NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3322 8.1133 119.7057 55.4820 31.5989 174.8143 3 K 4.1114 8.5008 121.4137 57.5808 32.5352 176.0580 4 C 4.1072 9.9306 119.0249 57.8641 37.6682 172.7319 5 S 4.4396 7.7309 115.2552 57.6662 62.3334 175.2163 6 L 4.0704 8.5827 127.9988 56.9424 41.8638 177.8273 7 T 4.2018 6.5632 115.9939 63.2961 69.2711 173.0025 8 G 3.6515 7.7653 112.1342 44.0495 0.0000 171.1673 9 E 5.1441 8.3186 119.0316 54.3766 32.3796 175.4979 10 W 5.5828 9.6421 123.7059 54.9262 33.8621 173.8691 11 D 5.6138 9.3893 120.8751 51.8546 43.1196 173.6842 12 N 5.8247 8.7084 116.2518 49.6438 40.3148 175.0177 13 D 4.3448 8.6935 117.3822 55.8932 39.3750 177.2152 14 L 4.2124 8.0376 118.4363 55.1755 42.0068 177.5917 15 G 4.0039 8.2246 107.4194 44.7117 0.0000 174.1237 16 S 4.5227 8.0021 115.8400 58.6273 64.5094 173.0645 17 I 5.0142 8.5386 123.2775 59.7026 40.4162 174.2334 18 M 5.1279 9.3427 126.6511 53.7225 35.5134 174.0102 19 T 5.1241 8.8092 115.5654 59.9381 71.8440 172.7754 20 I 4.6863 8.9047 126.2559 59.5932 40.5858 176.2075 21 G 4.1590 8.8480 114.5918 45.5462 0.0000 172.7168 22 A 4.3537 8.5714 122.6863 51.5623 19.1045 177.3137 23 V 4.4352 8.1241 121.4722 61.2078 32.9054 175.9249 24 N 4.7989 8.7598 125.5161 51.8448 38.9382 175.4116 25 D 4.3972 8.5714 116.9098 57.1976 40.8493 177.1896 26 N 4.5747 8.3728 114.0746 53.1423 39.1053 175.7603 27 G 4.3817 8.3402 107.3682 46.2140 0.0000 173.1773 28 E 4.7423 8.4165 120.1026 56.1537 30.8135 175.8502 29 F 5.2992 8.4790 117.3065 55.7016 42.1060 172.6757 30 D 5.4424 8.4270 119.0772 51.8296 43.3589 174.0270 31 G 4.0762 7.5563 103.7702 46.7655 0.0000 172.1594 32 T 5.3680 8.3294 108.9958 60.0943 72.8129 172.5225 33 Y 4.9477 9.2504 123.5775 56.1554 42.6160 173.8130 34 I 4.8970 8.8302 128.0402 59.7141 39.1813 175.1194 35 T 4.5043 9.0526 121.8533 61.7912 67.9569 174.4835 36 A 4.2895 8.6662 130.2832 53.8000 19.0360 178.0162 37 V 4.4546 7.3872 107.3127 59.9645 35.5583 174.1927 38 A 4.3275 7.9155 122.9341 51.4312 21.7908 176.3956 39 D 4.4868 8.7635 119.3314 57.1012 41.0748 177.2100 40 N 4.9246 7.7363 117.1432 50.1040 39.3615 172.8150 41 P 4.2116 0.0000 0.0000 65.0025 31.8896 179.7008 42 G 3.6271 8.0269 106.9922 47.7578 0.0000 173.6602 43 N 4.6104 7.7673 115.4392 52.9877 39.2245 175.5534 44 I 2.0000 6.8029 120.0889 61.1791 37.5082 175.4478 45 T 4.6742 7.3291 113.5402 58.9828 71.8848 173.1530 46 L 4.3228 8.6640 124.2240 56.4336 42.4421 176.4047 47 S 5.1016 9.2309 121.4041 56.0226 67.2037 171.7676 48 P 5.1382 0.0000 0.0000 62.5451 32.9081 174.8138 49 L 5.3201 8.6166 120.7367 54.2405 44.5672 174.9142 50 L 4.7113 8.7075 121.1280 54.0655 45.9645 175.3285 51 G 3.8574 7.8969 111.6757 45.8237 0.0000 171.3007 52 I 5.1834 8.4071 119.5668 59.6003 41.7438 174.8572 53 Q 5.4021 9.2978 124.5098 54.4599 31.7907 174.9995 54 H 4.5592 8.9838 118.0304 56.1126 29.5214 175.6823 55 K 4.3498 8.5657 121.7193 58.4069 33.3600 178.2559 56 R 3.9504 8.1661 117.0687 59.1519 30.2203 176.6986 57 A 4.1285 7.9427 119.2361 52.4334 18.7126 177.7370 58 S 4.3304 8.6648 115.8565 60.6312 63.8133 174.5368 59 Q 5.2760 7.8437 118.7818 52.4585 27.9454 173.3058 60 P 4.6546 0.0000 0.0000 62.4987 33.7322 177.2532 61 T 4.8279 8.4044 111.9570 61.8718 70.9793 172.8313 62 F 5.3129 8.3282 116.1110 56.7089 41.8070 172.8058 63 G 4.7267 9.3971 105.6762 45.3877 0.0000 171.7509 64 F 5.5206 8.9523 114.9201 55.9739 42.0142 172.8944 65 T 5.0381 9.1224 117.1637 61.8866 71.3310 173.3755 66 V 4.3925 8.6603 126.5463 61.3386 33.5958 174.0137 67 H 4.3334 8.3262 129.0409 54.3018 29.8187 174.4604 68 W 4.2704 7.4289 126.5833 56.8413 28.9577 176.5831 69 N 4.7403 9.2946 121.9839 53.9272 38.4411 175.5525 70 F 5.0080 7.4657 111.6079 56.0948 38.8171 174.0169 71 S 4.5386 7.1864 114.3721 57.7042 65.4755 173.5589 72 E 4.1961 8.4648 118.1194 57.0680 29.3045 177.0206 73 S 4.7578 7.5957 114.8616 58.2819 64.3220 172.8307 74 T 5.0616 8.6466 118.7672 62.0406 72.8495 173.2934 75 S 5.3461 8.7446 120.3485 56.9063 66.9867 173.4992 76 V 4.9915 8.6795 114.8394 59.6846 35.6746 174.6919 77 F 5.3144 9.0164 122.6184 55.6099 42.5765 174.5823 78 V 4.5083 8.6704 121.6586 60.3060 35.1653 175.3583 79 G 4.1318 7.1692 107.0058 46.4778 0.0000 171.4032 80 Q 4.9914 8.0541 120.2019 54.4743 33.2194 174.2697 81 C 5.2670 9.1466 126.2053 55.5422 45.7355 172.2534 82 F 5.5924 9.4262 125.3705 55.7005 42.0301 174.9167 83 V 5.0710 9.0791 121.3107 60.1120 33.8296 175.5099 84 D 4.7884 8.9606 125.1833 52.0601 40.6796 177.4502 85 R 3.9876 8.3962 117.7914 58.6342 30.0454 178.1991 86 S 4.2552 8.1188 110.9487 59.0719 63.5005 174.9764 87 G 3.9658 8.3830 110.1173 44.6958 0.0000 173.3451 88 K 4.2470 8.4789 122.6299 56.2061 33.2911 175.3607 89 E 5.4978 8.8894 127.0181 55.0390 31.4588 175.7805 90 V 4.9162 9.0606 122.8836 60.1225 35.2742 174.3035 91 L 5.0709 9.2725 124.9352 53.5711 43.2576 175.7532 92 K 5.1350 9.2490 125.4683 55.6052 33.4963 176.2403 93 T 5.3029 9.2328 115.1889 59.8419 72.5999 173.0521 94 K 5.2196 8.9826 121.4746 54.4566 36.2405 175.2448 95 W 5.4197 8.4744 118.8929 54.7779 32.1317 173.7078 96 L 5.4265 8.8336 120.3776 53.0660 44.8528 175.2027 97 Q 4.9616 9.3848 124.4690 54.3630 31.8751 173.8981 98 R 4.8711 9.2287 127.8035 55.1861 31.6528 175.1448 99 L 4.8507 8.7460 126.6619 53.3630 43.5716 176.0682 100 A 4.3463 8.3995 123.7175 51.6139 19.2574 177.3781 101 V 4.4657 8.1597 114.6314 59.3046 35.2066 175.7395 102 D 4.5151 8.5583 121.0361 56.5667 41.2188 176.6649 103 D 4.8535 7.6337 116.6510 51.8298 44.6477 175.6827 104 I 3.6728 8.4710 124.7207 64.0181 38.1044 178.0021 105 S 4.3155 8.4604 113.9682 60.4957 63.1338 174.5049 106 D 4.8989 8.2734 120.6825 53.9560 41.1793 177.3954 107 D 4.3541 8.0928 122.0139 56.9957 41.2562 178.6278 108 W 4.3202 8.3488 114.9446 59.0304 27.9954 176.5231 109 I 2.9108 6.4246 116.7955 61.2176 37.6105 175.7206 110 A 4.2321 7.6105 121.9177 53.0873 19.1354 176.2612 111 T 5.0829 7.5477 112.4363 61.7006 70.9927 173.9803 112 R 4.7071 9.0364 126.3700 55.0316 32.3696 176.0141 113 V 4.3663 7.7115 120.1682 60.3886 34.6590 175.3174 114 G 3.1103 6.4569 107.1846 45.7406 0.0000 171.5486 115 N 5.5918 8.3674 115.6967 51.7818 40.8195 173.5958 116 N 5.3638 9.3715 115.9286 52.3892 44.0767 173.0701 117 D 5.7043 9.1755 122.2273 52.7764 43.6982 175.2971 118 F 5.6525 9.5997 122.0150 56.0766 42.1762 174.7093 119 T 5.4668 9.0635 111.4747 59.6632 72.6378 173.3696 120 R 3.7516 8.4959 121.1975 56.0557 30.8650 176.8056 121 Q 4.0528 8.4213 123.2056 56.4217 29.0099 175.6301 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 R 8.11 4.33 0.00 1.90 1.93 0.00 3.11 0.00 0.00 3.35 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 3 K 8.50 4.11 0.00 1.86 1.79 0.00 2.03 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.49 7.81 4 C 9.93 4.11 0.00 3.22 3.20 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 5 S 7.73 4.44 0.00 3.84 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.58 4.07 0.00 0.98 1.00 -0.12 -0.13 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 7 T 6.56 4.20 4.20 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 1.22 0.00 0.00 8 G 7.77 3.65 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 0.00 0.00 0.00 9 E 8.32 5.14 0.00 1.78 1.88 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 2.21 2.29 0.00 10 W 9.64 5.58 0.00 3.16 3.23 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 11 D 9.39 5.61 0.00 2.84 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 12 N 8.71 5.82 0.00 2.32 1.42 0.00 0.00 6.65 7.97 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 13 D 8.69 4.34 0.00 2.83 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 14 L 8.04 4.21 0.00 1.86 1.79 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.22 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 16 S 8.00 4.52 0.00 3.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.54 5.01 1.83 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 1.11 0.82 0.89 0.00 0.00 18 M 9.34 5.13 0.00 1.95 1.57 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 19 T 8.81 5.12 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 1.19 0.00 0.00 20 I 8.90 4.69 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 0.78 0.52 0.37 0.00 0.00 21 G 8.85 4.16 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 0.00 0.00 0.00 22 A 8.57 4.35 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.12 4.44 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 1.00 0.00 0.00 0.92 0.00 0.00 24 N 8.76 4.80 0.00 2.99 2.99 0.00 0.00 6.57 8.09 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 25 D 8.57 4.40 0.00 2.69 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.37 4.57 0.00 2.82 2.84 0.00 0.00 7.12 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 27 G 8.34 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 0.00 0.00 0.00 0.00 28 E 8.42 4.74 0.00 2.02 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 29 F 8.48 5.30 0.00 3.03 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.43 5.44 0.00 2.87 2.80 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 31 G 7.56 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 32 T 8.33 5.37 4.29 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 1.23 0.00 0.00 33 Y 9.25 4.95 0.00 2.98 2.74 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 34 I 8.83 4.90 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.64 0.95 0.00 0.00 35 T 9.05 4.50 4.66 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 1.30 0.00 0.00 36 A 8.67 4.29 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 37 V 7.39 4.45 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 0.73 0.00 0.00 0.91 0.00 0.00 38 A 7.92 4.33 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 39 D 8.76 4.49 0.00 2.63 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 40 N 7.74 4.92 0.00 2.74 2.71 0.00 0.00 6.88 8.03 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 41 P 0.00 4.21 0.00 2.16 2.25 0.00 3.67 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 42 G 8.03 3.63 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 0.00 43 N 7.77 4.61 0.00 2.92 2.93 0.00 0.00 6.99 6.73 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 44 I 6.80 2.00 1.58 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 -0.01 0.79 0.00 0.00 45 T 7.33 4.67 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 1.28 0.00 0.00 46 L 8.66 4.32 0.00 1.75 1.72 0.96 0.91 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 47 S 9.23 5.10 0.00 3.95 3.90 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 48 P 0.00 5.14 0.00 2.08 2.16 0.00 3.94 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.94 0.00 49 L 8.62 5.32 0.00 1.92 1.69 0.84 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.71 4.71 0.00 1.69 1.41 0.89 0.90 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 51 G 7.90 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.41 5.18 1.85 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 1.15 0.61 0.89 0.00 0.00 53 Q 9.30 5.40 0.00 2.23 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.98 0.00 0.00 0.00 0.00 0.00 2.53 2.39 0.00 54 H 8.98 4.56 0.00 3.23 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.57 4.35 0.00 1.76 1.87 0.00 1.80 0.00 0.00 1.67 0.00 0.00 3.16 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.37 7.81 56 R 8.17 3.95 0.00 1.79 1.98 0.00 3.27 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 57 A 7.94 4.13 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.66 4.33 0.00 4.02 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 59 Q 7.84 5.28 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.20 0.00 60 P 0.00 4.65 0.00 2.25 2.27 0.00 3.67 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 61 T 8.40 4.83 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 62 F 8.33 5.31 0.00 3.49 3.27 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 0.00 63 G 9.40 4.73 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 0.00 0.00 0.00 64 F 8.95 5.52 0.00 3.25 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 9.12 5.04 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 1.17 0.00 0.00 66 V 8.66 4.39 1.09 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 -0.56 0.00 0.00 0.64 0.00 0.00 67 H 8.33 4.33 0.00 3.13 3.10 0.00 5.81 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 W 7.43 4.27 0.00 2.75 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 0.00 0.00 0.00 69 N 9.29 4.74 0.00 2.94 3.02 0.00 0.00 6.84 7.06 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 70 F 7.47 5.01 0.00 3.14 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 7.19 4.54 0.00 3.84 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.46 4.20 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.22 0.00 73 S 7.60 4.76 0.00 3.80 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 74 T 8.65 5.06 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 75 S 8.74 5.35 0.00 4.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.68 4.99 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 0.71 0.00 0.00 0.90 0.00 0.00 77 F 9.02 5.31 0.00 1.51 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 78 V 8.67 4.51 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 0.64 0.00 0.00 0.83 0.00 0.00 79 G 7.17 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 0.00 0.00 0.00 0.00 80 Q 8.05 4.99 0.00 1.92 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.79 0.00 0.00 0.00 0.00 0.00 1.26 2.09 0.00 81 C 9.15 5.27 0.00 3.00 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 82 F 9.43 5.59 0.00 3.05 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 83 V 9.08 5.07 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 0.80 0.00 0.00 1.02 0.00 0.00 84 D 8.96 4.79 0.00 2.97 2.91 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 85 R 8.40 3.99 0.00 1.84 2.06 0.00 3.22 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 86 S 8.12 4.26 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 87 G 8.38 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 88 K 8.48 4.25 0.00 1.91 2.09 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.47 7.81 89 E 8.89 5.50 0.00 2.11 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 2.38 2.38 0.00 90 V 9.06 4.92 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 1.14 0.00 0.00 1.19 0.00 0.00 91 L 9.27 5.07 0.00 1.78 1.84 -0.65 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 92 K 9.25 5.14 0.00 2.01 1.93 0.00 1.90 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.79 1.74 7.81 93 T 9.23 5.30 4.61 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 1.65 0.00 0.00 94 K 8.98 5.22 0.00 1.62 1.55 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.22 1.32 7.81 95 W 8.47 5.42 0.00 2.57 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 0.00 0.00 0.00 0.00 96 L 8.83 5.43 0.00 1.60 1.59 0.90 0.75 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 97 Q 9.38 4.96 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 98 R 9.23 4.87 0.00 1.93 1.93 0.00 3.34 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 99 L 8.75 4.85 0.00 1.46 1.51 0.86 0.68 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 0.00 100 A 8.40 4.35 1.20 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 0.00 0.00 101 V 8.16 4.47 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 0.67 0.00 0.00 0.93 0.00 0.00 102 D 8.56 4.52 0.00 2.66 2.72 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 0.00 103 D 7.63 4.85 0.00 2.70 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 0.00 0.00 0.00 0.00 104 I 8.47 3.67 1.88 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 1.50 1.20 0.93 0.00 0.00 105 S 8.46 4.32 0.00 4.09 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 0.00 106 D 8.27 4.90 0.00 2.82 2.61 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 0.00 107 D 8.09 4.35 0.00 2.93 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 0.00 108 W 8.35 4.32 0.00 3.62 3.24 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 0.00 109 I 6.42 2.91 0.56 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 -0.36 0.53 0.00 0.00 110 A 7.61 4.23 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 0.00 111 T 7.55 5.08 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 1.22 0.00 0.00 112 R 9.04 4.71 0.00 2.05 2.05 0.00 3.32 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 113 V 7.71 4.37 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 0.55 0.00 0.00 0.69 0.00 0.00 114 G 6.46 3.11 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 0.00 0.00 0.00 115 N 8.37 5.59 0.00 2.82 2.64 0.00 0.00 5.69 8.04 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 0.00 116 N 9.37 5.36 0.00 3.18 2.59 0.00 0.00 7.13 7.60 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 0.00 117 D 9.18 5.70 0.00 2.67 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 0.00 118 F 9.60 5.65 0.00 2.81 3.11 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 0.00 119 T 9.06 5.47 4.37 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 1.38 0.00 0.00 120 R 8.50 3.75 0.00 1.45 1.48 0.00 2.83 0.00 0.00 2.44 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 121 Q 8.42 4.05 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00