NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4624 8.3044 120.3337 55.1873 33.4165 174.5145 2 V 3.8350 8.2097 123.4752 60.7954 32.6382 172.1223 3 E 4.1599 9.3944 128.4418 56.0676 31.1792 175.2888 4 I 4.4817 8.2334 125.2194 59.4283 39.6965 174.5873 5 N 5.1728 8.2667 122.1919 50.4557 40.4244 174.3289 6 N 4.3372 8.6178 114.6607 56.9983 38.8575 177.0114 7 Q 4.1128 8.0983 119.1775 59.1196 29.0494 178.7480 8 R 4.0980 8.7684 119.4801 58.9609 29.9652 178.9924 9 K 4.0198 8.3007 119.4707 59.3667 32.1712 178.8113 10 A 3.8814 8.0925 121.2857 54.8582 18.3327 179.3917 11 F 4.3120 8.6323 119.3883 61.4106 39.4539 177.4007 12 L 3.9090 8.0733 118.4548 57.8204 41.4789 179.1454 13 D 4.3628 7.8976 118.9564 57.6660 40.7396 178.4203 14 M 3.9898 7.9506 118.5513 58.8412 32.1482 178.2733 15 L 3.8646 7.5952 118.1877 57.2985 41.6232 179.2303 16 A 4.2274 7.9574 122.4023 54.0157 18.1913 179.5155 17 W 4.3678 8.1337 128.2884 59.7854 30.6667 178.2086 18 S 3.4145 8.4046 112.7698 61.3400 61.7707 174.9275 19 E 4.1431 8.5114 116.6992 56.2780 29.5302 176.5393 20 G 3.7596 7.6424 107.3013 47.0972 0.0000 174.8075 21 T 4.3058 8.7148 111.3210 61.7672 70.5586 172.9464 22 D 4.8975 7.5206 121.1350 51.8881 41.4783 174.3102 23 N 5.2507 8.1352 116.3858 51.4518 39.1540 175.9641 24 G 4.0954 8.5190 108.7154 46.0162 0.0000 174.6398 25 R 4.0199 7.2158 118.9672 57.4578 30.7833 175.7346 26 Q 3.8005 8.6371 116.1133 56.4347 29.6707 176.8633 27 K 4.1940 8.4435 126.1216 56.5161 33.0719 175.7081 28 T 4.4760 7.9447 117.7791 61.4227 69.9411 173.3109 29 R 4.3362 8.6382 125.7733 56.8426 31.3769 176.9567 30 N 4.9017 7.8592 115.4055 54.7837 39.9593 173.4910 31 H 4.1734 8.3553 113.6048 55.6047 27.3575 176.6124 32 G 3.8678 8.5967 107.3190 45.5487 0.0000 175.6154 33 Y 4.1408 8.0472 117.9034 60.2563 38.1470 176.7276 34 D 3.3700 7.8288 117.7063 52.4527 41.0834 176.2106 35 V 4.2207 7.5420 120.8738 63.0701 32.8246 175.0308 36 I 5.0623 8.7749 128.3676 58.9458 40.5556 175.5820 37 V 4.0891 7.5791 123.9018 62.7524 31.5718 176.4945 38 G 3.9717 8.7713 111.7835 44.5025 0.0000 173.9084 39 G 4.1490 7.7652 106.8152 45.0110 0.0000 174.1046 40 E 4.2965 8.2130 118.6402 56.5032 30.8613 175.7475 41 L 5.4362 8.3667 119.9945 52.9801 45.3638 175.8415 42 F 5.1933 8.4183 115.5664 55.4800 40.3289 175.0066 43 T 4.3371 8.7377 107.7538 61.3435 70.5827 173.3996 44 D 4.7620 8.2016 121.9061 53.4918 41.7203 174.9780 45 Y 4.8163 8.7599 123.6549 57.9817 38.2433 177.5878 46 S 4.5706 8.1531 115.6529 60.6932 63.3921 173.1086 47 D 4.4373 7.4079 118.2369 53.2850 43.5965 173.7621 48 H 2.5800 7.7395 121.6600 54.3151 30.0865 174.0808 49 P 3.6100 0.0000 0.0000 64.1251 30.9250 176.1589 50 R 3.6391 7.0045 115.9641 56.7380 28.2113 175.8939 51 K 4.2160 7.8256 117.6199 54.6990 33.1325 175.3510 52 L 4.4194 8.2942 129.3948 54.3217 41.9249 175.5189 53 V 4.0021 8.6837 127.6162 62.4215 33.0321 175.0763 54 T 4.1779 8.4174 118.6863 60.9073 68.3449 174.4646 55 L 4.0026 8.6391 129.0718 54.9738 42.1547 177.2790 56 N 5.0569 7.9659 116.1076 50.3793 40.3793 174.6618 57 P 4.2328 0.0000 0.0000 65.0786 31.9552 176.2321 58 K 4.6041 8.0589 118.3640 54.2468 31.9302 176.1482 59 L 4.5736 7.0781 119.1022 54.8709 46.2587 172.6091 60 K 4.7364 8.4044 124.4091 54.9704 35.9061 174.8976 61 S 4.5987 8.6800 112.4972 58.0513 65.2913 175.0416 62 T 4.6865 8.4145 114.3838 60.9714 69.7422 174.9873 63 G 3.8142 7.7693 112.1669 46.5579 0.0000 172.6130 64 A 4.5890 9.0378 124.5878 51.8410 22.5982 176.2230 65 G 4.3460 9.0747 106.9124 44.8968 0.0000 174.7197 66 R 3.6271 9.2193 118.6057 58.5458 29.7682 176.7535 67 Y 4.7114 7.4384 113.8219 58.1588 38.5162 176.1978 68 Q 3.3756 7.6331 114.9051 57.1068 26.6404 172.2881 69 L 4.9127 8.9841 122.3929 53.4885 44.1624 176.2600 70 L 4.5881 8.6584 125.7574 54.4585 43.7424 178.3981 71 S 3.8647 8.1760 116.1691 61.4220 62.8066 176.5967 72 R 3.6042 7.7990 121.8630 59.2175 29.5709 178.4443 73 W 4.5570 7.6690 117.7283 59.1651 29.1261 178.3657 74 W 4.5228 8.2508 128.3338 60.7345 29.7336 177.5891 75 D 4.0729 8.2973 118.6672 57.2919 40.2189 178.7301 76 A 3.8556 7.6881 120.6337 55.5951 18.3943 179.4471 77 Y 4.1191 8.2643 115.4060 60.8617 37.8465 178.8872 78 R 3.4763 7.9495 117.7251 58.7647 29.2018 178.9565 79 K 3.8286 7.4518 119.6355 59.1379 32.0339 178.6461 80 Q 3.8953 7.9539 119.1776 58.6098 29.0420 176.6995 81 L 4.5188 8.2343 114.8935 53.4901 42.0146 176.2796 82 G 3.9882 7.4995 106.7254 46.2604 0.0000 174.2332 83 L 4.2690 8.0915 119.9474 53.9240 41.9516 177.6548 84 K 4.1356 8.9089 124.6043 58.8544 32.4024 177.1538 85 D 5.5301 7.8485 115.9439 51.2193 41.9217 175.6078 86 F 4.8826 8.9312 121.1356 57.9881 39.6228 176.4949 87 S 4.3602 8.2465 114.4878 57.1622 64.5849 172.3246 88 P 3.5597 0.0000 0.0000 65.2419 30.8776 178.7154 89 K 3.8457 7.8006 117.9187 59.8207 32.1678 178.8729 90 S 4.3696 7.8440 115.3062 61.6762 62.9121 176.6977 91 Q 4.2379 8.2498 121.0451 59.0221 28.3494 178.4781 92 D 4.5764 8.7748 120.1528 57.2037 40.7540 178.3232 93 A 4.0384 8.0011 120.9917 55.4445 18.3720 179.9646 94 V 3.3029 7.9183 115.7298 65.9373 31.6530 177.9405 95 A 4.1883 7.9721 120.1613 55.4747 18.2282 179.6324 96 L 4.0821 8.2787 117.2183 57.3489 41.5831 179.4313 97 Q 3.9808 7.6570 120.1617 59.0341 28.9770 177.9983 98 Q 3.9111 7.8434 119.1807 58.8444 28.7161 178.5755 99 I 3.7891 7.8154 120.9673 64.1728 37.1033 178.4621 100 K 3.9021 8.1870 120.4671 59.6284 31.8864 178.7966 101 E 4.1090 8.2109 117.6821 59.1895 29.4328 178.7829 102 R 4.2507 7.8622 115.8619 55.7390 30.4005 176.7221 103 G 3.8141 8.3357 106.8762 46.9950 0.0000 174.9885 104 A 4.3855 7.7334 120.6696 51.7368 19.3303 179.3839 105 L 3.8089 7.6840 118.1749 57.4240 41.7686 177.5978 106 P 4.2522 0.0000 0.0000 65.7272 31.2706 178.5708 107 M 4.0196 7.8781 117.1016 58.4115 31.6783 178.7474 108 I 3.5960 7.6203 119.9023 64.4317 37.0346 178.1955 109 D 4.4194 7.8938 118.9063 56.8977 40.7714 178.1725 110 R 4.3635 7.8412 113.6194 56.1412 30.0312 177.3138 111 G 3.9968 8.0346 109.0979 45.5276 0.0000 173.5656 112 D 4.8625 7.7538 122.0030 53.3107 37.5768 176.9446 113 I 3.6624 7.3153 123.6441 64.1671 37.7816 178.2244 114 R 3.9385 7.8596 118.6553 59.2906 29.8367 178.7089 115 Q 3.9986 8.0335 118.6754 58.8993 29.0948 177.9335 116 A 3.9601 7.7233 122.1354 55.0576 18.2347 179.6819 117 I 3.9419 8.0404 118.4463 64.7018 36.9837 178.2282 118 D 4.4900 7.8908 117.3246 57.0258 41.0756 177.8714 119 R 4.1260 7.5952 118.9881 58.8022 30.4153 177.1292 120 C 4.6555 8.1007 114.8482 59.6973 27.8946 175.4397 121 S 4.3050 7.8134 117.5511 61.5958 62.3251 175.9821 122 N 4.6621 8.1295 117.2968 54.3042 37.6495 175.8787 123 I 3.6160 7.6281 120.0178 62.7281 37.5879 176.0191 124 W 4.7640 7.8334 119.5372 54.4783 31.1459 176.7807 125 A 4.3930 8.8531 126.5684 55.1436 18.2342 178.2621 126 S 5.1000 8.3276 108.6308 58.6926 63.7999 173.6536 127 L 4.8714 7.6571 122.5769 52.2759 43.0029 174.1237 128 P 4.5305 0.0000 0.0000 64.9818 31.1865 176.4774 129 G 3.9796 9.5993 112.1149 44.8354 0.0000 173.9985 130 A 4.1758 7.1484 121.9468 54.5802 18.3513 179.7051 131 G 3.6833 8.4330 101.5268 46.9653 0.0000 173.5704 132 Y 4.4923 7.9897 114.7377 56.9300 38.1750 177.6233 133 G 3.9657 8.1521 107.2571 45.9303 0.0000 173.8917 134 Q 4.4672 7.5070 118.0391 54.5564 30.9858 175.2039 135 F 4.3007 8.8063 122.2047 58.6882 40.2139 173.5830 136 E 4.8479 8.0911 126.4887 54.9326 30.4933 176.2089 137 H 4.1485 8.8307 122.6038 55.2790 29.6884 175.5236 138 K 4.1520 8.2389 121.9092 55.8760 33.3039 177.9084 139 A 4.0586 8.7424 126.6173 55.6529 18.3771 179.8727 140 D 4.3791 8.1891 117.0606 57.5683 40.9860 179.2062 141 S 4.1482 8.0403 114.3080 61.3865 63.2063 176.4270 142 L 3.9172 7.7666 122.6353 57.4443 41.3611 179.4375 143 I 3.6615 7.6354 119.0706 64.2346 37.0429 178.2369 144 A 3.9301 7.7134 121.0086 55.1580 18.0370 179.4874 145 K 3.5088 7.2816 116.1850 59.3670 32.2731 178.2971 146 F 4.1608 8.2066 120.8085 61.3964 39.3641 177.1611 147 K 4.2134 8.5274 119.5626 58.6433 31.6711 178.2493 148 E 4.1883 7.8911 114.3172 56.9511 29.9264 177.4323 149 A 4.3496 7.4864 121.2997 51.7250 19.6541 177.7229 150 G 3.8483 7.5640 104.8058 45.1334 0.0000 174.8217 151 G 3.1516 7.2219 108.6026 45.3172 0.0000 172.4230 152 T 4.7154 8.7562 115.5397 61.5629 71.5333 174.2538 153 V 4.7578 7.9367 123.2781 61.0347 34.5406 175.4342 154 R 4.1894 8.5702 119.0148 57.0494 30.7935 176.2128 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 4.46 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 2 V 8.21 3.84 2.09 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 0.74 0.00 0.00 1.02 0.00 0.00 3 E 9.39 4.16 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 4 I 8.23 4.48 1.89 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 1.50 0.93 0.94 0.00 0.00 5 N 8.27 5.17 0.00 2.91 2.94 0.00 0.00 5.89 6.96 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 6 N 8.62 4.34 0.00 2.84 2.84 0.00 0.00 6.93 6.86 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 7 Q 8.10 4.11 0.00 2.31 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.69 0.00 0.00 0.00 0.00 0.00 2.50 2.70 0.00 8 R 8.77 4.10 0.00 1.92 2.00 0.00 3.24 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 9 K 8.30 4.02 0.00 1.97 1.96 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.48 7.81 10 A 8.09 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 8.63 4.31 0.00 3.49 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 12 L 8.07 3.91 0.00 2.03 1.86 0.99 0.48 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 13 D 7.90 4.36 0.00 2.77 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 14 M 7.95 3.99 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.45 0.00 15 L 7.60 3.86 0.00 1.65 1.09 -0.03 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.96 4.23 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 17 W 8.13 4.37 0.00 3.49 3.31 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 18 S 8.40 3.41 0.00 4.01 3.95 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 19 E 8.51 4.14 0.00 2.02 2.00 0.00 0.00 0.00 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 2.42 0.00 20 G 7.64 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 21 T 8.71 4.31 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 1.23 0.00 0.00 22 D 7.52 4.90 0.00 2.65 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.14 5.25 0.00 2.80 2.81 0.00 0.00 6.18 7.03 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 24 G 8.52 4.10 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 0.00 25 R 7.22 4.02 0.00 1.76 1.94 0.00 3.34 0.00 0.00 3.13 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 26 Q 8.64 3.80 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 27 K 8.44 4.19 0.00 1.71 1.65 0.00 1.73 0.00 0.00 1.61 0.00 0.00 3.05 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.39 1.45 7.81 28 T 7.94 4.48 4.17 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 0.00 0.00 0.00 1.16 0.00 0.00 29 R 8.64 4.34 0.00 1.96 1.94 0.00 3.22 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 30 N 7.86 4.90 0.00 2.74 2.75 0.00 0.00 7.40 7.89 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 31 H 8.36 4.17 0.00 3.28 3.25 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.60 3.87 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 0.00 0.00 0.00 33 Y 8.05 4.14 0.00 3.34 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 34 D 7.83 3.37 0.00 2.21 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 35 V 7.54 4.22 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 0.91 0.00 0.00 0.86 0.00 0.00 36 I 8.77 5.06 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.84 0.93 0.00 0.00 37 V 7.58 4.09 2.23 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 0.83 0.00 0.00 0.96 0.00 0.00 38 G 8.77 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 39 G 7.77 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 0.00 0.00 0.00 40 E 8.21 4.30 0.00 1.92 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 2.40 2.29 0.00 41 L 8.37 5.44 0.00 1.42 1.45 0.97 0.77 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 42 F 8.42 5.19 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 43 T 8.74 4.34 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 1.21 0.00 0.00 44 D 8.20 4.76 0.00 2.69 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 45 Y 8.76 4.82 0.00 3.10 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 46 S 8.15 4.57 0.00 4.14 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 0.00 47 D 7.41 4.44 0.00 2.66 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 48 H 7.74 2.58 0.00 1.40 2.60 0.00 5.75 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 3.61 0.00 1.91 1.52 0.00 2.55 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.21 0.00 50 R 7.00 3.64 0.00 1.87 1.96 0.00 3.10 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 51 K 7.83 4.22 0.00 1.62 1.65 0.00 1.63 0.00 0.00 1.61 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.45 7.81 52 L 8.29 4.42 0.00 1.66 1.59 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.68 4.00 2.09 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 1.01 0.00 0.00 0.99 0.00 0.00 54 T 8.42 4.18 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 1.21 0.00 0.00 55 L 8.64 4.00 0.00 1.82 1.59 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 56 N 7.97 5.06 0.00 2.92 2.91 0.00 0.00 5.92 7.76 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 57 P 0.00 4.23 0.00 2.06 2.21 0.00 3.62 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 2.04 2.12 0.00 58 K 8.06 4.60 0.00 1.65 1.71 0.00 1.78 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.39 7.81 59 L 7.08 4.57 0.00 1.78 1.60 0.95 0.74 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 60 K 8.40 4.74 0.00 1.74 1.76 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.38 7.81 61 S 8.68 4.60 0.00 3.82 3.66 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 62 T 8.41 4.69 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 1.19 0.00 0.00 63 G 7.77 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 0.00 0.00 0.00 64 A 9.04 4.59 1.07 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 0.00 0.00 65 G 9.07 4.35 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 0.00 66 R 9.22 3.63 0.00 0.69 0.66 0.00 2.21 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.00 0.00 67 Y 7.44 4.71 0.00 3.34 3.15 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 68 Q 7.63 3.38 0.00 2.46 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 69 L 8.98 4.91 0.00 2.06 1.93 1.29 1.32 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 70 L 8.66 4.59 0.00 2.04 1.63 1.14 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.18 3.86 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 72 R 7.80 3.60 0.00 1.49 1.23 0.00 2.64 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.15 0.00 73 W 7.67 4.56 0.00 3.64 3.43 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 74 W 8.25 4.52 0.00 3.57 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 75 D 8.30 4.07 0.00 2.81 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 76 A 7.69 3.86 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 77 Y 8.26 4.12 0.00 3.21 3.03 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 78 R 7.95 3.48 0.00 1.24 0.66 0.00 2.59 0.00 0.00 2.55 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.23 0.00 79 K 7.45 3.83 0.00 1.79 1.92 0.00 1.57 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.38 7.81 80 Q 7.95 3.90 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 81 L 8.23 4.52 0.00 1.77 1.72 1.04 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.50 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 83 L 8.09 4.27 0.00 1.65 1.90 1.17 0.94 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 84 K 8.91 4.14 0.00 1.84 1.95 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.43 7.81 85 D 7.85 5.53 0.00 3.16 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 86 F 8.93 4.88 0.00 2.44 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 87 S 8.25 4.36 0.00 3.96 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 88 P 0.00 3.56 0.00 1.55 0.49 0.00 3.23 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.42 0.00 89 K 7.80 3.85 0.00 1.76 1.79 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.55 7.81 90 S 7.84 4.37 0.00 4.16 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 91 Q 8.25 4.24 0.00 2.41 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 92 D 8.77 4.58 0.00 2.93 2.82 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 93 A 8.00 4.04 1.54 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 94 V 7.92 3.30 2.34 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 0.89 0.00 0.00 1.41 0.00 0.00 95 A 7.97 4.19 1.13 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 96 L 8.28 4.08 0.00 1.69 1.73 0.98 0.96 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 97 Q 7.66 3.98 0.00 2.20 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.57 2.78 0.00 98 Q 7.84 3.91 0.00 2.13 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.05 2.22 0.00 99 I 7.82 3.79 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.20 0.77 0.00 0.00 100 K 8.19 3.90 0.00 1.91 1.95 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.47 7.81 101 E 8.21 4.11 0.00 2.13 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 2.39 2.61 0.00 102 R 7.86 4.25 0.00 1.95 2.06 0.00 3.39 0.00 0.00 3.14 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.77 0.00 103 G 8.34 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 0.00 0.00 0.00 104 A 7.73 4.39 1.19 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 0.00 0.00 105 L 7.68 3.81 0.00 1.65 1.70 0.90 1.03 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 0.00 106 P 0.00 4.25 0.00 2.12 2.07 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 107 M 7.88 4.02 0.00 2.15 2.15 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 2.64 2.59 0.00 108 I 7.62 3.60 1.85 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.55 0.90 0.00 0.00 109 D 7.89 4.42 0.00 2.82 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 0.00 110 R 7.84 4.36 0.00 1.98 2.03 0.00 3.22 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.72 0.00 111 G 8.03 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 0.00 112 D 7.75 4.86 0.00 2.69 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 0.00 113 I 7.32 3.66 1.61 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.32 0.44 0.00 0.00 114 R 7.86 3.94 0.00 1.84 1.97 0.00 3.12 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 115 Q 8.03 4.00 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 116 A 7.72 3.96 1.13 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 0.00 117 I 8.04 3.94 2.08 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 1.40 1.46 0.97 0.00 0.00 118 D 7.89 4.49 0.00 2.81 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 0.00 119 R 7.60 4.13 0.00 2.02 2.07 0.00 3.35 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 120 C 8.10 4.66 0.00 3.43 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.81 4.31 0.00 4.24 4.32 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 0.00 122 N 8.13 4.66 0.00 2.88 2.98 0.00 0.00 6.00 7.81 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 0.00 123 I 7.63 3.62 1.32 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 1.11 0.48 -0.94 0.00 0.00 124 W 7.83 4.76 0.00 3.57 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 0.00 125 A 8.85 4.39 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 0.00 126 S 8.33 5.10 0.00 4.22 4.26 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 0.00 127 L 7.66 4.87 0.00 1.99 1.72 1.22 0.88 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 0.00 128 P 0.00 4.53 0.00 2.18 2.25 0.00 3.78 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 129 G 9.60 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.15 4.18 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 0.00 131 G 8.43 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 0.00 132 Y 7.99 4.49 0.00 3.18 2.98 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 0.00 0.00 0.00 133 G 8.15 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 0.00 134 Q 7.51 4.47 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.88 0.00 0.00 0.00 0.00 0.00 2.68 2.54 0.00 135 F 8.81 4.30 0.00 3.12 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 0.00 136 E 8.09 4.85 0.00 1.72 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 2.50 2.50 0.00 137 H 8.83 4.15 0.00 3.14 3.39 0.00 5.65 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 0.00 138 K 8.24 4.15 0.00 1.94 1.73 0.00 1.53 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.53 7.81 139 A 8.74 4.06 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 0.00 140 D 8.19 4.38 0.00 2.72 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 0.00 141 S 8.04 4.15 0.00 4.24 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 0.00 142 L 7.77 3.92 0.00 1.84 1.72 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 143 I 7.64 3.66 2.02 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.95 0.92 0.00 0.00 144 A 7.71 3.93 1.27 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 0.00 0.00 145 K 7.28 3.51 0.00 1.10 1.52 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.39 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 1.02 7.81 146 F 8.21 4.16 0.00 3.18 3.17 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 0.00 0.00 0.00 0.00 147 K 8.53 4.21 0.00 2.02 1.83 0.00 1.73 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.62 7.81 148 E 7.89 4.19 0.00 2.05 1.96 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 2.35 2.19 0.00 149 A 7.49 4.35 1.19 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 0.00 0.00 150 G 7.56 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 0.00 0.00 0.00 151 G 7.22 3.15 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 0.00 0.00 0.00 152 T 8.76 4.72 4.31 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 1.26 0.00 0.00 153 V 7.94 4.76 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 1.10 0.00 0.00 1.10 0.00 0.00 154 R 8.57 4.19 0.00 1.99 1.91 0.00 3.33 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00