.56 0.00 3.33 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 40 N 7.56 3.94 0.00 2.89 2.71 0.00 0.00 7.14 6.49 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 41 K 8.21 4.12 0.00 1.93 1.83 0.00 1.77 0.00 0.00 2.07 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.55 7.81 42 E 8.34 4.19 0.00 2.29 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 2.52 2.35 0.00 43 I 7.46 3.56 1.75 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.59 0.76 0.00 0.00 44 F 8.02 4.26 0.00 3.10 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 6.05 3.24 0.00 0.37 1.15 0.77 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 46 R 7.46 3.75 0.00 1.76 1.94 0.00 3.23 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 47 E 7.78 3.87 0.00 2.05 1.96 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 2.42 2.57 0.00 48 L 7.55 3.97 0.00 1.62 1.68 0.94 0.64 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 49 I 7.85 3.71 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.67 0.91 0.00 0.00 50 S 8.36 4.12 0.00 3.98 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 N 8.26 4.37 0.00 2.73 2.83 0.00 0.00 7.08 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 52 S 8.19 4.28 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 53 S 8.61 4.21 0.00 3.98 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 54 D 8.33 4.39 0.00 2.89 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.03 4.00 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 56 L 7.53 3.78 0.00 1.22 0.56 0.47 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 57 D 8.16 4.61 0.00 3.00 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 58 K 8.32 4.13 0.00 1.96 1.89 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.65 7.81 59 I 7.55 3.70 1.95 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.67 0.87 0.00 0.00 60 R 7.84 4.01 0.00 2.05 1.76 0.00 3.09 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 61 Y 8.26 4.23 0.00 3.13 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.61 3.95 0.00 2.36 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 2.32 2.39 0.00 63 S 7.38 4.33 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 64 L 8.07 4.17 0.00 1.79 1.75 1.15 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.66 4.44 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 66 D 8.02 4.72 0.00 2.70 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 67 P 0.00 4.40 0.00 2.19 2.10 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 68 S 8.16 4.31 0.00 4.04 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 69 K 8.19 3.93 0.00 1.82 1.89 0.00 1.67 0.00 0.00 1.62 0.00 0.00 3.13 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.74 7.81 70 L 7.76 4.07 0.00 1.78 1.73 0.90 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 71 D 7.73 4.61 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.41 4.33 0.00 3.83 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 73 G 8.53 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 0.00 0.00 0.00 74 K 7.45 4.02 0.00 1.67 1.71 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.39 7.81 75 E 8.51 4.12 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 76 L 8.38 4.12 0.00 1.69 1.42 0.93 0.97 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 77 H 8.73 5.14 0.00 3.37 3.45 0.00 5.40 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 I 9.11 5.06 1.92 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 1.23 0.71 0.93 0.00 0.00 79 N 9.45 5.61 0.00 2.54 2.67 0.00 0.00 6.44 6.63 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 80 L 9.53 5.14 0.00 1.61 1.61 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.83 5.01 1.86 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 1.18 0.65 0.89 0.00 0.00 82 P 0.00 4.93 0.00 2.20 2.11 0.00 3.99 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 83 N 9.20 4.85 0.00 2.74 2.70 0.00 0.00 6.93 6.68 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 84 K 8.86 4.12 0.00 1.80 1.87 0.00 1.82 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 85 Q 8.32 4.08 0.00 2.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 86 D 8.97 4.56 0.00 2.66 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.07 3.87 0.00 2.05 1.99 0.00 3.05 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 88 T 7.67 5.19 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 89 L 8.73 5.13 0.00 1.83 1.57 1.00 0.94 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 90 T 8.72 5.11 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 91 I 8.76 4.75 1.87 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 1.09 0.64 0.90 0.00 0.00 92 V 8.85 4.89 2.05 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 0.95 0.00 0.00 0.89 0.00 0.00 93 D 9.22 5.63 0.00 2.73 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 94 T 8.13 4.42 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 95 G 8.35 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 0.00 0.00 0.00 96 I 7.77 3.45 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.62 0.95 0.00 0.00 97 G 8.47 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 98 M 8.18 4.84 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 99 T 8.44 4.23 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 1.02 0.00 0.00 100 K 8.28 3.13 0.00 1.26 1.64 0.00 1.61 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.10 0.77 7.81 101 A 7.88 3.92 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 0.00 102 D 7.86 4.25 0.00 2.88 2.65 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 0.00 103 L 7.72 3.79 0.00 1.75 1.70 1.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 104 I 7.62 3.64 1.66 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 -0.36 0.71 0.00 0.00 105 N 8.59 4.32 0.00 2.66 2.84 0.00 0.00 7.05 6.89 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 0.00 106 N 8.04 4.48 0.00 2.67 2.73 0.00 0.00 6.86 7.38 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 0.00 107 L 8.97 4.53 0.00 1.33 0.94 -0.74 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.08 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 0.00 109 T 7.67 4.14 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 1.28 0.00 0.00 110 I 7.06 4.35 2.02 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 1.26 0.99 0.93 0.00 0.00 111 A 8.55 4.13 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 0.00 112 K 8.39 4.62 0.00 1.80 1.75 0.00 1.88 0.00 0.00 1.90 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.40 7.81 113 S 8.93 4.35 0.00 4.00 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 0.00 114 G 7.82 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 7.93 3.96 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 1.20 0.00 0.00 116 K 8.06 3.92 0.00 1.83 1.87 0.00 1.71 0.00 0.00 1.83 0.00 0.00 3.15 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.53 7.81 117 A 8.19 4.05 1.61 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 0.00 0.00 118 F 8.35 3.35 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 0.00 119 M 7.90 3.68 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.47 0.00 120 E 8.04 3.88 0.00 2.17 1.99 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 2.32 2.41 0.00 121 A 8.28 4.09 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 0.00 122 L 7.48 3.70 0.00 1.46 1.58 0.28 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 7.68 4.10 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.32 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 124 A 7.82 4.61 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 0.00 125 G 7.88 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 0.00 0.00 0.00 126 A 7.78 4.24 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 0.00 127 D 8.50 4.51 0.00 2.82 2.61 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 0.00 128 I 8.50 3.92 1.28 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.96 0.83 0.00 0.00 129 S 8.37 4.14 0.00 3.92 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 0.00 130 M 8.65 4.35 0.00 2.47 2.43 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.94 0.00 131 I 7.79 2.40 1.84 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.78 0.89 0.00 0.00 132 G 7.91 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 0.00 133 Q 7.68 4.14 0.00 1.90 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 134 F 8.10 4.21 0.00 2.83 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.66 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 0.00 136 V 7.41 4.77 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 0.98 0.00 0.00 0.97 0.00 0.00 137 G 8.37 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 0.00 0.00 0.00 138 F 8.14 3.88 0.00 2.92 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 Y 7.62 4.45 0.00 3.18 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 0.00 140 S 7.87 4.25 0.00 4.01 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 0.00 141 A 7.65 3.78 0.70 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 0.00 0.00 142 Y 7.27 4.42 0.00 3.21 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.19 4.25 0.00 1.50 1.68 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 144 V 7.40 4.20 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 0.33 0.00 0.00 -0.21 0.00 0.00 145 A 7.32 5.14 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 0.00 146 E 8.79 4.45 0.00 2.06 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 0.00 2.56 2.30 0.00 147 K 7.85 4.98 0.00 1.87 1.63 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.33 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.55 7.81 148 V 8.85 4.97 2.47 0.00 0.00 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 0.26 0.00 0.00 149 T 8.85 5.36 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 150 V 9.52 4.81 2.05 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 0.86 0.00 0.00 0.78 0.00 0.00 151 I 8.83 4.99 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.06 1.01 0.00 0.00 152 T 8.89 4.91 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 153 K 9.61 4.83 0.00 1.81 1.76 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.41 7.81 154 H 8.83 5.33 0.00 3.38 3.13 0.00 5.76 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 N 8.90 4.32 0.00 2.73 2.90 0.00 0.00 6.99 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.50 4.51 0.00 2.63 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 0.00 157 D 7.80 4.74 0.00 2.68 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 E 9.28 4.25 0.00 1.19 1.48 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 2.29 2.26 0.00 159 Q 7.93 4.53 0.00 2.06 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 160 Y 8.88 5.38 0.00 3.00 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 0.00 161 A 9.22 5.38 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 0.00 162 W 9.76 5.39 0.00 3.33 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 0.00 163 E 7.97 5.63 0.00 2.15 1.71 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 2.25 2.38 0.00 164 S 8.54 4.70 0.00 3.50 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 0.00 165 S 8.93 4.99 0.00 3.97 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 0.00 166 A 8.35 3.58 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.61 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 0.00 168 G 9.29 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 S 7.65 5.02 0.00 3.71 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 0.00 170 F 8.16 4.91 0.00 2.05 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 0.00 0.00 0.00 0.00 171 T 8.21 5.02 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 1.12 0.00 0.00 172 V 9.03 5.14 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 1.16 0.00 0.00 1.20 0.00 0.00 173 R 9.23 5.95 0.00 2.05 2.01 0.00 3.53 0.00 0.00 3.36 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.49 0.00 174 T 8.57 4.31 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 1.27 0.00 0.00 175 D 8.55 4.62 0.00 2.74 2.60 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 0.00 0.00 0.00 0.00 176 T 8.72 4.47 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 177 G 8.24 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 0.00 178 E 8.80 3.85 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 179 P 0.00 4.58 0.00 2.07 1.95 0.00 3.66 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 180 M 8.76 4.45 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.59 0.00 181 G 7.74 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 0.00 182 R 8.19 3.85 0.00 1.75 1.84 0.00 3.16 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.62 0.00 183 G 7.51 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 0.00 184 T 8.46 5.08 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 1.22 0.00 0.00 185 K 9.86 4.93 0.00 1.65 1.64 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.34 7.81 186 V 8.68 4.69 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 1.02 0.00 0.00 0.98 0.00 0.00 187 I 8.90 4.60 1.92 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 1.24 0.78 0.83 0.00 0.00 188 L 8.94 4.57 0.00 1.54 1.45 0.94 0.75 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 0.00 189 H 8.79 4.95 0.00 3.32 3.30 0.00 5.81 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 L 8.38 4.66 0.00 1.57 1.62 1.03 0.93 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 0.00 191 K 8.79 4.32 0.00 1.86 1.85 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.40 7.81 192 E 8.84 4.00 0.00 2.08 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 2.30 2.33 0.00 193 D 8.06 4.72 0.00 2.84 2.83 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 0.00 194 Q 8.04 4.67 0.00 2.16 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.57 0.00 195 T 7.88 4.10 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 196 E 7.86 3.88 0.00 1.86 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 1.65 1.47 0.00 197 Y 7.37 4.62 0.00 3.13 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 0.00 198 L 7.57 4.57 0.00 1.77 1.73 0.94 1.00 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 0.00 199 E 7.94 4.29 0.00 2.10 1.85 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 2.30 2.42 0.00 200 E 8.77 4.00 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 201 R 7.91 3.89 0.00 1.90 1.95 0.00 3.17 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 202 R 7.90 3.91 0.00 1.92 2.13 0.00 3.30 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 203 I 7.95 3.79 2.04 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 1.66 0.88 0.95 0.00 0.00 204 K 8.06 3.98 0.00 1.90 1.84 0.00 1.66 0.00 0.00 1.55 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.51 7.81 205 E 8.24 3.90 0.00 2.15 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 0.00 2.32 2.33 0.00 206 I 7.70 3.88 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.53 1.05 0.00 0.00 207 V 7.47 3.48 2.05 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 0.93 0.00 0.00 0.96 0.00 0.00 208 K 7.64 3.88 0.00 1.79 2.01 0.00 1.63 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 209 K 7.62 4.07 0.00 1.85 1.86 0.00 1.86 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.05 1.34 7.81 210 H 8.24 4.92 0.00 3.18 3.19 0.00 5.84 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 S 8.17 4.76 0.00 3.69 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 0.00 212 Q 8.02 3.87 0.00 1.70 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.64 7.56 0.00 0.00 0.00 0.00 0.00 1.16 1.34 0.00 213 F 7.30 4.92 0.00 3.07 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 0.00 214 I 7.64 4.03 1.88 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 1.44 0.75 1.03 0.00 0.00 215 G 8.62 3.40 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 0.00 216 Y 7.29 4.79 0.00 3.01 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 0.00 217 P 0.00 4.51 0.00 2.15 2.01 0.00 3.93 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 2.21 2.18 0.00 218 I 8.34 5.07 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 1.39 0.83 0.92 0.00 0.00 219 T 9.28 4.58 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 0.54 0.00 0.00 220 L 8.33 5.02 0.00 1.60 1.48 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 221 F 9.12 4.74 0.00 2.88 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 0.00 222 V 8.56 4.32 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.94 0.00 0.00 223 E 9.35 4.26 0.00 2.18 2.25 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 2.13 2.22 0.00 *224 K 8.63 4.11 0.00 1.54 1.66 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.