NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0957 8.0544 120.3924 62.5993 33.5472 174.9533 2 H 4.6956 7.9334 118.9511 54.6231 30.1706 171.8308 3 L 4.4057 8.0717 121.6246 53.7392 43.1389 175.8752 4 T 4.0133 8.7188 121.2210 61.2348 69.3243 172.8106 5 P 4.1957 0.0000 0.0000 65.8862 31.4344 178.6025 6 E 3.9362 8.0967 117.4294 59.2406 29.4858 178.6295 7 E 3.9156 7.9086 118.2387 59.1976 29.5565 179.2038 8 K 3.8426 8.3080 118.9565 59.3746 32.1048 179.1499 9 S 4.0430 8.1385 113.1586 61.5165 62.2909 176.2414 10 A 3.9977 7.9083 123.2101 54.9810 18.1094 179.8028 11 V 3.4043 7.9943 117.1027 66.4624 31.5808 178.4005 12 T 3.9525 8.1961 115.5606 66.5107 68.0454 176.4829 13 A 3.9979 7.8279 121.5638 55.1897 18.7751 179.1454 14 L 3.8273 7.9494 118.8327 58.0050 42.1451 178.9724 15 W 4.3156 8.7214 128.5323 60.3382 30.4222 178.0945 16 G 3.8084 8.2364 104.8391 46.7493 0.0000 174.1293 17 K 4.4391 7.7522 118.2516 56.0843 32.8688 176.7843 18 V 3.5682 7.3133 120.6362 62.1761 31.7889 175.5751 19 N 4.3343 8.4913 125.1429 53.7063 39.0211 175.2070 20 V 3.7596 8.0079 126.7971 64.4526 31.8907 176.7688 21 D 4.4636 8.0598 118.5747 58.0130 40.7851 178.0412 22 E 3.9963 8.6153 118.5857 59.3609 29.6063 179.7163 23 V 3.5718 8.0656 118.7827 65.7567 31.4433 178.2929 24 G 3.7552 8.0850 105.1701 47.8905 0.0000 175.7659 25 G 3.6016 7.5384 105.3845 47.4194 0.0000 175.7324 26 E 3.9846 8.5608 121.0697 59.0110 29.4232 179.3032 27 A 3.9344 8.2777 121.2083 55.0462 18.4811 179.4779 28 L 3.9905 8.3063 119.3590 58.1152 42.1960 179.2466 29 G 3.6155 8.4897 106.0675 48.1281 0.0000 175.8755 30 R 3.9155 8.2974 121.3012 58.4300 29.9286 178.7896 31 L 4.0571 8.1068 120.3911 58.4720 42.1268 179.2401 32 L 4.0581 7.8723 119.6906 56.5167 41.2425 179.6356 33 V 3.5702 7.3599 117.8407 65.7380 31.7389 177.9404 34 V 3.5231 7.8413 116.9403 64.2922 32.7956 175.6121 35 Y 3.6941 7.3646 116.1490 54.3979 37.8292 174.2488 36 P 5.0229 0.0000 0.0000 64.2624 31.8634 178.4282 37 W 4.3984 8.1987 116.9029 59.6013 27.4568 177.7207 38 T 4.2778 7.7527 110.2856 63.9205 68.1112 176.1312 39 Q 4.3176 8.1932 121.7060 58.4030 28.4073 178.2729 40 R 3.7486 7.6610 117.0018 59.2130 29.1807 177.9630 41 F 4.3173 7.3415 115.4625 57.6055 39.3672 175.7190 42 F 4.4495 7.9362 118.4407 56.6421 39.8254 176.8260 43 E 3.9699 8.4502 124.3704 59.3867 29.4940 178.5728 44 S 4.4190 7.9991 111.1025 60.1958 63.2395 174.6132 45 F 4.6560 8.3733 119.3791 58.2723 39.9084 176.5739 46 G 4.0045 7.6376 106.8390 44.5925 0.0000 175.0869 47 D 4.4886 8.6463 126.4702 54.4109 41.0012 175.6049 48 L 4.9100 8.3425 127.5044 54.5641 42.8943 178.0105 49 S 4.3684 8.4622 115.8580 60.3154 63.6916 174.2169 50 T 4.7379 7.4356 110.5091 58.3175 73.0552 172.6201 51 P 4.2212 0.0000 0.0000 66.0766 31.3341 178.7470 52 D 4.3687 8.0832 116.7920 57.2012 40.5422 178.4802 53 A 4.0063 7.8843 120.5840 55.0112 18.6399 179.7110 54 V 3.6886 7.8973 116.6377 66.6011 31.5106 178.3519 55 M 4.0299 8.3250 117.5141 57.9900 31.8739 177.5838 56 G 3.8392 7.9797 104.8763 45.3195 0.0000 173.6537 57 N 4.3394 7.9402 120.1400 53.1438 39.6938 173.7178 58 P 4.2232 0.0000 0.0000 65.4613 31.4378 178.8374 59 K 3.7073 7.9499 117.1548 58.9196 31.8669 179.3384 60 V 3.7065 8.1883 118.7697 65.9880 31.5524 178.3113 61 K 3.9359 8.2016 118.0006 59.4198 31.3802 179.2361 62 A 3.9803 8.2714 121.4754 55.3852 18.1842 179.1973 63 H 4.2965 8.5288 117.0968 59.3406 29.9370 177.5106 64 G 3.7567 8.4849 107.9770 47.9358 0.0000 175.4267 65 K 4.0138 8.0509 121.5099 59.2045 32.2308 179.1753 66 K 4.0368 7.7141 117.8932 59.3180 32.0025 179.4822 67 V 3.6484 8.0287 118.7433 66.2513 31.4592 178.1985 68 L 4.6308 8.6530 119.1661 57.6502 41.5299 179.6481 69 G 3.7528 8.4471 105.8441 47.8241 0.0000 175.6356 70 A 4.1285 8.2084 123.0602 54.9307 18.4367 179.5651 71 F 4.1074 8.4928 116.3949 61.0810 38.8089 178.0969 72 S 4.2465 8.5540 113.6722 61.6282 62.8751 176.0950 73 D 4.6155 8.2504 121.4783 57.4435 40.6209 179.0515 74 G 3.7629 8.0606 106.0444 48.0135 0.0000 175.6606 75 L 3.9707 7.7774 119.7112 56.6999 41.6521 178.5245 76 A 4.3668 7.3906 118.4662 52.4568 19.9822 177.4640 77 H 4.7913 7.6510 113.7233 53.9846 29.3579 173.1308 78 L 4.3462 7.9133 119.8702 55.4318 42.6005 178.0492 79 D 4.5046 8.0194 118.6039 56.7615 41.2489 176.1800 80 N 4.9282 7.5981 117.0910 50.6241 39.4700 174.0390 81 L 4.0806 8.1795 123.2849 56.9996 41.8318 178.6048 82 K 4.0796 8.0624 117.4837 59.5657 32.2386 179.1071 83 G 3.7040 8.7293 106.2253 48.0050 0.0000 175.7481 84 T 3.7087 7.8097 117.2867 65.8883 68.7383 175.6821 85 F 4.6650 7.9992 116.7718 57.1093 39.1581 177.4393 86 A 4.0592 7.7012 123.4072 55.6973 18.1982 180.4032 87 T 3.7975 7.8328 113.5768 66.8126 68.5435 176.5916 88 L 4.0784 7.9354 121.7376 57.9110 42.1270 178.7627 89 S 4.3686 8.6032 115.0196 61.0038 62.4210 175.9305 90 E 3.8768 8.3884 121.4174 59.2465 29.1900 179.1906 91 L 3.8896 8.0260 120.2265 58.6386 42.2527 178.8613 92 H 4.2240 8.6104 116.4645 58.8231 28.7495 177.3631 93 C 3.5145 7.9076 120.6853 62.4153 31.1585 175.3427 94 D 4.4455 8.4276 119.7468 55.9717 40.5838 177.4798 95 K 4.2839 7.7641 117.2308 57.6457 33.4502 177.4872 96 L 4.2022 7.7116 115.8181 54.7450 42.6216 176.0284 97 H 4.1336 7.1378 113.7953 56.6543 26.5743 175.3420 98 V 3.9449 7.8142 118.0238 60.8545 32.5971 174.7397 99 D 4.2838 8.7646 127.2955 53.8922 41.4906 175.1228 100 P 2.9700 0.0000 0.0000 63.9512 31.9018 177.8482 101 E 3.7933 8.1693 119.4230 59.3523 29.1985 178.3326 102 N 4.3042 7.8852 116.4413 56.3555 38.5257 177.2921 103 F 4.4990 7.6235 119.2479 60.5440 38.9451 177.9969 104 R 4.0061 7.9273 117.3928 59.0868 29.9222 178.8278 105 L 3.8232 7.7430 118.4635 57.7621 41.6330 179.3347 106 L 4.1287 8.3867 120.6882 58.0358 42.0269 179.0827 107 G 3.8260 8.3415 105.6998 48.2210 0.0000 175.4553 108 N 4.5056 8.2603 119.0961 55.7548 38.4963 177.8133 109 V 3.6511 8.1526 120.0688 65.7813 31.5341 177.7642 110 L 3.8367 8.4130 120.5876 58.1164 41.8061 179.0381 111 V 3.4823 7.8411 118.0774 66.3228 31.3866 177.7460 112 C 4.0380 8.0994 116.3300 62.8032 27.8716 176.3720 113 V 3.4562 7.7634 119.8642 65.7984 31.0287 178.1090 114 L 3.8168 7.8852 118.8766 57.5436 41.2662 179.3057 115 A 3.6731 7.2929 120.7916 55.2822 18.0842 179.1010 116 H 4.1034 8.0074 115.6450 59.8485 29.9909 176.9196 117 H 4.1007 8.1584 116.9450 58.1249 29.0015 176.9553 118 F 4.5995 8.5136 118.0531 56.3813 39.8017 177.2449 119 G 3.8652 8.9845 108.5987 46.0729 0.0000 177.5777 120 K 4.0057 8.8935 122.6646 59.2236 32.4495 177.8955 121 E 4.0765 8.0959 119.9070 58.6564 30.0823 177.0935 122 F 4.5400 8.1310 123.3672 56.9859 37.9346 175.1445 123 T 4.1494 7.3104 115.4963 60.3433 71.2712 173.4712 124 P 4.1447 0.0000 0.0000 65.6009 31.4044 177.1841 125 P 4.1973 0.0000 0.0000 65.4104 31.1701 178.9043 126 V 3.4784 7.5118 116.7033 65.8083 31.4259 177.6665 127 Q 3.5618 7.8703 119.4583 59.2084 28.8596 178.3936 128 A 4.0062 8.0816 121.3558 55.0260 18.3767 179.4610 129 A 3.8521 7.8911 119.1063 55.6643 18.4147 179.5705 130 Y 3.8670 8.2104 115.2678 61.1517 37.9001 178.7967 131 Q 4.1161 8.9376 119.5611 58.8223 28.7306 178.8484 132 K 3.9796 8.0554 119.5326 59.3036 31.9837 179.4197 133 V 3.5299 7.6796 118.3929 66.3534 31.4656 178.6523 134 V 3.8222 8.3303 112.1646 64.1991 31.2754 178.5520 135 A 4.1146 8.3469 120.9956 54.9733 18.1414 179.9225 136 G 3.5091 8.3138 104.4387 47.8624 0.0000 176.1223 137 V 3.1732 8.0686 120.9680 65.4600 31.5330 177.9634 138 A 3.8580 8.0250 120.5266 55.2683 18.0186 179.3676 139 N 4.3013 8.2470 113.9587 56.3438 39.0064 177.2274 140 A 4.1550 8.1363 122.3387 55.2355 18.6083 179.7686 141 L 3.8330 8.0215 117.5319 57.3213 41.6301 178.9236 142 A 4.3205 8.0626 119.6409 53.8295 18.3697 178.7973 143 H 4.3285 8.0463 116.4094 58.4093 30.0089 175.8030 144 K 4.4563 8.1115 117.8738 56.2369 32.1780 176.4484 145 Y 4.1090 7.9032 117.3693 58.5315 38.3923 175.8693 146 H 4.4513 8.2512 117.1756 56.1650 28.3361 173.2863 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 V 8.05 4.10 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 0.95 0.00 0.00 0.93 0.00 0.00 2 H 7.93 4.70 0.00 3.13 3.18 0.00 5.79 0.00 0.00 0.00 0.00 8.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.07 4.41 0.00 1.57 1.52 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.72 4.01 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 1.22 0.00 0.00 5 P 0.00 4.20 0.00 2.17 2.07 0.00 3.62 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 2.09 2.12 0.00 6 E 8.10 3.94 0.00 1.97 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 2.35 2.33 0.00 7 E 7.91 3.92 0.00 2.24 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 2.34 2.35 0.00 8 K 8.31 3.84 0.00 1.86 1.80 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.37 7.81 9 S 8.14 4.04 0.00 3.94 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 10 A 7.91 4.00 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 11 V 7.99 3.40 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 0.51 0.00 0.00 0.33 0.00 0.00 12 T 8.20 3.95 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 1.26 0.00 0.00 13 A 7.83 4.00 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 14 L 7.95 3.83 0.00 1.93 1.82 0.42 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.72 4.32 0.00 3.78 3.29 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 16 G 8.24 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 17 K 7.75 4.44 0.00 2.27 2.09 0.00 1.98 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.63 7.81 18 V 7.31 3.57 1.44 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 0.09 0.00 0.00 0.66 0.00 0.00 19 N 8.49 4.33 0.00 2.69 2.63 0.00 0.00 6.86 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 8.01 3.76 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 0.87 0.00 0.00 0.92 0.00 0.00 21 D 8.06 4.46 0.00 2.84 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 22 E 8.62 4.00 0.00 1.97 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 2.28 2.40 0.00 23 V 8.07 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 0.92 0.00 0.00 0.80 0.00 0.00 24 G 8.09 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 25 G 7.54 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 26 E 8.56 3.98 0.00 2.12 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 0.00 2.31 2.31 0.00 27 A 8.28 3.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.31 3.99 0.00 1.78 1.67 0.78 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.49 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 8.30 3.92 0.00 1.90 1.94 0.00 3.08 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 31 L 8.11 4.06 0.00 1.91 1.91 0.99 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.87 4.06 0.00 1.90 1.68 0.90 0.51 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 7.36 3.57 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.93 0.00 0.00 34 V 7.84 3.52 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 -0.12 0.00 0.00 0.77 0.00 0.00 35 Y 7.36 3.69 0.00 2.54 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 5.02 0.00 2.31 2.29 0.00 3.71 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 2.24 1.91 0.00 37 W 8.20 4.40 0.00 3.58 3.52 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 0.00 38 T 7.75 4.28 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 1.06 0.00 0.00 39 Q 8.19 4.32 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 40 R 7.66 3.75 0.00 1.67 1.99 0.00 3.01 0.00 0.00 2.63 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.50 0.00 41 F 7.34 4.32 0.00 1.89 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 0.00 0.00 0.00 0.00 42 F 7.94 4.45 0.00 2.86 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.45 3.97 0.00 1.97 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 0.00 2.41 2.33 0.00 44 S 8.00 4.42 0.00 4.16 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 45 F 8.37 4.66 0.00 3.21 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 7.64 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 8.65 4.49 0.00 2.68 2.64 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 48 L 8.34 4.91 0.00 1.67 1.63 1.08 1.05 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 49 S 8.46 4.37 0.00 4.01 4.01 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 0.00 0.00 0.00 50 T 7.44 4.74 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 51 P 0.00 4.22 0.00 2.15 2.12 0.00 3.59 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 2.09 2.16 0.00 52 D 8.08 4.37 0.00 2.68 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 53 A 7.88 4.01 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 54 V 7.90 3.69 2.20 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 1.06 0.00 0.00 0.94 0.00 0.00 55 M 8.33 4.03 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.78 0.00 56 G 7.98 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 0.00 0.00 0.00 57 N 7.94 4.34 0.00 3.12 2.86 0.00 0.00 7.17 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 58 P 0.00 4.22 0.00 2.14 2.04 0.00 3.62 0.00 0.00 3.88 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 7.95 3.71 0.00 1.58 0.74 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.27 1.33 7.81 60 V 8.19 3.71 2.25 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 1.11 0.00 0.00 1.11 0.00 0.00 61 K 8.20 3.94 0.00 1.94 1.81 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 62 A 8.27 3.98 1.28 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 0.00 0.00 63 H 8.53 4.30 0.00 3.50 3.54 0.00 5.81 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 8.48 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 65 K 8.05 4.01 0.00 2.01 1.99 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.69 7.81 66 K 7.71 4.04 0.00 2.03 1.86 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.63 7.81 67 V 8.03 3.65 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 1.27 0.00 0.00 1.03 0.00 0.00 68 L 8.65 4.63 0.00 2.02 1.87 0.90 0.97 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 69 G 8.45 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 70 A 8.21 4.13 1.50 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 0.00 0.00 71 F 8.49 4.11 0.00 3.51 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 72 S 8.55 4.25 0.00 4.29 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 73 D 8.25 4.62 0.00 2.91 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 74 G 8.06 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 75 L 7.78 3.97 0.00 1.47 1.46 -0.72 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.39 4.37 1.14 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 77 H 7.65 4.79 0.00 2.99 3.12 0.00 5.85 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 78 L 7.91 4.35 0.00 1.57 1.68 0.92 1.07 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 79 D 8.02 4.50 0.00 2.66 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 80 N 7.60 4.93 0.00 2.63 2.59 0.00 0.00 7.23 6.66 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 81 L 8.18 4.08 0.00 1.78 1.87 0.95 1.05 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 82 K 8.06 4.08 0.00 1.82 1.77 0.00 1.61 0.00 0.00 1.17 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.45 7.81 83 G 8.73 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 84 T 7.81 3.71 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 0.59 0.00 0.00 85 F 8.00 4.67 0.00 3.14 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 7.70 4.06 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 87 T 7.83 3.80 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 1.22 0.00 0.00 88 L 7.94 4.08 0.00 1.87 1.76 1.01 1.00 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 89 S 8.60 4.37 0.00 4.15 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 90 E 8.39 3.88 0.00 2.19 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 2.32 2.53 0.00 91 L 8.03 3.89 0.00 1.87 1.88 0.91 0.84 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 8.61 4.22 0.00 3.55 3.78 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.91 3.51 0.00 1.23 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 0.00 0.00 0.00 0.00 94 D 8.43 4.45 0.00 2.69 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 95 K 7.76 4.28 0.00 1.82 1.79 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.50 7.81 96 L 7.71 4.20 0.00 1.72 1.64 0.71 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.14 4.13 0.00 3.48 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.81 3.94 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 0.19 0.00 0.00 0.48 0.00 0.00 99 D 8.76 4.28 0.00 2.77 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 2.97 0.00 1.82 1.66 0.00 3.28 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.44 0.00 101 E 8.17 3.79 0.00 2.00 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 2.29 2.39 0.00 102 N 7.89 4.30 0.00 2.59 2.80 0.00 0.00 6.94 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 0.00 103 F 7.62 4.50 0.00 3.05 2.85 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 0.00 104 R 7.93 4.01 0.00 2.02 1.97 0.00 3.10 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 105 L 7.74 3.82 0.00 1.79 1.40 0.68 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.39 4.13 0.00 1.87 1.84 1.02 1.42 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 0.00 107 G 8.34 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 0.00 108 N 8.26 4.51 0.00 2.83 2.95 0.00 0.00 6.71 7.70 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 0.00 109 V 8.15 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 1.08 0.00 0.00 1.21 0.00 0.00 110 L 8.41 3.84 0.00 1.68 1.81 0.82 0.14 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 0.00 111 V 7.84 3.48 2.31 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 1.39 0.00 0.00 1.11 0.00 0.00 112 C 8.10 4.04 0.00 3.19 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 0.00 113 V 7.76 3.46 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 0.81 0.00 0.00 0.88 0.00 0.00 114 L 7.89 3.82 0.00 0.90 1.05 0.38 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.29 3.67 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 0.00 116 H 8.01 4.10 0.00 3.19 3.46 0.00 5.77 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 0.00 117 H 8.16 4.10 0.00 2.76 2.62 0.00 5.71 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 0.00 118 F 8.51 4.60 0.00 3.24 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 0.00 119 G 8.98 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 0.00 120 K 8.89 4.01 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 121 E 8.10 4.08 0.00 2.12 2.43 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 2.38 2.31 0.00 122 F 8.13 4.54 0.00 3.06 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 T 7.31 4.15 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 4.14 0.00 2.15 2.14 0.00 3.58 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 2.11 2.19 0.00 125 P 0.00 4.20 0.00 2.10 2.06 0.00 3.48 0.00 0.00 3.66 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 7.51 3.48 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 1.01 0.00 0.00 0.88 0.00 0.00 127 Q 7.87 3.56 0.00 1.67 2.10 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 2.41 2.59 0.00 128 A 8.08 4.01 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 0.00 129 A 7.89 3.85 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 0.00 130 Y 8.21 3.87 0.00 3.39 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 0.00 131 Q 8.94 4.12 0.00 2.21 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 2.75 2.61 0.00 132 K 8.06 3.98 0.00 2.00 1.84 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.67 7.81 133 V 7.68 3.53 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 1.09 0.00 0.00 0.70 0.00 0.00 134 V 8.33 3.82 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 0.94 0.00 0.00 1.10 0.00 0.00 135 A 8.35 4.11 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 0.00 136 G 8.31 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 3.17 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 -0.08 0.00 0.00 0.95 0.00 0.00 138 A 8.02 3.86 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 0.00 139 N 8.25 4.30 0.00 2.86 2.90 0.00 0.00 7.05 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 0.00 140 A 8.14 4.16 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 0.00 141 L 8.02 3.83 0.00 0.95 0.55 -0.23 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.06 4.32 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 0.00 143 H 8.05 4.33 0.00 3.44 3.51 0.00 5.75 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 8.11 4.46 0.00 1.83 1.84 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.60 7.81 145 Y 7.90 4.11 0.00 3.12 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 0.00 146 H 8.25 4.45 0.00 3.20 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