NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5371 8.3644 120.1886 52.6318 43.6687 174.9287 3 S 4.5345 7.6156 110.2011 57.2268 63.8941 174.3761 4 M 4.1971 8.0300 119.9557 58.7307 32.7818 176.9848 5 D 4.2640 7.9645 118.1746 57.6473 41.4881 177.7742 6 H 4.1876 7.9793 116.1928 58.9369 28.8865 177.8980 7 R 3.9568 7.6984 118.5340 59.2055 29.7906 179.2365 8 I 3.7331 7.7159 119.5745 64.3654 37.1274 178.2314 9 E 4.3394 8.3283 120.9993 58.8047 29.1708 179.5027 10 R 3.6414 7.8479 118.6214 59.3356 30.1415 178.6166 11 L 3.9734 7.6212 118.5113 57.7454 41.4111 179.4160 12 E 3.9777 8.3812 118.8332 59.4282 29.3827 178.7000 13 Y 4.2609 8.0128 119.5751 61.1034 38.8037 177.7803 14 Y 4.2713 8.0384 117.7536 61.1106 37.8143 178.6378 15 I 3.7529 8.0786 120.9641 64.4366 36.9738 178.4266 16 Q 4.0136 7.9122 118.0488 58.8536 28.5260 178.6785 17 L 4.0781 7.7200 120.0563 57.6600 41.6504 179.4085 18 L 3.9868 8.2186 119.5956 57.6879 41.5585 179.9582 19 V 3.6295 8.2022 119.4804 64.6132 31.0518 178.3492 20 K 4.1987 7.7158 117.8765 58.2556 31.9591 177.5741 21 T 4.3446 7.6347 108.2602 61.2428 69.3932 175.2635 22 V 3.6633 7.3551 123.1776 62.6432 32.2092 175.0703 23 D 4.4586 8.7290 125.9619 54.5775 40.5191 176.4570 24 M 4.3472 8.5847 126.5305 57.0837 32.1241 177.1089 25 D 4.6559 8.3293 117.9407 54.7822 41.3496 177.1824 26 R 4.1550 7.6934 117.2543 56.8070 32.8565 175.7433 27 Y 4.8214 7.9078 115.3332 56.0527 39.0674 175.6286 28 P 4.3977 0.0000 0.0000 65.8595 31.5778 177.3207 29 F 4.3813 8.3571 120.1640 61.5277 39.6249 176.6475 30 Y 4.2574 8.4117 116.2031 61.0218 37.5815 178.4515 31 A 4.0585 8.2145 121.8425 54.9884 18.4000 179.4290 32 L 3.9185 8.0440 118.8649 58.2429 42.2106 179.0658 33 L 3.8703 7.6392 118.8445 57.9195 41.5735 179.7556 34 I 3.6765 7.5409 119.0412 64.4853 36.8861 178.0120 35 D 4.3856 8.2905 117.9129 56.9250 41.1249 177.5294 36 K 4.3753 8.2276 116.4587 55.5534 32.4536 176.8933 37 G 3.8814 7.9185 107.2895 46.4246 0.0000 174.2409 38 L 4.3435 7.8111 119.3319 54.0004 42.3396 178.1516 39 S 4.4957 9.3438 118.3459 57.2946 65.4527 175.4999 40 K 3.8848 8.4057 121.8007 59.7227 31.8931 178.2758 41 E 3.9668 8.1438 118.3013 59.4954 29.4296 179.1173 42 E 4.0876 8.4031 118.6737 59.2650 29.6774 179.5732 43 G 3.6838 8.4067 106.0936 48.0847 0.0000 175.6304 44 E 4.1219 8.5435 121.2803 58.9129 29.5025 179.3679 45 A 4.0331 8.1058 121.0710 54.9030 18.3775 179.8390 46 V 3.5610 7.8856 116.8532 66.5651 31.6812 178.2061 47 M 4.1447 8.1193 118.0304 58.5419 31.7948 178.9830 48 R 4.3055 8.1483 119.5641 58.7061 30.1385 179.2045 49 I 3.7189 7.7160 119.4036 64.5929 37.0480 178.2307 50 C 3.8092 7.8996 117.5240 62.5960 27.1699 175.7791 51 D 4.4495 8.2603 120.7545 57.6944 40.4241 178.8963 52 E 4.0139 8.2498 118.8064 59.4627 29.4108 179.5376 53 L 3.9945 8.1643 119.1363 57.6554 41.5820 179.7239 54 S 4.0022 8.1996 115.5734 61.5656 62.7428 176.5575 55 E 3.9412 8.3964 121.4905 59.1805 29.1823 178.9847 56 E 3.8812 8.4349 119.7997 58.9697 29.6013 178.5853 57 L 3.6363 8.1809 120.5703 58.0794 42.1421 178.7486 58 A 3.9035 8.0066 120.7311 55.4905 18.3176 179.8075 59 T 3.8390 8.0223 114.1350 66.9656 68.5840 177.0822 60 Q 4.4370 8.4750 121.6938 58.3734 28.6694 178.9197 61 K 4.4017 8.5246 119.7020 59.6276 31.8976 179.2712 62 A 4.1250 7.9667 119.9040 54.8821 18.1766 178.8396 63 Q 4.3374 8.1644 114.8892 56.4218 28.8887 177.3843 64 G 4.0809 7.9762 108.7641 44.9563 0.0000 174.1634 65 F 4.2095 8.2118 118.2452 57.5417 39.3607 175.7098 66 V 4.4448 8.0791 114.1806 60.6990 33.5253 175.7442 67 T 4.3675 7.0008 109.1158 59.8310 71.3558 173.8208 68 F 4.9669 8.1819 121.3300 56.2108 40.9217 176.4595 69 D 4.4251 8.6905 123.3778 57.7953 40.5564 178.3362 70 K 4.0022 8.0778 119.1026 59.1641 32.1562 178.6699 71 L 4.1179 8.2167 119.8933 57.5793 41.5079 179.1024 72 L 3.0359 7.9304 119.8113 57.6577 41.9402 178.8383 73 A 3.9192 7.7947 120.2958 55.0375 18.2393 179.4045 74 L 3.8970 8.0078 117.4760 57.7935 41.6853 179.3630 75 F 4.0446 8.3271 120.2937 61.4803 39.1299 177.0293 76 A 3.9118 8.3119 119.3192 55.0278 18.2043 179.4659 77 G 3.6052 7.9994 103.0370 46.6357 0.0000 174.6985 78 Q 4.3908 7.3434 119.2610 55.0002 30.6214 175.4382 79 L 3.6395 7.1057 121.9854 54.7283 42.6146 175.8570 80 N 4.0553 8.7528 122.7759 54.0932 39.1106 175.0111 81 E 3.9338 8.9471 124.9819 59.5094 29.6759 178.5692 82 K 4.1567 8.9341 117.0746 57.8787 32.3072 176.8130 83 L 4.7863 7.7466 118.8993 52.7888 44.0847 175.7700 84 D 4.7414 8.3464 120.3838 53.0197 43.2664 177.1920 85 V 3.6799 8.4065 126.5235 66.6490 31.5864 177.7920 86 H 3.8735 8.3353 115.0815 58.9307 28.7121 177.1526 87 E 4.1801 8.9026 121.1119 59.7667 29.4330 179.0536 88 T 4.1244 8.4322 115.9718 66.7507 68.4969 176.7223 89 I 3.6395 7.9357 121.7136 64.5737 37.0502 178.6145 90 F 4.5395 8.1965 118.3721 60.3647 38.6881 177.7452 91 A 4.1389 8.4187 120.5705 55.2152 18.2192 179.5517 92 L 3.8056 8.3992 117.9764 58.0467 41.7184 179.1146 93 Y 4.1378 8.3639 119.5546 61.0387 38.5896 178.1837 94 E 3.8183 8.4598 118.2286 59.0798 29.6383 178.4113 95 Q 4.2465 7.4167 118.6605 55.6631 29.2068 176.3067 96 G 3.6761 7.6465 106.8845 46.5378 0.0000 173.2522 97 L 4.2198 7.7389 118.5942 53.8586 43.8868 176.1426 98 Y 3.5661 7.4598 117.1022 58.5822 35.7042 172.7296 99 Q 4.0249 7.8807 123.2426 59.4994 29.7448 176.8908 100 E 3.8610 8.0691 118.7703 59.4266 29.4957 179.0335 101 L 3.4772 7.6241 119.5471 58.2543 42.1606 178.7052 102 M 3.7615 8.1373 118.9568 58.3828 31.9062 178.6225 103 E 3.8438 8.3714 119.0127 59.1895 29.4809 179.6520 104 V 3.6285 7.4890 117.9607 65.9711 31.5599 178.1541 105 F 4.4498 8.1216 117.8994 60.8123 38.7257 177.7813 106 I 3.6446 8.2957 119.7746 64.0944 36.8839 178.1030 107 D 4.2677 8.1379 119.0125 57.4388 41.2826 178.1968 108 I 4.0058 8.1013 120.5210 65.0151 37.1048 178.3763 109 M 4.2379 8.3605 119.3944 58.3407 31.4984 179.0113 110 K 4.0902 7.8481 118.0507 59.7129 32.2405 178.8139 111 H 4.2524 7.9558 115.3607 57.7680 28.6922 176.7591 112 F 4.7187 7.9696 116.6834 57.6142 40.2231 175.4476 113 D 4.6206 8.5316 123.4533 54.5598 40.6512 175.9717 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 D 8.36 4.54 0.00 2.63 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 3 S 7.62 4.53 0.00 3.97 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 4 M 8.03 4.20 0.00 2.11 2.03 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 2.66 2.58 0.00 5 D 7.96 4.26 0.00 2.67 2.47 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 6 H 7.98 4.19 0.00 3.34 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 7.70 3.96 0.00 1.90 1.98 0.00 3.14 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 8 I 7.72 3.73 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.77 0.89 0.00 0.00 9 E 8.33 4.34 0.00 2.20 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 10 R 7.85 3.64 0.00 1.95 1.89 0.00 3.03 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.13 0.00 11 L 7.62 3.97 0.00 1.92 1.71 0.93 0.90 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 12 E 8.38 3.98 0.00 2.19 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 2.33 2.47 0.00 13 Y 8.01 4.26 0.00 2.89 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 14 Y 8.04 4.27 0.00 3.12 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 15 I 8.08 3.75 2.01 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 1.79 0.99 0.91 0.00 0.00 16 Q 7.91 4.01 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.43 2.72 0.00 17 L 7.72 4.08 0.00 1.69 1.56 0.52 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.22 3.99 0.00 1.82 1.69 0.89 0.76 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 19 V 8.20 3.63 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 0.86 0.00 0.00 0.98 0.00 0.00 20 K 7.72 4.20 0.00 1.93 1.92 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.65 1.59 7.81 21 T 7.63 4.34 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 1.26 0.00 0.00 22 V 7.36 3.66 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 0.90 0.00 0.00 1.05 0.00 0.00 23 D 8.73 4.46 0.00 2.80 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 24 M 8.58 4.35 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.72 0.00 25 D 8.33 4.66 0.00 2.76 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 26 R 7.69 4.15 0.00 1.53 0.91 0.00 3.03 0.00 0.00 3.51 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.47 0.00 27 Y 7.91 4.82 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.40 0.00 2.38 2.55 0.00 3.72 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 2.34 2.06 0.00 29 F 8.36 4.38 0.00 3.08 3.32 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 30 Y 8.41 4.26 0.00 3.08 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 31 A 8.21 4.06 1.45 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 0.00 0.00 32 L 8.04 3.92 0.00 2.01 1.88 1.00 0.75 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 33 L 7.64 3.87 0.00 1.73 1.58 0.68 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.54 3.68 1.98 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 1.36 0.99 0.90 0.00 0.00 35 D 8.29 4.39 0.00 2.73 2.85 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 36 K 8.23 4.38 0.00 1.81 1.84 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.64 1.62 7.81 37 G 7.92 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.81 4.34 0.00 1.75 1.60 0.93 0.73 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 39 S 9.34 4.50 0.00 3.99 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 40 K 8.41 3.88 0.00 1.82 1.84 0.00 1.71 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.52 7.81 41 E 8.14 3.97 0.00 2.10 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 2.40 2.47 0.00 42 E 8.40 4.09 0.00 2.27 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 2.33 2.33 0.00 43 G 8.41 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 44 E 8.54 4.12 0.00 2.18 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 2.38 2.53 0.00 45 A 8.11 4.03 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 46 V 7.89 3.56 2.52 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 1.23 0.00 0.00 1.08 0.00 0.00 47 M 8.12 4.14 0.00 2.33 2.37 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 3.21 0.00 48 R 8.15 4.31 0.00 2.02 1.99 0.00 3.54 0.00 0.00 3.30 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.70 0.00 49 I 7.72 3.72 2.04 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.72 0.99 0.00 0.00 50 C 7.90 3.81 0.00 1.95 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 51 D 8.26 4.45 0.00 2.83 2.77 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 52 E 8.25 4.01 0.00 1.98 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 2.53 2.50 0.00 53 L 8.16 3.99 0.00 1.73 1.73 1.28 0.85 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 54 S 8.20 4.00 0.00 4.07 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.40 3.94 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 2.33 2.44 0.00 56 E 8.43 3.88 0.00 2.12 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 2.27 2.30 0.00 57 L 8.18 3.64 0.00 1.54 1.66 -0.33 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.01 3.90 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 59 T 8.02 3.84 4.38 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 1.23 0.00 0.00 60 Q 8.47 4.44 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 1.95 2.36 0.00 61 K 8.52 4.40 0.00 1.97 1.93 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.62 1.35 7.81 62 A 7.97 4.13 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 63 Q 8.16 4.34 0.00 2.65 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.33 0.00 0.00 0.00 0.00 0.00 2.47 2.69 0.00 64 G 7.98 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 0.00 0.00 0.00 65 F 8.21 4.21 0.00 3.39 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 66 V 8.08 4.44 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 0.83 0.00 0.00 0.85 0.00 0.00 67 T 7.00 4.37 4.15 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 0.00 0.00 0.00 1.12 0.00 0.00 68 F 8.18 4.97 0.00 3.09 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 69 D 8.69 4.43 0.00 2.76 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 70 K 8.08 4.00 0.00 1.81 1.81 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.51 7.81 71 L 8.22 4.12 0.00 2.08 1.93 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 72 L 7.93 3.04 0.00 1.45 1.61 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.79 3.92 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 74 L 8.01 3.90 0.00 1.93 1.75 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 75 F 8.33 4.04 0.00 3.17 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 76 A 8.31 3.91 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.00 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 0.00 0.00 0.00 78 Q 7.34 4.39 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.73 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 79 L 7.11 3.64 0.00 0.85 1.18 0.71 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.75 4.06 0.00 2.74 2.72 0.00 0.00 7.20 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 81 E 8.95 3.93 0.00 1.98 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 2.29 2.32 0.00 82 K 8.93 4.16 0.00 1.79 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.47 7.81 83 L 7.75 4.79 0.00 1.61 1.64 1.04 1.07 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 84 D 8.35 4.74 0.00 2.84 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.41 3.68 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 1.02 0.00 0.00 0.89 0.00 0.00 86 H 8.34 3.87 0.00 3.58 3.61 0.00 5.88 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 87 E 8.90 4.18 0.00 2.23 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 0.00 2.46 2.51 0.00 88 T 8.43 4.12 4.60 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 1.52 0.00 0.00 89 I 7.94 3.64 1.66 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.80 0.59 0.00 0.00 90 F 8.20 4.54 0.00 3.19 3.10 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 91 A 8.42 4.14 1.69 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 92 L 8.40 3.81 0.00 1.79 1.69 0.83 -0.35 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 93 Y 8.36 4.14 0.00 3.10 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 94 E 8.46 3.82 0.00 2.05 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 2.71 2.52 0.00 95 Q 7.42 4.25 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.19 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 96 G 7.65 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 97 L 7.74 4.22 0.00 1.63 1.28 0.88 1.01 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 98 Y 7.46 3.57 0.00 2.99 2.77 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 99 Q 7.88 4.02 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.89 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 100 E 8.07 3.86 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 101 L 7.62 3.48 0.00 1.43 1.31 0.33 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 102 M 8.14 3.76 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.89 0.00 103 E 8.37 3.84 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.64 0.00 104 V 7.49 3.63 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 1.23 0.00 0.00 0.82 0.00 0.00 105 F 8.12 4.45 0.00 2.95 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 0.00 106 I 8.30 3.64 1.69 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 0.92 0.00 0.00 107 D 8.14 4.27 0.00 2.89 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 0.00 108 I 8.10 4.01 2.10 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.22 0.98 0.00 0.00 109 M 8.36 4.24 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.47 0.00 110 K 7.85 4.09 0.00 1.87 1.81 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.66 7.81 111 H 7.96 4.25 0.00 3.21 2.74 0.00 5.62 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 0.00 112 F 7.97 4.72 0.00 3.05 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 0.00 113 D 8.53 4.62 0.00 2.84 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