NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.3691 8.2644 123.5893 52.0776 20.1739 176.5096 4 Q 4.2157 7.9185 121.9965 52.7069 32.5890 173.8174 5 A 3.9065 8.8747 129.6887 55.4462 19.0503 178.5858 6 E 4.0361 8.4940 117.1918 59.6546 29.6699 178.8068 7 E 4.0162 8.0799 118.1518 59.1141 29.6389 178.8483 8 F 3.9612 7.8512 120.4145 60.9115 39.5250 176.7507 9 K 3.3467 8.2012 119.6828 59.6069 31.8886 178.6804 10 K 3.8843 7.8295 118.2482 59.5835 31.7409 178.6738 11 Y 4.0823 7.7806 118.6921 60.5561 38.9529 177.9581 12 L 3.6486 7.4545 119.6930 57.6295 41.7037 179.1304 13 E 4.1521 7.5019 119.3007 59.2684 29.2996 179.7284 14 T 4.0152 8.2291 113.6950 65.4146 68.3768 175.2887 15 N 4.7649 7.6220 117.6133 52.7077 39.5240 175.8733 16 G 3.8982 8.0503 111.0115 45.4277 0.0000 174.4783 17 I 4.0249 7.4018 121.0341 60.7074 37.2032 175.1975 18 K 4.7680 8.3420 125.0939 53.8021 34.1631 174.4320 19 P 3.7862 0.0000 0.0000 62.4151 32.3430 175.3459 20 K 4.3703 8.4917 123.8161 54.6614 34.8063 174.3025 21 Q 4.8804 8.0859 126.9385 54.6748 30.6864 174.4804 22 F 4.9350 9.0540 123.6079 56.0278 43.5614 173.6077 23 H 5.4971 8.9885 117.5174 53.4031 32.3735 173.4534 24 K 4.1017 8.2993 120.3688 57.9944 32.3114 177.4616 25 K 4.2171 9.0825 123.7936 56.9476 31.5004 176.3130 26 E 4.2930 8.0446 118.7934 56.2734 30.9062 175.8792 27 L 4.8224 8.2251 122.0224 53.2247 42.8133 176.5112 28 I 3.5667 8.1483 126.3792 63.5473 37.5422 176.7493 29 F 5.2369 7.4700 115.2993 54.8878 41.6518 173.5943 30 N 5.5519 8.8460 117.0024 50.8248 39.7916 175.4769 31 Q 4.1637 8.8719 117.1582 57.4595 28.6982 177.0051 32 W 4.7657 8.2161 117.5580 56.8389 29.8457 175.7235 33 D 4.6089 8.0266 119.5353 53.1437 40.6743 174.4037 34 P 4.3514 0.0000 0.0000 64.6499 31.8277 176.5731 35 Q 3.8819 8.1214 119.6349 55.7227 29.2120 175.2221 36 E 4.3396 8.1015 121.9048 55.2623 32.0113 174.6269 37 Y 5.1397 8.4221 118.9105 56.5179 43.2989 173.7134 38 C 5.0153 9.7919 123.3169 58.0077 33.7858 172.4495 39 I 4.7791 9.2413 128.4990 59.8860 38.9880 174.9001 40 F 5.2543 9.1079 131.3987 56.9212 40.0828 174.5473 41 L 4.3673 8.9937 130.5187 54.7643 41.8697 176.7324 42 Y 3.9613 8.8211 128.6915 60.0131 39.1083 175.1545 43 D 4.5774 8.2322 117.2632 52.5992 43.2735 173.0663 44 G 4.0478 8.5603 105.0942 44.1617 0.0000 172.2556 45 I 5.0124 8.3248 119.5730 59.6973 40.2966 175.5273 46 T 5.3656 9.4274 115.9511 60.1037 73.1502 172.4478 47 K 4.9985 9.1530 120.1779 55.0605 36.4524 174.8449 48 L 5.0436 8.9504 125.1080 54.1923 43.8065 175.3806 49 T 5.2334 8.9027 115.5256 59.9628 72.7417 172.5136 50 S 5.1928 8.9262 116.8825 56.4103 66.0259 172.7289 51 I 5.5820 8.4653 119.5127 58.0731 38.8324 175.4091 52 S 4.3850 8.5719 122.0446 57.4376 63.9200 174.8330 53 E 3.9845 8.7267 120.8888 59.3146 29.6327 177.2733 54 N 4.2932 8.3674 115.4162 57.7497 38.5076 175.1181 55 G 3.8746 7.6990 102.2753 45.5381 0.0000 174.4738 56 T 3.9294 8.1108 117.4475 64.3158 69.0043 172.4198 57 I 4.9311 8.1999 125.1802 59.7983 39.4544 174.5306 58 M 4.6413 8.9540 126.7654 53.6476 35.0745 174.1422 59 N 4.6476 8.6103 124.4255 52.8857 38.9011 174.4162 60 L 4.1405 8.5921 127.9847 57.4298 42.6421 177.5153 61 Q 4.3082 7.1955 115.6995 55.4586 32.0374 172.7829 62 Y 4.8826 8.4162 122.1449 57.8976 39.6587 174.6317 63 Y 4.6772 9.1627 119.4024 56.4311 42.1105 174.3891 64 K 4.9294 8.6760 124.4087 55.4404 35.7871 177.0691 65 G 3.7724 8.3502 109.4589 45.4291 0.0000 172.7889 66 A 4.6663 8.5599 124.1709 51.6435 19.5652 177.0768 67 F 4.9231 8.9114 123.8991 57.5826 43.8907 172.7332 68 V 5.1259 7.2525 120.6616 59.8304 33.9531 174.9480 69 I 4.4920 8.8835 124.3681 59.6927 40.3931 174.1472 70 M 5.1630 8.7002 126.3436 53.6317 34.3696 175.7847 71 S 4.3819 8.8679 117.4047 58.2986 64.5039 173.7969 72 G 4.2598 7.4776 106.5657 44.0526 0.0000 172.5539 73 F 4.3848 8.4847 120.6342 57.1716 39.3299 176.8965 74 I 3.6695 8.7541 123.5150 63.5086 37.9285 175.8491 75 D 4.5951 7.7910 119.0044 56.3777 41.7511 177.4046 76 T 3.8997 7.8019 109.4854 62.6026 69.7793 173.9093 77 E 3.8960 8.0201 121.9711 57.6615 27.4462 172.4452 78 T 4.7978 7.0914 107.7639 58.2476 72.9071 173.5759 79 S 4.5551 8.4029 115.8359 58.3810 62.7831 173.8978 80 V 3.9824 8.5120 118.6451 60.3888 31.6489 176.0288 81 G 4.1592 6.3242 110.7771 45.0745 0.0000 172.6268 82 Y 4.1202 7.1042 118.3510 55.9630 37.9344 174.7282 83 Y 5.2689 7.8523 120.8730 56.1913 43.1784 173.6498 84 N 5.2579 9.1517 117.3276 51.3624 43.1281 173.6741 85 L 4.6438 7.7967 123.0514 53.3372 44.5697 174.5002 86 E 5.0165 9.0770 128.4167 54.1076 32.3083 175.0811 87 V 4.0009 8.6052 127.4047 63.3845 32.2711 175.8398 88 I 4.2733 8.7009 128.8464 63.0848 38.5262 176.7798 89 S 4.3845 8.1397 114.6041 58.1439 63.4608 173.9343 90 E 4.3155 9.0910 119.5257 59.3516 29.6331 176.6835 91 Q 5.1356 7.9069 114.5346 54.4856 32.4026 173.2601 92 A 4.9295 9.0016 119.3031 51.1437 23.3824 175.3271 93 T 5.1169 9.3923 117.1788 61.8305 71.4015 173.3994 94 A 5.2683 8.9561 126.8922 50.4954 23.5456 173.8788 95 Y 4.8936 9.0003 117.4282 56.2830 40.4573 174.9911 96 V 4.6223 8.5613 124.1927 61.2758 33.4436 174.7568 97 I 4.7018 8.4988 127.9826 59.0749 40.6461 175.1282 98 K 4.2458 9.0415 126.5940 56.9035 32.7425 178.0154 99 I 3.6089 8.5613 125.2297 64.0250 38.0628 177.2410 100 N 4.8049 7.9506 114.4189 53.7801 37.5349 175.5105 101 E 4.3955 8.3189 119.1019 57.3378 30.2116 177.8002 102 L 3.9626 7.6162 120.7847 57.7484 42.1551 178.4243 103 K 3.6586 8.0032 119.1689 59.6520 32.1225 178.4218 104 E 3.9135 8.0073 118.0140 59.3809 29.3309 178.8038 105 L 4.0608 7.4383 117.2155 58.1894 42.1213 179.4237 106 L 4.1972 8.1625 118.7312 57.6157 41.3531 179.6088 107 S 4.3705 7.8039 114.4102 61.2844 62.7482 176.3274 108 K 4.4133 7.8878 121.5349 57.6610 32.2022 176.0049 109 N 4.8396 7.8151 116.8980 50.9406 40.5023 174.4780 110 L 4.1086 8.5998 127.1639 57.9149 41.7961 179.1253 111 T 3.9821 8.0980 115.4476 67.5151 68.3791 175.8879 112 H 4.4174 7.9870 116.9624 58.3301 28.7109 177.6006 113 F 4.1853 8.0617 122.7377 61.4827 39.1085 177.2358 114 F 4.2285 8.3538 117.4422 60.5312 38.7716 176.6899 115 Y 4.2554 8.1205 119.3609 61.1860 38.5346 178.8338 116 V 3.0744 7.7039 118.7105 65.5285 31.4710 177.7623 117 F 4.2649 8.4590 120.7351 61.1249 39.1415 176.8212 118 Q 3.8059 8.5044 119.9009 59.4612 28.7991 178.5665 119 T 3.7065 7.4315 110.5141 64.4619 68.6196 176.2978 120 L 3.8648 7.6171 123.1737 58.1007 42.1193 178.9815 121 Q 3.9380 7.9700 118.1421 58.6728 28.5324 178.8467 122 K 4.1788 8.3960 119.9802 59.5633 32.2600 178.9783 123 Q 4.0867 8.5727 119.9553 59.2335 29.0088 178.3383 124 V 3.6168 7.9085 119.3987 66.2488 31.5950 178.1021 125 S 4.2029 8.1649 113.7872 61.5802 62.8073 175.7577 126 Y 2.9735 7.9846 123.0553 60.3085 38.4848 178.2791 127 S 3.9798 7.9443 115.7555 61.2965 62.7665 176.7622 128 L 4.0253 7.9055 121.5431 57.8594 41.3845 179.4172 129 A 3.9702 7.8013 120.5772 54.8689 18.2524 179.6294 130 K 3.8294 7.7314 118.1750 59.5791 32.0317 178.8382 131 F 4.2825 8.0180 119.6973 61.2414 39.7135 176.2257 132 N 4.2477 8.4304 116.7714 56.9248 38.3234 176.5908 133 D 4.3703 8.3439 120.1453 57.4998 40.7848 178.9168 134 F 3.7037 8.3766 116.8850 60.1132 38.8723 177.1325 135 S 4.3886 7.5223 113.1789 60.2946 63.1227 176.1118 136 I 4.0384 7.1213 121.5826 62.8333 37.2660 176.2543 137 N 4.9591 7.6838 116.5220 52.6053 40.5154 175.4615 138 G 3.9819 8.0102 107.3475 46.2838 0.0000 176.0113 139 K 3.9286 8.5133 117.2341 59.1291 32.2035 178.4222 140 L 3.8293 7.9432 120.5181 58.3056 41.7882 179.1649 141 G 3.4716 7.6882 105.0555 48.0541 0.0000 175.7504 142 S 3.3081 7.6477 117.6745 60.5833 62.6547 176.9536 143 I 3.6624 7.6839 116.1261 64.1559 37.6033 177.9724 144 C 4.0924 7.7693 118.9918 62.4242 27.9176 176.4230 145 S 4.0540 7.8094 116.5802 61.4240 62.3454 176.4550 146 Q 4.1689 7.7406 122.1311 59.4131 28.7951 178.3078 147 L 3.9287 8.1758 120.3224 57.5906 41.3572 179.4188 148 L 3.9203 8.0513 119.6686 58.7557 42.3540 178.3312 149 I 3.9669 8.1594 119.2845 64.8051 36.8355 177.8462 150 L 4.0149 8.3077 120.6416 58.7068 41.8949 179.9253 151 T 4.0107 8.2421 115.5025 66.8751 68.1921 176.2220 152 Y 3.7086 7.9246 120.4756 59.9923 38.8465 176.9147 153 V 4.0703 7.1136 115.9105 62.0611 32.3599 175.0305 154 Y 4.5746 6.8869 111.1237 58.3818 40.4421 172.6694 155 G 5.4084 8.0553 120.9800 46.3329 0.0000 170.0484 156 K 4.6746 7.9518 124.5723 54.3854 35.5826 175.5338 157 E 4.3590 8.7127 122.8753 56.7908 29.4591 176.1397 158 T 4.5967 8.7874 124.4901 61.1413 70.5470 174.5562 159 P 4.3985 0.0000 0.0000 64.4855 31.2992 176.9090 160 D 4.5728 7.6115 117.0949 53.7828 41.7809 175.5968 161 G 3.8715 7.6731 105.0987 44.1462 0.0000 173.1138 162 I 4.8057 8.6108 123.9235 59.9317 38.5431 175.9404 163 K 4.7384 8.7150 127.4501 55.0700 34.7752 176.3221 164 I 4.0019 7.8321 115.6892 60.7965 37.4385 175.6834 165 T 4.0107 8.6725 125.6054 66.2295 68.7876 175.6059 166 L 3.7790 7.6798 119.3880 55.2996 42.1591 176.4235 167 D 4.5755 8.3180 119.2962 55.7612 41.9562 177.3871 168 N 4.4500 8.6416 114.9034 55.4839 38.8619 177.1458 169 L 3.8679 6.6936 116.9587 56.4109 38.0717 174.8548 170 T 4.7911 7.7012 114.5408 61.1656 71.8086 175.4465 171 M 4.4141 8.6715 122.2305 56.9768 32.1961 177.3618 172 Q 4.1517 8.0400 120.2449 58.3793 29.5471 177.4646 173 E 3.8588 8.1972 116.9358 58.5046 29.7826 177.3899 174 L 4.2579 7.4141 119.0399 56.1357 43.2742 176.4172 *184 S 4.0872 7.8267 111.6378 58.1810 62.8216 173.7219 185 A 4.3971 8.5176 132.7307 50.8535 16.9694 177.1670 186 V 3.3352 7.0280 119.6587 65.3525 33.5386 177.3027 187 S 4.5293 7.6098 116.9191 57.8298 60.9406 174.4157 188 R 4.2314 7.4207 123.9810 58.6976 31.1895 178.1839 189 I 3.9445 7.5166 118.3960 63.9793 37.1143 177.8150 190 I 4.1020 7.2444 109.4295 61.7260 37.5549 177.0719 191 S 4.4471 7.4798 118.5553 57.8200 61.8385 173.8748 192 K 4.6562 7.5757 119.6716 56.6049 38.8251 177.3984 193 L 3.8400 7.8676 118.7417 57.4723 41.3586 179.5497 194 K 4.0841 7.8335 119.6909 59.6595 32.4098 179.1520 195 Q 3.9803 7.9073 117.8811 58.1473 28.7597 177.2645 196 E 4.2785 8.0038 117.0117 54.9454 30.2566 176.0926 197 K 3.8369 7.8864 117.6599 57.5781 30.3624 176.6139 198 V 3.9157 8.4735 121.4143 64.7218 32.9551 175.7004 199 I 5.2108 7.4113 111.8685 59.4233 41.9169 174.4563 200 V 4.5383 8.4380 120.7146 62.0507 35.3629 171.5442 201 Y 5.0617 8.6249 129.0732 55.7793 40.3870 174.6913 202 K 4.4328 8.7648 124.0533 56.8128 36.1386 174.6535 203 N 3.9787 9.3890 115.7883 56.1766 35.8596 174.1532 204 S 3.8553 7.9152 104.1698 59.1372 61.5800 172.7350 205 C 4.1565 6.6546 114.4865 57.8783 32.2895 173.4984 206 F 4.9616 7.7285 121.1360 57.0812 40.5394 174.3613 207 Y 4.9540 8.8079 119.8197 56.2874 41.1844 175.0629 208 V 4.2265 8.7605 119.2999 61.1527 32.3702 176.9965 209 Q 4.3483 8.9356 123.9003 55.8199 30.7577 175.6544 210 N 4.7716 7.9141 117.1325 50.8224 39.7774 173.8051 211 L 3.9735 8.1432 126.7169 57.5648 42.2080 177.7676 212 D 4.4091 8.0074 117.6007 56.8826 40.6838 177.6194 213 Y 4.0863 7.6649 120.1231 60.5303 38.7333 177.3843 214 L 4.1614 8.1645 119.4870 58.0728 41.2822 179.6376 215 K 4.0694 8.0438 117.7782 59.3552 31.6524 179.6819 216 R 3.8157 7.3424 117.6684 58.7819 30.0112 177.6113 217 Y 4.6307 7.1744 113.3271 57.8060 39.3558 175.7867 218 A 4.8715 7.6003 122.8906 49.5517 19.7772 176.0775 219 P 4.3877 0.0000 0.0000 65.9376 31.9172 178.4679 220 K 4.0119 8.2313 117.9578 59.1282 32.0766 179.0985 221 L 4.0013 9.0204 119.5518 57.8276 41.4827 179.1406 222 D 4.6706 8.7173 118.2679 57.4685 40.7210 177.4128 223 E 4.0975 9.0177 120.5217 59.6032 29.4688 178.4779 224 W 4.4551 9.1845 128.7318 60.8223 30.3500 177.6794 225 F 4.2851 8.4240 116.1555 59.4907 38.3993 176.8004 226 Y 4.3328 8.1600 119.2741 60.3608 38.9876 177.0605 227 L 3.9268 9.0946 117.8185 55.8407 41.8634 177.5346 228 A 4.1813 6.7520 120.8304 51.2894 19.3976 175.3956 *230 P 4.4574 0.0000 0.0000 63.4720 33.3314 178.9189 231 A 4.0679 8.2012 120.0075 55.4004 18.6148 179.1756 232 T 4.0551 7.9899 113.7490 66.7958 68.4754 176.2338 233 W 4.6776 8.6557 128.5206 60.9760 30.5932 177.6906 234 G 4.0535 8.4670 104.2944 46.9585 0.0000 173.4300 235 K 4.1603 7.9028 125.8387 56.5848 32.2384 176.2036 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 3 A 8.26 4.37 1.54 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 0.00 0.00 4 Q 7.92 4.22 0.00 2.15 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.66 0.00 5 A 8.87 3.91 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.49 4.04 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 7 E 8.08 4.02 0.00 2.00 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 0.00 2.40 2.30 0.00 8 F 7.85 3.96 0.00 2.61 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 9 K 8.20 3.35 0.00 1.96 1.98 0.00 1.13 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.24 1.15 7.81 10 K 7.83 3.88 0.00 2.01 1.83 0.00 1.88 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.50 7.81 11 Y 7.78 4.08 0.00 2.76 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 12 L 7.45 3.65 0.00 1.16 1.26 0.08 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 13 E 7.50 4.15 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 14 T 8.23 4.02 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 1.17 0.00 0.00 15 N 7.62 4.76 0.00 2.45 2.49 0.00 0.00 7.10 6.97 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 16 G 8.05 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 0.00 0.00 0.00 17 I 7.40 4.02 1.91 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 1.43 1.02 1.07 0.00 0.00 18 K 8.34 4.77 0.00 1.71 1.70 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.17 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.34 7.81 19 P 0.00 3.79 0.00 1.75 1.16 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.90 0.00 20 K 8.49 4.37 0.00 1.71 1.54 0.00 1.18 0.00 0.00 1.35 0.00 0.00 2.42 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.44 0.24 7.81 21 Q 8.09 4.88 0.00 1.93 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.55 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 22 F 9.05 4.93 0.00 2.91 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 23 H 8.99 5.50 0.00 3.11 3.18 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.30 4.10 0.00 1.91 1.79 0.00 2.02 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.59 7.81 25 K 9.08 4.22 0.00 1.96 1.99 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.56 7.81 26 E 8.04 4.29 0.00 2.30 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 27 L 8.23 4.82 0.00 1.50 1.67 0.86 0.91 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 28 I 8.15 3.57 1.46 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.23 0.50 0.00 0.00 29 F 7.47 5.24 0.00 3.14 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.85 5.55 0.00 3.05 3.04 0.00 0.00 5.83 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 31 Q 8.87 4.16 0.00 1.83 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.14 1.16 0.00 32 W 8.22 4.77 0.00 3.49 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 33 D 8.03 4.61 0.00 2.80 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 34 P 0.00 4.35 0.00 2.20 2.17 0.00 3.87 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 35 Q 8.12 3.88 0.00 2.15 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 36 E 8.10 4.34 0.00 1.75 1.70 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 2.30 2.15 0.00 37 Y 8.42 5.14 0.00 2.66 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 C 9.79 5.02 0.00 2.91 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 39 I 9.24 4.78 1.96 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.19 0.95 0.00 0.00 40 F 9.11 5.25 0.00 3.42 3.22 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 41 L 8.99 4.37 0.00 1.80 1.75 0.91 0.75 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 42 Y 8.82 3.96 0.00 3.02 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.23 4.58 0.00 2.53 2.20 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 44 G 8.56 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 45 I 8.32 5.01 1.94 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 1.48 0.95 1.08 0.00 0.00 46 T 9.43 5.37 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 1.19 0.00 0.00 47 K 9.15 5.00 0.00 1.45 1.73 0.00 1.35 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.27 1.27 7.81 48 L 8.95 5.04 0.00 1.95 1.55 1.02 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.90 5.23 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 1.16 0.00 0.00 50 S 8.93 5.19 0.00 4.14 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 51 I 8.47 5.58 1.92 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 1.04 0.45 0.98 0.00 0.00 52 S 8.57 4.38 0.00 4.02 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 53 E 8.73 3.98 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 54 N 8.37 4.29 0.00 2.76 2.92 0.00 0.00 7.02 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.70 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.11 3.93 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 1.22 0.00 0.00 57 I 8.20 4.93 1.88 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 1.25 0.60 0.92 0.00 0.00 58 M 8.95 4.64 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 59 N 8.61 4.65 0.00 2.67 2.60 0.00 0.00 7.11 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.59 4.14 0.00 1.38 1.51 0.98 0.74 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 61 Q 7.20 4.31 0.00 1.84 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.03 0.00 0.00 0.00 0.00 0.00 1.76 2.16 0.00 62 Y 8.42 4.88 0.00 2.94 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 63 Y 9.16 4.68 0.00 2.87 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 64 K 8.68 4.93 0.00 1.79 1.65 0.00 1.98 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.32 1.64 7.81 65 G 8.35 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 66 A 8.56 4.67 1.54 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 0.00 0.00 67 F 8.91 4.92 0.00 3.41 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.25 5.13 2.22 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 0.48 0.00 0.00 0.85 0.00 0.00 69 I 8.88 4.49 1.84 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.07 0.90 0.00 0.00 70 M 8.70 5.16 0.00 1.76 1.87 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 2.44 2.47 0.00 71 S 8.87 4.38 0.00 3.40 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.48 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 0.00 0.00 0.00 0.00 73 F 8.48 4.38 0.00 3.00 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 74 I 8.75 3.67 1.89 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.70 0.97 0.00 0.00 75 D 7.79 4.60 0.00 2.68 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.80 3.90 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 1.13 0.00 0.00 77 E 8.02 3.90 0.00 2.12 1.94 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 2.21 2.21 0.00 78 T 7.09 4.80 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 1.26 0.00 0.00 79 S 8.40 4.56 0.00 3.62 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 80 V 8.51 3.98 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 0.85 0.00 0.00 81 G 6.32 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 82 Y 7.10 4.12 0.00 2.46 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 83 Y 7.85 5.27 0.00 3.05 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 84 N 9.15 5.26 0.00 2.56 2.58 0.00 0.00 6.77 6.31 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 85 L 7.80 4.64 0.00 0.50 0.60 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 86 E 9.08 5.02 0.00 1.94 1.70 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 2.19 2.19 0.00 87 V 8.61 4.00 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 1.03 0.00 0.00 0.88 0.00 0.00 88 I 8.70 4.27 2.08 0.00 0.00 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 1.36 0.81 0.93 0.00 0.00 89 S 8.14 4.38 0.00 3.91 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.09 4.32 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 91 Q 7.91 5.14 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 92 A 9.00 4.93 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 93 T 9.39 5.12 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 1.20 0.00 0.00 94 A 8.96 5.27 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 9.00 4.89 0.00 3.20 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 96 V 8.56 4.62 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 0.36 0.00 0.00 0.95 0.00 0.00 97 I 8.50 4.70 2.09 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.94 0.95 0.00 0.00 98 K 9.04 4.25 0.00 1.84 1.71 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.58 1.58 7.81 99 I 8.56 3.61 1.84 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 1.29 1.18 0.80 0.00 0.00 100 N 7.95 4.80 0.00 2.82 3.21 0.00 0.00 6.34 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.32 4.40 0.00 2.15 2.00 0.00 0.00 0.00 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 2.28 0.00 102 L 7.62 3.96 0.00 1.79 1.78 0.99 0.47 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 0.00 103 K 8.00 3.66 0.00 1.79 1.75 0.00 1.74 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.47 7.81 104 E 8.01 3.91 0.00 2.03 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 2.38 2.37 0.00 105 L 7.44 4.06 0.00 1.87 1.90 0.88 0.60 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 0.00 106 L 8.16 4.20 0.00 0.96 0.81 0.44 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.80 4.37 0.00 3.87 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 0.00 108 K 7.89 4.41 0.00 1.86 2.15 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.61 1.52 7.81 109 N 7.82 4.84 0.00 2.68 2.31 0.00 0.00 7.23 6.54 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 0.00 110 L 8.60 4.11 0.00 1.80 1.84 0.99 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.10 3.98 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 1.06 0.00 0.00 112 H 7.99 4.42 0.00 3.10 3.49 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 F 8.06 4.19 0.00 3.05 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 0.00 114 F 8.35 4.23 0.00 3.31 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 0.00 115 Y 8.12 4.26 0.00 2.96 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.70 3.07 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 0.81 0.00 0.00 0.58 0.00 0.00 117 F 8.46 4.26 0.00 3.22 3.25 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 0.00 118 Q 8.50 3.81 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 119 T 7.43 3.71 3.25 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 0.48 0.00 0.00 120 L 7.62 3.86 0.00 1.87 1.72 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 121 Q 7.97 3.94 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 1.98 1.75 0.00 122 K 8.40 4.18 0.00 2.21 2.32 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.51 7.81 123 Q 8.57 4.09 0.00 2.46 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 124 V 7.91 3.62 2.22 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 1.02 0.00 0.00 1.00 0.00 0.00 125 S 8.16 4.20 0.00 4.39 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 0.00 126 Y 7.98 2.97 0.00 2.33 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 0.00 127 S 7.94 3.98 0.00 3.90 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 0.00 128 L 7.91 4.03 0.00 1.86 1.76 0.95 0.79 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 0.00 129 A 7.80 3.97 1.25 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 0.00 0.00 130 K 7.73 3.83 0.00 1.37 1.69 0.00 1.30 0.00 0.00 1.25 0.00 0.00 2.23 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.99 1.25 7.81 131 F 8.02 4.28 0.00 3.02 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 0.00 132 N 8.43 4.25 0.00 2.95 2.91 0.00 0.00 7.25 8.83 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 0.00 133 D 8.34 4.37 0.00 2.82 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 0.00 134 F 8.38 3.70 0.00 3.03 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 0.00 135 S 7.52 4.39 0.00 3.68 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 0.00 136 I 7.12 4.04 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.32 0.91 0.00 0.00 137 N 7.68 4.96 0.00 2.76 2.65 0.00 0.00 7.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.01 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 0.00 139 K 8.51 3.93 0.00 1.73 1.81 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.42 7.81 140 L 7.94 3.83 0.00 1.49 1.62 -0.50 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.69 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 7.65 3.31 0.00 3.97 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 0.00 143 I 7.68 3.66 1.79 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 1.63 1.11 0.89 0.00 0.00 144 C 7.77 4.09 0.00 2.99 3.11 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 0.00 145 S 7.81 4.05 0.00 2.89 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 Q 7.74 4.17 0.00 2.31 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 147 L 8.18 3.93 0.00 1.66 1.63 0.83 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.05 3.92 0.00 1.81 1.98 1.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 149 I 8.16 3.97 2.28 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.97 1.24 0.00 0.00 150 L 8.31 4.01 0.00 1.77 1.72 0.86 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 151 T 8.24 4.01 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 152 Y 7.92 3.71 0.00 2.71 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 0.00 0.00 0.00 153 V 7.11 4.07 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.99 0.00 0.00 154 Y 6.89 4.57 0.00 2.91 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 0.00 155 G 8.06 5.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 7.95 4.67 0.00 1.77 1.72 0.00 1.58 0.00 0.00 1.76 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.48 7.81 157 E 8.71 4.36 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 158 T 8.79 4.60 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 159 P 0.00 4.40 0.00 1.97 2.05 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 160 D 7.61 4.57 0.00 1.58 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 G 7.67 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 8.61 4.81 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.78 0.87 0.00 0.00 163 K 8.72 4.74 0.00 1.51 2.05 0.00 1.46 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.27 7.81 164 I 7.83 4.00 1.83 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 1.48 0.41 0.96 0.00 0.00 165 T 8.67 4.01 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 166 L 7.68 3.78 0.00 1.32 1.44 0.09 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 167 D 8.32 4.58 0.00 2.58 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 N 8.64 4.45 0.00 2.77 2.91 0.00 0.00 7.00 7.85 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 0.00 169 L 6.69 3.87 0.00 1.68 1.81 0.89 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 170 T 7.70 4.79 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 1.24 0.00 0.00 171 M 8.67 4.41 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.77 0.00 172 Q 8.04 4.15 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.89 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 173 E 8.20 3.86 0.00 2.17 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 2.68 2.52 0.00 174 L 7.41 4.26 0.00 1.63 1.68 1.03 0.88 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 *184 S 7.83 4.09 0.00 3.90 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 0.00 185 A 8.52 4.40 1.25 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 0.00 0.00 186 V 7.03 3.34 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 0.89 0.00 0.00 0.98 0.00 0.00 187 S 7.61 4.53 0.00 3.89 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 0.00 188 R 7.42 4.23 0.00 2.02 1.86 0.00 3.17 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 189 I 7.52 3.94 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 1.45 0.79 0.89 0.00 0.00 190 I 7.24 4.10 1.84 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.68 0.88 0.00 0.00 191 S 7.48 4.45 0.00 3.82 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 0.00 192 K 7.58 4.66 0.00 1.69 1.70 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.40 7.81 193 L 7.87 3.84 0.00 1.71 1.58 0.89 0.79 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 0.00 194 K 7.83 4.08 0.00 2.00 2.10 0.00 1.68 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.39 7.81 195 Q 7.91 3.98 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.13 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 196 E 8.00 4.28 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 197 K 7.89 3.84 0.00 1.84 1.84 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.47 7.81 198 V 8.47 3.92 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 0.91 0.00 0.00 0.02 0.00 0.00 199 I 7.41 5.21 1.95 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 1.14 0.83 0.87 0.00 0.00 200 V 8.44 4.54 2.29 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 0.93 0.00 0.00 0.96 0.00 0.00 201 Y 8.62 5.06 0.00 3.10 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 0.00 202 K 8.76 4.43 0.00 1.97 1.88 0.00 1.46 0.00 0.00 1.53 0.00 0.00 2.76 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.49 1.55 7.81 203 N 9.39 3.98 0.00 2.82 2.84 0.00 0.00 7.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 S 7.92 3.86 0.00 3.90 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 0.00 205 C 6.65 4.16 0.00 2.85 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 0.00 0.00 0.00 206 F 7.73 4.96 0.00 2.87 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 0.00 207 Y 8.81 4.95 0.00 2.88 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 0.00 208 V 8.76 4.23 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 0.68 0.00 0.00 0.87 0.00 0.00 209 Q 8.94 4.35 0.00 1.90 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.28 0.00 210 N 7.91 4.77 0.00 2.65 2.59 0.00 0.00 6.87 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 L 8.14 3.97 0.00 1.63 1.51 0.54 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 212 D 8.01 4.41 0.00 2.68 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 0.00 213 Y 7.66 4.09 0.00 3.13 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 0.00 214 L 8.16 4.16 0.00 1.92 1.77 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 215 K 8.04 4.07 0.00 1.93 1.90 0.00 1.96 0.00 0.00 1.54 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.60 7.81 216 R 7.34 3.82 0.00 0.92 1.49 0.00 2.92 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 217 Y 7.17 4.63 0.00 2.85 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 0.00 218 A 7.60 4.87 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 0.00 219 P 0.00 4.39 0.00 2.31 2.32 0.00 3.88 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 220 K 8.23 4.01 0.00 2.15 1.94 0.00 1.60 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.65 7.81 221 L 9.02 4.00 0.00 2.01 2.01 1.09 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 222 D 8.72 4.67 0.00 3.08 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 0.00 223 E 9.02 4.10 0.00 2.25 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 224 W 9.18 4.46 0.00 3.38 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 F 8.42 4.29 0.00 3.05 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 Y 8.16 4.33 0.00 2.81 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 0.00 227 L 9.09 3.93 0.00 1.69 1.57 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 228 A 6.75 4.18 0.14 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 0.00 0.00 *230 P 0.00 4.46 0.00 2.17 2.00 0.00 3.66 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.70 0.00 231 A 8.20 4.07 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 0.00 232 T 7.99 4.06 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 233 W 8.66 4.68 0.00 3.52 3.52 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 0.00 234 G 8.47 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 0.00 235 K 7.90 4.16 0.00 1.76 1.72 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.43 7.81 * Residues marked with a * may have inaccurate shift predictions.