NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9192 8.0544 114.0507 61.5367 32.8809 174.9014 2 H 4.4478 8.5584 122.0965 54.4750 29.1512 172.4718 3 L 4.8025 7.7291 126.9181 52.5123 44.9896 177.2718 4 T 4.0328 8.6114 113.8936 60.9305 70.8119 173.8146 5 P 4.1562 0.0000 0.0000 65.8667 31.2185 178.7378 6 E 4.0577 8.0355 116.9404 59.0327 29.5681 178.8087 7 E 3.9104 7.9439 118.6127 59.1521 29.5427 179.2321 8 K 3.8632 8.2522 120.2244 59.5103 32.1883 179.0727 9 S 4.1474 8.1831 114.3704 61.1763 63.0119 176.2928 10 A 3.9732 8.0434 124.5342 54.9091 18.1016 179.6470 11 V 3.3188 7.7338 116.6440 66.4389 31.5586 178.3214 12 T 3.9157 7.9962 115.0138 66.6436 68.1412 176.4479 13 A 4.0319 8.0519 121.4889 55.2303 18.7661 179.1745 14 L 3.9073 8.0514 118.6885 57.9583 42.1864 178.9393 15 W 4.3783 8.7012 128.5639 60.3145 30.4082 178.0934 16 G 3.7310 8.0334 104.5422 46.8459 0.0000 174.7790 17 K 4.3988 7.6672 118.3258 55.5862 32.9352 176.8273 18 V 3.6076 6.9997 120.4905 62.2521 31.9706 175.7572 19 N 4.5042 8.3081 125.5374 52.3719 38.8365 175.3374 20 V 3.4399 8.0943 128.5046 65.9422 31.7698 176.9529 21 D 4.3590 7.9110 118.7141 57.6243 40.8236 178.7878 22 E 3.8777 8.1287 117.9592 59.5788 29.5826 179.6281 23 V 3.5920 7.9566 118.5895 65.5846 31.5158 178.1745 24 G 3.7485 8.3452 105.9958 47.8593 0.0000 175.9101 25 G 3.5918 7.9147 108.1958 47.3226 0.0000 175.6830 26 E 3.9094 8.0689 120.6439 58.9727 29.5281 179.2639 27 A 3.9175 8.2188 121.0910 55.1517 18.6363 179.4679 28 L 3.9861 8.0520 118.9508 58.1503 42.1997 179.3257 29 G 3.5904 8.1282 105.6684 48.0216 0.0000 175.9303 30 R 3.9076 8.2800 121.0402 58.5144 29.9639 178.8973 31 L 4.0192 7.9573 120.3017 58.3372 42.1244 179.1983 32 L 4.0644 7.7510 119.5473 56.6338 41.2017 179.7311 33 V 3.5278 7.2320 117.7301 65.8621 31.7478 178.0196 34 V 3.5351 7.6726 116.8679 64.4318 32.7047 175.5126 35 Y 3.8307 7.4456 116.4842 53.9755 38.1018 173.9364 36 P 4.7408 0.0000 0.0000 64.4311 31.8536 178.3952 37 W 4.2985 8.1817 116.6780 59.5649 27.6253 177.8304 38 T 4.1979 7.6594 110.2948 64.1285 68.0351 176.0072 39 Q 4.4253 8.3552 121.5661 58.0326 28.4576 178.0806 40 R 3.7268 7.5315 116.5821 58.7743 29.2107 177.8082 41 F 4.3464 7.0158 115.5186 57.2728 39.5192 175.5978 42 F 4.5540 7.8799 118.6180 56.6415 39.9359 177.0820 43 E 3.9913 8.5359 122.6489 59.4876 29.3989 178.3492 44 S 4.6656 8.0345 110.5218 58.5617 63.2445 174.5464 45 F 4.6390 8.4657 119.2339 58.2627 39.6972 175.9637 46 G 3.9264 8.1763 105.6710 44.0655 0.0000 172.9062 47 D 4.5428 8.5629 122.9822 54.1995 41.3862 176.4204 48 L 4.8770 8.3820 124.7693 54.2834 43.4097 177.6783 49 S 4.2814 8.1454 115.2557 60.6394 63.2711 174.9344 50 T 4.7308 7.4379 109.5601 58.2750 72.9066 172.7465 51 P 4.2448 0.0000 0.0000 65.9846 31.3437 178.7938 52 D 4.3086 8.0218 116.9420 57.0567 40.5997 178.3374 53 A 3.9491 7.7085 120.3110 55.1812 18.6096 179.3530 54 V 3.6905 8.2693 116.7472 66.7653 31.3970 178.2679 55 M 4.1955 8.2911 117.2411 57.6504 31.8294 178.0284 56 G 4.0326 7.7451 103.1384 43.4872 0.0000 173.5798 57 N 4.4831 7.5619 121.4058 52.5443 39.8683 173.9123 58 P 4.2462 0.0000 0.0000 65.9027 31.5495 178.7516 59 K 3.6131 8.2259 118.3641 58.7991 31.6861 179.5050 60 V 3.6643 7.7550 118.1468 65.9600 31.5681 178.0211 61 K 3.8996 7.9863 117.9770 59.3532 31.8802 179.1458 62 A 3.9567 8.1448 121.1772 55.4660 18.3504 179.1944 63 H 4.3074 8.3882 116.8696 59.3070 30.0093 177.4162 64 G 3.7453 8.4551 108.0379 47.9534 0.0000 175.4140 65 K 3.9978 8.2088 122.1634 58.9761 32.2104 179.0560 66 K 3.9798 7.9879 118.7495 59.4467 31.9950 179.4223 67 V 3.6391 8.1828 118.7578 66.2632 31.4583 178.1593 68 L 4.3464 8.2685 118.6995 57.5152 41.3231 179.7329 69 G 3.7295 8.3249 105.8641 47.9191 0.0000 175.6898 70 A 4.1565 7.9695 122.2723 54.6572 18.5597 179.1436 71 F 4.3214 8.6578 119.4417 61.6366 39.4972 177.4027 72 S 4.1393 9.0279 115.1823 61.8703 62.8273 176.2942 73 D 4.4873 8.1192 121.2530 57.5704 40.7355 179.2981 74 G 3.6158 7.8933 105.4714 47.1958 0.0000 175.6738 75 L 3.7800 7.2853 120.2229 57.0991 41.5902 178.5556 76 A 4.1596 7.5847 119.0021 53.3081 19.5384 176.8094 77 H 4.8397 7.7344 114.3270 54.7677 29.5711 175.0984 78 L 3.8614 7.8833 121.5927 57.5705 42.4353 176.9957 79 D 4.5482 7.8830 116.0601 54.5847 40.7151 176.0583 80 N 4.9937 8.1656 119.0199 51.5390 39.4267 174.5727 81 L 4.0467 7.9058 123.8885 57.9569 42.0025 179.2855 82 K 4.0573 8.1684 118.0378 59.6442 31.7873 179.4799 83 G 3.5782 8.0863 104.0652 47.9725 0.0000 175.4259 84 T 3.7828 7.9307 117.5123 65.8876 68.6805 175.8775 85 F 4.6387 8.2300 117.3769 57.0802 39.1511 177.3649 86 A 4.0716 7.6115 122.5921 55.7830 18.1786 180.4155 87 T 3.8058 7.8309 113.3271 66.9303 68.6807 176.8457 88 L 4.1266 7.9914 120.3409 57.6909 41.7336 179.3690 89 S 4.4327 8.7225 114.9395 61.0701 62.3661 176.1818 90 E 3.9218 8.2464 121.2706 59.0678 29.0691 179.0797 91 L 3.9015 8.0603 120.4187 58.6699 42.2459 178.9056 92 H 4.1323 8.4359 116.0225 58.7499 28.5595 177.3015 93 C 3.5634 7.7050 120.4900 62.2832 31.1586 175.3906 94 D 4.3821 8.2219 120.0303 56.7092 40.5790 177.6234 95 K 4.2363 7.6949 116.5460 57.8311 33.2616 177.6260 96 L 4.1462 7.9241 117.3676 55.1321 42.0286 176.4215 97 H 4.1752 7.2723 112.8167 56.6467 26.5969 174.8672 98 V 3.6147 7.7795 119.1771 61.2981 32.0809 175.0273 99 D 4.3444 8.7758 127.1356 53.9075 41.6432 175.1893 100 P 3.0365 0.0000 0.0000 64.2078 31.7797 177.9407 101 E 3.8651 8.1772 119.2579 59.1072 29.3431 178.3666 102 N 4.3282 8.0052 116.6922 56.0660 38.4497 177.2875 103 F 4.5250 7.4655 119.4926 60.5397 39.0534 177.9302 104 R 3.9750 7.9225 117.3366 59.1491 29.8982 178.9042 105 L 3.8111 7.8645 118.7898 57.6393 41.5843 179.2471 106 L 4.0484 8.1110 120.3989 58.0753 42.1082 179.0609 107 G 3.7499 8.1468 105.6286 48.1392 0.0000 175.4059 108 N 4.4492 8.1291 118.7381 55.9532 38.6154 177.7833 109 V 3.6394 8.1150 119.9083 65.8016 31.5181 177.7022 110 L 3.8797 8.3723 120.5926 58.0778 41.8277 179.0494 111 V 3.5600 7.6989 117.7463 66.3765 31.4719 177.5986 112 C 4.0350 7.9738 116.2461 63.0041 27.8915 176.5014 113 V 3.5234 7.7238 119.5708 65.8547 31.0910 178.1337 114 L 3.8442 7.8980 118.7541 57.5758 41.3214 179.2726 115 A 3.8194 7.3551 120.7206 55.3341 18.0842 179.1832 116 H 4.0710 8.0080 115.6808 59.5389 30.0003 176.8068 117 H 3.8566 8.0984 119.2165 59.0718 29.8014 176.7958 118 F 4.4958 8.5162 118.7781 57.4540 39.4194 177.1866 119 G 3.9263 8.8173 108.3531 45.9421 0.0000 176.7471 120 K 3.9042 8.9752 123.2041 59.2549 32.0752 177.7013 121 E 4.1589 7.9198 117.2739 58.7263 29.7819 177.4931 122 F 4.6042 8.1688 123.4183 57.0354 37.8485 175.3297 123 T 4.1941 7.4220 115.8453 60.0118 71.3548 173.4969 124 P 4.1499 0.0000 0.0000 65.6691 31.4029 177.1791 125 P 4.2193 0.0000 0.0000 65.3652 31.1530 178.9331 126 V 3.5376 7.3734 116.7233 65.8522 31.4695 177.7648 127 Q 3.5229 7.8501 119.4523 59.1154 28.9748 178.1125 128 A 4.0452 8.0559 121.4381 55.1727 18.4218 179.5378 129 A 3.8819 7.8479 118.9273 55.5898 18.4405 179.4733 130 Y 3.8978 8.3165 115.4397 61.3337 38.0048 178.9134 131 Q 4.1590 8.8997 119.3485 58.9956 28.8161 179.0714 132 K 4.0372 8.0516 119.2430 59.1702 32.0154 179.6954 133 V 3.4714 7.6158 118.3865 66.2266 31.5062 178.6507 134 V 3.8639 8.3926 112.3512 64.3100 31.2494 178.4881 135 A 4.1197 8.1790 120.7752 54.8892 18.1972 179.8699 136 G 3.5202 8.0464 104.2649 47.9456 0.0000 176.0839 137 V 3.2824 7.8630 120.9308 65.4090 31.6738 177.8325 138 A 3.9155 8.0706 120.5251 55.3344 17.8932 179.4115 139 N 4.2958 8.5069 115.0089 56.3255 38.3967 177.4454 140 A 4.0332 8.1338 121.4567 55.3638 18.7673 179.5293 141 L 3.9499 8.0291 117.1682 57.0739 41.6795 178.6967 142 A 4.4529 7.8308 119.0852 52.8698 18.7621 178.3958 143 H 4.0890 7.8216 117.0146 59.0544 29.9420 175.9792 144 K 4.4628 8.3012 115.7383 56.3434 32.0123 176.4350 145 Y 4.1507 7.9893 117.6555 58.4445 38.4170 175.6756 146 H 4.4142 8.3658 117.6189 56.2465 28.1226 173.3993 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 3.92 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 0.88 0.00 0.00 0.86 0.00 0.00 2 H 8.56 4.45 0.00 3.16 3.24 0.00 5.68 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 3 L 7.73 4.80 0.00 1.53 1.43 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.61 4.03 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 1.21 0.00 0.00 5 P 0.00 4.16 0.00 2.15 2.14 0.00 3.56 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 6 E 8.04 4.06 0.00 1.95 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 2.38 2.32 0.00 7 E 7.94 3.91 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 8 K 8.25 3.86 0.00 1.91 1.75 0.00 1.43 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.41 7.81 9 S 8.18 4.15 0.00 4.10 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 10 A 8.04 3.97 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 11 V 7.73 3.32 1.87 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 0.65 0.00 0.00 0.42 0.00 0.00 12 T 8.00 3.92 4.37 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 1.24 0.00 0.00 13 A 8.05 4.03 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 14 L 8.05 3.91 0.00 2.09 1.93 0.85 -0.44 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 15 W 8.70 4.38 0.00 3.85 3.21 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 16 G 8.03 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.67 4.40 0.00 1.92 2.03 0.00 1.70 0.00 0.00 1.51 0.00 0.00 3.25 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.55 7.81 18 V 7.00 3.61 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.65 0.00 0.00 19 N 8.31 4.50 0.00 2.71 2.59 0.00 0.00 6.84 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 8.09 3.44 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 1.20 0.00 0.00 0.91 0.00 0.00 21 D 7.91 4.36 0.00 2.84 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.13 3.88 0.00 2.04 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 2.30 0.00 23 V 7.96 3.59 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 0.95 0.00 0.00 0.66 0.00 0.00 24 G 8.35 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 25 G 7.91 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.07 3.91 0.00 2.22 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 2.27 2.41 0.00 27 A 8.22 3.92 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 28 L 8.05 3.99 0.00 1.76 1.64 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.13 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.28 3.91 0.00 1.80 1.92 0.00 3.07 0.00 0.00 3.01 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.74 0.00 31 L 7.96 4.02 0.00 1.90 1.88 1.01 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.75 4.06 0.00 1.94 1.67 0.97 0.22 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 33 V 7.23 3.53 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.67 3.54 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 0.05 0.00 0.00 0.74 0.00 0.00 35 Y 7.45 3.83 0.00 2.58 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.74 0.00 2.31 2.29 0.00 3.64 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 37 W 8.18 4.30 0.00 3.55 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 7.66 4.20 4.42 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 1.10 0.00 0.00 39 Q 8.36 4.43 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 40 R 7.53 3.73 0.00 1.67 1.97 0.00 3.00 0.00 0.00 2.61 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.50 0.00 41 F 7.02 4.35 0.00 1.94 2.40 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 42 F 7.88 4.55 0.00 2.83 2.14 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 43 E 8.54 3.99 0.00 1.95 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 2.25 2.22 0.00 44 S 8.03 4.67 0.00 4.09 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 45 F 8.47 4.64 0.00 3.22 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.18 3.93 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 0.00 0.00 0.00 47 D 8.56 4.54 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.38 4.88 0.00 1.66 1.63 1.06 1.04 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 49 S 8.15 4.28 0.00 4.04 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 50 T 7.44 4.73 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.24 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 52 D 8.02 4.31 0.00 2.67 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.71 3.95 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.27 3.69 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 1.01 0.00 0.00 0.96 0.00 0.00 55 M 8.29 4.20 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.91 0.00 56 G 7.75 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 57 N 7.56 4.48 0.00 2.93 2.85 0.00 0.00 6.94 8.25 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 58 P 0.00 4.25 0.00 2.24 2.25 0.00 3.71 0.00 0.00 3.89 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 59 K 8.23 3.61 0.00 1.60 0.74 0.00 1.42 0.00 0.00 1.53 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.04 1.20 7.81 60 V 7.76 3.66 2.22 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 1.12 0.00 0.00 1.08 0.00 0.00 61 K 7.99 3.90 0.00 1.95 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.67 7.81 62 A 8.14 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.39 4.31 0.00 3.63 3.50 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 8.46 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 65 K 8.21 4.00 0.00 1.95 2.06 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.73 7.81 66 K 7.99 3.98 0.00 2.05 1.91 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.67 7.81 67 V 8.18 3.64 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 1.16 0.00 0.00 0.90 0.00 0.00 68 L 8.27 4.35 0.00 2.01 1.90 1.05 0.81 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 69 G 8.32 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.97 4.16 1.52 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 0.00 0.00 71 F 8.66 4.32 0.00 3.23 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 72 S 9.03 4.14 0.00 4.19 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 73 D 8.12 4.49 0.00 2.78 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.89 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 75 L 7.29 3.78 0.00 1.51 1.47 0.32 -0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.58 4.16 1.25 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 0.00 0.00 77 H 7.73 4.84 0.00 3.12 3.15 0.00 5.82 0.00 0.00 0.00 0.00 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.88 3.86 0.00 1.47 1.62 0.81 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.88 4.55 0.00 2.80 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 80 N 8.17 4.99 0.00 2.72 2.64 0.00 0.00 7.04 7.29 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 81 L 7.91 4.05 0.00 1.75 1.80 0.87 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.17 4.06 0.00 1.79 1.82 0.00 1.49 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.14 1.51 7.81 83 G 8.09 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 0.00 0.00 0.00 84 T 7.93 3.78 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 0.43 0.00 0.00 85 F 8.23 4.64 0.00 3.15 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.61 4.07 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 87 T 7.83 3.81 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 88 L 7.99 4.13 0.00 2.02 1.88 1.11 0.89 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 8.72 4.43 0.00 4.13 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 90 E 8.25 3.92 0.00 2.31 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 2.48 0.00 91 L 8.06 3.90 0.00 1.78 1.89 0.90 0.87 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 92 H 8.44 4.13 0.00 3.55 3.75 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 7.70 3.56 0.00 1.23 2.32 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 94 D 8.22 4.38 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 7.69 4.24 0.00 1.79 1.81 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.36 7.81 96 L 7.92 4.15 0.00 1.71 1.64 0.73 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.27 4.18 0.00 3.48 3.48 0.00 5.65 0.00 0.00 0.00 0.00 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.78 3.61 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 0.10 0.00 0.00 0.47 0.00 0.00 99 D 8.78 4.34 0.00 2.80 2.78 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 0.00 0.00 0.00 100 P 0.00 3.04 0.00 1.92 1.70 0.00 3.38 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.47 0.00 101 E 8.18 3.87 0.00 2.02 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 0.00 2.31 2.38 0.00 102 N 8.01 4.33 0.00 2.50 2.72 0.00 0.00 6.88 7.66 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 0.00 103 F 7.47 4.52 0.00 3.08 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 0.00 104 R 7.92 3.98 0.00 2.06 1.96 0.00 3.15 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 1.73 1.80 0.00 105 L 7.86 3.81 0.00 1.70 1.37 0.69 -0.13 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 0.00 106 L 8.11 4.05 0.00 1.82 1.73 0.93 0.91 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 0.00 107 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 8.13 4.45 0.00 2.95 2.95 0.00 0.00 6.70 7.21 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 0.00 109 V 8.11 3.64 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 1.07 0.00 0.00 1.17 0.00 0.00 110 L 8.37 3.88 0.00 1.72 1.76 0.89 0.41 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 0.00 111 V 7.70 3.56 2.32 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 1.33 0.00 0.00 1.17 0.00 0.00 112 C 7.97 4.04 0.00 3.21 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 0.00 113 V 7.72 3.52 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 1.01 0.00 0.00 0.93 0.00 0.00 114 L 7.90 3.84 0.00 0.87 1.13 0.59 1.22 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 0.00 115 A 7.36 3.82 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 0.00 116 H 8.01 4.07 0.00 3.17 3.42 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.10 3.86 0.00 2.88 2.73 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.52 4.50 0.00 3.28 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 0.00 119 G 8.82 3.93 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 0.00 0.00 0.00 120 K 8.98 3.90 0.00 1.77 1.92 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.52 7.81 121 E 7.92 4.16 0.00 2.12 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 0.00 2.43 2.60 0.00 122 F 8.17 4.60 0.00 3.02 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.42 4.19 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 1.30 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.15 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 125 P 0.00 4.22 0.00 2.12 2.07 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 7.37 3.54 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 1.09 0.00 0.00 0.92 0.00 0.00 127 Q 7.85 3.52 0.00 1.57 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 128 A 8.06 4.05 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 7.85 3.88 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 0.00 130 Y 8.32 3.90 0.00 3.45 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 0.00 131 Q 8.90 4.16 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.62 0.00 132 K 8.05 4.04 0.00 1.97 1.83 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.59 7.81 133 V 7.62 3.47 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 0.88 0.00 0.00 0.74 0.00 0.00 134 V 8.39 3.86 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 0.95 0.00 0.00 1.13 0.00 0.00 135 A 8.18 4.12 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.05 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 0.00 0.00 0.00 137 V 7.86 3.28 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 0.65 0.00 0.00 0.64 0.00 0.00 138 A 8.07 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.51 4.30 0.00 2.90 2.88 0.00 0.00 6.94 7.73 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 0.00 140 A 8.13 4.03 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 0.00 141 L 8.03 3.95 0.00 1.02 0.63 0.04 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.83 4.45 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 0.00 143 H 7.82 4.09 0.00 3.30 3.53 0.00 5.75 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 0.00 144 K 8.30 4.46 0.00 1.83 1.83 0.00 1.79 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.71 7.81 145 Y 7.99 4.15 0.00 3.13 2.96 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 0.00 0.00 0.00 146 H 8.37 4.41 0.00 3.23 3.25 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