NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4610 8.3044 118.1951 55.1647 32.5890 174.1032 1 V 4.2564 7.8472 117.7137 60.6622 34.3504 172.9735 2 L 4.3582 8.3228 127.4997 53.8756 43.6680 176.9618 3 S 4.5199 8.5692 117.8767 57.7252 65.3244 175.1358 4 E 4.3088 8.8683 122.7701 59.5877 29.4695 179.1822 5 G 3.6909 8.1027 105.3130 47.7488 0.0000 175.4590 6 E 3.9444 7.9727 120.9984 58.9688 29.3934 179.2599 7 W 4.4368 8.0884 118.9842 60.1186 29.1241 178.6132 8 Q 4.1319 8.6733 118.3479 58.7979 27.9925 178.6622 9 L 4.0380 7.8838 119.7120 57.9105 41.6888 179.8473 10 V 3.7754 7.8966 118.0269 66.1241 31.5867 177.9404 11 L 4.3505 8.5656 118.3693 57.1116 41.2876 178.9499 12 H 4.2503 8.1707 118.3088 59.2355 30.2049 177.1028 13 V 3.6567 7.7188 120.2438 65.6920 31.3898 177.4645 14 W 3.8467 8.5093 128.0217 60.6738 30.1992 177.7127 15 A 3.9665 8.0703 119.3311 54.9334 17.9916 179.4957 16 K 3.9385 7.7844 117.2426 59.1994 32.1545 179.3235 17 V 2.8496 7.2387 118.0851 66.0452 30.9583 177.6504 18 E 3.8709 7.4644 115.1831 58.2043 29.2704 178.6067 19 A 4.2396 7.5429 120.5719 53.6743 19.7949 177.6043 20 D 4.6389 7.8404 116.8474 52.0039 42.5227 175.5486 21 V 3.4510 8.0204 123.0522 65.3982 32.0931 176.7244 22 A 4.0521 8.0071 120.1508 55.1311 18.2907 179.6620 23 G 3.6800 8.2402 105.4362 47.8462 0.0000 175.6853 24 H 4.2303 8.2771 119.2023 58.2769 28.6800 178.0871 25 G 3.6438 8.3403 107.8197 47.8882 0.0000 175.6932 26 Q 3.9117 7.9406 120.4160 58.7662 28.7320 178.5777 27 D 4.3040 7.9767 119.7546 57.4193 40.7875 179.0394 28 I 3.6372 7.7827 120.0325 64.4417 37.0913 178.5295 29 L 3.4374 7.7367 119.6303 57.6652 41.3506 179.7316 30 I 3.6970 7.8926 120.1269 64.1838 36.9501 178.4697 31 R 3.7824 8.0009 119.6524 59.2153 29.8314 177.9829 32 L 3.8848 7.9620 120.4278 58.5931 41.9207 179.1346 33 F 4.5102 7.9970 117.4687 60.4067 38.5513 178.0258 34 K 4.0339 8.0413 117.6740 59.5703 32.0536 179.3203 35 S 4.2392 8.0087 114.3073 60.4528 64.2000 174.5610 36 H 4.7688 8.2531 118.2839 51.9174 29.1789 171.7395 37 P 4.5446 0.0000 0.0000 64.7766 31.2344 177.6011 38 E 4.0928 8.2960 116.0240 59.6095 29.4028 179.2152 39 T 3.9255 8.2084 110.9517 64.4078 68.6761 176.2523 40 L 3.6089 8.0946 123.4602 58.0135 41.7763 178.6580 41 E 3.9882 7.7507 116.3473 59.3606 29.4422 179.1856 42 K 4.3245 8.1249 117.0121 57.4877 32.9369 178.0925 43 F 4.4482 8.1851 119.7829 55.2272 37.5803 175.4297 44 D 4.1664 8.3779 123.2440 57.1165 41.0089 178.4942 45 R 4.2155 7.6537 112.8818 57.1664 30.3338 176.7161 46 F 5.0841 8.6146 117.3030 57.5767 41.3996 177.4904 47 K 4.0279 8.2576 121.3923 59.7132 32.1523 176.6994 48 H 4.4483 8.2197 111.7623 56.8436 29.0354 175.4286 49 L 4.0942 7.3539 121.6699 55.0131 41.7551 176.8938 50 K 4.2712 9.5944 123.5488 57.4949 33.3076 176.8552 51 T 4.7212 7.2757 107.4530 58.9561 73.2485 174.2253 52 E 3.9149 8.6036 120.2342 59.1826 29.3143 178.4279 53 A 3.9850 7.8435 119.9538 54.9863 18.9384 178.9893 54 E 4.0303 8.0109 116.8685 59.6582 29.6198 179.1739 55 M 3.9271 8.0533 118.7426 58.6881 31.9006 178.9318 56 K 3.8546 7.9453 116.5207 59.0545 32.3023 178.2400 57 A 4.4745 7.4462 117.8149 51.1376 19.6571 176.9067 58 S 4.2480 7.3564 114.0787 57.4573 63.0291 174.6224 59 E 4.0409 8.7739 128.4810 59.1079 29.4757 178.3053 60 D 4.4611 8.0376 118.9396 57.1937 40.9863 178.1927 61 L 2.8428 7.7307 120.9616 57.3630 41.9404 178.9195 62 K 3.8674 7.7696 119.2877 59.3584 32.1710 178.9408 63 K 4.1086 8.3174 119.0179 59.4912 31.9942 179.5465 64 G 3.9760 8.4141 106.1827 47.6637 0.0000 176.0889 65 G 3.5755 8.1287 108.0493 47.5794 0.0000 175.8737 66 V 3.6187 7.7653 121.2014 65.9894 31.5194 177.9439 67 T 3.9029 7.9936 115.3218 66.8069 68.3326 176.4996 68 V 3.6518 7.9155 119.7122 66.2198 31.5286 178.1264 69 L 4.2186 8.2062 118.6932 58.0867 41.5678 179.5091 70 T 3.9604 8.6576 115.8867 66.6007 68.2596 176.5054 71 A 3.9758 8.0505 122.5542 55.0034 18.4373 179.4215 72 L 3.6720 8.0922 119.0236 58.1277 42.2320 179.1239 73 G 3.4618 8.4050 105.8131 47.9843 0.0000 175.3445 74 A 4.0234 7.6639 121.7188 54.7462 18.6517 179.6063 75 I 3.7994 7.2991 118.4819 64.5500 37.1419 178.6533 76 L 4.0319 7.7288 119.8471 57.6046 41.1666 179.5537 77 K 3.9089 7.5756 116.9512 58.4754 32.2504 178.8056 78 K 3.9323 7.7137 118.0574 56.1940 32.7143 176.5787 79 K 2.0000 8.3168 118.4923 56.3383 29.6513 175.7821 80 G 3.9799 7.9420 105.6662 45.7244 0.0000 173.5052 81 H 4.7694 7.6105 118.6237 54.4346 27.4968 174.8036 82 H 5.2832 7.1875 111.1589 54.5787 29.3629 176.5189 83 E 3.9809 8.5235 121.2694 60.2964 28.9740 178.9160 84 A 4.0817 7.9839 118.3152 55.4397 17.8148 179.0610 85 E 4.0808 8.1453 116.4986 59.4530 29.5162 179.1908 86 L 4.2186 8.1916 120.4139 57.6376 42.1050 179.0228 87 K 3.9671 7.7361 117.8215 59.0821 32.0988 177.4876 88 P 4.3162 0.0000 0.0000 65.6140 31.3723 178.1316 89 L 4.0013 7.5291 116.8233 58.0177 41.9873 178.8483 90 A 4.2491 8.4204 121.1236 55.1211 18.2263 179.4911 91 Q 3.8583 8.2795 118.3665 59.4135 29.2173 178.5888 92 S 3.9893 8.2223 115.3728 61.7493 63.0393 176.1383 93 H 4.2101 8.5931 119.6139 58.1666 28.2054 177.6372 94 A 2.5800 7.9939 122.3068 54.1554 18.4824 178.6755 95 T 4.0027 7.5602 108.9148 62.0277 68.3828 175.0998 96 K 4.1311 7.3613 120.0322 58.5622 33.1621 177.0162 97 H 4.2734 8.1232 115.0088 56.4001 29.2829 175.5241 98 K 3.3162 7.4336 117.2512 56.9108 28.4422 174.2107 99 I 4.3254 8.0711 118.7687 58.6016 38.1374 174.7327 100 P 4.5337 0.0000 0.0000 62.2370 32.1844 177.3945 101 I 3.6017 8.4234 120.9238 64.6832 37.0483 178.4572 102 K 3.5923 7.9940 119.7097 59.9797 31.8189 178.1222 103 Y 4.1921 8.0005 116.6150 60.7057 37.8059 178.0747 104 L 4.2130 7.8498 119.8122 57.6595 41.7802 179.0540 105 E 4.0291 8.1899 118.8037 59.2606 29.4449 179.3453 106 F 4.4998 7.7072 117.6565 60.8065 38.9564 177.6410 107 I 3.8546 8.1014 118.0989 63.8311 37.7212 178.1309 108 S 4.1686 8.0725 116.3231 61.6898 62.7612 176.0005 109 E 4.0184 8.4756 121.6971 59.5304 29.2850 178.8393 110 A 4.0694 8.0276 120.4183 54.9551 18.3442 179.6785 111 I 3.6954 8.1722 118.8367 64.7654 37.2507 178.7341 112 I 3.8405 7.9994 120.5909 64.5446 36.9076 178.0288 113 H 4.1379 8.4626 119.1989 59.2368 29.6512 177.6102 114 V 3.5435 7.8894 119.9878 65.9423 31.3460 177.7888 115 L 3.7412 7.9407 119.0578 58.0301 41.0917 178.9283 116 H 4.2784 7.6796 116.7392 59.6231 29.8722 177.1898 117 S 4.1793 7.7419 115.5623 61.4571 62.7856 176.3703 118 R 4.1002 7.9554 119.2844 57.2467 31.5183 176.4590 119 H 4.9987 8.2538 115.6459 53.4940 29.0265 172.4739 120 P 4.2976 0.0000 0.0000 65.7881 31.8509 179.7646 121 G 3.6152 8.1902 106.8656 47.6635 0.0000 173.7406 122 N 5.0121 8.2452 114.6812 52.8130 39.4771 174.8615 123 F 5.0157 7.8648 118.5185 56.4494 39.5150 174.1545 124 G 3.9368 7.6892 109.2213 43.7324 0.0000 172.1245 125 A 3.8858 8.4053 120.6686 55.3134 18.2762 179.5196 126 D 4.1929 7.9934 116.4683 57.6289 41.0146 178.8960 127 A 3.9519 7.7790 120.6051 55.0531 18.3381 179.2906 128 Q 3.1281 7.8454 118.4574 58.5140 28.8748 178.5212 129 G 3.4826 8.1573 107.0634 47.7560 0.0000 175.5407 130 A 3.8395 7.9189 123.6485 54.8665 18.2499 179.4662 131 M 3.9780 8.0855 116.8012 58.5987 32.3874 177.7997 132 N 4.2735 8.4754 117.7178 56.6663 39.0287 176.5683 133 K 3.7918 8.1945 120.7857 59.5370 32.2551 178.4583 134 A 3.7559 8.0886 121.2447 55.1620 18.1516 179.6369 135 L 4.1189 8.3356 117.8089 57.8319 41.7022 179.4197 136 E 3.9552 8.7883 119.0200 59.1205 29.2572 179.0040 137 L 3.9138 8.2889 120.7554 58.1629 42.1992 178.4346 138 F 4.1152 8.3301 120.4873 61.8064 39.1641 177.4861 139 R 3.4609 8.2361 117.4384 58.7609 29.7836 179.0426 140 K 3.8117 8.0435 119.5478 59.6532 32.2698 178.6622 141 D 4.3148 8.2447 119.4421 57.4327 40.6483 178.8851 142 I 3.4536 7.7882 120.4876 64.1184 36.9657 178.3296 143 A 3.6849 8.0206 121.7818 54.9506 18.0315 179.5506 144 A 3.9491 7.9286 119.3399 55.1797 18.4387 180.1192 145 K 3.9743 7.9960 117.0562 59.6506 32.0858 178.8478 146 Y 4.3580 8.3943 117.5781 61.3933 37.9175 178.8127 147 K 3.8983 8.1504 119.9787 59.8997 32.0394 178.6144 148 E 4.0555 7.8856 117.2657 59.1704 29.4536 178.7637 149 L 4.2917 7.8267 117.4550 55.5923 41.8446 177.8759 150 G 4.0131 7.8360 106.8453 45.2467 0.0000 172.4262 151 Y 4.8160 7.8757 119.5132 56.3117 41.6125 177.5255 152 Q 2.5200 8.1740 123.2838 58.9424 27.9926 174.3560 153 G 4.1405 7.8564 110.6085 46.3399 0.0000 174.4890 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 0 M 8.30 4.46 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 1 V 7.85 4.26 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 0.89 0.00 0.00 0.95 0.00 0.00 2 L 8.32 4.36 0.00 1.11 0.64 0.56 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.57 4.52 0.00 4.08 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 8.87 4.31 0.00 2.20 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 2.43 2.52 0.00 5 G 8.10 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 6 E 7.97 3.94 0.00 1.85 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 0.00 2.23 2.26 0.00 7 W 8.09 4.44 0.00 3.61 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 8 Q 8.67 4.13 0.00 2.32 2.21 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 2.46 2.66 0.00 9 L 7.88 4.04 0.00 1.90 1.75 0.89 0.59 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 10 V 7.90 3.78 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.93 0.00 0.00 11 L 8.57 4.35 0.00 1.85 1.82 0.92 1.12 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 12 H 8.17 4.25 0.00 3.28 3.60 0.00 5.95 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 13 V 7.72 3.66 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.30 0.00 0.00 14 W 8.51 3.85 0.00 3.71 3.28 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 15 A 8.07 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.78 3.94 0.00 1.50 1.67 0.00 1.63 0.00 0.00 1.45 0.00 0.00 2.74 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.45 7.81 17 V 7.24 2.85 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 -0.02 0.00 0.00 0.44 0.00 0.00 18 E 7.46 3.87 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.06 0.00 19 A 7.54 4.24 1.29 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 20 D 7.84 4.64 0.00 2.69 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.02 3.45 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 1.07 0.00 0.00 0.85 0.00 0.00 22 A 8.01 4.05 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 23 G 8.24 3.68 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 0.00 24 H 8.28 4.23 0.00 3.10 3.24 0.00 5.83 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 8.34 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 7.94 3.91 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 27 D 7.98 4.30 0.00 2.86 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 28 I 7.78 3.64 1.91 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 1.53 0.72 0.89 0.00 0.00 29 L 7.74 3.44 0.00 1.43 1.10 0.87 0.38 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 30 I 7.89 3.70 1.88 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 1.41 0.64 0.89 0.00 0.00 31 R 8.00 3.78 0.00 1.92 2.05 0.00 3.04 0.00 0.00 2.86 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 32 L 7.96 3.88 0.00 1.69 1.40 1.05 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.00 4.51 0.00 3.10 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 34 K 8.04 4.03 0.00 1.74 1.83 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.76 7.81 35 S 8.01 4.24 0.00 3.66 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 36 H 8.25 4.77 0.00 2.99 2.74 0.00 5.64 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 4.54 0.00 2.15 2.12 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 38 E 8.30 4.09 0.00 2.30 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.53 0.00 39 T 8.21 3.93 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 40 L 8.09 3.61 0.00 1.36 1.78 0.09 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.75 3.99 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 42 K 8.12 4.32 0.00 1.91 1.69 0.00 1.89 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.74 1.89 7.81 43 F 8.19 4.45 0.00 2.95 2.26 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 44 D 8.38 4.17 0.00 2.58 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.65 4.22 0.00 1.93 1.98 0.00 2.95 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.71 0.00 46 F 8.61 5.08 0.00 2.62 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.26 4.03 0.00 1.88 1.90 0.00 1.86 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.50 7.81 48 H 8.22 4.45 0.00 3.34 3.43 0.00 5.59 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 49 L 7.35 4.09 0.00 1.56 1.56 0.80 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.59 4.27 0.00 1.67 1.84 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.52 7.81 51 T 7.28 4.72 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 1.20 0.00 0.00 52 E 8.60 3.91 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 53 A 7.84 3.99 1.29 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 54 E 8.01 4.03 0.00 2.13 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 2.31 2.33 0.00 55 M 8.05 3.93 0.00 2.04 2.39 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.56 0.00 56 K 7.95 3.85 0.00 1.83 1.85 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.43 7.81 57 A 7.45 4.47 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 58 S 7.36 4.25 0.00 3.84 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 59 E 8.77 4.04 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 2.38 2.46 0.00 60 D 8.04 4.46 0.00 2.91 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 61 L 7.73 2.84 0.00 0.96 1.44 0.78 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.77 3.87 0.00 1.83 1.86 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.45 7.81 63 K 8.32 4.11 0.00 2.07 1.92 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.67 7.81 64 G 8.41 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 65 G 8.13 3.58 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 0.00 0.00 0.00 66 V 7.77 3.62 2.24 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 0.86 0.00 0.00 0.97 0.00 0.00 67 T 7.99 3.90 4.55 0.00 0.00 0.00 0.00 0.00 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 68 V 7.92 3.65 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 1.12 0.00 0.00 1.17 0.00 0.00 69 L 8.21 4.22 0.00 1.89 1.84 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.66 3.96 4.33 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 1.26 0.00 0.00 71 A 8.05 3.98 1.41 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 72 L 8.09 3.67 0.00 1.61 1.66 0.27 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.41 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.66 4.02 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 75 I 7.30 3.80 1.82 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 1.53 1.01 0.88 0.00 0.00 76 L 7.73 4.03 0.00 1.24 1.57 -0.05 0.81 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 77 K 7.58 3.91 0.00 1.68 1.80 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.32 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.52 7.81 78 K 7.71 3.93 0.00 1.82 1.89 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.64 1.60 7.81 79 K 8.32 2.00 0.00 1.19 0.74 0.00 1.47 0.00 0.00 1.43 0.00 0.00 2.72 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.30 0.82 7.81 80 G 7.94 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 81 H 7.61 4.77 0.00 3.22 3.22 0.00 5.77 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.19 5.28 0.00 3.33 3.47 0.00 5.67 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 83 E 8.52 3.98 0.00 2.10 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 2.42 2.49 0.00 84 A 7.98 4.08 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 85 E 8.15 4.08 0.00 2.25 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 2.41 2.44 0.00 86 L 8.19 4.22 0.00 2.02 1.68 1.04 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.74 3.97 0.00 2.05 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.61 7.81 88 P 0.00 4.32 0.00 2.29 2.33 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.04 0.00 89 L 7.53 4.00 0.00 1.77 1.94 0.94 0.96 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 90 A 8.42 4.25 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.28 3.86 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 92 S 8.22 3.99 0.00 3.96 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 0.00 93 H 8.59 4.21 0.00 3.61 3.62 0.00 5.80 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 7.99 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.56 4.00 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 1.11 0.00 0.00 96 K 7.36 4.13 0.00 1.55 1.63 0.00 1.60 0.00 0.00 1.62 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.20 1.31 7.81 97 H 8.12 4.27 0.00 2.96 3.10 0.00 5.86 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.43 3.32 0.00 1.79 1.79 0.00 1.38 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.25 1.33 7.81 99 I 8.07 4.33 2.12 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 1.53 0.95 1.16 0.00 0.00 100 P 0.00 4.53 0.00 1.93 1.95 0.00 3.27 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.24 0.00 101 I 8.42 3.60 1.79 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.80 0.80 0.00 0.00 102 K 7.99 3.59 0.00 1.71 1.65 0.00 0.80 0.00 0.00 1.50 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 0.90 7.81 103 Y 8.00 4.19 0.00 3.25 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 0.00 104 L 7.85 4.21 0.00 1.79 1.80 0.73 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.19 4.03 0.00 2.02 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 2.30 2.42 0.00 106 F 7.71 4.50 0.00 3.12 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 0.00 107 I 8.10 3.85 2.00 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 1.59 1.55 1.08 0.00 0.00 108 S 8.07 4.17 0.00 4.24 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 8.48 4.02 0.00 2.15 2.37 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 2.39 2.43 0.00 110 A 8.03 4.07 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 0.00 111 I 8.17 3.70 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.80 1.04 0.00 0.00 112 I 8.00 3.84 2.13 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 1.71 0.89 1.14 0.00 0.00 113 H 8.46 4.14 0.00 3.38 3.49 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.89 3.54 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 1.02 0.00 0.00 1.00 0.00 0.00 115 L 7.94 3.74 0.00 0.43 0.62 0.85 1.00 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 0.00 116 H 7.68 4.28 0.00 3.48 3.66 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 7.74 4.18 0.00 3.81 3.84 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 0.00 118 R 7.96 4.10 0.00 1.48 1.65 0.00 3.11 0.00 0.00 2.99 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 119 H 8.25 5.00 0.00 3.15 3.18 0.00 5.63 0.00 0.00 0.00 0.00 6.79 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 4.30 0.00 2.20 2.26 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 121 G 8.19 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 0.00 0.00 0.00 122 N 8.25 5.01 0.00 2.79 2.92 0.00 0.00 6.71 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 0.00 123 F 7.86 5.02 0.00 2.90 2.99 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 0.00 124 G 7.69 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.41 3.89 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 0.00 126 D 7.99 4.19 0.00 2.65 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 0.00 127 A 7.78 3.95 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 0.00 128 Q 7.85 3.13 0.00 1.03 1.71 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 2.21 2.25 0.00 129 G 8.16 3.48 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 0.00 0.00 0.00 130 A 7.92 3.84 1.29 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 0.00 131 M 8.09 3.98 0.00 2.35 2.32 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.94 0.00 132 N 8.48 4.27 0.00 2.85 2.91 0.00 0.00 6.86 6.32 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 0.00 133 K 8.19 3.79 0.00 1.91 1.74 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.37 7.81 134 A 8.09 3.76 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 0.00 135 L 8.34 4.12 0.00 1.91 1.81 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.79 3.96 0.00 2.09 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 2.28 2.61 0.00 137 L 8.29 3.91 0.00 1.74 1.93 1.07 0.99 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 0.00 138 F 8.33 4.12 0.00 3.13 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 0.00 139 R 8.24 3.46 0.00 1.94 1.82 0.00 3.15 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.92 0.00 140 K 8.04 3.81 0.00 1.84 1.98 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.44 7.81 141 D 8.24 4.31 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 0.00 142 I 7.79 3.45 1.24 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 -0.03 0.11 0.00 0.00 143 A 8.02 3.68 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.93 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 8.00 3.97 0.00 2.05 1.93 0.00 1.59 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.54 7.81 146 Y 8.39 4.36 0.00 3.26 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 0.00 147 K 8.15 3.90 0.00 2.00 2.00 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 148 E 7.89 4.06 0.00 2.12 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 2.36 2.52 0.00 149 L 7.83 4.29 0.00 1.79 1.70 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.84 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 0.00 151 Y 7.88 4.82 0.00 2.50 2.53 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 0.00 152 Q 8.17 2.52 0.00 1.94 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.14 0.00 0.00 0.00 0.00 0.00 1.78 1.16 0.00 153 G 7.86 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 0.00 0.00 0.00