NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 3.4762 8.0249 121.4095 59.8865 38.6037 175.7754 3 P 4.1380 0.0000 0.0000 61.0513 32.9703 175.9205 4 R 3.9138 8.8152 119.4968 59.5392 29.6832 178.7207 5 R 3.9479 8.0544 118.8454 59.3577 29.9548 178.4471 6 I 3.8873 7.7846 119.0820 64.5264 37.1991 178.1512 7 T 3.8664 7.9043 116.7193 66.5346 68.2690 176.2668 8 K 3.9055 8.1114 121.1865 59.7522 32.2822 178.5227 9 E 4.0033 8.4957 118.9125 59.7287 29.3792 179.6152 10 T 4.1097 8.3302 115.8417 66.8797 68.5280 176.6573 11 Q 4.0326 8.2665 119.9632 59.0547 28.6667 178.5808 12 N 4.3092 8.3846 117.9842 56.8389 38.8040 176.9835 13 L 3.9959 7.9362 118.9270 57.5318 41.7232 179.0242 14 A 4.2025 7.9520 120.2728 54.9290 18.5196 178.8429 15 N 4.6188 8.4092 113.9725 54.5464 40.0646 175.5797 16 E 4.7810 8.3453 118.7370 54.4459 30.3312 173.9493 17 P 4.4528 0.0000 0.0000 61.8723 32.7870 175.1028 18 P 4.4058 0.0000 0.0000 61.6570 31.9668 174.3511 19 P 4.3917 0.0000 0.0000 64.5828 31.7335 177.1435 20 G 4.0332 9.1681 110.0532 45.2400 0.0000 172.3809 21 I 5.0870 7.5952 120.0427 59.6249 40.0126 174.9715 22 M 4.9481 9.2927 125.7068 53.4608 35.7538 174.6628 23 A 5.1864 8.6252 123.7203 50.3892 22.1122 175.6579 24 V 4.6161 9.0502 122.0774 59.3592 34.8189 173.8463 25 P 4.0962 0.0000 0.0000 62.2179 32.2972 176.1459 26 V 3.7721 8.6891 123.2828 61.8109 32.7044 173.8849 27 P 4.3198 0.0000 0.0000 64.6129 31.5528 175.5867 28 E 3.9043 9.0619 119.7178 57.2183 27.5100 175.1074 29 N 4.9237 7.9193 117.2842 51.1564 39.2110 174.5788 30 Y 4.1308 8.1105 119.2144 59.1635 38.7382 178.1759 31 R 4.2782 7.4428 118.4644 57.1385 31.6209 175.1708 32 H 5.4573 8.2775 120.2178 54.3186 32.5570 173.0101 33 F 5.2110 9.4127 123.4803 55.7922 43.2028 173.4566 34 N 5.3571 9.3208 120.4973 52.1170 40.2862 174.1712 35 I 5.0457 8.8411 124.4723 59.4034 41.0659 174.4618 36 L 5.2150 8.9364 125.3838 53.0040 45.0349 175.4532 37 I 5.0334 8.7183 124.3777 59.3716 40.2701 174.8082 38 N 5.0571 9.3193 125.7335 52.7602 39.2308 175.5289 39 G 4.0236 9.2558 111.5783 45.9566 0.0000 171.8998 40 P 4.6291 0.0000 0.0000 61.9375 32.2250 175.8228 41 D 4.6419 8.5282 121.4470 56.3010 41.1911 177.1604 42 G 3.9467 10.1417 111.3472 45.6616 0.0000 172.8489 43 T 4.7066 7.3067 107.9812 58.3774 71.6034 173.1344 44 P 4.2621 0.0000 0.0000 65.0665 31.4676 177.1654 45 Y 4.7336 7.2149 115.9642 58.0182 38.2721 174.9192 46 E 4.3038 7.8100 122.1991 58.0126 29.9478 176.9926 47 G 4.0539 9.3117 114.6971 45.0199 0.0000 173.4497 48 G 4.2091 8.2595 107.0525 45.7003 0.0000 172.9665 49 T 5.2519 8.5969 117.7340 61.7012 71.5602 173.1427 50 Y 4.4149 9.1871 124.1389 56.1070 40.6518 174.9342 51 K 4.8132 9.1592 124.5664 55.6324 33.8836 176.0021 52 L 5.2361 8.9399 123.8634 52.7965 46.3998 175.0958 53 E 5.2648 8.9030 117.5712 54.6986 33.4162 174.4711 54 L 5.2036 8.7645 121.6883 53.4572 46.2956 174.6400 55 F 5.4028 9.1828 127.2018 56.4555 42.8026 173.7496 56 L 4.2842 8.6071 127.0659 52.2252 41.6660 175.0244 57 P 3.6555 0.0000 0.0000 61.8629 31.9779 177.4853 58 E 3.9265 8.6013 118.6010 59.4410 29.6505 178.1472 59 Q 4.3965 7.9562 115.9567 55.6950 29.0699 174.7450 60 Y 4.5641 8.0420 120.0248 56.8442 39.1115 174.0512 61 P 3.6323 0.0000 0.0000 62.6372 31.9483 176.5722 62 M 4.2588 8.0203 119.7239 57.9239 32.1627 176.3056 63 E 4.7273 8.1761 117.5878 53.5274 31.8624 173.9060 64 P 2.9700 0.0000 0.0000 60.9762 32.1365 174.3708 65 P 4.1996 0.0000 0.0000 62.7139 32.2607 175.6949 66 K 4.5837 8.9584 121.4272 54.7346 34.5617 175.6872 67 V 5.0564 8.2442 123.7491 61.3267 34.9010 174.3168 68 R 4.9627 8.6612 122.0097 54.7967 33.4901 174.2113 69 F 4.5156 9.5974 120.1648 57.7579 39.7103 176.1474 70 L 4.5489 9.2002 121.8323 56.0452 43.5731 177.3610 71 T 4.4195 8.0546 114.8810 62.3391 69.4222 175.2196 72 K 4.1692 8.6243 127.0659 56.6363 32.9467 175.8021 73 I 4.8895 8.2940 123.2726 60.2944 40.7371 173.2306 74 Y 4.3996 8.8309 128.1098 56.5140 38.8144 174.2222 75 H 4.3278 7.8514 125.9788 53.9933 32.8227 172.6183 76 P 4.0645 0.0000 0.0000 64.7862 31.5162 176.5990 77 N 4.7633 8.0921 114.8244 52.7077 39.3144 173.6105 78 I 4.7556 7.2617 120.0808 59.3581 39.7677 175.2727 79 D 4.7758 8.4223 125.7603 51.6348 41.3117 177.2972 80 K 4.0421 8.5541 117.4340 59.0711 32.0253 177.9947 81 L 4.4296 8.1605 117.1726 54.2711 41.8079 177.1322 82 G 4.3576 8.4954 108.7207 46.9457 0.0000 174.3180 83 R 4.5259 8.5056 121.3325 56.4183 30.7469 179.6570 84 I 4.6580 8.3102 124.7200 59.1325 38.7602 175.4159 85 C 4.4242 9.2268 129.6465 58.2002 31.2607 172.1325 86 L 4.6499 8.0304 126.9016 53.0781 44.9134 176.6223 87 D 4.4668 8.9591 126.3103 57.3908 40.9750 178.3077 88 I 3.9888 7.7690 110.4686 62.6214 37.8364 176.3026 89 L 4.6050 7.8951 120.2541 55.1386 43.5659 176.1248 90 K 4.7828 7.4203 118.2037 56.7907 32.0013 179.3526 91 D 4.5995 9.3365 130.3811 56.8854 40.9720 176.5882 92 K 4.3990 8.0517 117.6417 55.6005 32.3418 176.6718 93 W 4.4369 7.9130 129.8393 57.7126 31.3529 175.1817 94 S 4.2516 6.6090 117.1699 55.5316 65.4210 173.1109 95 P 4.1971 0.0000 0.0000 64.8518 31.1415 177.4466 96 A 3.9082 7.1745 121.5662 54.2968 18.4094 177.6609 97 L 4.2088 6.7892 115.9833 54.2885 42.8133 175.5943 98 Q 4.9183 7.9979 116.9062 54.3996 32.6682 175.2662 99 I 3.6861 8.9568 120.4032 64.5370 36.8578 178.5345 100 R 3.8712 8.0397 118.9772 59.8475 29.7718 178.3787 101 T 3.8566 7.9325 114.8060 66.7558 68.4696 176.5055 102 V 3.6484 7.8449 119.9340 66.0784 31.4353 178.1140 103 L 3.9661 8.0902 118.7209 57.7164 41.4220 179.4341 104 L 3.9879 8.2559 119.3326 57.6675 41.5050 179.5517 105 S 4.0748 8.3823 113.3685 61.3503 62.3560 176.1584 106 I 3.6705 7.9027 122.6002 64.5731 36.5094 177.9440 107 Q 3.9627 8.3711 120.3370 59.4673 28.7152 178.5334 108 A 4.2480 8.2371 121.4651 54.6250 18.2351 179.2372 109 L 3.8658 8.1358 118.9364 58.3495 42.1323 178.8756 110 L 3.9717 7.5677 117.7918 57.5074 41.5506 178.9629 111 S 4.5987 7.4232 114.0736 58.9937 64.5643 174.4384 112 S 4.6755 7.8314 114.9481 55.4524 61.8396 171.5959 113 P 4.3667 0.0000 0.0000 62.6920 32.2375 176.9666 114 E 4.5269 8.1375 120.8415 53.6626 29.1388 174.9249 115 P 4.4211 0.0000 0.0000 63.8793 31.5830 177.6285 116 D 4.6561 7.7433 118.1779 55.5684 41.7120 177.4059 117 D 4.4651 7.7451 119.5229 56.4090 40.9654 175.4758 118 P 4.5439 0.0000 0.0000 62.1993 32.4136 176.3825 119 L 4.1535 8.4676 120.1646 57.6548 41.9538 177.7540 120 D 4.6406 7.6184 116.5505 51.2401 41.5579 172.5446 121 S 4.7020 7.8538 115.1802 55.7690 65.2135 173.7283 122 K 4.0628 8.6164 129.0043 59.2437 31.9170 179.5268 123 V 3.4289 7.7136 118.0097 65.9636 31.4839 177.5190 124 A 4.0091 7.8438 120.4586 55.4566 18.0764 179.4055 125 E 3.9156 8.1557 116.6023 59.7584 29.4557 179.0035 126 H 4.1672 8.2095 118.0370 59.5051 29.7238 177.2436 127 F 3.9248 8.1810 118.1000 60.4263 38.7583 177.5627 128 K 4.1734 8.2009 117.4050 59.6873 31.9699 179.1545 129 Q 4.3947 8.1343 117.1755 57.8356 29.6914 176.2662 130 D 4.5359 8.3412 120.0722 51.6858 42.8140 175.0353 131 K 3.8450 8.5417 126.0718 59.1899 32.2171 177.4288 132 N 4.2352 7.9252 115.4917 56.5052 39.0741 175.9291 133 D 3.9976 8.2806 119.2762 57.1692 41.3133 178.0346 134 A 3.2869 7.6397 121.3885 54.9148 17.9618 179.4500 135 E 3.8312 7.8798 116.9608 59.5249 29.4289 179.0720 136 H 4.1017 7.7321 116.7077 58.9260 28.7187 177.8627 137 V 3.2759 7.4069 118.8715 65.8642 31.3778 177.4854 138 A 4.0535 7.8598 120.6262 55.4504 18.2698 179.6479 139 R 4.1610 8.2498 118.6807 59.0524 30.1718 178.5527 140 Q 4.0583 8.2654 119.4601 59.0464 29.0695 178.1812 141 W 4.5550 8.7821 120.2849 59.7541 29.0833 177.7876 142 N 4.6140 8.7634 117.1600 56.9895 38.2009 176.9470 143 K 3.9803 7.8143 117.7955 59.4944 32.2052 179.2071 144 I 3.6629 7.4939 118.7015 64.2405 37.2307 177.3423 145 Y 4.5762 8.3220 114.7937 58.1436 38.7796 176.4465 146 A 4.4969 7.8566 121.1870 51.8229 19.4834 177.5318 147 N 4.5617 8.0427 116.4134 55.4429 39.4464 175.0448 148 N 4.3733 8.2664 119.2626 53.3028 36.9865 174.3572 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 I 8.02 3.48 1.60 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.71 0.51 0.00 0.00 3 P 0.00 4.14 0.00 2.32 2.04 0.00 3.58 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 4 R 8.82 3.91 0.00 2.04 2.19 0.00 2.98 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 5 R 8.05 3.95 0.00 1.94 2.06 0.00 3.19 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.82 0.00 6 I 7.78 3.89 2.08 0.00 0.00 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 1.86 0.73 1.17 0.00 0.00 7 T 7.90 3.87 4.40 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 1.21 0.00 0.00 8 K 8.11 3.91 0.00 1.97 2.06 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.51 7.81 9 E 8.50 4.00 0.00 2.12 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 2.41 2.75 0.00 10 T 8.33 4.11 4.52 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 0.00 0.00 0.00 1.35 0.00 0.00 11 Q 8.27 4.03 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 12 N 8.38 4.31 0.00 2.85 2.98 0.00 0.00 7.27 6.21 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 13 L 7.94 4.00 0.00 1.86 1.74 0.74 0.61 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 14 A 7.95 4.20 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 15 N 8.41 4.62 0.00 2.79 2.90 0.00 0.00 6.83 7.57 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 16 E 8.35 4.78 0.00 2.14 1.86 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 2.24 2.37 0.00 17 P 0.00 4.45 0.00 2.34 2.19 0.00 3.79 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 18 P 0.00 4.41 0.00 2.21 2.02 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 19 P 0.00 4.39 0.00 2.05 2.03 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 20 G 9.17 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 0.00 0.00 0.00 21 I 7.60 5.09 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.74 0.90 0.00 0.00 22 M 9.29 4.95 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 23 A 8.63 5.19 1.17 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 0.00 0.00 24 V 9.05 4.62 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 0.97 0.00 0.00 0.93 0.00 0.00 25 P 0.00 4.10 0.00 1.72 1.48 0.00 3.60 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 1.85 1.49 0.00 26 V 8.69 3.77 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 0.87 0.00 0.00 0.92 0.00 0.00 27 P 0.00 4.32 0.00 2.05 1.99 0.00 3.84 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 2.01 2.11 0.00 28 E 9.06 3.90 0.00 2.09 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 0.00 2.22 2.30 0.00 29 N 7.92 4.92 0.00 2.75 2.62 0.00 0.00 6.77 7.55 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 30 Y 8.11 4.13 0.00 2.94 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 31 R 7.44 4.28 0.00 1.81 1.94 0.00 2.94 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.60 0.00 32 H 8.28 5.46 0.00 3.30 3.10 0.00 5.72 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 9.41 5.21 0.00 2.84 2.89 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 34 N 9.32 5.36 0.00 2.67 2.76 0.00 0.00 6.70 7.00 0.00 0.00 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 I 8.84 5.05 1.80 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.89 0.87 0.00 0.00 36 L 8.94 5.22 0.00 1.56 1.55 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.72 5.03 1.90 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.70 0.95 0.00 0.00 38 N 9.32 5.06 0.00 2.65 2.84 0.00 0.00 7.02 7.22 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 39 G 9.26 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.63 0.00 2.28 2.04 0.00 3.81 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 2.18 2.17 0.00 41 D 8.53 4.64 0.00 2.70 2.65 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 42 G 10.14 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 0.00 0.00 0.00 43 T 7.31 4.71 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 44 P 0.00 4.26 0.00 1.90 2.28 0.00 3.36 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.70 0.00 45 Y 7.21 4.73 0.00 3.13 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 46 E 7.81 4.30 0.00 2.21 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 2.39 2.49 0.00 47 G 9.31 4.05 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 0.00 0.00 0.00 48 G 8.26 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 0.00 0.00 0.00 0.00 49 T 8.60 5.25 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 1.29 0.00 0.00 50 Y 9.19 4.41 0.00 3.18 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 51 K 9.16 4.81 0.00 1.68 1.72 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.40 7.81 52 L 8.94 5.24 0.00 1.37 1.34 0.46 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.90 5.26 0.00 2.09 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 2.19 2.25 0.00 54 L 8.76 5.20 0.00 1.61 1.45 0.67 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 55 F 9.18 5.40 0.00 2.87 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.61 4.28 0.00 1.22 1.14 0.82 0.15 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 57 P 0.00 3.66 0.00 2.11 2.08 0.00 3.34 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.83 0.00 58 E 8.60 3.93 0.00 2.01 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 0.00 2.35 2.38 0.00 59 Q 7.96 4.40 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.08 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 60 Y 8.04 4.56 0.00 2.78 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 61 P 0.00 3.63 0.00 1.94 1.14 0.00 3.72 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 62 M 8.02 4.26 0.00 2.07 2.35 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 2.61 2.50 0.00 63 E 8.18 4.73 0.00 1.99 1.79 0.00 0.00 0.00 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 2.24 0.00 64 P 0.00 2.97 0.00 1.66 1.17 0.00 3.61 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.91 0.00 65 P 0.00 4.20 0.00 1.67 1.61 0.00 2.62 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 66 K 8.96 4.58 0.00 1.71 1.71 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.29 7.81 67 V 8.24 5.06 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 0.77 0.00 0.00 0.82 0.00 0.00 68 R 8.66 4.96 0.00 2.06 1.98 0.00 2.85 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 69 F 9.60 4.52 0.00 3.04 3.28 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 70 L 9.20 4.55 0.00 1.60 1.73 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 71 T 8.05 4.42 4.60 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 1.19 0.00 0.00 72 K 8.62 4.17 0.00 1.32 1.11 0.00 0.82 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.81 1.06 7.81 73 I 8.29 4.89 2.11 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.84 0.49 0.00 0.00 74 Y 8.83 4.40 0.00 1.78 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 75 H 7.85 4.33 0.00 2.88 2.73 0.00 5.73 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.06 0.00 1.96 1.80 0.00 2.50 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.17 0.00 77 N 8.09 4.76 0.00 2.66 2.90 0.00 0.00 6.92 7.32 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 78 I 7.26 4.76 1.49 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.18 0.59 0.00 0.00 79 D 8.42 4.78 0.00 2.84 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 80 K 8.55 4.04 0.00 1.80 1.95 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.57 1.54 7.81 81 L 8.16 4.43 0.00 1.77 1.69 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.50 4.36 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 0.00 83 R 8.51 4.53 0.00 1.51 1.82 0.00 3.25 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 84 I 8.31 4.66 1.92 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.35 0.95 0.00 0.00 85 C 9.23 4.42 0.00 2.91 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 86 L 8.03 4.65 0.00 1.70 1.45 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.96 4.47 0.00 2.76 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 88 I 7.77 3.99 2.04 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.64 0.94 0.00 0.00 89 L 7.90 4.61 0.00 1.85 1.72 0.92 0.71 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 90 K 7.42 4.78 0.00 1.79 0.90 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.58 7.81 91 D 9.34 4.60 0.00 2.70 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 92 K 8.05 4.40 0.00 1.80 1.84 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.38 7.81 93 W 7.91 4.44 0.00 3.64 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 6.61 4.25 0.00 3.74 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.20 0.00 2.08 2.26 0.00 3.55 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.92 0.00 96 A 7.17 3.91 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 97 L 6.79 4.21 0.00 0.58 1.39 0.77 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.00 4.92 0.00 2.64 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 99 I 8.96 3.69 1.82 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.81 0.61 0.00 0.00 100 R 8.04 3.87 0.00 1.87 1.95 0.00 3.19 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 101 T 7.93 3.86 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 102 V 7.84 3.65 2.29 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 1.10 0.00 0.00 1.22 0.00 0.00 103 L 8.09 3.97 0.00 1.84 1.66 0.82 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.26 3.99 0.00 1.85 1.72 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.38 4.07 0.00 3.94 4.09 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 0.00 106 I 7.90 3.67 1.86 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 1.46 1.08 0.99 0.00 0.00 107 Q 8.37 3.96 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 108 A 8.24 4.25 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 0.00 109 L 8.14 3.87 0.00 1.70 1.85 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.57 3.97 0.00 1.79 1.66 0.76 0.51 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 0.00 111 S 7.42 4.60 0.00 4.10 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 0.00 112 S 7.83 4.68 0.00 3.77 3.84 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 0.00 0.00 0.00 113 P 0.00 4.37 0.00 1.79 1.41 0.00 3.63 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 1.85 1.99 0.00 114 E 8.14 4.53 0.00 1.91 1.81 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 2.25 2.17 0.00 115 P 0.00 4.42 0.00 2.18 2.11 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 116 D 7.74 4.66 0.00 2.67 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 0.00 117 D 7.75 4.47 0.00 2.60 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 0.00 118 P 0.00 4.54 0.00 2.13 2.01 0.00 3.57 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.18 0.00 119 L 8.47 4.15 0.00 1.66 1.76 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 120 D 7.62 4.64 0.00 2.55 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 0.00 121 S 7.85 4.70 0.00 3.86 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 0.00 122 K 8.62 4.06 0.00 1.85 1.89 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.47 7.81 123 V 7.71 3.43 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 0.39 0.00 0.00 0.76 0.00 0.00 124 A 7.84 4.01 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.16 3.92 0.00 2.28 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 2.52 2.48 0.00 126 H 8.21 4.17 0.00 3.25 3.42 0.00 5.61 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 0.00 127 F 8.18 3.92 0.00 3.14 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 0.00 128 K 8.20 4.17 0.00 2.01 1.89 0.00 1.92 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.56 7.81 129 Q 8.13 4.39 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.96 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 130 D 8.34 4.54 0.00 2.58 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 0.00 131 K 8.54 3.85 0.00 2.05 1.79 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.65 7.81 132 N 7.93 4.24 0.00 2.70 2.75 0.00 0.00 6.90 8.47 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 0.00 133 D 8.28 4.00 0.00 2.98 2.67 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 0.00 134 A 7.64 3.29 -0.24 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 0.00 135 E 7.88 3.83 0.00 2.09 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 2.44 2.56 0.00 136 H 7.73 4.10 0.00 3.16 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.41 3.28 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 -0.46 0.00 0.00 0.66 0.00 0.00 138 A 7.86 4.05 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 R 8.25 4.16 0.00 1.96 2.04 0.00 3.13 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.50 0.00 140 Q 8.27 4.06 0.00 2.32 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 141 W 8.78 4.56 0.00 3.64 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 0.00 142 N 8.76 4.61 0.00 3.23 3.22 0.00 0.00 7.20 5.73 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 0.00 143 K 7.81 3.98 0.00 2.03 1.86 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.77 7.81 144 I 7.49 3.66 1.01 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.45 -0.18 0.00 0.00 145 Y 8.32 4.58 0.00 3.13 3.02 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 0.00 0.00 0.00 0.00 146 A 7.86 4.50 0.89 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 0.00 147 N 8.04 4.56 0.00 2.93 2.87 0.00 0.00 7.02 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 8.27 4.37 0.00 2.81 2.85 0.00 0.00 5.87 7.56 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