NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0820 8.0549 120.3910 62.6367 32.7208 174.5095 2 L 4.3746 8.1751 126.0280 51.3093 43.3115 175.7169 3 S 4.4814 9.0324 118.2214 57.7974 66.1691 174.8831 4 E 4.2559 8.8299 122.6388 59.5590 29.3571 179.1175 5 G 3.6614 8.1042 105.3046 47.8472 0.0000 175.4285 6 E 3.9711 8.3060 120.9275 58.9267 29.4346 179.4285 7 W 4.2045 8.3213 119.3557 59.8711 29.0332 178.5794 8 Q 4.1659 8.3132 118.1389 58.7383 28.1123 178.7929 9 L 4.0193 7.8603 119.6883 57.8127 41.7372 179.3968 10 V 3.7250 7.7861 118.0473 66.4782 31.5462 178.1830 11 L 4.2709 8.3151 118.3695 57.8848 41.1981 179.0161 12 H 4.2738 8.4481 118.0222 59.3546 30.1287 177.4893 13 V 3.7465 8.0242 114.3009 63.8636 31.3756 178.2367 14 W 3.9596 8.4344 128.1288 60.5148 30.3028 177.8902 15 A 4.2682 7.6635 120.3256 54.4158 17.8792 179.5385 16 K 3.8934 7.7722 117.2723 59.4720 32.0808 179.5326 17 V 2.7250 7.0855 117.9526 65.8683 30.7335 177.7413 18 E 3.8836 7.8658 117.4916 58.6074 29.0232 178.4276 19 A 4.3479 7.3890 119.3239 52.8239 20.2439 177.6229 20 D 4.5967 7.6099 114.4928 52.6105 43.6404 175.8125 21 V 3.5892 7.8508 123.1915 65.3880 32.0894 176.8500 22 A 4.0996 7.9869 120.2719 55.0841 18.2796 179.7224 23 G 3.4942 8.3311 104.3335 48.0752 0.0000 175.8277 24 H 4.1742 8.1908 118.3273 58.5278 28.6916 178.1229 25 G 3.5901 8.1899 107.5658 47.7844 0.0000 175.7510 26 Q 3.9151 8.1192 120.5319 58.7643 28.7157 178.3943 27 D 4.3022 7.9298 119.7358 57.5449 40.8884 179.0742 28 I 3.6061 7.7060 119.8575 64.5303 37.1783 178.5944 29 L 3.4635 7.8199 119.5876 57.5282 41.2952 179.6406 30 I 3.6269 7.8629 120.1804 64.2075 37.0465 178.2306 31 R 3.7555 7.9750 119.7114 59.4415 29.8173 178.2181 32 L 3.8668 7.6795 119.8339 58.2926 42.1735 179.0364 33 F 4.5984 7.6447 117.5803 60.3709 38.5396 177.9157 34 K 4.0644 8.1466 118.1604 59.0754 31.9933 179.0571 35 S 4.3399 7.9497 113.5728 59.9685 64.8641 174.4368 36 H 4.6414 8.1282 118.8760 52.1722 29.2622 171.9968 37 P 4.9652 0.0000 0.0000 64.3204 31.5509 177.6245 38 E 4.1305 8.2463 116.6711 59.2867 29.6680 178.9412 39 T 3.7252 8.1198 110.9818 64.4929 68.7375 176.0868 40 L 4.0312 7.9400 123.2027 57.7014 41.7943 178.1905 41 E 4.3073 8.1755 116.9672 57.9593 29.6369 178.2456 42 K 4.4455 8.2211 117.6781 56.4857 32.3634 176.4676 43 F 4.6027 7.9411 118.9336 55.3970 40.2527 175.9581 44 D 4.3552 8.6425 126.8979 57.3074 40.8726 179.1045 45 R 3.8787 7.7813 117.5807 58.4694 30.3017 176.7074 46 F 5.0408 7.6575 115.3548 56.8973 39.2455 177.4313 47 K 4.0276 7.8206 122.4065 59.7540 32.1798 177.4141 48 H 4.5712 8.2367 112.7594 55.7473 29.1149 174.6359 49 L 4.4578 7.8209 122.0666 53.6685 41.7454 174.6281 50 K 4.3970 9.3501 122.9696 57.6984 35.6712 177.4839 51 T 4.1624 8.7120 108.9690 61.3996 71.2184 175.3207 52 E 3.9003 8.6626 121.9222 59.2679 29.5099 178.7998 53 A 3.9780 7.9342 120.4580 55.1939 18.2398 179.3294 54 E 3.8803 8.5367 116.3036 59.7919 29.9231 179.1173 55 M 4.0835 7.9039 118.6208 58.4917 31.8344 179.1013 56 K 3.9734 8.3019 117.3188 58.7986 32.2740 178.3662 57 A 4.3620 7.4865 118.5653 51.4568 19.4982 177.2522 58 S 4.2763 7.4011 113.9164 57.9488 63.3064 174.8382 59 E 4.1601 8.8164 126.8156 59.0329 29.5084 178.8851 60 D 4.4857 8.1291 118.7254 57.3650 41.0282 178.3758 61 L 3.8937 8.1958 120.9267 57.9013 42.1247 178.9375 62 K 3.9516 7.8946 119.5190 59.4498 32.2605 179.0051 63 K 4.0295 8.2937 118.8563 59.7422 31.9087 178.8170 64 H 4.3783 8.6747 118.7091 59.2517 29.8357 177.3766 65 G 3.6915 8.2720 107.5916 47.8152 0.0000 175.8078 66 V 3.6052 7.7640 120.2089 66.1029 31.6251 178.1139 67 T 3.8928 7.7884 115.2719 66.7154 68.3132 176.6621 68 V 3.6116 8.0396 120.2164 66.2028 31.6005 178.1579 69 L 4.2560 8.1452 118.6493 57.8458 41.4185 179.6443 70 T 3.9420 8.4564 116.0755 66.5593 68.3549 176.4696 71 A 3.9741 7.9767 122.5288 55.2277 18.4231 179.4471 72 L 3.8113 8.1635 119.0191 58.1062 42.1332 179.3217 73 G 3.2569 8.3657 105.5233 47.6803 0.0000 175.5280 74 A 4.0320 7.7347 122.1739 54.7462 18.6471 179.6949 75 I 3.7963 7.4705 118.0736 64.6356 37.3066 178.5725 76 L 3.9969 7.8595 120.1202 57.8025 41.1748 179.7768 77 K 3.9752 7.7080 116.9958 58.6471 32.2601 178.6658 78 K 3.9880 8.0110 117.8454 55.9159 32.7519 176.5289 79 K 2.0000 8.3197 118.6456 56.3350 29.8010 175.4132 80 G 3.8629 7.8358 105.8909 45.6120 0.0000 173.7126 81 H 4.6038 7.2559 119.0493 55.0715 27.3969 174.6558 82 H 4.9480 7.3066 112.0450 54.8617 29.8502 176.1603 83 E 3.9579 8.5896 120.9090 60.2751 28.7257 178.7244 84 A 3.9737 7.8867 119.8737 54.9907 18.6636 179.0936 85 E 4.0928 8.0719 115.0429 59.1166 29.9379 178.6888 86 L 4.1858 8.5208 120.9402 57.3032 42.2089 178.3640 87 K 3.8286 8.1658 119.9761 59.4477 32.0541 176.8432 88 P 4.2936 0.0000 0.0000 65.3070 31.2904 178.4194 89 L 4.0171 7.9244 118.5614 58.0605 42.1596 178.5106 90 A 4.0977 8.1229 120.6430 55.5015 18.3193 179.5374 91 Q 3.9520 8.2143 116.3765 59.0652 28.7437 179.4592 92 S 4.0006 8.1376 115.1955 61.9164 63.0857 176.3497 93 H 4.0468 8.5389 119.6030 58.3337 28.1933 177.1110 94 A 2.6240 7.7207 123.2695 54.4645 17.9821 179.7692 95 T 3.5711 7.7389 113.6507 66.3294 68.8579 176.5135 96 K 4.0041 7.7275 118.6957 59.0255 32.4616 178.0164 97 H 4.3937 7.6485 113.0465 55.3238 29.9619 175.1390 98 K 3.3206 6.9982 117.8053 57.1401 29.2776 174.7956 99 I 4.3028 7.5088 118.0052 58.6798 39.1987 175.0228 100 P 4.6762 0.0000 0.0000 62.0641 32.2206 177.3287 101 I 3.5636 8.6583 121.7277 64.7393 37.5831 178.1119 102 K 3.5468 8.2387 120.2402 60.1269 31.7032 177.9480 103 Y 4.2441 8.0529 116.4358 61.1007 37.7330 178.7340 104 L 4.2093 8.1255 120.1637 57.6508 41.6879 179.3404 105 E 4.0265 7.8488 118.2210 59.2749 29.5006 179.0033 106 F 4.5234 7.7056 117.7415 60.9557 38.9770 177.6777 107 I 3.8990 8.1114 117.7909 63.6871 37.7368 178.1602 108 S 4.1678 8.0611 116.0304 61.6564 62.7300 176.2690 109 E 4.0413 8.3235 121.0241 59.3904 29.1640 179.2127 110 A 4.0219 8.0832 120.6987 55.3989 18.4674 179.7886 111 I 3.6548 8.0384 118.3259 64.5108 37.1524 178.7202 112 I 3.7585 7.9422 120.6723 64.5689 36.9862 177.9024 113 H 4.0235 8.3507 118.9522 59.3552 29.7369 177.4370 114 V 3.5621 7.9670 120.0743 65.9662 31.3306 177.9106 115 L 3.7095 7.6744 118.6762 57.8046 41.0511 179.0101 116 H 4.2395 7.6269 117.0605 59.3555 29.9327 177.2351 117 S 4.1810 7.6734 115.5364 61.8003 62.7775 176.6735 118 R 3.9673 7.7511 119.2659 58.1278 30.9374 176.8554 119 H 5.0390 8.5808 115.1851 54.0142 29.4603 173.1632 120 P 4.2609 0.0000 0.0000 65.8480 31.6316 179.2459 121 G 3.7166 8.1306 106.4702 47.4794 0.0000 173.6146 122 D 4.7443 7.6043 118.6045 54.8561 42.6312 177.4594 123 F 4.8660 8.2349 122.0148 58.3668 37.0017 175.1653 124 G 3.9587 7.6659 108.3641 43.8511 0.0000 170.9170 125 A 3.8769 8.3698 120.7322 55.2520 18.4727 179.7316 126 D 4.1480 7.9377 116.5948 57.5448 40.9405 178.7476 127 A 3.8672 7.7152 120.5315 55.2945 18.3465 179.4991 128 Q 3.4454 7.9786 116.9105 58.6017 28.6280 179.3335 129 G 3.4720 7.9130 106.5765 47.8225 0.0000 175.7129 130 A 3.8334 7.7960 123.7931 54.7177 18.2463 179.4646 131 M 3.9594 8.2667 117.0460 58.6740 32.3593 177.8137 132 N 4.2921 8.3449 117.4029 56.8640 39.1499 176.9686 133 K 3.9146 8.1672 119.5402 59.2734 32.0720 179.2373 134 A 3.8797 7.8868 121.1361 55.1925 18.2795 179.7604 135 L 4.1080 8.2764 118.0342 57.7068 41.6871 179.5271 136 E 4.0339 8.4716 117.9532 59.0995 29.4900 178.9276 137 L 3.9340 7.9508 121.2634 57.8864 42.1577 178.3979 138 F 4.0716 8.2800 120.5928 61.6409 39.1624 177.4108 139 R 3.4754 8.1553 117.2172 58.9664 29.8804 178.8076 140 K 3.7308 7.9153 119.3860 59.8508 32.2462 178.5262 141 D 4.3353 8.2726 119.1588 57.1453 40.6489 178.8768 142 I 3.4345 7.5031 120.2447 64.2287 37.0893 178.2263 143 A 3.6511 8.3193 122.0915 54.9476 17.9764 179.4155 144 A 3.9263 8.0376 119.1903 55.4404 18.3691 180.0920 145 K 4.0039 7.9719 116.6043 59.6625 32.0109 179.0901 146 Y 4.3325 8.3527 117.2240 61.1792 37.7957 178.7253 147 K 3.9050 8.1038 119.2231 59.8372 32.0295 178.9390 148 E 3.9437 7.8474 117.6719 58.9483 29.6120 178.1276 149 L 4.3379 7.6678 117.1153 54.9912 42.0688 177.8872 150 G 3.8217 8.1079 106.9768 45.2365 0.0000 172.7278 151 Y 4.3105 8.0071 121.6726 56.6424 39.9617 174.3225 152 Q 4.1104 7.6852 131.8597 54.7315 27.1245 176.5101 153 G 3.7551 8.9792 116.9604 46.5723 0.0000 173.5693 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 1 V 8.05 4.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.94 0.00 0.00 2 L 8.18 4.37 0.00 0.94 0.93 0.05 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.03 4.48 0.00 4.04 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 4 E 8.83 4.26 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 5 G 8.10 3.66 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 0.00 0.00 0.00 6 E 8.31 3.97 0.00 2.05 1.76 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 2.23 2.27 0.00 7 W 8.32 4.20 0.00 3.61 3.26 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 8 Q 8.31 4.17 0.00 2.39 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.75 0.00 9 L 7.86 4.02 0.00 1.95 1.73 0.96 1.04 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 10 V 7.79 3.73 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.91 0.00 0.00 11 L 8.32 4.27 0.00 1.96 1.83 0.99 1.13 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 12 H 8.45 4.27 0.00 3.24 3.61 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.02 3.75 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 1.09 0.00 0.00 1.28 0.00 0.00 14 W 8.43 3.96 0.00 3.66 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 15 A 7.66 4.27 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 16 K 7.77 3.89 0.00 1.87 1.37 0.00 1.40 0.00 0.00 1.47 0.00 0.00 3.25 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.12 1.29 7.81 17 V 7.09 2.72 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 0.02 0.00 0.00 0.31 0.00 0.00 18 E 7.87 3.88 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.19 0.00 19 A 7.39 4.35 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.61 4.60 0.00 2.71 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 21 V 7.85 3.59 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 0.97 0.00 0.00 0.89 0.00 0.00 22 A 7.99 4.10 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 23 G 8.33 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.19 4.17 0.00 3.34 3.21 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.19 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 3.92 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.63 0.00 27 D 7.93 4.30 0.00 2.78 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.71 3.61 2.03 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 1.49 0.71 0.87 0.00 0.00 29 L 7.82 3.46 0.00 1.46 1.20 0.98 0.61 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 30 I 7.86 3.63 1.85 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 1.36 0.60 0.87 0.00 0.00 31 R 7.98 3.76 0.00 1.89 2.06 0.00 3.01 0.00 0.00 2.89 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 32 L 7.68 3.87 0.00 1.66 1.31 0.99 0.74 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 33 F 7.64 4.60 0.00 3.01 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 34 K 8.15 4.06 0.00 1.66 1.82 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.65 7.81 35 S 7.95 4.34 0.00 3.83 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 8.13 4.64 0.00 3.09 3.07 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.97 0.00 2.17 2.11 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 38 E 8.25 4.13 0.00 2.29 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 2.62 2.57 0.00 39 T 8.12 3.73 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 0.85 0.00 0.00 40 L 7.94 4.03 0.00 1.53 1.86 -0.18 0.72 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 41 E 8.18 4.31 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 42 K 8.22 4.45 0.00 1.98 1.69 0.00 1.70 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 2.10 2.09 7.81 43 F 7.94 4.60 0.00 3.07 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 44 D 8.64 4.36 0.00 2.73 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 45 R 7.78 3.88 0.00 1.54 1.28 0.00 3.68 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 46 F 7.66 5.04 0.00 2.90 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 7.82 4.03 0.00 1.84 2.00 0.00 1.62 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.77 1.46 7.81 48 H 8.24 4.57 0.00 3.29 3.44 0.00 5.53 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.82 4.46 0.00 1.72 1.44 0.78 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.35 4.40 0.00 1.74 1.66 0.00 1.69 0.00 0.00 1.86 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.46 7.81 51 T 8.71 4.16 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 1.31 0.00 0.00 52 E 8.66 3.90 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 2.34 2.35 0.00 53 A 7.93 3.98 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 54 E 8.54 3.88 0.00 2.13 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 2.34 2.33 0.00 55 M 7.90 4.08 0.00 2.00 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.43 0.00 56 K 8.30 3.97 0.00 1.79 1.85 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.56 7.81 57 A 7.49 4.36 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.40 4.28 0.00 3.96 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 59 E 8.82 4.16 0.00 2.05 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 2.40 2.35 0.00 60 D 8.13 4.49 0.00 2.93 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 61 L 8.20 3.89 0.00 1.31 1.51 0.62 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.89 3.95 0.00 1.81 2.01 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.48 7.81 63 K 8.29 4.03 0.00 2.11 1.92 0.00 1.79 0.00 0.00 1.62 0.00 0.00 3.23 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.82 7.81 64 H 8.67 4.38 0.00 3.59 3.73 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.27 3.69 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 0.00 0.00 0.00 66 V 7.76 3.61 2.27 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 1.12 0.00 0.00 0.98 0.00 0.00 67 T 7.79 3.89 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 1.27 0.00 0.00 68 V 8.04 3.61 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 1.11 0.00 0.00 0.94 0.00 0.00 69 L 8.15 4.26 0.00 1.80 1.82 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.46 3.94 4.50 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 1.26 0.00 0.00 71 A 7.98 3.97 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 72 L 8.16 3.81 0.00 1.63 1.66 0.03 0.70 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 73 G 8.37 3.26 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 74 A 7.73 4.03 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 75 I 7.47 3.80 1.91 0.00 0.00 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 1.56 0.79 0.93 0.00 0.00 76 L 7.86 4.00 0.00 1.08 1.53 -0.12 0.76 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 77 K 7.71 3.98 0.00 1.77 1.83 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.49 1.42 7.81 78 K 8.01 3.99 0.00 1.90 1.87 0.00 1.97 0.00 0.00 1.67 0.00 0.00 3.12 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.41 1.55 7.81 79 K 8.32 2.00 0.00 1.15 0.74 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.68 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.30 0.56 7.81 80 G 7.84 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 81 H 7.26 4.60 0.00 3.22 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.31 4.95 0.00 3.25 3.43 0.00 5.50 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.59 3.96 0.00 2.19 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 0.00 2.38 2.35 0.00 84 A 7.89 3.97 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 85 E 8.07 4.09 0.00 2.10 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 2.32 2.43 0.00 86 L 8.52 4.19 0.00 1.69 1.74 0.74 0.45 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 87 K 8.17 3.83 0.00 1.96 1.83 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.53 7.81 88 P 0.00 4.29 0.00 2.23 2.10 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 89 L 7.92 4.02 0.00 1.83 1.93 0.94 1.18 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 90 A 8.12 4.10 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 91 Q 8.21 3.95 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 92 S 8.14 4.00 0.00 3.99 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.54 4.05 0.00 3.54 3.60 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.72 2.62 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.74 3.57 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 96 K 7.73 4.00 0.00 1.28 1.63 0.00 1.53 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.19 7.81 97 H 7.65 4.39 0.00 2.97 3.15 0.00 5.85 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.00 3.32 0.00 1.72 1.82 0.00 1.54 0.00 0.00 1.53 0.00 0.00 3.05 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.34 7.81 99 I 7.51 4.30 2.06 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 1.34 0.98 1.14 0.00 0.00 100 P 0.00 4.68 0.00 1.94 1.75 0.00 2.67 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.93 0.00 101 I 8.66 3.56 1.81 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.75 0.78 0.00 0.00 102 K 8.24 3.55 0.00 1.74 1.69 0.00 1.26 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 0.98 7.81 103 Y 8.05 4.24 0.00 3.28 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 0.00 104 L 8.13 4.21 0.00 1.95 1.75 1.07 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.85 4.03 0.00 1.95 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 2.36 2.45 0.00 106 F 7.71 4.52 0.00 3.19 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 0.00 107 I 8.11 3.90 2.02 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 1.13 0.00 0.00 108 S 8.06 4.17 0.00 4.20 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 0.00 109 E 8.32 4.04 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.69 0.00 110 A 8.08 4.02 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 0.00 111 I 8.04 3.65 2.09 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 1.58 0.99 0.99 0.00 0.00 112 I 7.94 3.76 2.11 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 1.72 0.69 1.16 0.00 0.00 113 H 8.35 4.02 0.00 3.33 3.47 0.00 5.79 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 0.00 114 V 7.97 3.56 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 0.89 0.00 0.00 1.02 0.00 0.00 115 L 7.67 3.71 0.00 0.77 0.29 0.79 0.59 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 0.00 116 H 7.63 4.24 0.00 3.47 3.50 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.67 4.18 0.00 3.80 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 0.00 118 R 7.75 3.97 0.00 1.60 1.59 0.00 3.11 0.00 0.00 2.96 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 119 H 8.58 5.04 0.00 3.19 3.22 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.26 0.00 2.18 2.24 0.00 3.66 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 121 G 8.13 3.72 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 0.00 0.00 0.00 122 D 7.60 4.74 0.00 3.05 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 F 8.23 4.87 0.00 3.11 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 0.00 124 G 7.67 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 0.00 0.00 0.00 125 A 8.37 3.88 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 0.00 126 D 7.94 4.15 0.00 2.63 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 0.00 127 A 7.72 3.87 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 0.00 128 Q 7.98 3.45 0.00 1.82 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.30 1.89 0.00 129 G 7.91 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 0.00 130 A 7.80 3.83 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 0.00 131 M 8.27 3.96 0.00 2.41 2.35 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.87 0.00 132 N 8.34 4.29 0.00 2.92 2.89 0.00 0.00 7.26 7.05 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 0.00 133 K 8.17 3.91 0.00 1.78 1.69 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.53 7.81 134 A 7.89 3.88 1.18 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 0.00 0.00 135 L 8.28 4.11 0.00 1.75 1.82 0.97 0.94 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 0.00 136 E 8.47 4.03 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.40 0.00 137 L 7.95 3.93 0.00 1.88 2.02 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.28 4.07 0.00 3.19 3.34 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 0.00 139 R 8.16 3.48 0.00 2.01 1.85 0.00 3.16 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.94 0.00 140 K 7.92 3.73 0.00 1.97 2.01 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.47 7.81 141 D 8.27 4.34 0.00 2.87 2.68 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 0.00 142 I 7.50 3.43 1.47 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.13 0.27 0.00 0.00 143 A 8.32 3.65 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 0.00 144 A 8.04 3.93 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 0.00 145 K 7.97 4.00 0.00 2.02 1.94 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.64 7.81 146 Y 8.35 4.33 0.00 3.18 3.36 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 0.00 147 K 8.10 3.91 0.00 2.15 1.90 0.00 1.60 0.00 0.00 1.95 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.52 7.81 148 E 7.85 3.94 0.00 1.93 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 149 L 7.67 4.34 0.00 1.80 1.71 0.88 1.42 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 0.00 150 G 8.11 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 0.00 151 Y 8.01 4.31 0.00 2.78 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 0.00 152 Q 7.69 4.11 0.00 1.75 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.93 0.00 0.00 0.00 0.00 0.00 2.36 2.17 0.00 153 G 8.98 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 0.00 0.00 0.00