NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 G 3.9369 8.2127 109.7420 45.1097 0.0000 173.7610 10 L 3.7318 8.7780 127.4151 58.2784 42.2085 177.5592 11 C 4.7816 9.0663 115.0095 57.2818 41.2417 174.3770 12 D 4.4457 7.7981 121.0062 55.9582 41.5520 177.9202 13 R 3.7097 7.9386 118.8395 58.4373 30.2617 177.1415 14 F 5.0520 7.4828 115.7145 58.0637 40.2491 174.8719 15 R 3.5686 9.4368 115.5628 57.5232 28.3407 176.2539 16 G 3.8578 8.3553 105.1933 45.4094 0.0000 172.0481 17 F 5.2805 7.7574 118.8012 56.8298 40.4272 175.0951 18 Y 4.6788 9.1843 125.9922 55.2942 39.5932 172.4975 19 P 4.6577 0.0000 0.0000 62.4418 32.5533 175.8741 20 V 4.4447 8.6665 124.3103 60.7538 34.7032 174.4510 21 V 4.2797 8.7027 129.1022 62.8534 32.4627 174.8123 22 I 5.1849 8.5859 128.2535 59.6223 40.9108 174.4056 23 D 4.8532 8.8972 124.4737 52.4948 44.9029 174.0948 24 V 4.7911 8.3949 124.0804 61.0177 34.4568 173.7991 25 E 4.7409 9.1014 129.1146 54.6886 31.5847 174.6683 26 T 5.0386 8.1004 115.2189 59.8031 71.8001 173.7053 27 A 4.2143 9.0562 124.2595 54.1911 19.1355 177.3167 28 G 4.1199 7.7310 102.4075 44.6562 0.0000 172.5201 29 F 4.5005 8.3095 113.0371 57.9581 38.7447 175.5475 30 N 4.4261 8.2404 120.9425 52.1974 37.5572 174.9520 31 A 2.8464 8.4984 129.6965 54.4109 18.5774 178.6990 32 K 4.1249 7.9381 114.6398 58.3690 32.4266 178.0715 33 T 4.4781 7.4385 105.3143 61.6865 70.6153 173.9402 34 D 4.8071 8.3812 121.0007 53.7332 42.1366 175.8581 35 A 4.4348 8.4472 122.0273 50.9900 20.5050 176.3454 36 L 4.3168 8.5294 124.8266 55.0499 42.4124 176.2148 37 L 4.6114 8.7566 125.6947 55.8093 44.5817 176.0389 38 E 5.1304 7.7618 116.8522 55.2901 33.1466 173.9618 39 I 5.1707 8.6704 125.0721 59.6682 42.2585 173.3003 40 A 5.3254 8.9856 129.0366 50.1828 22.8580 174.7054 41 A 5.2097 9.0680 121.9512 50.2238 23.0208 175.3936 42 I 5.1276 9.0140 122.0100 59.6950 40.7994 175.5618 43 T 4.5475 8.7354 118.1177 61.3164 70.5056 173.5032 44 L 5.4342 8.0272 121.1568 52.9130 45.5552 175.7225 45 K 4.8238 9.4482 118.8893 55.7971 36.6892 174.6828 46 M 5.3090 8.5361 120.4009 53.5772 34.2997 176.2267 47 D 4.7620 8.9368 123.8392 52.3439 40.9711 176.7966 48 E 4.0534 8.6908 116.2186 59.1929 29.5139 177.8571 49 Q 4.0535 8.2601 116.6950 56.5261 29.2930 176.5219 50 G 3.8153 8.1431 106.2347 44.7150 0.0000 173.2279 51 W 4.8939 8.5448 120.0026 55.7980 30.6100 175.1703 52 L 5.2072 9.3710 126.7444 54.3983 43.0016 175.3680 53 M 4.9312 9.1334 121.9165 53.3202 35.0766 172.1662 54 P 4.3188 0.0000 0.0000 64.3850 31.7677 173.6471 55 D 4.6452 9.5804 121.5665 54.0511 42.8711 176.0087 56 T 4.6754 6.9172 112.3503 62.3431 71.7807 174.3656 57 T 5.0626 8.4937 121.6100 61.8434 70.9056 173.4692 58 L 4.7802 8.9603 126.3297 53.4570 45.5419 175.2614 59 H 5.0800 7.5296 119.3695 55.4222 32.9460 172.7482 60 F 4.8656 9.2361 124.1702 56.0398 43.4147 173.4094 61 H 5.0546 8.8038 119.3310 54.7436 30.5802 174.0917 62 V 4.8131 8.4716 122.9147 61.1569 34.0515 174.9148 63 E 4.2800 8.8707 127.6319 54.7243 29.6748 175.3658 64 P 3.9413 0.0000 0.0000 64.8227 31.3679 177.6080 65 F 4.9884 7.6235 112.5347 57.0720 39.8421 175.5671 66 V 3.9685 7.3582 113.8314 61.2300 31.9451 176.1730 67 G 3.8254 8.5649 111.4946 46.1725 0.0000 174.6236 *88 G 3.8228 7.9904 106.2206 44.3868 0.0000 173.3093 89 A 4.4947 7.9801 120.9084 52.3981 19.1847 177.5841 90 V 4.6842 8.7643 113.2842 58.9198 36.5915 175.3996 91 S 4.4122 8.5585 116.0789 58.3112 63.8336 175.5849 92 G 3.6140 8.8681 108.0773 48.1874 0.0000 175.0418 93 Y 3.9078 8.0007 121.4547 60.4931 38.7002 177.9168 94 E 3.7998 8.2110 119.6364 59.0445 29.8845 178.3056 95 A 2.6093 7.6068 120.6987 54.9733 18.2991 179.6800 96 L 3.4187 7.6190 117.3043 57.8853 41.5134 179.3263 97 H 3.7397 7.9783 118.5615 59.0842 29.7255 177.1926 98 E 4.0048 8.1134 120.5665 59.3421 29.1886 179.3988 99 I 3.8434 7.4948 119.3666 64.6118 37.2098 178.5451 100 F 4.5176 8.3734 118.8958 60.3342 38.7585 177.7212 101 K 3.9023 8.4911 119.7983 59.5819 32.0864 179.0783 102 V 3.6350 7.8702 118.5569 65.9188 31.3771 178.1539 103 V 3.6049 8.1412 118.1290 66.1555 31.3484 178.1085 104 R 3.7656 8.2993 118.2158 59.0909 29.7856 179.0222 105 K 3.9485 7.9817 119.2140 59.3231 32.2572 179.1427 106 G 3.5761 7.7230 107.2988 47.1546 0.0000 175.4393 107 I 3.2181 7.0872 122.7770 63.7695 36.8986 178.1470 108 K 3.7310 7.7776 118.8298 59.6835 32.0894 178.2334 109 A 4.1129 7.8003 119.3759 55.1691 18.4342 179.2093 110 S 4.4678 8.0494 111.3386 58.7726 63.2081 175.2964 111 G 3.7963 7.8115 109.3619 46.2628 0.0000 173.1705 112 C 4.6965 7.9257 117.3543 56.0592 41.3765 172.7559 113 N 4.8069 8.2361 115.2323 52.4713 38.1306 174.3685 114 R 4.4848 7.5971 117.4446 55.7068 33.6178 173.1243 115 A 5.0198 8.3737 126.1706 50.9195 21.1337 176.0177 116 I 4.5169 8.0793 119.6202 59.0205 41.3979 174.2251 117 M 4.7430 8.6352 129.1509 55.4816 33.5921 174.5392 118 V 4.6062 8.4476 126.1216 61.2978 33.9532 174.2439 119 A 4.6204 8.0886 126.4744 51.5359 23.3452 174.3508 120 H 4.6589 8.9024 119.6327 55.1668 30.4647 175.1602 121 N 4.1980 9.0239 123.6822 53.6878 36.9159 175.5501 122 A 3.9755 8.1426 121.0745 55.4185 18.6405 178.5060 123 N 3.9360 8.0172 114.8680 57.1376 38.7254 176.8464 124 F 4.3212 7.3919 117.8433 60.7312 39.0392 177.5370 125 D 4.4594 8.2650 118.0950 57.5682 40.5560 178.2397 126 H 4.0380 8.3869 118.9567 59.3224 29.9254 177.5717 127 S 4.0992 8.3504 116.2071 61.3016 62.7482 176.2622 128 F 3.8072 8.3420 124.3907 61.1413 39.1036 176.9013 129 M 4.0741 8.4049 118.0830 59.0045 32.0957 178.1034 130 M 4.0172 8.1911 118.8127 58.3685 31.9959 178.6763 131 A 3.9532 8.0542 120.7707 54.8980 18.4765 179.5892 132 A 3.8613 8.1192 119.3396 55.1475 18.3530 179.7182 133 A 3.9563 8.2716 119.5590 55.2231 18.4783 179.5396 134 E 3.8899 8.1999 117.8102 59.5339 29.5365 179.1707 135 R 3.9693 8.1084 117.0208 58.7488 30.1460 177.8835 136 A 4.5577 7.7740 117.6932 50.9710 19.1492 176.8882 137 S 3.7900 8.0013 113.1557 60.0330 61.1256 172.7636 138 L 4.2116 8.2076 120.2546 54.8804 41.8492 177.4856 139 K 4.4453 8.6745 122.7513 55.5687 34.0443 176.0224 140 R 3.5835 8.5329 114.5997 56.6892 28.1312 176.7538 141 N 3.5929 8.0147 114.7145 54.2213 39.4751 172.4108 142 P 4.2200 0.0000 0.0000 64.0209 32.0671 176.1477 143 F 4.6161 7.4983 118.2495 56.7301 39.7280 174.7811 144 H 4.1540 8.6559 125.1862 55.6658 29.9980 173.8996 145 P 4.5661 0.0000 0.0000 64.4648 31.6490 176.7931 146 F 4.8499 7.4656 110.1054 56.4183 39.9169 174.7337 147 A 4.2120 7.5221 124.0731 51.7043 19.0375 176.1045 148 T 4.4096 7.8084 110.7453 60.3005 72.7527 173.7307 149 F 4.9892 8.5740 121.4955 55.8721 40.2854 174.1395 150 D 5.0372 8.4795 124.6293 53.7627 41.1691 176.9933 151 T 4.1173 8.9267 117.8705 64.0285 68.8949 176.5950 152 A 3.8676 7.9597 123.8112 55.0349 18.5088 179.2417 153 A 3.8965 7.8408 119.3891 55.2991 18.4283 179.8293 154 L 3.8441 7.9302 117.3394 57.9508 41.7052 179.7223 155 A 4.0851 8.5834 121.2303 54.8363 18.1368 179.8544 156 G 3.5697 8.1056 104.4760 47.8180 0.0000 175.7104 157 L 3.9076 7.5814 121.3450 57.9128 42.2828 178.6396 158 A 4.2040 7.9724 119.3613 54.1947 18.5563 177.9771 159 L 4.5284 8.1161 113.6352 53.4868 43.5862 177.4639 160 G 3.9454 8.0874 106.5249 45.9069 0.0000 173.3845 161 Q 4.6994 7.9097 116.8610 53.9834 31.8047 175.4248 162 T 4.4700 8.4427 109.2342 61.1905 70.7699 174.6476 163 V 4.1682 7.4246 122.5887 61.2486 33.6763 175.2856 164 L 3.5864 8.2768 128.1189 58.3055 41.9157 179.3171 165 S 2.7900 7.3355 113.1607 60.9681 62.7828 176.3360 166 K 3.8425 7.7609 121.7340 58.7789 31.8227 178.9429 167 A 3.9444 8.2529 121.3081 55.3235 18.2619 179.3900 168 C 4.0426 8.1125 115.3649 63.1070 28.2772 176.3093 169 Q 4.2445 7.9333 120.7019 58.9302 28.1444 179.2471 170 T 3.8795 8.1374 115.2869 66.5930 68.5152 176.1668 171 A 4.2234 7.9313 121.6675 53.2694 18.4122 178.3257 172 G 3.9839 8.0368 105.7860 45.5568 0.0000 173.1359 173 M 4.6611 8.1067 116.7152 52.8701 33.5557 175.0859 174 D 4.7814 8.3467 119.3628 54.2886 41.7888 176.2309 175 F 4.5791 8.5505 123.7867 56.9690 42.3197 173.0493 176 D 4.7817 9.1038 128.6447 52.2728 41.2214 176.5794 177 S 4.3845 8.7589 124.5174 61.5905 63.1226 177.1968 178 T 3.9904 8.0250 109.8834 63.9889 68.7492 175.6430 179 Q 3.7769 7.4119 119.1116 56.3993 29.0339 175.6370 180 A 4.6699 6.9305 119.9628 52.0524 19.1291 176.9364 181 H 4.3021 9.0170 112.6527 56.7065 27.0261 174.9236 182 S 4.6004 7.4162 113.4098 56.1610 64.3326 174.0389 183 A 4.6780 8.4878 131.0009 55.5571 18.0877 178.9073 184 L 3.7535 7.7743 117.0913 58.3537 42.2340 178.4953 185 Y 3.9642 7.9391 118.5557 61.0181 38.6553 177.7716 186 D 4.3797 8.2160 119.6142 57.6153 40.8063 179.0538 187 T 3.8384 8.1028 116.2876 66.6615 68.4945 176.4665 188 E 3.9030 8.2954 120.6952 59.5622 29.4916 179.7706 189 R 3.8361 7.8226 117.9747 59.4977 30.0507 179.2529 190 T 3.8955 8.1418 115.4518 66.4544 68.3658 176.5342 191 A 4.0180 8.3259 123.0259 55.3018 18.3896 179.8717 192 V 3.5511 7.8185 116.7918 65.8542 31.4546 177.9479 193 L 3.9330 8.1081 120.1145 58.1547 42.0219 178.5825 194 F 4.1156 8.4199 120.6094 61.6710 39.2614 176.8384 195 C 4.1103 8.4616 116.3030 62.8001 27.8914 175.6844 196 E 3.9529 8.5234 121.2071 59.2948 29.3186 179.0093 197 I 3.6674 7.9635 120.0451 64.3397 37.3159 178.5922 198 V 3.5156 7.5227 118.9988 66.1655 31.2950 177.8645 199 N 4.7277 8.6602 116.6346 56.3241 38.3624 177.4466 200 R 4.0186 8.3801 120.5223 59.1028 30.0985 178.3577 201 W 4.4128 8.2939 127.9856 60.2356 30.6711 177.9685 202 K 3.9865 8.2194 119.3422 59.5868 31.5096 178.5446 203 R 4.1822 8.3610 118.0061 59.6441 30.0375 177.5292 204 L 4.3501 7.8331 115.3154 54.5454 41.7656 177.4658 205 G 3.7116 8.1368 107.6918 45.9784 0.0000 175.3191 206 G 2.0255 7.2761 110.7785 45.8840 0.0000 174.6830 207 W 4.7393 7.0134 128.0248 54.3536 33.6774 172.7730 208 P 2.9700 0.0000 0.0000 61.1665 31.7168 175.6599 209 L 4.0009 6.6655 118.3296 54.7950 42.1421 177.4609 210 S 3.9982 8.1206 115.5960 58.7810 62.2447 173.7087 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 9 G 8.21 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 10 L 8.78 3.73 0.00 1.87 1.84 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 11 C 9.07 4.78 0.00 3.10 3.13 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 12 D 7.80 4.45 0.00 2.88 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 13 R 7.94 3.71 0.00 1.50 1.50 0.00 2.21 0.00 0.00 2.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.50 0.00 14 F 7.48 5.05 0.00 3.69 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 15 R 9.44 3.57 0.00 1.96 2.03 0.00 3.34 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 16 G 8.36 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 17 F 7.76 5.28 0.00 3.20 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 18 Y 9.18 4.68 0.00 3.02 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 19 P 0.00 4.66 0.00 1.83 1.72 0.00 3.55 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.04 0.00 20 V 8.67 4.44 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 1.14 0.00 0.00 1.05 0.00 0.00 21 V 8.70 4.28 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 0.90 0.00 0.00 0.86 0.00 0.00 22 I 8.59 5.18 1.77 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 1.28 0.82 0.84 0.00 0.00 23 D 8.90 4.85 0.00 2.77 2.43 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 24 V 8.39 4.79 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 0.56 0.00 0.00 0.91 0.00 0.00 25 E 9.10 4.74 0.00 2.07 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 2.21 2.25 0.00 26 T 8.10 5.04 3.97 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 -0.04 0.00 0.00 27 A 9.06 4.21 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.73 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.31 4.50 0.00 3.20 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 30 N 8.24 4.43 0.00 1.96 2.58 0.00 0.00 6.89 7.76 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 31 A 8.50 2.85 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 32 K 7.94 4.12 0.00 1.80 1.82 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.49 7.81 33 T 7.44 4.48 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 1.17 0.00 0.00 34 D 8.38 4.81 0.00 2.88 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 35 A 8.45 4.43 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.53 4.32 0.00 1.79 1.59 0.98 0.94 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 37 L 8.76 4.61 0.00 1.67 1.65 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.76 5.13 0.00 2.01 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 2.29 2.29 0.00 39 I 8.67 5.17 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.46 0.98 0.00 0.00 40 A 8.99 5.33 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 41 A 9.07 5.21 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 9.01 5.13 1.87 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 1.29 0.77 0.97 0.00 0.00 43 T 8.74 4.55 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 1.44 0.00 0.00 44 L 8.03 5.43 0.00 1.48 1.73 1.13 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 45 K 9.45 4.82 0.00 1.78 1.91 0.00 1.33 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.47 7.81 46 M 8.54 5.31 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.66 0.00 47 D 8.94 4.76 0.00 3.00 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 48 E 8.69 4.05 0.00 2.12 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 0.00 2.32 2.31 0.00 49 Q 8.26 4.05 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.97 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 50 G 8.14 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 51 W 8.54 4.89 0.00 3.52 3.07 0.00 0.00 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*88 G 7.99 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 89 A 7.98 4.49 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 90 V 8.76 4.68 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 0.87 0.00 0.00 0.90 0.00 0.00 91 S 8.56 4.41 0.00 3.91 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 92 G 8.87 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 0.00 0.00 0.00 93 Y 8.00 3.91 0.00 3.06 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 94 E 8.21 3.80 0.00 2.13 1.83 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 2.10 2.25 0.00 95 A 7.61 2.61 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 96 L 7.62 3.42 0.00 1.29 0.83 0.78 0.93 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0.00 0.00 0.00 113 N 8.24 4.81 0.00 2.59 2.79 0.00 0.00 6.76 7.00 0.00 0.00 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 R 7.60 4.48 0.00 1.88 1.85 0.00 3.17 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 115 A 8.37 5.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.08 4.52 0.75 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 1.18 0.11 0.00 0.00 117 M 8.64 4.74 0.00 2.06 1.69 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.43 0.00 118 V 8.45 4.61 1.74 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 0.46 0.00 0.00 0.25 0.00 0.00 119 A 8.09 4.62 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 0.00 120 H 8.90 4.66 0.00 3.16 3.25 0.00 5.90 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 9.02 4.20 0.00 3.10 3.13 0.00 0.00 6.50 8.00 0.00 0.00 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 A 8.14 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 N 8.02 3.94 0.00 2.43 2.07 0.00 0.00 7.23 7.71 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 0.00 124 F 7.39 4.32 0.00 3.21 3.15 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 0.00 125 D 8.26 4.46 0.00 2.72 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 0.00 126 H 8.39 4.04 0.00 3.16 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 S 8.35 4.10 0.00 4.12 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 0.00 128 F 8.34 3.81 0.00 3.46 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 M 8.40 4.07 0.00 1.99 1.99 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.21 4.21 0.00 1.87 1.76 0.74 0.53 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 0.00 139 K 8.67 4.45 0.00 1.81 1.77 0.00 1.96 0.00 0.00 1.82 0.00 0.00 3.25 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.42 7.81 140 R 8.53 3.58 0.00 1.96 1.99 0.00 3.23 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 141 N 8.01 3.59 0.00 2.68 2.71 0.00 0.00 7.30 7.69 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 0.00 142 P 0.00 4.22 0.00 1.82 1.98 0.00 2.20 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.61 0.00 143 F 7.50 4.62 0.00 2.92 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 0.00 144 H 8.66 4.15 0.00 3.14 2.95 0.00 5.75 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 P 0.00 4.57 0.00 2.29 2.16 0.00 3.16 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 1.84 1.88 0.00 146 F 7.47 4.85 0.00 3.02 3.17 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 0.00 147 A 7.52 4.21 0.56 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 0.00 148 T 7.81 4.41 4.18 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 0.91 0.00 0.00 149 F 8.57 4.99 0.00 2.61 2.76 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 0.00 150 D 8.48 5.04 0.00 2.77 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 0.00 151 T 8.93 4.12 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 152 A 7.96 3.87 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 0.00 153 A 7.84 3.90 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 0.00 154 L 7.93 3.84 0.00 1.86 1.68 0.98 0.59 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 0.00 155 A 8.58 4.09 1.37 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 0.00 156 G 8.11 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 0.00 157 L 7.58 3.91 0.00 1.59 1.79 0.86 0.87 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 0.00 158 A 7.97 4.20 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 L 8.12 4.53 0.00 1.65 1.66 0.97 0.93 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 0.00 160 G 8.09 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 0.00 161 Q 7.91 4.70 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.22 0.00 162 T 8.44 4.47 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 1.21 0.00 0.00 163 V 7.42 4.17 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 0.96 0.00 0.00 0.92 0.00 0.00 164 L 8.28 3.59 0.00 1.29 1.38 0.81 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 165 S 7.34 2.79 0.00 3.70 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 0.00 166 K 7.76 3.84 0.00 1.85 1.95 0.00 1.66 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.41 7.81 167 A 8.25 3.94 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 0.00 168 C 8.11 4.04 0.00 3.03 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 0.00 169 Q 7.93 4.24 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 170 T 8.14 3.88 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 1.26 0.00 0.00 171 A 7.93 4.22 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 0.00 172 G 8.04 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 0.00 173 M 8.11 4.66 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 174 D 8.35 4.78 0.00 2.74 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 0.00 175 F 8.55 4.58 0.00 2.97 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 0.00 176 D 9.10 4.78 0.00 2.56 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 0.00 0.00 0.00 177 S 8.76 4.38 0.00 3.98 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 0.00 178 T 8.03 3.99 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 1.16 0.00 0.00 179 Q 7.41 3.78 0.00 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 180 A 6.93 4.67 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 H 9.02 4.30 0.00 3.35 3.41 0.00 5.60 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 S 7.42 4.60 0.00 3.92 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 0.00 183 A 8.49 4.68 1.34 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 0.00 184 L 7.77 3.75 0.00 1.37 1.58 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 7.94 3.96 0.00 3.02 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 0.00 186 D 8.22 4.38 0.00 2.89 2.74 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 0.00 187 T 8.10 3.84 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 1.20 0.00 0.00 188 E 8.30 3.90 0.00 1.93 1.89 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 2.28 2.51 0.00 189 R 7.82 3.84 0.00 1.77 2.06 0.00 2.87 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.92 0.00 190 T 8.14 3.90 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 1.23 0.00 0.00 191 A 8.33 4.02 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 0.00 192 V 7.82 3.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.97 0.00 0.00 193 L 8.11 3.93 0.00 1.90 1.94 0.93 0.78 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 0.00 194 F 8.42 4.12 0.00 3.14 3.20 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 0.00 195 C 8.46 4.11 0.00 3.20 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 E 8.52 3.95 0.00 2.09 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 2.31 2.40 0.00 197 I 7.96 3.67 1.84 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 1.39 1.11 0.79 0.00 0.00 198 V 7.52 3.52 1.89 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 0.96 0.00 0.00 0.28 0.00 0.00 199 N 8.66 4.73 0.00 2.89 3.08 0.00 0.00 6.71 7.26 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 0.00 200 R 8.38 4.02 0.00 2.21 2.17 0.00 3.15 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 201 W 8.29 4.41 0.00 3.40 3.24 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 0.00 202 K 8.22 3.99 0.00 1.93 2.08 0.00 1.25 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.13 1.39 7.81 203 R 8.36 4.18 0.00 2.12 2.28 0.00 3.42 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 204 L 7.83 4.35 0.00 1.76 1.60 1.01 0.82 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 0.00 205 G 8.14 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 0.00 0.00 0.00 206 G 7.28 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 0.00 0.00 0.00 0.00 0.00 0.00 207 W 7.01 4.74 0.00 3.43 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 0.00 208 P 0.00 2.97 0.00 1.60 1.30 0.00 3.60 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 209 L 6.67 4.00 0.00 1.37 1.50 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 210 S 8.12 4.00 0.00 3.71 3.60 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 * Residues marked with a * may have inaccurate shift predictions.