NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.6734 8.4449 120.3891 55.6908 31.0552 172.7708 3 L 4.1308 7.9974 124.5237 52.6473 42.5184 176.1719 4 T 4.1603 9.3332 114.5654 60.2308 72.2168 174.0034 5 P 4.1885 0.0000 0.0000 65.8739 31.2208 178.8143 6 E 3.9792 8.0985 116.7746 59.4566 29.3408 179.1828 7 E 3.9141 8.2900 118.6448 59.1323 29.4103 179.4794 8 K 3.8326 8.3621 118.9519 59.6562 32.1518 179.4697 9 S 4.0815 8.1313 115.0657 61.5721 62.7096 176.7187 10 A 4.0198 8.2467 123.5974 55.0494 18.1445 179.8400 11 V 3.5049 7.9012 116.8324 66.4591 31.7086 178.3691 12 T 3.9513 8.1683 115.4229 66.5418 68.0717 176.4406 13 A 4.0246 8.2391 121.7727 55.2363 18.7329 179.1414 14 L 3.8594 8.0124 118.8691 58.0193 42.0799 178.9852 15 W 4.3129 8.8221 128.4193 60.1722 30.4115 178.0323 16 G 3.7422 8.1369 104.5602 46.7717 0.0000 174.6412 17 K 4.4421 7.8418 118.4874 55.3340 33.0189 176.4880 18 V 3.5844 7.1812 120.6323 62.0068 32.1425 175.9591 19 N 4.4966 8.1144 125.2382 52.1979 38.7280 175.5231 20 V 3.4717 8.0045 127.9159 66.0867 31.7415 177.2779 21 D 4.3889 8.0514 118.0583 57.1364 40.7206 178.2284 22 E 3.8208 8.5686 119.9362 59.3775 29.6633 179.1254 23 V 3.5765 8.0061 118.7826 65.6430 31.4065 178.2287 24 G 3.6684 8.5895 106.1820 47.7049 0.0000 175.8419 25 G 3.6127 8.1512 108.7737 47.4189 0.0000 175.3306 26 E 3.8558 8.2300 121.7757 58.8525 29.5719 178.8231 27 A 3.9301 8.3133 121.2680 54.9931 18.4847 179.4316 28 L 3.9480 8.2822 119.4047 58.0316 42.1788 179.3046 29 G 3.5956 8.2021 105.8455 48.0707 0.0000 175.9021 30 R 3.8952 8.2815 121.2409 58.5093 29.9899 178.9132 31 L 4.0204 8.0846 120.5886 58.3143 42.0508 179.1778 32 L 4.0731 7.9416 119.9781 56.6638 41.2191 179.6261 33 V 3.5775 7.3893 117.7033 65.6675 31.7415 177.9688 34 V 3.5202 7.7433 117.0793 64.4013 32.8199 175.6564 35 Y 3.7806 7.2143 116.1276 54.3641 37.8448 174.2205 36 P 4.7324 0.0000 0.0000 64.1251 31.9867 178.2257 37 W 4.3949 8.1243 116.5972 58.9778 28.2636 177.4832 38 T 4.3129 7.7628 110.6056 63.7030 68.3257 176.0631 39 Q 4.5115 8.2734 121.6343 58.0634 28.4758 178.1130 40 R 3.7348 7.5862 116.5578 58.8533 29.3180 178.0758 41 F 4.1098 7.0077 114.9937 57.7978 39.3614 175.8888 42 F 4.3880 7.5592 118.5995 56.5987 39.5102 177.2133 43 E 4.0027 8.3557 124.0041 59.0781 29.5524 177.3884 44 S 4.5614 8.0767 110.6769 59.0362 63.4785 174.4538 45 F 4.5501 8.5566 119.6214 58.2401 39.8492 176.6669 46 G 3.9961 8.1013 106.5607 44.4798 0.0000 173.8127 47 D 4.5325 8.5607 124.4377 54.3307 41.4386 176.0433 48 L 4.9353 8.3155 127.0324 54.5434 43.1567 178.0177 49 S 4.3029 8.8906 117.1846 60.5180 63.4915 174.3239 50 T 4.7461 7.4378 109.8666 58.2109 73.0899 172.8805 51 P 4.2000 0.0000 0.0000 65.9229 31.3713 178.7455 52 D 4.3219 8.0739 116.9346 57.2559 40.5371 178.6013 53 A 3.9897 8.1455 120.8652 54.9737 18.8074 179.4965 54 V 3.6907 8.1838 117.1794 66.6197 31.4232 178.2385 55 M 4.1855 8.0691 117.0894 57.8281 31.8754 178.0748 56 G 3.9893 7.8450 102.8806 43.5510 0.0000 173.1978 57 N 4.4820 7.5349 121.2552 52.6410 39.4407 174.0396 58 P 4.2177 0.0000 0.0000 65.4648 31.3128 178.8157 59 K 3.7087 8.3326 117.6352 58.8659 31.8229 179.5791 60 V 3.7109 7.8913 118.1318 66.0299 31.6178 177.9935 61 K 3.9082 8.2429 118.1521 59.4565 32.0130 179.1821 62 A 3.9824 8.0845 121.0891 55.4386 18.2288 179.1921 63 H 4.3555 8.6876 117.2840 59.2451 29.9269 177.6709 64 G 3.6327 8.5637 108.3235 47.7084 0.0000 175.7728 65 K 4.0868 8.1850 121.5702 59.3580 32.6133 179.1873 66 K 3.9414 7.9901 120.4364 59.2726 32.2219 178.9267 67 V 3.6354 8.0013 118.7791 66.1552 31.5339 177.8150 68 L 4.3210 8.5734 120.3633 57.6890 41.8002 179.0385 69 G 3.7301 8.4522 106.0159 47.7275 0.0000 175.6121 70 A 4.0978 8.1063 122.8532 54.7485 18.2032 179.4015 71 F 4.1309 8.3345 118.2219 61.5482 39.8234 176.7907 72 S 4.2081 8.9715 112.9880 61.8653 62.3499 176.0344 73 D 4.5202 8.6530 121.7300 57.2102 40.4435 178.9424 74 G 3.5932 7.9799 105.8625 47.0262 0.0000 175.2915 75 L 3.8583 7.3848 119.5865 56.3809 41.6956 178.1903 76 A 4.1611 7.5354 119.4750 52.9993 19.5993 176.7323 77 H 4.9061 8.0908 115.0807 54.7564 29.4931 175.5285 78 L 3.8558 7.9068 120.1207 57.4182 41.9859 178.3961 79 D 4.7675 7.9209 115.6333 53.1403 39.5239 176.0991 80 N 5.0185 8.2403 119.3767 51.8876 39.4908 176.3109 81 L 4.1230 8.1655 119.9773 57.7892 42.1598 179.0175 82 K 4.1115 8.0780 118.0921 59.3603 31.8267 179.4430 83 G 3.6696 7.9703 105.6431 47.6372 0.0000 175.3285 84 T 3.7702 7.9575 117.5452 65.5446 68.6584 175.7910 85 F 4.6751 8.0288 116.8439 56.9412 39.3391 177.3190 86 A 4.0849 7.7993 122.1965 55.9607 18.1943 180.1876 87 T 3.8562 7.8599 113.3837 66.7243 68.5801 176.9346 88 L 4.1688 7.9640 120.5234 57.4261 41.7077 179.3403 89 S 4.3861 8.7281 115.1673 60.9767 62.4210 175.8096 90 E 3.9017 8.4097 121.5354 59.4139 29.1619 179.1858 91 L 3.8918 8.0364 120.0248 58.6533 42.1463 178.7476 92 H 4.0771 8.4572 116.0872 58.9012 28.3019 177.3201 93 C 3.4637 7.8491 120.4365 62.3097 31.1684 175.4080 94 D 4.3086 8.4184 119.8158 56.5358 40.5168 177.4220 95 K 4.3266 7.7098 116.3181 57.3099 34.0511 177.2065 96 L 4.1806 7.9862 117.0289 54.9767 42.2148 176.1606 97 H 4.0586 7.0545 114.7213 56.5746 26.6708 175.2997 98 V 3.9806 7.9404 118.5891 61.2393 32.2329 174.8564 99 D 4.4153 8.9027 127.4015 53.8694 41.6096 175.1541 100 P 3.5396 0.0000 0.0000 64.8144 31.7287 177.9436 101 E 3.8970 8.4851 119.0786 59.2743 29.2523 178.4046 102 N 4.2046 7.9161 116.5540 56.2300 38.4613 177.2970 103 F 4.4691 7.4321 119.2914 60.4205 38.9032 177.7513 104 R 3.9398 7.8349 118.0130 59.3405 29.9584 178.3709 105 L 3.7729 8.1248 119.1956 57.6682 41.5834 179.2645 106 L 4.0595 8.4255 120.8688 57.9761 41.9895 179.2128 107 G 3.6950 8.1820 105.8093 47.9944 0.0000 175.4914 108 N 4.4653 8.4248 119.1135 55.9697 38.5209 177.7789 109 V 3.6548 8.1635 119.9725 65.6890 31.5618 177.8389 110 L 3.8611 8.4606 120.5876 58.0849 41.8665 179.0555 111 V 3.5194 7.9103 118.1048 66.3147 31.4038 177.6584 112 C 4.0511 8.0581 116.3707 62.8640 27.9293 176.4006 113 V 3.4968 8.0341 120.1192 65.9189 31.0862 178.0560 114 L 3.8196 8.2938 118.8342 57.5416 41.3289 179.3006 115 A 3.7947 7.4384 120.8104 55.3350 18.0934 179.1495 116 H 4.1230 8.0490 115.6794 59.6085 29.9972 176.7641 117 H 3.9317 8.2269 119.1972 58.9346 30.1688 176.6250 118 F 4.5967 8.5784 118.2623 56.6834 39.5993 177.2888 119 G 3.8647 8.8495 108.7879 46.0360 0.0000 177.4345 120 K 4.0184 8.8840 122.4222 59.2019 32.4416 177.8864 121 E 4.0547 8.0770 120.0386 58.8264 29.9877 177.1886 122 F 4.4858 8.2205 122.8621 57.1831 37.7476 174.7816 123 T 4.2220 7.3420 116.2919 59.9636 71.4863 173.6205 124 P 4.1451 0.0000 0.0000 65.4750 31.3104 177.1568 125 P 4.2594 0.0000 0.0000 65.4711 31.1628 178.8855 126 V 3.5499 7.4173 117.2266 65.8764 31.4117 177.8669 127 Q 3.5046 7.9551 119.4623 58.9298 28.9801 177.8841 128 A 3.9870 8.3878 121.9483 55.2036 18.4709 179.4001 129 A 3.8805 8.0257 118.9740 55.7406 18.4868 179.5647 130 Y 3.8868 8.4252 115.3216 61.1194 37.8332 178.8841 131 Q 4.1403 8.7520 119.6567 58.9670 28.8223 178.9367 132 K 3.9518 8.0007 119.2151 59.3039 31.9906 179.5389 133 V 3.4492 7.5593 118.1845 66.2653 31.4423 178.6459 134 V 3.8479 8.4387 112.3047 64.1649 31.2564 178.5325 135 A 4.0879 8.3881 121.0190 55.0393 18.2742 179.8558 136 G 3.5088 8.4696 104.7034 47.9595 0.0000 176.0945 137 V 3.2657 8.0743 121.0898 65.4460 31.5017 177.9762 138 A 3.8547 8.1262 120.6708 55.2425 18.0022 179.3877 139 N 4.2882 8.2654 114.1446 56.2712 38.9602 177.2644 140 A 4.1335 7.8918 122.2387 55.2052 18.2305 179.7556 141 L 3.8335 8.0472 117.4473 56.9517 41.6333 178.5870 142 A 4.3304 7.7611 119.2981 52.7058 18.8504 178.4812 143 H 4.1707 7.9215 116.8707 58.6729 30.0743 176.0424 144 K 4.4552 8.3479 116.5825 56.2600 32.0577 176.4139 145 Y 4.1878 7.9567 117.4632 58.4285 38.4248 175.7074 146 H 4.4766 8.2742 117.1298 56.1325 28.4218 173.2482 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 H 8.44 4.67 0.00 3.10 3.23 0.00 5.69 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 3 L 8.00 4.13 0.00 1.63 1.45 0.79 0.52 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 4 T 9.33 4.16 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 1.25 0.00 0.00 5 P 0.00 4.19 0.00 2.16 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 2.11 2.17 0.00 6 E 8.10 3.98 0.00 2.03 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 2.38 2.45 0.00 7 E 8.29 3.91 0.00 2.18 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 2.28 2.30 0.00 8 K 8.36 3.83 0.00 1.86 1.79 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.49 7.81 9 S 8.13 4.08 0.00 4.00 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 10 A 8.25 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 11 V 7.90 3.50 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 0.64 0.00 0.00 0.50 0.00 0.00 12 T 8.17 3.95 4.39 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 1.25 0.00 0.00 13 A 8.24 4.02 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 14 L 8.01 3.86 0.00 1.86 1.93 0.13 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.82 4.31 0.00 3.84 3.22 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 0.00 16 G 8.14 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 17 K 7.84 4.44 0.00 2.10 2.08 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.62 7.81 18 V 7.18 3.58 1.08 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 -0.15 0.00 0.00 0.66 0.00 0.00 19 N 8.11 4.50 0.00 2.68 2.55 0.00 0.00 6.83 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 8.00 3.47 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 1.21 0.00 0.00 0.95 0.00 0.00 21 D 8.05 4.39 0.00 2.70 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 22 E 8.57 3.82 0.00 1.99 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 0.00 2.16 2.25 0.00 23 V 8.01 3.58 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 0.89 0.00 0.00 0.64 0.00 0.00 24 G 8.59 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 0.00 0.00 0.00 25 G 8.15 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 26 E 8.23 3.86 0.00 2.15 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 0.00 2.23 2.31 0.00 27 A 8.31 3.93 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 28 L 8.28 3.95 0.00 1.72 1.62 0.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.20 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 30 R 8.28 3.90 0.00 1.90 1.93 0.00 3.08 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 31 L 8.08 4.02 0.00 1.85 1.84 0.99 0.93 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 32 L 7.94 4.07 0.00 1.96 1.66 0.90 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.39 3.58 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 0.71 0.00 0.00 0.93 0.00 0.00 34 V 7.74 3.52 1.60 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 -0.07 0.00 0.00 0.75 0.00 0.00 35 Y 7.21 3.78 0.00 2.57 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 4.73 0.00 2.32 2.29 0.00 3.76 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 2.23 1.90 0.00 37 W 8.12 4.39 0.00 3.54 3.44 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 38 T 7.76 4.31 4.39 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 1.08 0.00 0.00 39 Q 8.27 4.51 0.00 2.26 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 40 R 7.59 3.73 0.00 1.72 1.99 0.00 2.77 0.00 0.00 3.02 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.50 0.00 41 F 7.01 4.11 0.00 1.53 2.27 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 42 F 7.56 4.39 0.00 2.84 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 0.00 0.00 0.00 43 E 8.36 4.00 0.00 1.88 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 2.31 2.31 0.00 44 S 8.08 4.56 0.00 4.16 4.07 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 0.00 0.00 0.00 0.00 45 F 8.56 4.55 0.00 3.22 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 46 G 8.10 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 47 D 8.56 4.53 0.00 2.65 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 48 L 8.32 4.94 0.00 1.65 1.62 1.01 1.03 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 49 S 8.89 4.30 0.00 3.97 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 0.00 50 T 7.44 4.75 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 4.20 0.00 2.15 2.10 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 2.08 2.15 0.00 52 D 8.07 4.32 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 8.15 3.99 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 54 V 8.18 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 0.96 0.00 0.00 55 M 8.07 4.19 0.00 2.00 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 2.88 0.00 56 G 7.85 3.99 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 0.00 0.00 0.00 57 N 7.53 4.48 0.00 3.02 2.83 0.00 0.00 7.15 7.09 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 58 P 0.00 4.22 0.00 2.14 2.04 0.00 3.62 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 59 K 8.33 3.71 0.00 1.66 0.74 0.00 1.74 0.00 0.00 1.32 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.11 1.25 7.81 60 V 7.89 3.71 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 1.12 0.00 0.00 1.04 0.00 0.00 61 K 8.24 3.91 0.00 1.96 1.82 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.56 7.81 62 A 8.08 3.98 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 63 H 8.69 4.36 0.00 3.65 3.47 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 8.56 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 65 K 8.19 4.09 0.00 2.05 2.26 0.00 1.32 0.00 0.00 1.91 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.64 1.66 7.81 66 K 7.99 3.94 0.00 1.94 2.05 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.51 1.52 7.81 67 V 8.00 3.64 2.15 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 0.99 0.00 0.00 0.90 0.00 0.00 68 L 8.57 4.32 0.00 1.89 1.76 0.76 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.45 3.73 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 70 A 8.11 4.10 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 8.33 4.13 0.00 3.09 3.39 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 72 S 8.97 4.21 0.00 4.53 4.28 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 73 D 8.65 4.52 0.00 2.85 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 74 G 7.98 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 0.00 0.00 0.00 75 L 7.38 3.86 0.00 1.42 1.41 -0.39 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.54 4.16 1.10 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 0.00 0.00 77 H 8.09 4.91 0.00 3.01 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.91 3.86 0.00 1.54 1.64 0.77 0.91 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 79 D 7.92 4.77 0.00 2.73 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 80 N 8.24 5.02 0.00 2.71 2.66 0.00 0.00 7.20 7.17 0.00 0.00 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 8.17 4.12 0.00 1.74 1.80 0.88 0.83 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 82 K 8.08 4.11 0.00 1.73 1.77 0.00 1.40 0.00 0.00 1.17 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.44 7.81 83 G 7.97 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 0.00 0.00 0.00 84 T 7.96 3.77 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 0.37 0.00 0.00 85 F 8.03 4.68 0.00 3.18 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 86 A 7.80 4.08 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 87 T 7.86 3.86 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 1.22 0.00 0.00 88 L 7.96 4.17 0.00 2.03 1.86 1.16 0.95 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 89 S 8.73 4.39 0.00 4.14 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 0.00 90 E 8.41 3.90 0.00 2.17 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 2.34 2.56 0.00 91 L 8.04 3.89 0.00 1.88 1.87 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.46 4.08 0.00 3.77 3.81 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.85 3.46 0.00 1.23 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 94 D 8.42 4.31 0.00 2.67 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 K 7.71 4.33 0.00 1.76 1.79 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.35 7.81 96 L 7.99 4.18 0.00 1.68 1.63 0.67 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.05 4.06 0.00 3.28 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.94 3.98 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 0.17 0.00 0.00 0.34 0.00 0.00 99 D 8.90 4.42 0.00 2.80 2.59 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 0.00 100 P 0.00 3.54 0.00 2.01 1.91 0.00 3.47 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.50 0.00 101 E 8.49 3.90 0.00 2.04 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 2.32 2.38 0.00 102 N 7.92 4.20 0.00 2.39 2.64 0.00 0.00 6.92 8.02 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 0.00 103 F 7.43 4.47 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 0.00 104 R 7.83 3.94 0.00 1.89 2.08 0.00 3.19 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 105 L 8.12 3.77 0.00 1.67 1.25 0.72 -0.17 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 0.00 106 L 8.43 4.06 0.00 1.82 1.86 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.18 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 0.00 108 N 8.42 4.47 0.00 2.90 2.95 0.00 0.00 6.68 7.20 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 0.00 109 V 8.16 3.65 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 1.09 0.00 0.00 1.17 0.00 0.00 110 L 8.46 3.86 0.00 1.70 1.82 0.90 0.38 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 0.00 111 V 7.91 3.52 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 1.41 0.00 0.00 1.19 0.00 0.00 112 C 8.06 4.05 0.00 3.16 2.94 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 0.00 113 V 8.03 3.50 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 0.92 0.00 0.00 0.89 0.00 0.00 114 L 8.29 3.82 0.00 0.85 1.17 0.63 1.09 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 0.00 115 A 7.44 3.79 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 0.00 116 H 8.05 4.12 0.00 3.16 3.39 0.00 5.78 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 8.23 3.93 0.00 2.84 2.94 0.00 5.99 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 8.58 4.60 0.00 3.26 3.08 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 0.00 119 G 8.85 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 0.00 120 K 8.88 4.02 0.00 1.91 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.48 7.81 121 E 8.08 4.05 0.00 2.09 2.27 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 2.28 2.26 0.00 122 F 8.22 4.49 0.00 3.11 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 0.00 123 T 7.34 4.22 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 1.28 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.13 0.00 3.57 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 2.11 2.18 0.00 125 P 0.00 4.26 0.00 2.11 2.06 0.00 3.48 0.00 0.00 3.65 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 3.55 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 1.04 0.00 0.00 0.90 0.00 0.00 127 Q 7.96 3.50 0.00 1.66 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 128 A 8.39 3.99 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 8.03 3.88 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 0.00 130 Y 8.43 3.89 0.00 3.36 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 0.00 131 Q 8.75 4.14 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.77 2.62 0.00 132 K 8.00 3.95 0.00 1.95 1.82 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.63 7.81 133 V 7.56 3.45 2.16 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 0.90 0.00 0.00 0.69 0.00 0.00 134 V 8.44 3.85 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 1.02 0.00 0.00 1.14 0.00 0.00 135 A 8.39 4.09 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 0.00 136 G 8.47 3.51 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 0.00 0.00 0.00 137 V 8.07 3.27 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 0.52 0.00 0.00 0.61 0.00 0.00 138 A 8.13 3.85 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 0.00 0.00 139 N 8.27 4.29 0.00 2.88 2.88 0.00 0.00 7.04 7.52 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 0.00 140 A 7.89 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 0.00 141 L 8.05 3.83 0.00 0.50 0.39 0.04 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.76 4.33 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 0.00 143 H 7.92 4.17 0.00 3.36 3.53 0.00 5.75 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 0.00 144 K 8.35 4.46 0.00 1.86 1.85 0.00 1.84 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.78 7.81 145 Y 7.96 4.19 0.00 3.13 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 0.00 146 H 8.27 4.48 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