NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9719 8.0544 120.3840 63.1721 33.0937 174.8351 2 H 4.4946 8.5426 115.5433 55.5523 27.7775 174.2955 3 L 4.4951 7.1667 120.9343 54.0517 44.2707 177.7486 4 T 4.2118 8.3536 113.2038 60.7537 70.9966 174.2013 5 P 4.2360 0.0000 0.0000 65.5354 31.2825 178.8717 6 E 3.9880 8.0855 116.2124 59.3802 29.6501 178.9269 7 E 3.9105 8.0457 119.0796 59.0248 29.6297 179.3685 8 K 3.8954 8.1721 118.8292 59.5322 32.1269 179.5581 9 S 4.1449 8.1287 114.2782 61.3363 62.9588 176.4353 10 A 4.0088 8.0509 124.4893 54.7182 18.1194 179.7538 11 V 3.5462 7.8323 116.7541 66.5048 31.6224 178.3666 12 T 3.9587 7.8156 114.8754 66.5623 68.0810 176.3704 13 A 4.0060 7.7999 121.3219 55.1758 18.7768 179.1132 14 L 3.8947 7.8641 118.2611 58.1406 42.2369 179.0379 15 W 4.3757 8.7370 128.3862 60.2989 30.3977 178.0018 16 G 3.8265 8.1889 104.9543 46.9417 0.0000 174.6664 17 K 4.4623 7.8097 118.2197 55.3531 32.8705 176.4312 18 V 3.6579 6.9627 120.5366 61.6978 32.1330 175.6926 19 N 4.4461 8.2816 125.5716 52.6833 38.9299 175.4566 20 V 3.4421 8.0372 128.4211 65.8942 31.7213 177.1410 21 D 4.3821 8.1104 118.1501 57.5363 40.7002 178.7088 22 E 3.8710 8.3114 118.7741 59.5231 29.4892 179.6607 23 V 3.6285 7.9617 118.5463 65.5999 31.4556 178.3239 24 G 3.6755 8.2776 105.8991 47.7286 0.0000 175.9391 25 G 3.5994 7.8393 108.4089 47.2922 0.0000 175.3395 26 E 3.8790 8.1662 121.5830 58.9574 29.6929 178.8704 27 A 3.9327 8.1322 120.9021 55.0356 18.5082 179.3929 28 L 4.0000 7.9909 119.0970 58.1230 42.3008 179.3549 29 G 3.5845 8.0759 105.6661 48.0296 0.0000 175.8889 30 R 3.9079 8.1047 120.8512 58.4931 30.0021 178.7680 31 L 4.0128 7.9598 120.2625 58.4597 41.9887 179.2669 32 L 4.0472 7.7658 117.8016 57.0487 41.2176 179.6631 33 V 3.5693 7.1873 117.4994 65.7241 31.7362 177.9122 34 V 3.5321 7.6876 116.9305 64.2917 32.8935 175.6525 35 Y 3.8025 7.2036 116.2927 54.4753 37.6735 174.3112 36 P 4.6817 0.0000 0.0000 64.2769 31.8182 178.4231 37 W 4.3728 8.1563 116.7871 59.5417 28.0668 177.7969 38 T 4.1808 7.6389 110.3417 64.0586 68.1837 176.1018 39 Q 4.3773 8.1934 121.5934 58.2891 28.4162 178.3230 40 R 3.7915 7.5794 116.8157 58.8983 29.2095 177.8938 41 F 4.3187 6.9639 114.6776 57.4516 39.4848 175.6497 42 F 4.5776 7.8170 118.4013 56.8309 39.7826 177.2473 43 E 4.0552 8.3482 122.9141 59.4592 29.4544 179.0564 44 S 4.3687 8.0506 110.6235 59.4958 63.3284 174.5014 45 F 4.6885 8.4553 119.6109 57.9319 39.9809 177.2670 46 G 3.9713 7.5651 107.4508 44.9726 0.0000 174.4226 47 D 4.5007 8.6447 125.3109 54.4071 41.2146 175.9431 48 L 4.8981 8.3487 127.9139 54.6002 42.8635 177.8093 49 S 4.4244 8.3375 115.2119 59.9350 63.8300 174.2920 50 T 4.7328 7.4035 110.6616 58.2697 73.0517 172.5278 51 P 4.1918 0.0000 0.0000 66.2467 31.3490 178.7585 52 D 4.3268 8.0771 116.6232 57.1590 40.5463 178.4913 53 A 4.0110 7.8205 120.7893 54.8964 18.6592 179.7202 54 V 3.6857 7.8250 116.7822 66.5400 31.5267 178.3361 55 M 4.0211 8.0808 117.1328 57.9653 31.8619 177.5770 56 G 3.8347 7.8126 104.7950 45.2328 0.0000 173.6283 57 N 4.3048 7.8347 119.8145 53.0161 39.7432 173.4813 58 P 4.2254 0.0000 0.0000 66.0458 31.3168 178.5827 59 K 3.6938 7.9330 117.6677 58.6491 31.9527 179.3280 60 V 3.6477 8.0417 118.6685 65.9539 31.3710 178.1798 61 K 3.8986 8.0622 117.9149 59.4456 32.0119 179.1551 62 A 3.9731 7.9300 120.9220 55.5001 18.3043 179.2140 63 H 4.3646 8.3980 116.9171 59.3079 29.9597 177.6534 64 G 3.7002 8.3451 107.6698 47.6579 0.0000 175.7799 65 K 4.0311 7.8878 121.0723 59.2720 32.1870 179.5456 66 K 4.1067 7.7245 118.2661 59.6611 32.6412 179.5450 67 V 3.6053 7.7556 119.4853 65.9559 31.4973 177.8706 68 L 4.3590 8.2001 119.9520 57.5831 41.8836 178.9675 69 G 3.7397 8.3743 106.0087 47.8448 0.0000 175.5741 70 A 4.1124 8.1637 123.2394 54.6502 18.1778 179.3389 71 F 4.1727 8.2003 118.3187 61.6605 39.9028 176.9461 72 S 4.2210 8.7986 112.8942 61.6811 62.1558 175.7424 73 D 4.5090 8.2978 121.6684 57.4531 40.5846 179.0660 74 G 3.5409 7.9411 105.1845 46.9887 0.0000 175.3837 75 L 3.8872 7.2247 119.4932 56.5315 41.6047 178.0421 76 A 4.2844 7.2561 119.4322 52.4587 19.3048 176.6472 77 H 4.9388 7.9878 115.4800 55.0737 29.9252 175.7167 78 L 3.9276 8.0496 120.3130 57.5156 41.7766 178.3072 79 D 4.5969 7.9088 115.9905 54.9420 41.9639 175.6857 80 N 5.0325 8.1129 118.1872 51.6546 39.2622 175.3137 81 L 4.1185 7.8153 121.6418 57.8000 42.0543 179.3821 82 K 4.0676 8.0379 117.4187 59.4568 32.2230 179.1404 83 G 3.6871 8.0390 105.8795 48.0163 0.0000 175.7040 84 T 3.6623 7.5410 117.2505 65.9469 68.6639 175.7115 85 F 4.6724 7.8714 116.7792 57.0828 39.1762 177.4939 86 A 4.0550 7.7345 123.3734 55.6951 18.2238 180.5453 87 T 3.8801 7.8455 107.6835 64.9886 68.8782 176.5422 88 L 4.1284 7.9465 121.3717 57.3111 41.6806 179.2006 89 S 4.3022 8.4226 113.4179 61.5436 62.3346 175.9013 90 E 3.8724 8.1682 121.2346 59.3682 29.2351 179.2079 91 L 3.9003 7.9417 120.0708 58.6813 42.2481 178.8688 92 H 4.2388 8.4918 116.0484 58.7247 28.2798 177.3374 93 C 3.5904 7.6978 120.7694 62.3893 31.1886 175.3550 94 D 4.3441 8.1247 119.8344 56.1277 40.5665 177.4202 95 K 4.2998 7.7724 117.1139 57.4802 33.6501 177.3881 96 L 4.1916 7.7177 115.9918 54.7262 42.6418 175.9657 97 H 4.0087 7.0424 114.8265 56.6734 26.5202 175.6707 98 V 3.8320 7.7641 118.1959 60.7436 32.2903 174.7520 99 D 4.3250 8.8455 127.1717 54.2277 41.4704 175.4624 100 P 3.5627 0.0000 0.0000 64.3769 31.8059 177.8712 101 E 3.8926 8.2072 119.3134 59.2776 29.2930 178.3208 102 N 4.2471 7.8266 116.5849 56.3370 38.4802 177.2738 103 F 4.4739 7.4182 119.1312 60.4497 39.0120 178.0529 104 R 3.9515 7.9211 117.3978 59.1683 30.0039 178.7943 105 L 3.8255 7.7888 118.8076 57.7173 41.5074 179.3462 106 L 4.0918 8.1587 120.3744 58.0492 41.9790 179.1504 107 G 3.6822 8.1454 105.7241 48.0508 0.0000 175.4524 108 N 4.4657 8.1358 118.4538 55.8897 38.5244 177.7292 109 V 3.6208 7.9068 119.8243 65.8806 31.6014 177.7571 110 L 3.8750 8.1830 120.3225 58.1326 41.8739 179.0422 111 V 3.5905 7.8249 118.1146 66.3449 31.4722 177.7646 112 C 4.0931 8.0160 116.2280 62.8301 27.9592 176.3364 113 V 3.5435 7.9166 119.8833 65.8356 31.0204 178.1424 114 L 3.8609 7.8678 118.6146 57.4829 41.4019 179.1981 115 A 3.7218 7.0953 120.6421 55.3863 18.0956 179.1310 116 H 4.1157 7.9222 115.3105 59.6008 29.9740 176.7355 117 H 3.9676 7.9286 118.7898 59.0537 29.7640 176.7086 118 F 4.5565 8.4176 118.4282 57.0296 39.6090 177.1636 119 G 4.0011 8.7923 108.0539 46.0965 0.0000 177.4637 120 K 4.0594 8.8782 122.3658 59.2544 32.5562 177.9674 121 E 4.0390 7.8604 119.9471 58.8663 29.9919 177.2128 122 F 4.5404 8.1580 122.8541 57.0583 37.7844 175.1769 123 T 4.1641 7.3443 115.4788 60.4035 71.3042 173.4602 124 P 4.1502 0.0000 0.0000 65.5792 31.2657 177.2629 125 P 4.2441 0.0000 0.0000 65.3129 31.2414 178.8838 126 V 3.5361 7.4162 117.4732 65.7417 31.3072 177.7526 127 Q 3.5248 7.7274 119.2776 59.1221 28.9963 178.2191 128 A 3.9750 7.9182 121.4279 55.1127 18.4573 179.5043 129 A 3.8923 7.8318 118.8218 55.6575 18.4948 179.5833 130 Y 3.9589 8.1636 115.1588 61.1042 37.9309 178.8485 131 Q 4.1236 8.6535 119.6999 58.7464 28.7978 178.6183 132 K 3.9157 7.9597 119.1914 59.4498 32.1271 179.4729 133 V 3.4544 7.5699 117.7375 66.2600 31.5332 178.6135 134 V 3.8533 8.1607 111.9521 64.2211 31.3319 178.4978 135 A 4.1327 8.1483 120.8033 55.1070 18.2518 179.9496 136 G 3.5002 8.0779 104.3088 47.7915 0.0000 176.2172 137 V 3.2774 7.8729 120.3873 65.5498 31.6358 177.9811 138 A 3.8805 7.9472 120.5450 55.1796 18.0072 179.1046 139 N 4.2398 8.0936 114.2571 56.7027 39.4177 176.6659 140 A 4.1419 8.0147 122.1552 55.2537 18.3110 179.6984 141 L 3.8501 7.7117 116.1495 57.3779 41.6602 178.9706 142 A 4.1751 7.9782 119.7031 54.0194 18.3581 178.8625 143 H 4.2824 8.0299 116.3401 58.5297 29.9856 175.8530 144 K 4.4450 7.9482 117.7628 56.2182 32.2275 176.4513 145 Y 4.1685 7.8477 117.9543 58.6425 38.3841 175.9310 146 H 4.4092 8.3936 117.4388 56.2973 28.0751 173.4652 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 3.97 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 0.94 0.00 0.00 0.93 0.00 0.00 2 H 8.54 4.49 0.00 3.18 3.19 0.00 5.79 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.17 4.50 0.00 1.60 1.51 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.35 4.21 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 1.21 0.00 0.00 5 P 0.00 4.24 0.00 2.16 2.12 0.00 3.57 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 6 E 8.09 3.99 0.00 2.14 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 0.00 2.33 2.32 0.00 7 E 8.05 3.91 0.00 2.25 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 2.29 2.31 0.00 8 K 8.17 3.90 0.00 1.90 1.82 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.39 7.81 9 S 8.13 4.14 0.00 4.06 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.05 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.83 3.55 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 0.66 0.00 0.00 0.44 0.00 0.00 12 T 7.82 3.96 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 13 A 7.80 4.01 1.40 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 0.00 0.00 0.00 14 L 7.86 3.89 0.00 1.94 1.91 0.16 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.74 4.38 0.00 3.82 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 16 G 8.19 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.81 4.46 0.00 2.11 2.10 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.49 7.81 18 V 6.96 3.66 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.79 0.00 0.00 19 N 8.28 4.45 0.00 2.69 2.58 0.00 0.00 6.85 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.04 3.44 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.97 0.00 0.00 21 D 8.11 4.38 0.00 2.86 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 22 E 8.31 3.87 0.00 2.05 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 2.27 2.36 0.00 23 V 7.96 3.63 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 0.98 0.00 0.00 0.70 0.00 0.00 24 G 8.28 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 25 G 7.84 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.17 3.88 0.00 2.05 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 2.24 2.32 0.00 27 A 8.13 3.93 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 28 L 7.99 4.00 0.00 1.79 1.65 0.94 1.14 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 29 G 8.08 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 30 R 8.10 3.91 0.00 1.90 1.94 0.00 3.09 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 31 L 7.96 4.01 0.00 1.89 1.89 0.98 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.77 4.05 0.00 1.87 1.67 0.95 0.82 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 33 V 7.19 3.57 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 0.72 0.00 0.00 0.92 0.00 0.00 34 V 7.69 3.53 1.65 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 -0.12 0.00 0.00 0.78 0.00 0.00 35 Y 7.20 3.80 0.00 2.56 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 36 P 0.00 4.68 0.00 2.30 2.28 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.91 0.00 37 W 8.16 4.37 0.00 3.53 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 38 T 7.64 4.18 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 1.04 0.00 0.00 39 Q 8.19 4.38 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 40 R 7.58 3.79 0.00 1.65 1.95 0.00 2.98 0.00 0.00 2.63 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.50 0.00 41 F 6.96 4.32 0.00 1.87 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.82 4.58 0.00 2.85 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 43 E 8.35 4.06 0.00 1.99 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 2.34 2.21 0.00 44 S 8.05 4.37 0.00 4.12 4.08 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 0.00 0.00 0.00 45 F 8.46 4.69 0.00 3.18 3.14 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 46 G 7.57 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 0.00 0.00 0.00 47 D 8.64 4.50 0.00 2.65 2.63 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 48 L 8.35 4.90 0.00 1.66 1.62 1.06 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.34 4.42 0.00 4.01 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.40 4.73 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.12 0.00 3.58 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 2.09 2.16 0.00 52 D 8.08 4.33 0.00 2.67 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 53 A 7.82 4.01 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 54 V 7.82 3.69 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.94 0.00 0.00 55 M 8.08 4.02 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.78 0.00 56 G 7.81 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.83 4.30 0.00 3.05 2.84 0.00 0.00 6.90 7.96 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 58 P 0.00 4.23 0.00 2.23 2.25 0.00 3.71 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 59 K 7.93 3.69 0.00 1.46 0.74 0.00 1.55 0.00 0.00 1.47 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.23 1.29 7.81 60 V 8.04 3.65 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.06 0.00 0.00 61 K 8.06 3.90 0.00 1.95 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.52 7.81 62 A 7.93 3.97 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 63 H 8.40 4.36 0.00 3.58 3.48 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 64 G 8.35 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.89 4.03 0.00 1.90 1.89 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.68 7.81 66 K 7.72 4.11 0.00 2.16 2.10 0.00 1.42 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.44 7.81 67 V 7.76 3.61 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.00 0.00 0.00 68 L 8.20 4.36 0.00 1.97 1.76 0.77 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.37 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.16 4.11 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.20 4.17 0.00 3.14 3.40 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 0.00 72 S 8.80 4.22 0.00 4.61 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 0.00 73 D 8.30 4.51 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 74 G 7.94 3.54 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 0.00 75 L 7.22 3.89 0.00 1.47 1.42 -0.42 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.26 4.28 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.99 4.94 0.00 3.11 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.05 3.93 0.00 1.55 1.66 0.74 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.91 4.60 0.00 2.63 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 80 N 8.11 5.03 0.00 2.69 2.60 0.00 0.00 7.12 6.33 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 81 L 7.82 4.12 0.00 1.74 1.80 0.87 0.77 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 82 K 8.04 4.07 0.00 1.67 1.80 0.00 1.63 0.00 0.00 1.36 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.44 7.81 83 G 8.04 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 84 T 7.54 3.66 4.13 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 0.47 0.00 0.00 85 F 7.87 4.67 0.00 3.02 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 86 A 7.73 4.06 1.40 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 0.00 0.00 0.00 87 T 7.85 3.88 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 1.20 0.00 0.00 88 L 7.95 4.13 0.00 1.88 1.88 1.09 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.42 4.30 0.00 4.07 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.17 3.87 0.00 2.22 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 2.32 2.45 0.00 91 L 7.94 3.90 0.00 1.88 1.86 0.91 1.08 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 92 H 8.49 4.24 0.00 3.61 3.74 0.00 5.86 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 93 C 7.70 3.59 0.00 1.23 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 94 D 8.12 4.34 0.00 2.69 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 95 K 7.77 4.30 0.00 1.79 1.79 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.50 7.81 96 L 7.72 4.19 0.00 1.68 1.62 0.70 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.04 4.01 0.00 3.28 3.40 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.76 3.83 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 0.09 0.00 0.00 0.36 0.00 0.00 99 D 8.85 4.32 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.56 0.00 1.99 1.90 0.00 3.39 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.44 0.00 101 E 8.21 3.89 0.00 2.04 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 2.32 2.39 0.00 102 N 7.83 4.25 0.00 2.43 2.67 0.00 0.00 6.92 8.25 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 0.00 103 F 7.42 4.47 0.00 3.10 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 0.00 104 R 7.92 3.95 0.00 1.97 1.97 0.00 3.12 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 105 L 7.79 3.83 0.00 1.70 1.38 0.69 -0.07 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 0.00 106 L 8.16 4.09 0.00 1.81 1.73 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.15 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 0.00 108 N 8.14 4.47 0.00 2.82 2.95 0.00 0.00 6.67 7.51 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 0.00 109 V 7.91 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 1.05 0.00 0.00 1.16 0.00 0.00 110 L 8.18 3.87 0.00 1.69 1.78 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.82 3.59 2.32 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 1.31 0.00 0.00 1.13 0.00 0.00 112 C 8.02 4.09 0.00 3.19 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 0.00 113 V 7.92 3.54 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.92 0.00 0.00 114 L 7.87 3.86 0.00 1.05 1.23 0.72 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.10 3.72 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 0.00 116 H 7.92 4.12 0.00 3.13 3.42 0.00 5.96 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 0.00 117 H 7.93 3.97 0.00 2.99 2.93 0.00 5.79 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 0.00 118 F 8.42 4.56 0.00 3.27 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 0.00 119 G 8.79 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.88 4.06 0.00 1.92 2.01 0.00 1.61 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 1.45 1.47 7.81 121 E 7.86 4.04 0.00 2.05 2.33 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 2.29 2.27 0.00 122 F 8.16 4.54 0.00 3.05 3.14 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 0.00 123 T 7.34 4.16 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.42 3.54 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 0.90 0.00 0.00 0.88 0.00 0.00 127 Q 7.73 3.52 0.00 1.73 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 128 A 7.92 3.97 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 0.00 129 A 7.83 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 0.00 130 Y 8.16 3.96 0.00 3.24 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 0.00 131 Q 8.65 4.12 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 132 K 7.96 3.92 0.00 2.01 1.83 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.59 7.81 133 V 7.57 3.45 2.14 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 0.85 0.00 0.00 0.71 0.00 0.00 134 V 8.16 3.85 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 1.09 0.00 0.00 1.10 0.00 0.00 135 A 8.15 4.13 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 0.00 136 G 8.08 3.50 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 0.00 137 V 7.87 3.28 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.69 0.00 0.00 138 A 7.95 3.88 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.09 4.24 0.00 2.77 3.02 0.00 0.00 7.24 7.55 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 0.00 140 A 8.01 4.14 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 0.00 141 L 7.71 3.85 0.00 0.83 0.60 -0.02 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.98 4.18 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 8.03 4.28 0.00 3.40 3.49 0.00 5.75 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 0.00 144 K 7.95 4.44 0.00 1.86 1.84 0.00 1.80 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.52 1.59 7.81 145 Y 7.85 4.17 0.00 3.02 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 0.00 146 H 8.39 4.41 0.00 3.22 3.24 0.00 5.75 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