NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2583 8.3044 120.3271 55.5352 33.4043 170.7263 2 Q 3.1902 8.5796 128.2831 55.2761 30.1497 171.8898 3 R 4.6841 8.6044 127.0325 56.0635 32.8185 173.7656 4 G 4.5697 7.5453 107.8436 45.8987 0.0000 171.9048 5 I 4.7940 8.2144 122.1520 59.4167 41.6279 174.9086 6 V 4.7866 8.2709 124.3707 61.2699 35.1260 173.4873 7 W 5.5167 9.0331 128.7527 55.7814 30.4912 175.6932 8 V 4.4924 8.8320 126.3743 62.3645 32.7701 175.3535 9 V 5.4861 8.3026 125.6872 59.8417 31.3204 172.8472 10 D 5.1792 8.1444 122.7399 51.6806 45.2625 174.8702 11 D 4.7937 8.6589 122.8312 54.4008 41.0977 175.5033 12 D 5.0699 8.1491 118.6790 52.7159 44.6242 175.3244 13 S 4.8837 8.3702 111.8247 58.3027 63.0261 173.7800 14 S 4.7815 8.0210 114.1025 59.4077 64.8293 175.4356 15 I 3.6510 7.6741 120.5559 63.7625 37.0415 178.0938 16 R 4.1457 7.9988 116.6279 59.0334 28.4443 178.6556 17 W 4.1636 8.0314 128.2588 60.1647 30.4934 177.8212 18 V 3.0388 6.7043 117.7793 65.8748 30.3536 177.6736 19 L 4.0016 8.8271 118.8838 58.0059 41.5856 179.1621 20 E 4.1181 8.1375 118.9415 59.2801 29.5202 178.9174 21 R 3.8830 9.3070 118.8660 59.4125 30.2083 178.3148 22 A 3.9860 9.1287 121.0887 55.2810 18.3554 179.5453 23 L 3.7868 9.1552 117.9578 57.6644 41.5279 178.8254 24 A 4.7307 7.7185 119.3181 52.0441 18.9092 178.3192 25 G 3.9238 7.8788 103.3510 45.1669 0.0000 175.0864 26 A 4.4282 8.7671 121.7452 52.0182 19.2191 177.4681 27 G 3.8007 8.5496 104.7851 45.7681 0.0000 172.7412 28 L 5.0220 8.6770 120.3053 53.1440 46.0525 175.1837 29 T 4.6081 9.4348 119.4200 62.9814 70.5453 173.6483 30 C 5.0064 8.3221 122.1714 58.8884 35.1443 173.8680 31 T 4.3159 9.2764 121.2587 61.8554 71.7560 173.2955 32 T 3.9770 8.0633 117.8466 61.6111 69.5124 175.2528 33 F 5.0039 9.4352 125.5603 55.0386 39.9083 175.4491 34 E 4.4254 7.9150 122.4978 54.7695 29.5838 179.7119 35 N 4.6625 8.1928 114.7733 52.3102 41.2354 175.7340 36 G 3.9955 8.4917 111.2738 47.7059 0.0000 172.0747 37 N 4.2720 8.1885 118.6399 56.6617 39.0359 176.2140 38 E 4.1729 8.3898 120.1042 59.7044 29.6359 179.7424 39 V 3.1629 7.5454 116.1954 64.4828 31.0645 176.9834 40 L 4.2074 7.5541 119.0076 57.4186 42.3108 177.2666 41 A 4.3765 8.7641 118.3329 52.8015 18.5718 177.9049 42 A 4.5709 8.1951 119.5368 52.5416 20.1965 177.8227 43 L 4.8491 7.9100 117.1498 54.5535 42.4411 177.2086 44 A 4.4093 7.6231 117.6664 53.4223 19.2051 178.1001 45 S 4.6456 7.6734 111.0392 58.6469 65.5905 173.6013 46 K 4.3840 7.2759 114.4171 56.8805 36.2117 173.4888 47 T 4.4233 7.9466 112.7765 60.7517 70.3552 173.5319 48 P 4.3431 0.0000 0.0000 62.5193 33.1412 175.1959 49 D 4.3327 8.2984 115.4209 55.6265 41.0045 175.9465 50 V 4.1918 6.0714 118.2171 62.6022 34.8629 169.5462 51 L 4.8923 7.4548 120.7419 52.4018 46.0154 176.2819 52 L 4.9706 8.3432 120.9811 54.3193 41.1353 175.4707 53 S 4.6677 8.1563 118.0961 58.8065 64.8965 174.4654 54 D 5.4623 8.3978 121.7830 54.7733 43.8998 174.6921 55 I 4.2859 8.7594 120.4041 61.3092 35.9510 176.4210 56 R 4.1348 9.3787 119.2849 57.2191 28.7501 176.4718 57 M 4.0861 7.7205 115.4676 54.4483 33.0821 174.7529 58 P 4.0767 0.0000 0.0000 62.9901 31.2003 178.1249 59 G 3.8907 9.0174 106.5307 46.4238 0.0000 173.8953 60 M 3.2272 7.7820 127.1897 55.8693 32.1422 176.6456 61 D 4.7201 7.7139 116.1312 53.5208 43.6748 176.5959 62 G 4.8763 7.8139 109.0380 47.4527 0.0000 174.5401 63 L 4.8443 7.9944 113.6742 53.6154 44.3934 179.3029 64 A 3.9191 8.1498 122.5520 55.1671 18.7573 179.7349 65 L 3.9166 8.2109 118.3242 58.4701 41.7691 179.1435 66 L 3.9913 7.5467 119.1498 57.7486 41.1942 179.3173 67 K 3.9133 8.3919 119.2086 60.4038 32.3115 178.4311 68 Q 4.0953 8.5902 120.3457 58.8534 28.4860 178.6470 69 I 3.7728 7.9276 119.5737 64.9229 36.8574 177.8755 70 K 3.8980 8.3617 121.0468 59.8309 32.3035 178.8093 71 Q 4.0606 9.0168 119.3409 58.4333 28.9111 177.7733 72 R 4.4463 8.1917 118.5980 57.1547 32.4633 176.5656 73 H 4.9477 9.5067 113.1437 53.3391 28.5357 172.2457 74 P 4.7967 0.0000 0.0000 61.1091 30.0589 175.4297 75 M 4.4289 7.5541 126.9061 56.7500 35.2632 175.4028 76 L 4.0093 7.7698 119.0172 54.6535 42.6537 176.4619 77 P 4.3304 0.0000 0.0000 62.0379 30.2231 176.7712 78 V 3.6243 6.8240 117.2899 63.8264 32.7680 174.1957 79 I 3.4899 7.3087 123.9565 62.7060 39.2161 176.5682 80 I 3.8116 7.5838 119.3151 61.4600 36.2589 172.3464 81 M 5.3996 8.4657 121.2248 54.2478 34.2883 175.7825 82 T 4.7795 8.6105 109.8598 60.5442 72.1806 173.6317 83 A 5.3907 8.4014 122.4618 51.9701 19.8062 177.7954 84 H 4.5236 8.5236 122.8161 58.2442 27.1157 177.4513 85 S 4.5818 7.9452 110.7904 59.3111 62.7810 174.3040 86 D 4.9435 8.0472 119.0384 53.8951 41.0153 176.1784 87 L 4.3571 7.5330 123.5627 55.8227 43.7435 177.7807 88 D 4.4765 8.0921 116.9153 55.8591 41.2739 176.5978 89 A 4.4208 7.7673 119.0588 52.3688 20.2191 176.8919 90 A 3.9380 7.3150 116.8439 52.2443 20.5212 177.9705 91 V 3.9349 8.6601 115.2135 64.2935 32.4754 176.1604 92 S 4.6359 7.0890 111.7299 54.6019 62.2176 173.4657 93 A 4.8571 7.3301 125.6290 51.3056 20.9747 176.0541 94 Y 4.4482 7.4584 120.4368 56.1629 41.5798 173.2064 95 Q 3.9344 7.4844 125.7184 57.9646 29.7033 177.1011 96 Q 4.3615 7.8710 124.5979 54.0519 28.2414 175.9974 97 G 3.7609 7.9553 106.9306 46.6473 0.0000 171.6726 98 A 4.4475 7.9150 126.0131 51.6941 20.0837 175.3281 99 F 4.6850 8.1445 120.6196 58.1639 41.6343 176.9384 100 D 4.5556 8.1909 120.2368 57.4092 42.2153 176.5145 101 Y 4.8503 6.4508 118.2107 57.1752 34.8646 174.6998 102 L 3.7724 8.2024 123.5395 53.4613 42.7022 176.0850 103 P 4.8296 0.0000 0.0000 60.8618 28.9790 176.2987 104 K 4.3145 8.4912 120.3442 57.3669 34.0028 176.4539 105 P 4.5016 0.0000 0.0000 62.6432 32.1614 175.3847 106 F 4.8007 7.0932 113.7386 54.8335 40.9213 174.2488 107 D 4.6398 8.8734 120.5890 53.5213 40.4472 176.9004 108 I 3.9342 8.2859 126.7112 64.7455 37.1504 177.1530 109 D 4.2847 8.2867 117.9263 57.7952 40.7832 178.2702 110 E 3.6508 9.0103 119.0762 59.1599 29.4861 179.1666 111 A 3.8341 7.8153 120.5501 54.6970 18.6779 179.7395 112 V 3.4945 8.5110 117.4206 66.1457 31.4635 178.1776 113 A 4.0075 8.4708 120.0560 54.8697 18.2868 179.1541 114 L 3.9197 7.5390 119.4112 58.1363 41.9936 179.1410 115 V 3.6710 7.4813 118.7912 65.3174 30.8883 178.0445 116 E 3.9392 7.9412 117.9656 57.9875 29.6383 178.5343 117 R 4.3775 8.8331 115.7316 56.4861 30.6021 177.7624 118 A 3.8543 7.4612 120.9664 54.1258 19.2937 178.9558 119 I 3.6494 9.0863 117.1382 63.4178 37.3743 178.0330 120 S 4.6905 7.8620 115.8778 60.9291 63.4351 175.8374 121 H 4.4041 8.0388 115.5330 58.0020 28.1982 176.5617 122 Y 4.1369 8.0250 120.0172 59.5359 38.8931 176.9362 123 Q 3.5115 7.5376 122.9780 54.4433 27.6588 175.1031 124 E 4.1078 7.1967 122.8350 56.3952 29.9808 174.5001 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 M 8.30 4.26 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.54 0.00 2 Q 8.58 3.19 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 7.59 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 3 R 8.60 4.68 0.00 1.74 2.02 0.00 3.29 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.46 0.00 4 G 7.55 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.21 4.79 2.04 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 1.30 0.97 0.95 0.00 0.00 6 V 8.27 4.79 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 1.25 0.00 0.00 0.93 0.00 0.00 7 W 9.03 5.52 0.00 3.40 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 8 V 8.83 4.49 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 0.95 0.00 0.00 0.99 0.00 0.00 9 V 8.30 5.49 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.22 0.00 0.00 10 D 8.14 5.18 0.00 3.00 2.46 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 11 D 8.66 4.79 0.00 2.73 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 12 D 8.15 5.07 0.00 2.80 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.37 4.88 0.00 3.81 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 14 S 8.02 4.78 0.00 3.90 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 15 I 7.67 3.65 1.92 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.97 0.77 0.00 0.00 16 R 8.00 4.15 0.00 2.04 2.23 0.00 2.97 0.00 0.00 3.49 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.81 0.00 17 W 8.03 4.16 0.00 3.33 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 6.70 3.04 1.74 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 0.77 0.00 0.00 -0.46 0.00 0.00 19 L 8.83 4.00 0.00 1.89 1.73 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.14 4.12 0.00 2.09 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 0.00 2.36 2.35 0.00 21 R 9.31 3.88 0.00 2.21 2.24 0.00 3.55 0.00 0.00 3.38 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 22 A 9.13 3.99 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 23 L 9.16 3.79 0.00 1.86 1.76 0.94 0.94 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 24 A 7.72 4.73 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 25 G 7.88 3.92 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 0.00 0.00 0.00 26 A 8.77 4.43 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 27 G 8.55 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.68 5.02 0.00 1.64 1.59 0.99 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 29 T 9.43 4.61 4.46 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 1.28 0.00 0.00 30 C 8.32 5.01 0.00 2.97 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 31 T 9.28 4.32 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 0.47 0.00 0.00 32 T 8.06 3.98 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 1.20 0.00 0.00 33 F 9.44 5.00 0.00 3.05 2.75 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 0.00 0.00 0.00 34 E 7.92 4.43 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 35 N 8.19 4.66 0.00 2.77 2.77 0.00 0.00 6.90 7.62 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 36 G 8.49 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 37 N 8.19 4.27 0.00 2.78 2.82 0.00 0.00 7.22 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.39 4.17 0.00 2.17 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 39 V 7.55 3.16 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 1.16 0.00 0.00 0.88 0.00 0.00 40 L 7.55 4.21 0.00 1.84 1.88 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.76 4.38 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 42 A 8.20 4.57 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.91 4.85 0.00 2.04 1.69 0.50 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.62 4.41 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 45 S 7.67 4.65 0.00 3.88 3.93 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 46 K 7.28 4.38 0.00 1.83 1.65 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.32 7.81 47 T 7.95 4.42 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 1.14 0.00 0.00 48 P 0.00 4.34 0.00 1.91 1.41 0.00 3.22 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.44 0.00 49 D 8.30 4.33 0.00 2.59 2.54 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 50 V 6.07 4.19 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 0.83 0.00 0.00 0.85 0.00 0.00 51 L 7.45 4.89 0.00 1.70 1.63 0.64 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.34 4.97 0.00 1.64 1.62 0.92 0.97 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 53 S 8.16 4.67 0.00 3.99 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 54 D 8.40 5.46 0.00 2.63 2.55 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 0.00 55 I 8.76 4.29 2.16 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.77 1.04 0.00 0.00 56 R 9.38 4.13 0.00 2.02 2.28 0.00 3.34 0.00 0.00 3.44 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 57 M 7.72 4.09 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.79 0.00 58 P 0.00 4.08 0.00 2.22 2.08 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 59 G 9.02 3.89 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 0.00 0.00 0.00 60 M 7.78 3.23 0.00 2.15 2.17 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 2.46 2.54 0.00 61 D 7.71 4.72 0.00 2.68 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 62 G 7.81 4.88 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 63 L 7.99 4.84 0.00 1.46 1.59 0.89 0.85 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 64 A 8.15 3.92 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 65 L 8.21 3.92 0.00 1.79 1.77 0.94 0.67 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 66 L 7.55 3.99 0.00 1.93 1.76 1.05 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.39 3.91 0.00 1.92 2.06 0.00 1.33 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.68 7.81 68 Q 8.59 4.10 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 69 I 7.93 3.77 2.12 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.28 0.92 0.00 0.00 70 K 8.36 3.90 0.00 1.64 1.74 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.55 1.39 7.81 71 Q 9.02 4.06 0.00 2.02 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 72 R 8.19 4.45 0.00 2.15 2.05 0.00 3.49 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 73 H 9.51 4.95 0.00 3.27 3.32 0.00 5.28 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.80 0.00 2.21 2.15 0.00 3.86 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 75 M 7.55 4.43 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 76 L 7.77 4.01 0.00 1.89 1.69 0.97 0.89 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 77 P 0.00 4.33 0.00 2.03 2.09 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.01 0.00 78 V 6.82 3.62 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 1.14 0.00 0.00 1.06 0.00 0.00 79 I 7.31 3.49 1.66 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.48 0.70 0.00 0.00 80 I 7.58 3.81 2.30 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.04 1.28 0.00 0.00 81 M 8.47 5.40 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.94 0.00 82 T 8.61 4.78 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 1.34 0.00 0.00 83 A 8.40 5.39 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 84 H 8.52 4.52 0.00 3.41 3.53 0.00 5.63 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 85 S 7.95 4.58 0.00 3.88 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 86 D 8.05 4.94 0.00 2.67 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 87 L 7.53 4.36 0.00 1.68 1.78 0.97 1.23 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 88 D 8.09 4.48 0.00 2.77 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 89 A 7.77 4.42 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 90 A 7.32 3.94 -0.29 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 91 V 8.66 3.93 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 0.86 0.00 0.00 1.03 0.00 0.00 92 S 7.09 4.64 0.00 3.94 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 93 A 7.33 4.86 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 94 Y 7.46 4.45 0.00 2.81 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 95 Q 7.48 3.93 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.27 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 96 Q 7.87 4.36 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 97 G 7.96 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 98 A 7.92 4.45 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 99 F 8.14 4.68 0.00 2.40 1.64 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 0.00 100 D 8.19 4.56 0.00 2.43 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 0.00 101 Y 6.45 4.85 0.00 2.99 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 8.20 3.77 0.00 0.76 0.60 0.49 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.83 0.00 1.83 1.99 0.00 3.37 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.77 0.00 104 K 8.49 4.31 0.00 1.68 2.35 0.00 1.33 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.38 7.81 105 P 0.00 4.50 0.00 2.10 1.96 0.00 3.79 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 1.97 1.91 0.00 106 F 7.09 4.80 0.00 3.00 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 0.00 107 D 8.87 4.64 0.00 2.87 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 0.00 108 I 8.29 3.93 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.81 0.89 0.00 0.00 109 D 8.29 4.28 0.00 2.72 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 0.00 110 E 9.01 3.65 0.00 2.29 1.93 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 2.32 2.35 0.00 111 A 7.82 3.83 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 0.00 112 V 8.51 3.49 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 0.95 0.00 0.00 1.00 0.00 0.00 113 A 8.47 4.01 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 0.00 114 L 7.54 3.92 0.00 1.59 1.82 0.75 0.62 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 0.00 115 V 7.48 3.67 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 0.81 0.00 0.00 0.85 0.00 0.00 116 E 7.94 3.94 0.00 2.09 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 2.46 0.00 117 R 8.83 4.38 0.00 1.87 2.28 0.00 2.69 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.00 118 A 7.46 3.85 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 0.00 119 I 9.09 3.65 1.82 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.53 0.62 0.00 0.00 120 S 7.86 4.69 0.00 3.90 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 0.00 121 H 8.04 4.40 0.00 3.34 3.62 0.00 5.57 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 0.00 122 Y 8.02 4.14 0.00 3.17 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 0.00 123 Q 7.54 3.51 0.00 1.40 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 124 E 7.20 4.11 0.00 2.02 1.62 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 2.12 2.22 0.00