NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4190 8.3344 116.7952 57.6929 64.3124 173.0479 3 L 3.7078 8.3238 124.1479 54.6215 42.2754 175.1848 4 S 4.3581 9.2731 121.6200 57.3777 63.0813 172.9446 5 I 4.0728 8.1626 129.9570 59.9502 37.7605 174.4350 6 P 4.7104 0.0000 0.0000 62.9035 33.1753 175.2110 7 T 4.9773 8.4047 110.7474 60.1084 72.1323 173.3083 8 I 4.3621 8.6432 123.5148 60.8350 37.8065 176.9499 9 K 4.0276 9.2674 130.0302 58.9934 32.6517 176.6627 10 Q 5.0148 7.8810 119.1455 54.8446 32.5226 172.7637 11 V 4.9608 8.7126 124.4662 60.0781 33.8159 175.2246 12 R 4.8504 9.1662 121.4951 54.3401 34.4053 173.8400 13 A 5.1832 9.0775 124.5238 50.2067 21.3838 175.6331 14 F 5.2313 9.6543 120.1985 55.6099 43.8022 174.0927 15 V 5.0031 8.9270 119.9301 61.1807 34.4318 174.1169 16 L 5.0180 8.9155 128.4100 53.3529 45.5404 175.1706 17 R 4.8007 8.8676 122.8672 55.4810 33.7707 175.7497 18 G 3.6981 9.3920 111.2662 46.8507 0.0000 175.3271 19 G 3.5722 9.5765 119.0707 47.2154 0.0000 171.3013 20 G 3.8257 8.6835 108.7262 45.7694 0.0000 173.6804 21 A 2.0000 8.1185 121.8280 54.5705 18.4624 177.8269 22 D 4.4966 7.2446 116.7474 52.2179 39.4414 175.6905 23 Y 4.0998 7.6684 123.4338 61.1227 38.1281 178.1652 24 H 4.5547 8.2270 112.9545 56.0682 29.7947 175.3829 25 D 4.5230 8.0748 122.8469 53.1626 39.4942 174.1134 26 Q 4.6585 7.4316 119.9282 54.1961 32.4462 175.2576 27 G 4.1644 7.9784 107.6484 44.8928 0.0000 173.2229 28 D 4.4901 8.4948 120.2985 55.0150 41.7140 176.2684 29 G 3.8837 8.6398 107.5033 46.5172 0.0000 172.6871 30 H 4.8921 7.7569 119.3010 53.4881 31.4902 175.9261 31 W 4.3059 8.8782 123.9637 59.6138 27.9507 177.7119 32 I 2.8373 6.6318 116.6871 62.0206 37.2773 175.1402 33 D 4.6610 7.8651 117.3999 54.4465 41.8283 175.5552 34 D 4.5883 8.0302 119.4116 53.6504 39.8063 175.2803 35 H 4.2349 9.1013 129.0743 56.5240 29.1610 174.4580 36 I 4.2400 7.7684 117.9395 60.8902 37.8535 176.6567 37 S 4.4632 9.0190 123.4164 58.7184 62.7649 173.1669 38 T 5.0874 8.3647 115.8937 58.8301 72.5409 173.3130 39 P 4.4027 0.0000 0.0000 62.0131 30.3836 178.1078 *41 G 4.0116 8.1301 108.2163 45.2564 0.0000 175.2608 42 K 4.1121 7.8691 116.7055 57.7980 32.9022 176.1699 43 Y 4.6922 7.3696 118.1310 55.6975 38.8175 174.2744 44 P 4.2753 0.0000 0.0000 65.7963 31.6372 178.8477 45 E 3.8974 8.2818 116.0119 58.7212 29.4246 177.1812 46 Y 4.9615 7.9617 114.0309 56.9138 38.6036 176.5479 47 R 4.2014 7.9199 122.5862 58.9200 30.7235 177.7096 48 Q 4.0590 8.1151 118.6636 58.0575 29.4893 175.4718 49 S 4.9589 7.7285 111.6649 56.2167 65.3550 174.6925 50 R 3.4204 8.6287 126.6471 58.7035 30.2968 179.2625 51 R 3.8573 7.6678 117.5456 58.7184 30.3262 179.0659 52 S 4.1676 7.7492 113.2378 60.7034 63.0138 175.4971 53 F 4.6456 7.8310 113.2519 56.3931 38.0970 175.7639 54 G 3.8498 7.9022 109.8891 46.3379 0.0000 175.5858 55 I 3.8447 6.9251 120.4919 62.2797 38.0729 175.9349 56 N 4.9877 7.7441 116.6048 52.7711 37.4150 175.9997 57 V 3.8028 7.4261 120.7812 64.5488 32.2742 177.4918 58 L 4.0764 8.1018 120.7595 57.2081 42.4708 177.5805 59 G 4.0033 7.9752 105.4610 44.6935 0.0000 171.2800 60 T 4.9543 8.1293 114.9900 62.1401 70.8236 173.8327 61 L 5.0565 8.8713 128.4138 53.5885 44.2820 174.9901 62 V 4.9652 9.1820 126.7107 61.1832 34.1732 174.1312 63 V 4.9955 8.8326 127.7975 61.2067 34.1185 173.9392 64 E 5.4905 9.5182 127.0937 54.7340 33.2218 175.1826 65 I 4.9107 9.2526 123.8479 59.6865 40.9104 173.8578 66 E 4.9125 9.2439 129.2376 55.0508 31.2574 175.3243 67 A 5.2256 8.9600 129.0587 50.0845 21.5965 177.9647 68 S 4.1967 9.1011 114.3961 60.5223 63.0569 174.9937 69 D 4.6183 8.1138 119.2389 53.0805 39.6219 176.9818 70 G 4.0411 8.0849 109.4759 45.4074 0.0000 174.1151 71 N 4.6158 8.4425 117.6431 53.4008 39.8908 174.5105 72 V 4.8769 8.3898 121.4711 61.3882 34.3131 174.8289 73 G 4.5208 9.1405 115.7269 45.2417 0.0000 171.9660 74 F 6.1168 9.4635 115.3908 56.5929 41.5990 172.7364 75 A 4.7010 8.4137 118.6095 52.0317 22.3617 175.4624 76 V 5.0447 7.8582 111.5182 60.4588 35.5907 175.2513 77 T 4.4994 8.3464 116.6516 62.0583 71.0258 171.3339 78 T 4.7587 8.7554 118.1525 62.1442 69.4870 176.0742 79 G 4.3733 9.4038 125.0644 45.0047 0.0000 173.6520 80 G 4.2887 7.5527 108.9568 44.9158 0.0000 174.0832 81 E 4.0409 8.9880 118.4724 59.1079 29.5655 177.8462 82 P 4.3361 0.0000 0.0000 65.8950 31.1965 178.2075 83 A 4.0539 7.8878 119.0594 54.8556 18.2201 179.3871 84 A 4.0049 8.3626 119.5720 55.3628 18.3439 179.1679 85 Y 3.1631 8.2954 118.0263 60.7512 38.8429 178.5059 86 I 3.8261 7.7269 120.6071 64.3088 37.2342 178.5872 87 V 3.5691 7.9963 119.0913 66.1122 31.2873 178.0316 88 E 3.7864 8.2829 118.3949 59.4105 29.1813 179.4615 89 K 3.8160 7.7611 117.0815 58.0810 31.9338 177.0855 90 H 4.7659 7.7459 115.1696 57.8643 31.7393 175.8050 91 L 4.4490 8.1503 120.3048 57.4579 41.4570 179.0340 92 A 3.9424 7.9713 121.2708 55.4474 17.9295 179.8074 93 R 3.7294 6.9176 113.4664 59.1937 29.3097 178.5315 94 F 4.5602 7.5356 116.7623 58.8069 39.3022 176.9975 95 L 4.5769 7.6587 118.0536 55.3506 42.3199 176.4194 96 E 4.2587 7.5512 118.6558 58.3427 29.4772 177.1093 97 G 3.9914 9.1134 113.4773 45.2715 0.0000 173.6239 98 A 4.3347 8.0508 122.7604 51.3976 19.5775 177.0591 99 R 4.5225 8.3809 118.7640 55.8228 30.7249 178.9538 100 V 3.6944 8.3004 115.2717 64.0820 31.5964 177.4201 101 T 4.1531 7.6469 107.7977 62.2352 69.7332 174.6832 102 D 4.7036 7.9430 124.3225 54.5481 40.8333 178.5931 103 I 3.6320 7.7193 122.3352 64.6939 37.4858 177.7284 104 E 4.0744 8.1410 118.8355 59.4422 29.3503 179.3804 105 R 3.9480 7.9563 118.2075 59.5052 30.0829 178.4150 106 I 3.7678 7.6944 118.4921 64.0109 37.1553 177.9230 107 W 4.0951 8.1852 128.1563 60.5496 30.8261 177.0275 108 D 4.8669 8.4130 117.9689 57.5512 40.6019 178.6724 109 Q 4.0581 7.9184 117.0302 56.1494 28.5546 177.7043 *111 Y 4.0097 7.8464 122.1304 57.6016 40.2946 176.8820 112 N 4.2876 8.1393 115.5430 55.8985 38.5933 177.0762 113 S 4.4704 7.6489 115.5691 59.9227 63.3514 175.3447 114 T 4.1363 7.0386 111.0816 61.0350 69.0622 175.8142 115 L 3.4974 7.5809 123.1733 58.3522 41.4276 178.5206 116 Y 4.4838 8.0194 115.4653 59.2787 37.7956 176.5623 117 Y 4.8987 7.4464 116.8510 56.6741 40.9358 174.8851 118 G 3.4689 7.4384 109.4349 45.0601 0.0000 174.3020 119 R 4.5031 10.0110 123.9902 56.2122 28.6245 175.6290 120 K 4.5821 7.4193 112.3389 55.9210 37.0384 176.6389 121 G 3.7693 8.4177 106.3371 45.9472 0.0000 174.1179 122 L 3.8352 8.6942 119.2834 58.7507 41.9285 180.3116 123 V 3.5342 7.7100 117.1869 66.0920 31.3562 177.9136 124 I 3.8752 7.8004 119.5244 64.1150 36.7029 178.0682 125 N 4.7299 8.0172 118.4126 56.1034 38.5370 177.3177 126 T 3.9872 8.0312 116.9347 66.8216 68.5271 176.7526 127 I 3.7077 7.8309 121.6149 64.5146 36.9822 178.6766 128 S 4.3792 8.6753 116.5305 61.5826 62.6881 177.0043 129 G 3.5797 8.2931 108.4294 47.7473 0.0000 175.9574 130 V 3.6692 7.8016 120.5827 65.7384 31.5911 177.5564 131 D 4.5377 8.4833 117.9710 57.5134 41.1217 178.2452 132 L 4.2739 8.4357 119.5449 57.9217 41.5642 179.4123 133 A 4.2348 8.2429 120.6928 55.0690 18.1866 179.7488 134 L 3.9788 8.1550 117.7493 57.8466 41.7153 179.7556 135 W 4.0225 8.5170 119.0006 59.5240 28.9879 178.1818 136 D 4.3384 8.7295 118.2944 57.2441 40.6568 178.0428 137 L 4.0146 8.2210 120.9585 58.1623 42.0717 178.7113 138 L 3.9975 8.2811 120.6602 58.0259 41.8872 179.2044 139 G 3.5646 8.2852 105.8290 47.7151 0.0000 175.9412 140 K 4.0292 8.1555 120.9101 59.0988 31.8121 179.7222 141 V 3.6247 7.8917 118.1742 65.9308 31.6055 177.8602 142 R 4.0924 8.1391 115.6715 56.1029 30.5247 176.4215 143 R 3.9161 7.6031 116.5148 57.0009 28.2916 175.8371 144 E 4.7544 8.2955 115.2465 53.6570 34.1756 173.9756 145 P 4.9408 0.0000 0.0000 61.8694 32.3403 177.4380 146 V 3.4547 8.0845 120.3793 66.5997 31.1569 178.2317 147 H 4.2050 8.2697 114.1690 58.7270 27.9948 177.1376 148 Q 4.1485 7.7889 119.2866 57.7279 28.7073 177.4007 149 L 4.4268 7.8385 118.7935 55.2382 42.2505 176.9146 150 L 4.4680 7.7564 118.7489 54.3117 42.1484 177.4662 151 G 3.7704 8.1716 107.2061 44.6307 0.0000 175.2393 152 G 4.0473 7.9706 104.8615 45.2730 0.0000 173.3203 153 A 4.1244 8.1918 122.8016 52.2601 18.8986 178.1489 154 V 4.3331 8.4828 113.3730 60.8949 32.5693 176.1345 155 R 4.6848 7.2757 115.0714 54.5487 32.3339 174.9664 156 D 4.4998 8.5824 118.6449 56.2143 41.4036 175.9381 157 E 4.8219 7.5458 114.5905 55.1823 32.2799 174.1864 158 L 4.4225 8.0532 119.8719 53.1903 43.6026 175.4326 159 Q 4.8791 8.0360 119.3708 54.3892 31.4308 174.2510 160 F 5.8588 9.0618 120.9372 55.9816 42.7496 173.9110 161 Y 5.3573 9.0465 119.1536 55.4637 41.0428 174.1382 162 A 4.9387 9.1323 122.9033 50.5349 21.7734 175.5605 163 T 4.8790 8.7328 119.0607 61.0748 70.2554 175.0111 164 G 2.0790 7.6984 115.0665 44.8092 0.0000 172.4580 165 A 4.0470 6.4579 119.9801 52.9173 19.0544 178.1373 166 R 4.6795 6.9553 114.7521 53.1233 30.5125 174.5153 167 P 4.3773 0.0000 0.0000 65.6135 31.1408 178.4427 168 D 4.1355 7.9393 118.8204 56.4743 39.1668 178.4694 169 L 4.0041 7.7600 118.7310 57.1013 41.9632 178.7518 170 A 4.2956 7.9404 121.0775 55.1072 18.3269 179.4009 171 Q 3.7579 7.8632 118.1413 58.8325 29.1504 179.3387 172 K 4.2552 7.4206 119.5223 55.8329 31.4374 178.0549 *174 G 3.8461 7.8621 106.0646 44.8216 0.0000 173.4603 175 F 4.4503 7.8554 118.4302 57.2866 39.7880 175.6590 176 I 3.7705 8.8830 116.5015 62.5379 38.1258 175.3583 177 G 3.2121 7.4064 107.0395 45.3561 0.0000 172.4710 178 G 4.5290 8.5196 106.9685 44.4561 0.0000 172.6685 179 K 4.6339 9.0947 128.2210 54.1793 35.0020 173.0490 *181 P 4.7849 0.0000 0.0000 62.4252 32.4478 175.9871 182 L 4.1877 8.9580 125.5329 55.3998 42.7379 176.9188 183 H 5.2396 8.9815 121.1533 55.4549 29.9666 174.5898 184 H 5.1072 8.1269 116.6559 53.8518 32.0346 173.1960 185 G 3.9100 9.1137 113.1728 42.7151 0.0000 172.0354 186 P 3.6484 0.0000 0.0000 65.4692 31.2507 179.0960 187 S 4.1225 7.8365 111.5519 60.5466 63.3764 174.9780 188 E 4.4086 8.4857 120.4080 55.3668 30.2085 177.5930 189 G 4.0621 8.0640 109.0350 46.2813 0.0000 174.7766 190 E 4.0379 8.7428 116.4372 59.4101 29.5136 178.6269 191 E 4.0288 8.2434 119.2348 59.2266 29.7133 178.9968 192 G 3.5762 8.1010 105.5793 47.5342 0.0000 175.4864 193 L 4.1717 8.0097 124.0803 57.4727 42.1149 179.2528 194 K 4.0503 8.3451 118.6045 59.4194 31.9767 179.5117 195 K 4.0198 8.1211 118.7868 59.4017 32.0650 179.1242 196 N 4.4904 8.5100 116.9443 56.5835 38.4609 177.5721 197 L 4.2367 8.1701 120.1230 57.6277 41.5703 179.4748 198 E 3.9325 8.3553 118.9932 59.3453 29.1620 179.1184 199 E 3.9561 8.1152 117.7744 59.2101 29.5970 178.8811 200 L 3.8164 7.6632 118.8089 57.8782 42.4621 178.4387 201 A 3.3153 7.5900 120.9178 55.1459 18.3068 180.2382 202 T 3.7861 7.6611 110.2976 64.8171 68.4184 176.0401 *204 R 4.2567 7.9188 123.7196 56.3624 31.8754 177.2080 205 E 4.0085 8.2344 117.7125 59.1721 29.8211 178.1295 206 R 4.0573 7.8123 116.6951 58.6871 30.1971 177.8954 207 V 4.3907 7.1740 108.0216 60.5160 32.2513 176.4958 208 G 4.0013 7.8562 105.4386 44.0895 0.0000 171.7454 209 P 4.4897 0.0000 0.0000 64.3981 31.8140 176.9720 210 D 4.6608 8.0304 118.0260 55.7650 41.8934 177.0323 211 F 4.0883 8.2934 119.8024 58.4650 39.8503 174.4414 212 W 4.3892 7.4404 126.6917 56.7702 29.9633 175.3282 213 L 5.4216 7.9526 122.3170 51.6169 46.3213 175.1637 *215 F 4.9880 8.3337 117.4426 57.7060 40.7603 173.5647 216 D 5.4491 9.0779 122.7618 53.0419 42.9553 176.0873 217 C 4.6861 9.3808 122.8665 58.8707 29.0435 173.3053 218 W 3.5993 8.4992 125.6350 59.6954 30.8037 175.3552 *220 S 4.3436 7.8083 110.0812 57.4127 64.0639 172.8754 221 L 4.5368 7.8765 121.3978 53.3380 43.9586 175.0518 222 D 5.0084 8.0129 118.2333 50.9906 43.3307 176.4345 223 L 3.8715 8.3384 121.0650 58.5304 41.9017 178.6227 224 N 4.2738 8.1432 116.1679 56.8526 38.7131 175.9545 225 Y 3.8569 9.1038 121.0263 60.6655 38.8484 177.8880 226 A 4.1021 8.4215 121.8599 55.4342 18.4467 179.7283 227 T 3.8098 8.1394 114.3777 67.0022 68.5103 177.1768 228 R 3.9148 8.1522 120.0937 58.8058 30.0214 178.9118 229 L 3.7809 8.1415 120.5221 57.9989 41.8959 178.8536 230 A 4.0645 7.9266 119.5613 55.2138 18.5378 179.2652 231 R 4.0791 8.0848 117.3866 59.5971 29.9729 179.0655 232 G 3.6557 8.1799 104.2011 47.3067 0.0000 174.8714 233 A 4.5534 8.0981 121.7766 53.5697 18.6569 179.2871 234 R 3.8553 7.6886 117.7861 59.3427 29.9066 178.0186 235 E 3.7533 8.0335 117.5560 58.3645 29.4769 177.2225 236 Y 4.7875 7.3553 114.5963 56.4751 38.5911 175.4367 237 G 3.9728 8.2874 107.6497 45.8406 0.0000 174.3428 238 L 3.8831 8.1427 120.3669 54.9199 42.6850 176.6144 239 K 3.9917 8.7503 128.3618 58.8546 32.3141 176.5641 240 W 5.2102 7.2609 112.0596 55.3774 31.1664 173.4588 241 I 4.8610 8.7255 121.1802 59.4685 40.0572 173.4438 242 E 5.1980 9.8341 130.9215 54.3263 31.7912 175.2509 243 E 4.5748 9.1711 126.0399 56.1539 28.8631 175.1875 244 A 4.1971 8.1145 123.4228 54.4259 19.2250 177.7468 245 L 4.9887 7.0809 112.7995 51.6491 45.3685 174.4610 246 P 4.3315 0.0000 0.0000 62.0202 31.8041 176.0823 247 P 4.1464 0.0000 0.0000 65.8319 31.2908 177.4640 248 D 4.1721 7.8010 115.5404 55.7878 41.4216 176.9602 249 D 4.9491 7.7501 121.7799 53.0406 37.7166 175.8216 250 Y 4.0834 7.0514 122.0950 60.8135 38.4951 178.3231 251 W 4.3801 8.0694 119.4312 59.8173 29.1690 178.6441 252 G 3.7392 8.9172 107.1835 47.4615 0.0000 175.3318 253 Y 3.9991 8.0718 118.9102 60.7859 38.0199 178.5751 254 A 4.3738 8.0875 122.9680 54.7467 18.4939 179.5963 255 E 3.9770 8.2918 117.0184 59.3840 29.6397 179.2809 256 L 3.9582 8.3267 120.8199 58.2654 41.9613 179.0210 257 R 3.9899 8.2051 117.7347 59.5511 30.0392 178.4162 258 R 4.1304 7.7455 116.7784 58.6025 30.1951 177.6942 259 N 4.6986 7.8987 113.2248 52.3298 39.2907 175.3871 260 A 4.2506 7.1315 123.5295 50.8706 19.2033 175.9239 261 P 4.2872 0.0000 0.0000 62.7003 31.9072 176.8250 262 T 3.7406 8.4623 119.2048 65.7794 68.9257 174.8330 263 G 3.8324 8.6067 116.6041 45.6496 0.0000 173.6434 *266 V 4.2460 7.5541 117.5579 62.7972 33.2021 174.6693 267 T 4.9476 8.2304 117.0752 60.4658 72.5779 172.4770 268 T 3.9979 7.9706 116.1414 62.0476 71.5257 172.3361 269 G 3.7770 8.7734 110.9827 45.5368 0.0000 175.9357 270 E 4.4923 8.2648 117.1696 58.3941 29.7068 177.1942 271 H 4.9851 8.0957 115.7442 55.3981 29.4076 173.3740 272 E 4.6169 8.0166 119.0137 54.2709 32.2122 174.8407 273 A 4.8670 8.3517 125.7456 51.6257 22.7629 176.1370 274 T 3.8398 8.8370 111.5248 60.9500 70.0819 173.3708 275 R 3.7492 8.3581 119.1373 59.2324 28.7804 179.1272 276 W 4.3437 7.5728 118.5132 59.2090 29.2590 178.3784 277 G 3.7439 7.7731 106.5066 47.3576 0.0000 175.6575 278 F 4.1903 8.0976 119.8836 59.4163 38.8185 178.0693 279 R 4.1794 7.7724 117.4685 56.5930 29.7162 178.1345 *281 L 4.2719 7.9004 118.4180 54.3728 43.7113 179.4263 282 L 3.9322 8.0266 117.1063 57.9549 41.5270 180.1736 283 E 4.1969 8.1898 117.6278 56.3520 28.3156 177.4798 *285 G 3.8388 7.9721 104.6317 45.7412 0.0000 175.6215 286 C 4.3998 8.3652 119.1445 61.9950 28.6567 173.8378 287 C 4.7731 7.5365 111.5771 57.4683 31.4810 172.9917 288 D 4.7063 9.2121 119.6430 55.3462 42.3009 176.8730 289 I 4.9188 7.3402 118.9011 59.2938 41.5158 174.2794 290 I 4.4878 8.2471 120.4294 59.0647 39.6690 175.6286 291 Q 5.2936 8.7095 122.5696 53.0942 28.2932 173.4516 292 P 4.8236 0.0000 0.0000 63.0387 33.6366 176.3459 293 D 4.9277 8.5117 121.3552 52.3334 42.5942 177.5575 294 V 3.5365 8.4571 125.8313 64.3346 31.4592 177.6187 295 G 3.9548 8.5542 108.3370 45.6329 0.0000 174.7772 296 W 5.2455 8.0515 117.2583 56.0161 31.7878 176.0343 297 C 4.5119 9.0502 112.5717 58.7240 29.6085 173.4325 298 G 3.5340 9.0437 111.4152 44.9911 0.0000 174.1803 299 G 4.3117 8.1235 108.1050 43.6659 0.0000 174.3038 300 V 3.3146 8.4732 116.3459 66.1765 30.9517 178.0531 301 T 3.9587 8.6941 115.6700 66.8884 68.3142 176.1438 302 E 3.3099 7.7016 120.3683 58.6092 29.7189 178.2341 303 L 3.6560 7.9087 120.5918 57.6047 41.9664 178.9015 304 L 4.1870 7.9876 119.3985 57.7893 41.5515 179.6059 305 K 3.8997 7.2913 118.1936 59.2573 31.9534 179.5721 306 I 3.5188 7.6659 120.3039 64.2823 36.9034 178.4210 307 S 4.0006 8.4719 114.1883 61.2750 62.2121 176.0847 308 A 4.1742 7.9569 124.8826 54.3369 18.1400 179.3491 309 L 3.8156 7.8933 118.7208 58.3194 42.1052 179.0808 310 A 3.9877 7.9908 120.6382 55.1572 18.3364 179.2313 311 D 4.2399 8.1829 117.2805 57.6548 40.7214 179.0431 312 A 4.1184 7.8172 119.7489 54.8497 18.4239 178.3768 313 H 4.4502 7.8350 111.6458 54.7815 29.4155 174.7761 314 N 4.0958 7.8841 117.1045 54.2838 36.7131 173.7340 315 A 4.7910 7.8910 117.6591 50.1827 21.8742 177.8400 316 L 4.3044 7.8076 120.4012 54.3792 43.5933 176.5171 317 V 4.2577 8.5909 122.5248 61.3807 33.8530 174.2296 318 V 4.4680 8.1438 128.7073 59.3969 31.9320 172.0832 319 P 4.4810 0.0000 0.0000 62.5586 32.1918 175.2618 320 H 4.3202 8.7435 123.8668 55.9660 30.4155 175.3670 321 G 3.8516 9.0501 115.0074 46.7818 0.0000 173.4600 322 S 4.7817 8.3867 121.7993 57.5022 65.2035 174.8065 323 S 2.7900 7.5921 115.2005 57.4419 61.7194 174.0578 324 V 3.4386 7.3579 106.6720 64.3846 31.9182 177.8892 325 Y 3.6608 6.6321 117.4878 60.2342 37.3557 178.0595 326 S 4.2957 7.5397 114.4006 60.6292 63.9226 175.8223 327 Y 4.4655 7.6494 120.3162 61.6332 37.4839 178.5607 328 H 4.3477 8.3092 115.5243 58.5876 29.0463 177.5848 329 F 4.1018 7.8998 120.4049 61.4530 39.5100 177.9567 330 V 3.7395 8.4925 112.0107 64.1948 31.2374 178.3905 331 A 4.0139 7.9464 120.9216 54.4365 17.9304 178.5903 332 T 4.5386 7.3851 107.1586 60.0266 69.7774 174.5970 333 R 4.3850 7.0118 122.4743 54.4554 31.4399 177.3030 334 Q 3.9703 8.6423 122.8942 58.7201 29.0699 176.9803 335 N 4.6556 8.0033 113.3653 53.0109 36.9939 174.4550 336 S 4.9699 7.9450 113.5485 54.6271 62.0320 172.4585 337 P 4.4776 0.0000 0.0000 64.6581 31.8403 177.0135 338 F 5.2504 6.8555 109.1341 55.3374 41.3821 173.5365 339 A 5.0494 9.3518 120.8876 50.1687 22.7706 174.5539 340 E 3.8940 8.9392 120.0426 54.9085 31.2634 175.2690 341 F 4.7681 8.4303 128.1555 56.5967 42.1153 174.1873 342 L 4.3424 7.7170 130.1556 54.0316 43.1567 175.5891 *345 A 4.2168 8.3181 122.2113 52.2967 19.9092 175.8498 346 P 3.7192 0.0000 0.0000 65.2142 31.5073 178.0516 347 K 4.7130 8.1232 113.3621 55.0905 32.3513 175.6218 348 A 3.8690 8.0115 120.7053 53.5197 16.4744 177.8913 349 D 4.9069 7.9422 115.7039 53.9590 40.0600 175.4500 350 Q 4.5728 7.4546 115.0004 55.7435 30.7321 173.3634 351 V 4.2722 8.3411 119.3049 62.3625 32.4516 175.6902 352 V 4.7202 8.2423 118.6412 58.8433 36.3132 175.5140 353 P 4.7424 0.0000 0.0000 62.7072 30.9970 177.8337 *355 F 4.6705 8.4626 118.8807 58.4200 40.6127 174.3184 356 H 4.4858 8.3106 120.6459 56.0692 30.1424 173.5104 357 P 4.7791 0.0000 0.0000 62.5924 31.6036 176.3810 358 Q 4.0300 8.0562 120.7623 58.2727 28.7734 175.6724 359 L 5.0600 7.8410 117.6137 52.7779 42.7541 175.9887 360 L 4.2048 8.8174 125.4133 55.6623 42.2534 178.3931 361 G 3.8294 8.9605 110.2145 45.4558 0.0000 172.8186 362 E 4.1494 8.0147 121.0250 54.9426 30.0361 174.6287 363 P 4.5502 0.0000 0.0000 62.5569 32.4078 175.8862 364 V 4.4043 7.8327 113.3658 58.5578 34.4066 173.9684 365 P 4.0229 0.0000 0.0000 62.4915 31.8969 175.9638 366 E 4.1902 9.0793 123.7103 54.9393 29.9439 175.4280 367 N 4.1224 9.2890 127.6461 54.6801 37.4718 175.3938 368 G 3.3711 7.3817 102.4230 45.9085 0.0000 173.2311 369 R 5.2530 7.0392 118.8830 53.7791 32.5864 174.0171 *371 R 4.3985 8.3584 118.1921 56.8564 31.4635 176.6414 372 L 3.9731 8.6016 122.6310 57.4992 41.8015 179.6351 373 S 4.2038 7.9560 112.1184 60.7111 62.9781 175.5663 374 R 4.0731 7.8707 119.5796 58.0975 30.5610 177.2669 375 L 4.5551 7.6257 120.6012 53.4803 40.0547 176.0809 376 D 4.8209 7.7235 115.3295 53.1061 40.9885 177.4213 377 Q 4.4315 7.6989 119.5042 54.2180 30.3320 173.4494 378 P 4.3400 0.0000 0.0000 63.7917 33.0636 177.4093 379 G 3.6516 8.3524 109.0525 47.3518 0.0000 175.3342 380 F 4.1777 9.6278 123.8873 56.7492 38.8894 176.5840 381 G 4.1116 8.1440 107.9803 46.2883 0.0000 173.7653 382 V 4.9882 7.3712 111.7354 59.4113 35.5059 174.9099 383 T 5.0508 8.7061 111.2012 59.6565 72.4308 172.8666 384 L 4.3235 7.9265 125.0758 54.6325 43.1833 175.8377 385 N 4.4011 8.9935 125.8874 53.1628 39.1624 173.9745 386 P 4.2730 0.0000 0.0000 65.5345 31.8389 177.6292 387 E 4.0110 8.6373 117.6824 59.3099 29.4514 177.3313 388 C 4.0933 7.6874 116.6081 59.6492 28.0395 173.5787 389 Q 4.1506 8.4963 125.1070 55.1521 28.0345 176.0243 390 L 4.3291 8.1196 123.3115 54.7785 42.9188 176.2114 391 H 4.7597 8.7703 119.7830 54.6796 32.9328 172.4562 392 R 4.6666 8.6000 126.9507 54.0559 28.6932 173.4899 393 P 4.2244 0.0000 0.0000 64.3976 31.8150 176.3548 394 Y 4.9288 7.4578 112.8913 56.3120 41.7030 173.7655 395 T 4.9547 8.4713 110.0775 59.5260 72.3172 173.6423 396 H 4.3615 8.2323 115.6905 56.0458 28.2835 173.2542 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 8.33 4.42 0.00 3.88 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 3 L 8.32 3.71 0.00 1.66 1.58 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 4 S 9.27 4.36 0.00 3.87 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 5 I 8.16 4.07 1.87 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 1.46 0.92 0.90 0.00 0.00 6 P 0.00 4.71 0.00 2.12 2.19 0.00 3.66 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 7 T 8.40 4.98 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 1.22 0.00 0.00 8 I 8.64 4.36 2.10 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.87 1.00 0.00 0.00 9 K 9.27 4.03 0.00 1.75 1.99 0.00 1.84 0.00 0.00 1.90 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.40 7.81 10 Q 7.88 5.01 0.00 2.15 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.64 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 11 V 8.71 4.96 2.11 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 0.74 0.00 0.00 0.96 0.00 0.00 12 R 9.17 4.85 0.00 1.75 1.30 0.00 3.21 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 13 A 9.08 5.18 1.16 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 0.00 0.00 14 F 9.65 5.23 0.00 2.94 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 15 V 8.93 5.00 2.11 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 1.00 0.00 0.00 1.01 0.00 0.00 16 L 8.92 5.02 0.00 1.79 1.43 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.87 4.80 0.00 1.66 1.75 0.00 3.38 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 18 G 9.39 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 0.00 0.00 0.00 0.00 19 G 9.58 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 20 G 8.68 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 21 A 8.12 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 7.24 4.50 0.00 2.78 2.48 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 23 Y 7.67 4.10 0.00 2.87 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 24 H 8.23 4.55 0.00 3.08 3.21 0.00 5.89 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 8.07 4.52 0.00 2.89 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 26 Q 7.43 4.66 0.00 1.90 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.51 0.00 0.00 0.00 0.00 0.00 2.21 1.85 0.00 27 G 7.98 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 0.00 0.00 0.00 0.00 28 D 8.49 4.49 0.00 2.68 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 29 G 8.64 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 30 H 7.76 4.89 0.00 3.16 3.00 0.00 5.88 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 W 8.88 4.31 0.00 3.65 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 32 I 6.63 2.84 0.56 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 -0.11 0.31 0.00 0.00 33 D 7.87 4.66 0.00 2.43 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 34 D 8.03 4.59 0.00 2.89 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 35 H 9.10 4.23 0.00 3.36 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 I 7.77 4.24 1.79 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.96 0.89 0.00 0.00 37 S 9.02 4.46 0.00 3.89 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 38 T 8.36 5.09 4.69 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 1.39 0.00 0.00 39 P 0.00 4.40 0.00 1.95 2.03 0.00 3.86 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.04 0.00 *41 G 8.13 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 7.87 4.11 0.00 1.57 1.73 0.00 0.81 0.00 0.00 0.70 0.00 0.00 2.76 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.93 0.21 7.81 43 Y 7.37 4.69 0.00 3.39 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 44 P 0.00 4.28 0.00 2.20 2.16 0.00 3.71 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 45 E 8.28 3.90 0.00 1.34 1.62 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 2.20 2.32 0.00 46 Y 7.96 4.96 0.00 3.13 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 47 R 7.92 4.20 0.00 1.95 2.09 0.00 3.31 0.00 0.00 3.41 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.52 0.00 48 Q 8.12 4.06 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.64 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 49 S 7.73 4.96 0.00 3.79 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 50 R 8.63 3.42 0.00 1.63 1.21 0.00 2.28 0.00 0.00 2.61 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.38 0.00 51 R 7.67 3.86 0.00 1.71 1.86 0.00 3.04 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 52 S 7.75 4.17 0.00 4.02 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 53 F 7.83 4.65 0.00 2.76 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 54 G 7.90 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 0.00 0.00 0.00 55 I 6.93 3.84 1.35 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.90 0.63 0.00 0.00 56 N 7.74 4.99 0.00 2.78 2.94 0.00 0.00 6.10 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 57 V 7.43 3.80 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.92 0.00 0.00 58 L 8.10 4.08 0.00 1.72 1.76 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 59 G 7.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.13 4.95 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 1.20 0.00 0.00 61 L 8.87 5.06 0.00 1.88 1.57 1.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 62 V 9.18 4.97 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.03 0.00 0.00 63 V 8.83 5.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.00 0.00 0.00 64 E 9.52 5.49 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 2.42 2.63 0.00 65 I 9.25 4.91 1.96 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 1.19 0.82 0.96 0.00 0.00 66 E 9.24 4.91 0.00 2.11 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 2.29 2.30 0.00 67 A 8.96 5.23 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 68 S 9.10 4.20 0.00 3.97 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.11 4.62 0.00 2.81 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 70 G 8.08 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 0.00 0.00 0.00 71 N 8.44 4.62 0.00 2.89 2.80 0.00 0.00 6.20 7.22 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 72 V 8.39 4.88 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 0.93 0.00 0.00 1.05 0.00 0.00 73 G 9.14 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 F 9.46 6.12 0.00 3.27 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 75 A 8.41 4.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.86 5.04 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 0.98 0.00 0.00 1.31 0.00 0.00 77 T 8.35 4.50 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 1.32 0.00 0.00 78 T 8.76 4.76 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 79 G 9.40 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 80 G 7.55 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.99 4.04 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.41 2.36 0.00 149 L 7.84 4.43 0.00 1.88 2.03 1.08 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 150 L 7.76 4.47 0.00 1.39 1.33 0.65 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 151 G 8.17 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 G 7.97 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 8.19 4.12 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 8.48 4.33 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 0.72 0.00 0.00 0.87 0.00 0.00 155 R 7.28 4.68 0.00 1.79 1.79 0.00 2.94 0.00 0.00 3.31 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 156 D 8.58 4.50 0.00 2.69 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 0.00 157 E 7.55 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0.00 0.00 0.00 0.00 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 R 6.96 4.68 0.00 1.92 1.86 0.00 3.24 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.61 0.00 167 P 0.00 4.38 0.00 2.40 2.33 0.00 3.74 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 2.03 1.95 0.00 168 D 7.94 4.14 0.00 2.83 2.88 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 0.00 169 L 7.76 4.00 0.00 1.72 1.76 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 170 A 7.94 4.30 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 0.00 171 Q 7.86 3.76 0.00 0.93 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.13 0.00 0.00 0.00 0.00 0.00 2.04 1.83 0.00 172 K 7.42 4.26 0.00 1.92 1.78 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.53 7.81 *174 G 7.86 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 0.00 0.00 0.00 175 F 7.86 4.45 0.00 3.40 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 0.00 176 I 8.88 3.77 1.11 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.42 0.76 0.00 0.00 177 G 7.41 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 8.52 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 K 9.09 4.63 0.00 1.74 1.92 0.00 2.14 0.00 0.00 2.06 0.00 0.00 3.34 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.52 1.37 7.81 *181 P 0.00 4.78 0.00 2.28 2.42 0.00 3.80 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 1.94 2.30 0.00 182 L 8.96 4.19 0.00 1.75 1.56 -0.03 1.24 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 0.00 183 H 8.98 5.24 0.00 3.04 3.16 0.00 5.94 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 0.00 184 H 8.13 5.11 0.00 3.32 3.21 0.00 5.62 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 0.00 185 G 9.11 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 P 0.00 3.65 0.00 1.97 2.07 0.00 3.32 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.31 0.00 187 S 7.84 4.12 0.00 3.93 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 0.00 188 E 8.49 4.41 0.00 2.26 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 2.27 0.00 189 G 8.06 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 0.00 190 E 8.74 4.04 0.00 2.01 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 2.43 2.33 0.00 191 E 8.24 4.03 0.00 2.09 1.95 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 2.38 2.43 0.00 192 G 8.10 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 201 A 7.59 3.32 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 T 7.66 3.79 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 1.18 0.00 0.00 *204 R 7.92 4.26 0.00 1.92 2.15 0.00 3.31 0.00 0.00 3.46 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 205 E 8.23 4.01 0.00 2.06 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 0.00 2.32 2.29 0.00 206 R 7.81 4.06 0.00 1.82 1.90 0.00 3.16 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 207 V 7.17 4.39 1.81 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 0.72 0.00 0.00 1.08 0.00 0.00 208 G 7.86 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 P 0.00 4.49 0.00 2.23 2.22 0.00 3.78 0.00 0.00 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 340 E 8.94 3.89 0.00 2.03 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 2.10 1.85 0.00 341 F 8.43 4.77 0.00 2.90 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 0.00 342 L 7.72 4.34 0.00 1.50 1.54 1.05 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 *345 A 8.32 4.22 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 346 P 0.00 3.72 0.00 2.19 2.11 0.00 3.60 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 347 K 8.12 4.71 0.00 1.90 1.83 0.00 1.92 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.44 7.81 348 A 8.01 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 349 D 7.94 4.91 0.00 2.78 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 0.00 350 Q 7.45 4.57 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 351 V 8.34 4.27 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 0.89 0.00 0.00 1.17 0.00 0.00 352 V 8.24 4.72 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 0.90 0.00 0.00 1.05 0.00 0.00 353 P 0.00 4.74 0.00 2.34 2.23 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 *355 F 8.46 4.67 0.00 3.23 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 0.00 356 H 8.31 4.49 0.00 3.41 3.35 0.00 5.76 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 357 P 0.00 4.78 0.00 2.09 1.62 0.00 3.82 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.85 0.00 358 Q 8.06 4.03 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 359 L 7.84 5.06 0.00 1.90 1.76 1.27 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 360 L 8.82 4.20 0.00 1.86 1.63 0.94 1.09 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 0.00 361 G 8.96 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 0.00 362 E 8.01 4.15 0.00 2.11 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 2.43 2.37 0.00 363 P 0.00 4.55 0.00 2.23 2.08 0.00 3.91 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 364 V 7.83 4.40 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 0.87 0.00 0.00 0.88 0.00 0.00 365 P 0.00 4.02 0.00 1.36 1.40 0.00 2.66 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 366 E 9.08 4.19 0.00 1.83 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 367 N 9.29 4.12 0.00 2.86 2.66 0.00 0.00 7.09 8.28 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 0.00 368 G 7.38 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 0.00 0.00 0.00 369 R 7.04 5.25 0.00 1.75 1.67 0.00 3.39 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 *371 R 8.36 4.40 0.00 1.82 1.85 0.00 3.32 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 372 L 8.60 3.97 0.00 1.76 1.62 0.62 0.86 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 0.00 373 S 7.96 4.20 0.00 3.96 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 0.00 374 R 7.87 4.07 0.00 1.95 2.03 0.00 3.11 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 375 L 7.63 4.56 0.00 1.67 1.64 0.85 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 376 D 7.72 4.82 0.00 2.78 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 0.00 377 Q 7.70 4.43 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.08 0.00 0.00 0.00 0.00 0.00 2.46 2.36 0.00 378 P 0.00 4.34 0.00 2.20 2.11 0.00 3.76 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 2.13 2.10 0.00 379 G 8.35 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 380 F 9.63 4.18 0.00 2.99 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 0.00 381 G 8.14 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 382 V 7.37 4.99 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 0.85 0.00 0.00 0.99 0.00 0.00 383 T 8.71 5.05 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 1.32 0.00 0.00 384 L 7.93 4.32 0.00 0.84 1.28 0.79 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 385 N 8.99 4.40 0.00 2.94 2.69 0.00 0.00 6.84 7.22 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 0.00 386 P 0.00 4.27 0.00 2.05 2.07 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 387 E 8.64 4.01 0.00 2.01 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 0.00 2.43 2.44 0.00 388 C 7.69 4.09 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 0.00 389 Q 8.50 4.15 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.01 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 390 L 8.12 4.33 0.00 1.27 1.34 0.12 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 391 H 8.77 4.76 0.00 3.24 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 392 R 8.60 4.67 0.00 2.01 1.86 0.00 2.88 0.00 0.00 2.74 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.73 0.00 393 P 0.00 4.22 0.00 1.57 1.70 0.00 3.67 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 394 Y 7.46 4.93 0.00 2.88 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 395 T 8.47 4.95 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 1.19 0.00 0.00 396 H 8.23 4.36 0.00 3.17 3.24 0.00 5.56 0.00 0.00 0.00 0.00 6.91 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.