NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 F 4.8129 8.3249 122.8171 57.2736 41.2878 175.1207 3 L 4.4967 7.5507 118.5249 50.3834 44.5766 175.4907 4 T 4.0436 9.1874 116.3192 61.4477 71.3696 175.0748 5 A 3.9885 8.4735 123.3204 55.2963 18.3091 179.7539 6 E 3.9513 8.0299 117.3654 59.3831 29.8956 178.4334 7 E 3.9214 8.5838 119.0336 59.5965 29.5918 179.6541 8 K 4.1373 8.2208 118.3145 58.9006 31.9191 179.6217 9 G 3.5650 7.6022 105.1395 47.7204 0.0000 175.4839 10 L 4.0171 7.8612 122.2247 57.5099 41.7506 179.6946 11 V 3.5707 7.7841 117.7880 66.3306 31.3992 177.8120 12 N 4.6037 8.3182 115.6018 56.2497 38.2737 177.5275 13 G 3.8146 8.1822 106.5016 47.9748 0.0000 174.8734 14 L 4.1619 7.9491 121.5707 57.2466 42.1677 178.6189 15 W 4.3743 8.7602 128.6060 60.1126 30.4411 178.2533 16 G 3.6966 8.3442 105.3361 47.5383 0.0000 175.3513 17 K 4.2413 7.5179 119.6990 57.3133 32.3538 177.8333 18 V 3.6490 6.6200 119.9164 62.7288 31.6285 176.0649 19 N 4.5271 8.5542 126.4830 52.0123 36.9053 174.7000 20 V 3.3915 8.0659 124.1752 65.5615 31.1624 176.9124 21 D 4.4443 7.7343 118.6694 56.8901 41.3336 177.8501 22 E 3.9201 8.3814 118.7593 60.1514 29.8183 179.7408 23 V 3.5430 7.5770 119.1898 65.4296 31.4248 178.0235 24 G 3.7411 7.8191 104.9829 47.7955 0.0000 175.4790 25 G 3.8940 7.8274 105.2623 45.2416 0.0000 174.0926 26 E 4.2565 7.4891 119.8345 57.6518 31.0307 177.6718 27 A 3.8703 7.9571 120.8352 55.3691 18.1823 179.4311 28 L 3.9135 8.1903 118.5086 58.1652 41.6632 179.3342 29 G 3.6239 7.5679 105.0822 47.9791 0.0000 175.9012 30 R 3.8694 8.5165 120.8155 58.6321 30.2088 178.5352 31 L 3.9196 7.9861 120.4232 58.5311 41.9618 179.3014 32 L 3.9316 7.5388 118.3325 57.6215 41.3340 179.7261 33 V 3.5099 7.0961 116.0001 66.0472 31.6940 177.9888 34 V 3.5728 7.6550 116.7928 64.7426 32.6630 175.5633 35 Y 4.6458 7.3397 115.5461 54.5982 38.3920 173.7587 36 P 5.1398 0.0000 0.0000 64.1913 32.1714 178.1976 37 W 4.5636 8.5707 116.8566 59.6640 27.7841 177.5176 38 T 4.5145 7.6091 109.7817 63.6580 68.4471 176.3284 39 Q 4.3344 8.5565 122.2263 58.5725 28.4063 178.6294 40 R 4.2808 7.3836 117.1618 58.6296 29.5340 178.2148 41 F 4.2356 7.8244 115.1293 58.1762 38.9633 175.6579 42 F 4.4901 7.8099 116.8856 56.8272 40.2643 176.5338 43 E 4.0145 8.3718 123.8644 59.4174 29.3961 177.5882 44 S 4.7970 7.8051 112.5134 59.2215 63.5468 174.3914 45 F 5.2011 8.1529 117.0018 58.1574 40.5844 177.7361 46 G 3.9107 8.2703 107.2970 45.4094 0.0000 173.0893 47 D 4.6323 8.5569 122.8839 54.0561 41.7018 176.6071 48 L 4.8753 8.2999 126.8306 54.7948 43.2246 177.0513 49 S 4.5832 8.2094 114.2351 58.8074 63.2915 174.6134 50 S 4.6924 7.5886 114.2490 55.5842 66.9783 174.2765 51 A 3.9033 8.5347 126.8245 55.7035 18.3594 179.3975 52 D 4.3012 8.2723 116.3983 58.0100 40.7103 179.2473 53 A 4.1194 7.8126 119.6124 55.0534 18.6320 179.5031 54 I 3.7565 8.0193 118.6855 64.9206 37.0415 178.2108 55 M 3.9681 7.8577 118.8420 58.0089 31.9434 178.1189 56 S 4.7029 7.2218 109.6168 56.9731 63.9723 174.2065 57 N 4.3176 7.7696 122.7457 53.4817 39.5214 174.6765 58 A 3.9485 8.6438 130.1773 55.5381 18.4429 179.3434 59 K 3.7398 7.6909 115.4564 58.4740 32.1097 179.7352 60 V 3.5503 7.1377 119.3920 65.8419 31.3398 178.1490 61 K 3.9572 7.8734 117.5866 59.3302 31.4363 179.0912 62 A 3.9824 7.7531 120.8110 55.3364 18.2121 179.1765 63 H 4.3546 8.2034 116.9845 59.1838 29.9558 177.3018 64 G 3.9416 8.1641 107.6573 48.2168 0.0000 175.4441 65 K 3.9748 7.8584 121.3638 58.8577 32.1170 179.5535 66 K 3.9761 7.7323 117.3830 59.4911 32.0419 179.3940 67 V 3.6497 8.0671 118.7813 66.2110 31.4031 177.8896 68 L 4.2943 8.5435 120.2925 58.1990 41.9162 178.6012 69 N 4.5240 8.8010 117.0882 55.8862 38.4532 177.1946 70 S 4.1096 8.2545 114.9570 61.4472 62.3921 176.0904 71 F 4.0655 8.3890 123.0533 61.4539 38.7976 176.8449 72 S 4.2877 9.0065 115.2896 62.2956 62.5343 176.8342 73 D 4.4103 8.4915 120.2461 56.8982 40.6793 178.5333 74 G 3.7142 7.9389 106.4956 47.9879 0.0000 175.6217 75 L 3.8328 7.1372 119.9272 57.1489 41.6946 179.2654 76 K 4.2621 7.4011 114.8636 57.7818 32.1025 177.4984 77 N 4.9310 8.1787 115.1190 53.0929 41.6148 176.0880 78 I 3.5134 7.9889 114.2801 64.0773 37.3612 176.7781 79 D 4.4121 7.9544 118.8713 55.5562 38.7589 176.8032 80 D 4.4051 8.4260 119.4494 52.6997 42.6976 174.4172 81 L 4.2934 7.9218 125.8152 55.8953 42.4423 178.2240 82 K 4.0297 8.0720 117.6337 59.3725 31.7617 178.9976 83 G 4.1423 8.3311 106.5562 47.4472 0.0000 175.5967 84 A 3.9575 7.4842 121.9239 53.2775 18.4899 178.0966 85 F 4.7312 7.8068 113.8922 57.1126 39.8233 177.1117 86 A 4.0577 7.8437 124.2565 55.3935 18.1603 180.4779 87 K 4.0184 7.9963 116.3707 59.3892 32.2611 179.4598 88 L 4.1945 7.9733 118.8438 57.3351 41.6033 179.3018 89 S 4.4173 8.4404 115.2224 61.1091 62.3504 176.0853 90 E 3.9399 7.9445 120.9106 59.1032 29.0394 178.9200 91 L 3.9176 7.7435 120.0591 58.7622 42.2535 178.9454 92 H 4.2318 8.6042 115.9061 59.0269 28.7575 176.5652 93 C 3.9381 8.0484 121.4726 61.8819 31.0316 175.1575 94 D 4.3675 8.4993 122.5999 56.5912 40.7165 177.8090 95 K 4.1408 7.9361 119.5136 58.4559 32.7295 177.5846 96 L 4.0764 7.7352 116.1801 55.1843 42.6589 176.1702 97 H 4.2148 7.7693 114.2634 56.7157 25.8590 174.2568 98 V 4.3353 7.9644 118.1519 60.4129 33.8956 174.6043 99 D 4.2576 8.5658 126.6420 53.6401 41.5644 175.0019 100 P 2.9700 0.0000 0.0000 64.9141 30.6163 178.0414 101 E 3.8509 7.8889 117.2911 59.6249 29.2213 178.7846 102 N 4.4958 7.9445 115.4881 55.1336 38.5527 177.3549 103 F 4.5164 7.7163 120.2938 60.4606 38.9877 177.2848 104 R 3.8967 7.7018 117.9332 59.7422 29.8660 178.2987 105 L 3.9981 7.5909 118.6541 57.6684 41.5346 179.3110 106 L 4.1378 7.9932 120.0577 57.9312 42.2677 178.7998 107 G 3.7544 8.1485 105.7695 47.9319 0.0000 175.4747 108 N 4.3993 8.2569 118.5435 56.2599 38.6337 177.6160 109 V 3.5652 7.8391 119.6661 66.0848 31.5941 177.8034 110 L 3.8994 8.1324 120.0288 57.9217 41.9469 179.2024 111 V 3.5293 7.6660 118.2488 65.8996 31.4204 177.8142 112 C 4.0310 8.2053 116.6354 62.7029 27.9955 176.0094 113 V 3.4318 7.9080 120.0578 66.2496 31.1935 177.7715 114 L 3.6875 7.5140 118.0245 57.8836 41.3667 179.7086 115 A 3.6423 7.2110 120.0779 55.1857 18.1455 178.8208 116 H 3.8223 8.0596 115.9986 59.8830 29.8479 176.4229 117 H 4.1048 7.6790 115.9885 56.5260 29.0752 175.9271 118 F 5.0424 7.6296 116.4905 56.6689 41.6347 177.5155 119 G 3.8325 7.8918 110.8288 45.9994 0.0000 175.9291 120 H 3.9821 9.2596 121.5939 58.9666 28.4332 175.9996 121 D 4.4770 8.2905 117.8675 56.7506 41.3070 176.7982 122 F 4.5118 8.7231 124.9178 57.0074 38.2495 175.1660 123 N 4.6497 7.4090 121.3139 51.8603 40.2951 173.7901 124 P 4.1087 0.0000 0.0000 66.0056 30.7459 178.7642 125 Q 3.9012 7.8424 117.7540 59.0901 29.2677 178.0672 126 V 3.6117 7.4984 118.8543 65.9055 31.6410 177.5966 127 Q 3.7384 7.8758 119.3717 59.0109 28.9249 178.0982 128 A 4.0921 8.0051 121.1319 54.4918 18.2343 179.6388 129 A 3.9604 7.6035 118.9709 55.4323 18.4933 179.6312 130 F 3.8628 8.3274 115.8521 60.8506 38.9887 177.8539 131 Q 4.1643 8.4100 117.4369 59.1743 28.4546 179.0339 132 K 3.8164 7.6646 117.8979 59.5714 31.9857 179.4839 133 V 3.7036 7.5574 117.7818 66.3425 31.6938 178.6932 134 V 3.8408 8.8482 112.2499 64.0901 31.3241 178.5070 135 A 4.2101 9.0341 121.8182 54.8975 18.1416 179.8997 136 G 3.5320 7.9580 104.3832 47.8172 0.0000 176.2765 137 V 3.1370 8.4697 120.8862 65.4248 31.0314 178.0532 138 A 3.9614 7.8803 120.2234 55.1888 18.0233 179.4020 139 N 4.3358 8.0432 113.8979 56.2276 38.7074 177.2931 140 A 4.1360 8.1095 122.4900 55.1103 18.0890 179.6993 141 L 3.8748 7.6360 116.7450 57.1940 41.6988 178.5645 142 A 4.6623 7.7655 118.5252 52.7878 18.8510 178.3848 143 H 4.3579 8.0933 117.7065 58.1327 29.9829 175.8458 144 K 4.5655 7.9474 117.7778 56.1098 32.1930 175.9836 145 Y 4.0819 7.6820 116.8877 58.4493 38.3392 175.9134 146 H 4.4573 8.3456 118.0921 56.0925 28.3883 173.1954 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 F 8.32 4.81 0.00 2.91 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.55 4.50 0.00 1.67 1.42 0.84 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.19 4.04 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 1.19 0.00 0.00 5 A 8.47 3.99 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 6 E 8.03 3.95 0.00 2.03 1.92 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 2.35 2.38 0.00 7 E 8.58 3.92 0.00 2.13 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 2.25 2.29 0.00 8 K 8.22 4.14 0.00 1.79 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.65 7.81 9 G 7.60 3.56 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 0.00 10 L 7.86 4.02 0.00 1.88 1.80 0.91 0.87 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 11 V 7.78 3.57 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 0.59 0.00 0.00 0.75 0.00 0.00 12 N 8.32 4.60 0.00 2.92 2.92 0.00 0.00 7.01 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.18 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 14 L 7.95 4.16 0.00 2.05 2.23 0.60 1.17 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 15 W 8.76 4.37 0.00 3.81 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 8.34 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 0.00 0.00 0.00 17 K 7.52 4.24 0.00 1.63 1.81 0.00 1.52 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.55 7.81 18 V 6.62 3.65 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 0.09 0.00 0.00 0.93 0.00 0.00 19 N 8.55 4.53 0.00 2.81 2.65 0.00 0.00 6.78 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 8.07 3.39 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 1.03 0.00 0.00 0.87 0.00 0.00 21 D 7.73 4.44 0.00 2.92 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 3.92 0.00 2.14 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 0.00 2.29 2.29 0.00 23 V 7.58 3.54 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 0.92 0.00 0.00 0.69 0.00 0.00 24 G 7.82 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 25 G 7.83 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 26 E 7.49 4.26 0.00 2.26 1.85 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 2.14 2.30 0.00 27 A 7.96 3.87 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 28 L 8.19 3.91 0.00 1.80 1.64 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.57 3.62 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 0.00 0.00 0.00 30 R 8.52 3.87 0.00 1.91 1.87 0.00 3.07 0.00 0.00 2.99 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 31 L 7.99 3.92 0.00 1.74 1.83 0.97 0.69 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 32 L 7.54 3.93 0.00 1.84 1.66 0.80 0.71 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 33 V 7.10 3.51 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 0.73 0.00 0.00 0.94 0.00 0.00 34 V 7.65 3.57 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.71 0.00 0.00 35 Y 7.34 4.65 0.00 2.61 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 5.14 0.00 2.40 2.32 0.00 3.80 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 37 W 8.57 4.56 0.00 3.59 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 38 T 7.61 4.51 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 0.62 0.00 0.00 39 Q 8.56 4.33 0.00 2.23 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 40 R 7.38 4.28 0.00 1.76 1.97 0.00 3.01 0.00 0.00 3.03 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.53 0.00 41 F 7.82 4.24 0.00 2.51 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 42 F 7.81 4.49 0.00 2.94 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.37 4.01 0.00 1.99 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 0.00 2.42 2.33 0.00 44 S 7.81 4.80 0.00 4.06 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 45 F 8.15 5.20 0.00 3.17 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 46 G 8.27 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 0.00 0.00 0.00 47 D 8.56 4.63 0.00 2.65 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 48 L 8.30 4.88 0.00 1.65 1.63 1.05 1.04 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 49 S 8.21 4.58 0.00 3.89 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 50 S 7.59 4.69 0.00 4.01 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.53 3.90 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 52 D 8.27 4.30 0.00 2.76 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 53 A 7.81 4.12 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 54 I 8.02 3.76 2.00 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 1.53 0.82 0.91 0.00 0.00 55 M 7.86 3.97 0.00 1.93 2.27 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 56 S 7.22 4.70 0.00 4.06 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 57 N 7.77 4.32 0.00 2.98 2.84 0.00 0.00 7.02 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 58 A 8.64 3.95 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 59 K 7.69 3.74 0.00 1.34 0.74 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.30 7.81 60 V 7.14 3.55 2.17 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 0.99 0.00 0.00 0.98 0.00 0.00 61 K 7.87 3.96 0.00 1.92 1.80 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.60 7.81 62 A 7.75 3.98 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 63 H 8.20 4.35 0.00 3.67 3.64 0.00 5.82 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 8.16 3.94 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 0.00 0.00 0.00 65 K 7.86 3.97 0.00 1.93 1.91 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.50 7.81 66 K 7.73 3.98 0.00 2.04 1.88 0.00 1.74 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 8.07 3.65 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 1.06 0.00 0.00 0.97 0.00 0.00 68 L 8.54 4.29 0.00 2.04 1.78 1.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 69 N 8.80 4.52 0.00 2.83 2.92 0.00 0.00 6.55 7.37 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 70 S 8.25 4.11 0.00 4.14 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 0.00 71 F 8.39 4.07 0.00 3.50 3.38 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 72 S 9.01 4.29 0.00 4.16 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.49 4.41 0.00 2.58 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 74 G 7.94 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.14 3.83 0.00 1.54 1.57 -0.05 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.40 4.26 0.00 1.67 1.82 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.63 1.59 7.81 77 N 8.18 4.93 0.00 2.70 2.61 0.00 0.00 6.65 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 78 I 7.99 3.51 2.07 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.83 0.91 0.00 0.00 79 D 7.95 4.41 0.00 2.76 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 8.43 4.41 0.00 2.64 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 81 L 7.92 4.29 0.00 1.54 1.71 0.45 0.68 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 82 K 8.07 4.03 0.00 1.62 1.77 0.00 1.58 0.00 0.00 1.17 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 1.38 7.81 83 G 8.33 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.48 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 F 7.81 4.73 0.00 3.03 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.84 4.06 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.00 4.02 0.00 1.81 1.88 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.53 7.81 88 L 7.97 4.19 0.00 2.02 1.88 1.11 0.96 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 8.44 4.42 0.00 3.98 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 7.94 3.94 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 91 L 7.74 3.92 0.00 1.92 1.84 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.60 4.23 0.00 3.54 3.69 0.00 5.86 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 93 C 8.05 3.94 0.00 1.33 2.39 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 94 D 8.50 4.37 0.00 2.77 2.71 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 0.00 0.00 0.00 0.00 95 K 7.94 4.14 0.00 1.71 1.82 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.52 7.81 96 L 7.74 4.08 0.00 1.85 1.70 0.75 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.77 4.21 0.00 3.46 3.39 0.00 5.61 0.00 0.00 0.00 0.00 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.96 4.34 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 0.46 0.00 0.00 0.81 0.00 0.00 99 D 8.57 4.26 0.00 2.71 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 0.00 100 P 0.00 2.97 0.00 1.76 1.64 0.00 3.25 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.50 0.00 101 E 7.89 3.85 0.00 1.97 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 2.21 2.43 0.00 102 N 7.94 4.50 0.00 2.57 2.81 0.00 0.00 6.96 8.95 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 0.00 103 F 7.72 4.52 0.00 3.07 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 7.70 3.90 0.00 2.11 1.95 0.00 3.09 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 105 L 7.59 4.00 0.00 1.73 1.40 0.41 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.99 4.14 0.00 1.82 1.71 0.94 1.07 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 0.00 107 G 8.15 3.75 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 0.00 0.00 0.00 108 N 8.26 4.40 0.00 3.16 2.98 0.00 0.00 6.62 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 0.00 109 V 7.84 3.57 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 1.10 0.00 0.00 1.03 0.00 0.00 110 L 8.13 3.90 0.00 1.75 1.84 0.94 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.67 3.53 2.30 0.00 0.00 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 1.16 0.00 0.00 112 C 8.21 4.03 0.00 3.11 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 0.00 113 V 7.91 3.43 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 0.81 0.00 0.00 0.91 0.00 0.00 114 L 7.51 3.69 0.00 1.26 0.99 0.57 1.20 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 0.00 115 A 7.21 3.64 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 0.00 116 H 8.06 3.82 0.00 3.16 3.43 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.68 4.10 0.00 2.31 1.98 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.63 5.04 0.00 3.21 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 0.00 119 G 7.89 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 0.00 0.00 0.00 120 H 9.26 3.98 0.00 3.20 3.41 0.00 5.71 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.29 4.48 0.00 3.06 2.81 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 0.00 122 F 8.72 4.51 0.00 3.04 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 0.00 123 N 7.41 4.65 0.00 2.92 2.91 0.00 0.00 6.08 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 0.00 124 P 0.00 4.11 0.00 2.15 2.15 0.00 3.56 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 125 Q 7.84 3.90 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 126 V 7.50 3.61 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 0.95 0.00 0.00 0.91 0.00 0.00 127 Q 7.88 3.74 0.00 1.73 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 128 A 8.01 4.09 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 0.00 129 A 7.60 3.96 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 0.00 130 F 8.33 3.86 0.00 3.49 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 0.00 131 Q 8.41 4.16 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.74 0.00 0.00 0.00 0.00 0.00 2.77 2.65 0.00 132 K 7.66 3.82 0.00 1.90 1.61 0.00 1.54 0.00 0.00 1.16 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.38 7.81 133 V 7.56 3.70 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 0.73 0.00 0.00 0.75 0.00 0.00 134 V 8.85 3.84 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 1.16 0.00 0.00 1.18 0.00 0.00 135 A 9.03 4.21 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 7.96 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 0.00 0.00 0.00 137 V 8.47 3.14 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 0.36 0.00 0.00 0.57 0.00 0.00 138 A 7.88 3.96 1.47 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 0.00 0.00 139 N 8.04 4.34 0.00 2.81 2.91 0.00 0.00 7.04 7.36 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 0.00 140 A 8.11 4.14 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 0.00 141 L 7.64 3.87 0.00 1.35 0.93 0.05 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.77 4.66 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 0.00 143 H 8.09 4.36 0.00 3.41 3.48 0.00 5.74 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.95 4.57 0.00 1.86 1.83 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.51 7.81 145 Y 7.68 4.08 0.00 3.25 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.35 4.46 0.00 3.21 3.23 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