NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 M 4.2516 8.3044 120.3598 55.4057 33.5010 175.5475 6 D 4.5591 8.3765 125.4239 52.3579 41.2615 175.2358 7 W 4.0844 9.7212 129.2492 59.9782 29.6805 177.5666 8 D 4.5994 8.4271 118.1729 57.0718 40.0724 178.3898 9 K 4.3023 7.9964 117.6114 57.9359 32.5184 178.3218 10 T 4.2704 7.8074 114.7602 64.6121 69.4855 175.8280 11 V 3.7790 8.1768 119.0674 65.4826 32.2755 175.1328 12 G 4.2485 8.1589 102.4170 42.3425 0.0000 173.6838 13 A 4.4687 8.7207 123.2682 50.9618 20.2976 178.6552 14 A 3.9701 8.5796 124.8910 55.3585 18.5978 180.0184 15 E 3.9192 8.2691 116.5505 59.8923 29.5808 179.3429 16 D 4.3613 8.0655 118.0137 57.4888 40.9363 178.8764 17 V 3.6844 8.1807 119.0747 65.9249 31.3956 177.9775 18 R 3.9223 8.3187 118.7312 59.4552 29.7074 178.4843 19 R 3.9751 7.8682 117.4275 59.4044 30.3647 178.3392 20 I 3.9182 7.9707 119.6019 64.3284 37.2968 177.7639 21 F 4.0295 8.5887 121.9585 61.7055 39.0088 176.5039 22 E 3.9793 8.6364 118.8102 59.4190 29.1015 177.7155 23 H 4.8841 7.6720 112.1825 54.2511 29.5697 175.1616 24 I 3.7092 6.9739 123.1757 61.0552 37.8043 175.5835 25 P 4.5711 0.0000 0.0000 60.7096 29.8516 175.4408 26 A 4.3785 6.8861 118.5428 51.6185 22.4375 176.3578 27 I 4.0316 8.1338 121.8932 61.4226 38.3217 175.0782 28 L 5.3691 8.8156 126.8374 52.8810 45.2992 175.8432 29 V 4.7793 8.8990 122.3061 61.2358 35.5082 173.9402 30 G 4.5275 9.4333 114.6772 44.4480 0.0000 171.8934 31 L 5.4777 8.9734 123.3868 52.6855 46.1246 175.3471 32 E 4.8170 8.9877 118.7056 55.7774 33.6790 176.3873 33 G 4.1640 9.3107 110.5676 44.1158 0.0000 172.7225 34 P 3.1177 0.0000 0.0000 64.3563 31.6696 176.8761 35 D 4.4317 7.7022 118.0546 53.3808 41.8301 175.8381 36 H 4.0015 7.4152 115.4309 56.9656 26.6919 174.9030 37 R 4.4468 8.0583 118.9330 55.7298 32.0068 178.2419 38 F 4.4035 9.1153 122.9013 58.2802 39.2539 175.8081 39 V 4.1654 9.0769 123.9262 64.1156 33.4204 176.1573 40 A 4.7064 7.6772 120.9854 50.8862 22.3729 175.7380 41 V 5.2067 8.8072 114.9584 58.9656 36.2028 174.5731 42 N 5.3119 8.9184 120.7277 50.4150 40.1901 175.3840 43 A 4.0194 8.6214 119.7364 55.1681 18.2846 179.6978 44 A 3.9385 7.9363 118.8166 55.4334 18.4821 178.7716 45 Y 4.0610 8.3870 117.9664 61.3493 38.3799 178.9151 46 R 4.2896 8.5666 118.8645 59.0655 29.9131 179.3566 47 G 3.6658 8.4491 105.6183 47.5445 0.0000 175.3783 48 F 4.5407 8.0401 122.0469 59.6703 40.7981 175.4704 49 S 4.1423 7.5645 114.5274 55.0629 61.6494 172.1845 50 P 4.4275 0.0000 0.0000 63.5449 31.8427 177.7497 51 L 4.0192 8.0323 117.9970 57.4922 41.6470 177.8830 52 L 3.8570 7.2810 119.0738 55.3752 42.3295 176.1419 53 D 4.7346 8.2273 124.1065 55.4015 42.5833 175.8353 54 T 4.3191 7.1648 112.8140 62.8682 72.3160 172.4791 55 V 4.0756 7.9366 122.3525 63.1191 32.5215 175.7944 56 G 4.1188 8.6659 112.9510 45.5272 0.0000 174.1897 57 Q 4.4176 7.9737 118.7866 54.0076 30.3435 173.5088 58 P 4.5890 0.0000 0.0000 61.9582 32.3240 177.2073 59 A 4.3114 8.5148 124.7422 55.7832 17.9868 180.3827 60 R 3.7073 7.7257 115.7654 59.5647 29.8192 178.9990 61 E 4.0646 7.8027 117.0802 58.9256 29.4582 179.1350 62 V 3.6689 7.6266 117.3467 64.4674 33.5230 175.7193 63 Y 5.0156 8.2933 115.5053 55.6625 38.1379 174.4962 64 P 4.5342 0.0000 0.0000 64.9107 32.1631 179.3910 65 E 4.0694 8.2600 115.9198 58.7647 29.6984 177.5211 66 L 4.2854 8.0579 118.2284 55.2335 42.1127 176.4915 67 E 4.4566 8.0457 120.1106 57.7956 29.6916 177.3651 68 G 4.0409 9.2540 111.7720 45.4933 0.0000 173.6923 69 Q 4.2956 8.0519 117.4977 55.5451 29.2677 177.0032 70 Q 4.0523 8.2329 116.2800 56.9340 26.6874 175.3822 71 I 3.3028 7.3338 120.5002 64.6716 37.0724 177.9674 72 Y 4.1861 7.3625 117.0349 60.8731 37.7265 177.7541 73 E 4.0055 8.4249 119.9403 59.7436 29.7304 178.6026 74 M 4.1019 7.8457 117.6331 58.5646 32.2991 178.1140 75 L 3.9135 8.0904 119.3899 57.9920 41.7238 179.0225 76 D 4.5300 8.6298 119.1484 57.6786 40.6976 179.1455 77 R 3.9502 8.0924 118.9434 59.3461 30.0528 178.7712 78 V 3.8602 7.7707 119.1916 65.7273 31.3644 177.3944 79 Y 4.0002 8.0861 118.0785 60.7803 38.7106 177.7044 80 Q 4.1722 8.5432 118.6134 58.6283 29.1130 177.7638 81 T 4.3433 8.2297 108.9200 61.1734 69.7018 176.0956 82 G 3.8562 8.1504 108.7492 45.4361 0.0000 173.0937 83 E 4.2321 8.0959 120.9585 54.9326 29.8413 174.7844 84 P 4.7660 0.0000 0.0000 62.8236 32.6019 175.7433 85 Q 4.8713 9.0012 119.4886 54.4594 33.2045 174.5118 86 S 4.6497 8.5897 115.4127 56.8828 66.6416 173.0186 87 G 4.0502 7.4325 106.5213 44.9586 0.0000 171.4226 88 S 5.1715 8.4667 115.2819 56.5356 64.6288 173.7064 89 E 3.9772 9.5887 128.0826 56.9788 27.7350 175.0289 90 W 4.3196 8.7911 128.8755 57.8454 32.0268 174.6649 91 R 4.7544 8.5835 127.8450 55.1702 31.0351 175.2966 92 L 4.8459 9.1902 125.9174 53.2395 45.7106 175.1206 93 Q 4.9814 8.7898 126.0509 55.2991 30.1737 174.0504 94 T 4.3508 8.7552 120.6020 61.3963 71.8903 171.3770 95 D 5.0235 8.3493 123.2718 53.3475 40.7662 175.4264 96 Y 4.1406 8.8329 124.7949 59.5453 38.7345 176.2398 97 D 4.5498 8.5312 117.4605 54.5684 42.5216 177.0203 98 G 4.0293 8.7665 105.3835 45.2551 0.0000 173.6754 99 S 4.5266 7.8558 111.9693 56.9050 63.9783 173.4059 100 G 4.1516 8.5083 107.2823 43.4647 0.0000 173.8305 101 V 4.0515 8.1991 120.8683 62.8137 32.1899 175.0160 102 E 4.8878 9.7175 124.9251 54.6477 33.6807 173.6357 103 E 4.8930 8.8017 121.9465 55.5716 30.6547 175.3995 104 R 4.7719 9.1142 124.9578 54.5861 35.0703 173.7490 105 Y 5.2509 8.2849 117.1240 56.3798 42.1301 174.8488 106 F 5.3898 9.2484 120.6907 56.0292 43.4146 173.9550 107 D 5.4634 9.0238 122.9322 53.8488 43.0646 175.3514 108 F 5.3641 8.2514 114.2665 56.2702 42.0511 173.0056 109 V 5.0163 8.8409 119.5906 61.1934 34.9720 174.4253 110 V 5.1792 9.3856 127.3970 60.1680 34.5331 174.6445 111 T 5.1530 8.8188 113.6815 59.0309 72.3110 171.6822 112 P 4.9669 0.0000 0.0000 62.7913 33.0020 175.2372 113 R 4.6012 8.9740 121.0559 54.7884 32.3361 174.6985 114 R 4.9541 8.5674 125.3046 54.6080 32.0722 176.5821 115 R 4.2624 8.8109 120.8757 55.2170 31.0188 177.5917 116 A 3.9794 8.5766 122.0751 55.4499 18.2282 178.3538 117 D 4.5090 8.0195 112.4174 53.8029 39.8674 177.2885 118 G 3.9597 8.2837 109.7737 45.3096 0.0000 174.3083 119 S 4.2898 8.2933 114.6768 58.0093 63.8383 173.0773 120 I 4.6058 7.8892 122.5974 60.0425 38.1076 175.6977 121 E 4.4937 8.8990 123.1226 56.2029 31.0972 175.8422 122 G 3.9532 7.1073 105.4694 46.0568 0.0000 171.6453 123 V 5.2060 7.5203 111.3602 60.0261 36.7011 174.5708 124 Q 5.1778 9.0276 119.0832 55.1505 32.5202 173.4733 125 L 5.2197 9.1052 119.2955 54.5839 44.6475 174.1637 126 I 4.9874 8.4757 120.0960 59.3074 40.5658 174.3773 127 V 5.0590 8.5722 128.3444 61.1942 34.7355 174.2032 128 D 4.9152 9.1076 126.3670 52.3949 44.0506 174.5838 129 D 4.5889 8.8223 123.8833 53.6840 41.6491 175.7746 130 V 4.2964 8.3785 119.8206 61.5215 32.4382 178.1569 131 T 3.9334 8.1120 120.4979 67.0745 68.1386 176.5083 132 S 4.1165 7.9097 115.3870 61.1456 63.0199 176.2810 133 R 3.7707 7.8253 121.8782 59.2004 29.8372 178.4553 134 V 3.3611 7.6264 117.8720 66.1112 31.3793 178.2173 135 R 3.8270 7.9582 117.5027 59.1582 29.8762 178.9849 136 A 3.9442 8.2000 120.8131 54.8422 18.2504 179.6779 137 R 3.7815 8.1647 117.5216 59.6762 30.1391 178.6840 138 Q 4.0752 8.1984 117.7268 59.0901 28.7297 178.9052 139 A 3.9528 8.2852 121.6773 55.0518 18.3722 179.5971 140 A 3.9497 8.1206 119.3645 55.2461 18.3748 179.7668 141 E 3.8830 8.5365 117.2778 59.4551 29.4536 179.3246 142 A 4.3921 8.1384 122.3013 54.5832 18.3638 179.7562 143 R 3.8226 8.0018 117.4092 59.5180 30.1454 179.1312 144 V 3.6254 7.7858 119.0752 64.7140 31.1692 178.0703 145 E 3.9059 8.3744 119.3662 59.1453 29.1524 178.6430 146 E 4.0537 8.0853 117.8538 59.6900 29.7977 178.7106 147 L 4.1665 8.1092 118.9960 57.7240 41.4667 179.5684 148 S 4.2405 8.2743 113.1763 60.5054 63.1803 175.2930 149 E 4.3730 7.5941 119.8494 55.6036 29.9896 176.5210 150 R 4.2765 7.2547 119.6415 56.3534 30.7968 175.4041 151 Y 4.6660 7.8605 118.0503 56.6642 40.2602 173.9455 152 R 4.2294 8.4266 119.0620 54.2849 30.6567 175.2525 153 N 4.6546 7.8635 121.5437 52.8333 39.8574 175.3392 154 V 3.8354 7.9527 122.8669 62.0351 31.5736 175.9211 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 5 M 8.30 4.25 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.22 0.00 6 D 8.38 4.56 0.00 2.87 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 W 9.72 4.08 0.00 3.37 3.32 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 8 D 8.43 4.60 0.00 2.88 2.77 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 0.00 0.00 0.00 0.00 9 K 8.00 4.30 0.00 1.67 1.87 0.00 1.60 0.00 0.00 1.96 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.53 7.81 10 T 7.81 4.27 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 1.08 0.00 0.00 11 V 8.18 3.78 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 0.76 0.00 0.00 0.32 0.00 0.00 12 G 8.16 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.72 4.47 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 14 A 8.58 3.97 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 15 E 8.27 3.92 0.00 2.04 2.05 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 2.42 2.43 0.00 16 D 8.07 4.36 0.00 2.90 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 17 V 8.18 3.68 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 1.16 0.00 0.00 1.06 0.00 0.00 18 R 8.32 3.92 0.00 1.91 2.10 0.00 3.17 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 19 R 7.87 3.98 0.00 2.06 2.13 0.00 3.37 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 1.74 1.77 0.00 20 I 7.97 3.92 2.10 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.85 0.97 0.00 0.00 21 F 8.59 4.03 0.00 3.20 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 22 E 8.64 3.98 0.00 2.28 2.26 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 2.27 2.12 0.00 23 H 7.67 4.88 0.00 3.22 3.31 0.00 5.72 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 6.97 3.71 1.81 0.00 0.00 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 1.58 0.71 0.86 0.00 0.00 25 P 0.00 4.57 0.00 2.17 2.10 0.00 3.79 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 1.98 1.96 0.00 26 A 6.89 4.38 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 8.13 4.03 2.04 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.74 1.06 0.00 0.00 28 L 8.82 5.37 0.00 1.09 1.48 0.58 0.75 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 29 V 8.90 4.78 2.11 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 1.05 0.00 0.00 0.92 0.00 0.00 30 G 9.43 4.53 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 31 L 8.97 5.48 0.00 1.50 1.38 0.73 0.22 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 32 E 8.99 4.82 0.00 1.95 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 2.15 2.21 0.00 33 G 9.31 4.16 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 0.00 0.00 0.00 34 P 0.00 3.12 0.00 1.97 1.99 0.00 3.60 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.91 0.00 35 D 7.70 4.43 0.00 2.57 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 36 H 7.42 4.00 0.00 3.20 3.11 0.00 5.61 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.06 4.45 0.00 1.82 1.84 0.00 3.08 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.54 0.00 38 F 9.12 4.40 0.00 2.98 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 39 V 9.08 4.17 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 0.71 0.00 0.00 1.06 0.00 0.00 40 A 7.68 4.71 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.81 5.21 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 0.40 0.00 0.00 0.94 0.00 0.00 42 N 8.92 5.31 0.00 2.70 2.33 0.00 0.00 6.62 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 43 A 8.62 4.02 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 44 A 7.94 3.94 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 45 Y 8.39 4.06 0.00 3.38 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 46 R 8.57 4.29 0.00 1.99 2.03 0.00 3.23 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.03 0.00 47 G 8.45 3.67 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 0.00 0.00 0.00 48 F 8.04 4.54 0.00 2.95 3.27 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 49 S 7.56 4.14 0.00 2.72 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 50 P 0.00 4.43 0.00 2.05 2.08 0.00 3.90 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 2.00 2.03 0.00 51 L 8.03 4.02 0.00 1.64 1.66 0.99 0.95 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 52 L 7.28 3.86 0.00 1.75 1.62 0.55 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.23 4.73 0.00 2.62 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 54 T 7.16 4.32 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 1.19 0.00 0.00 55 V 7.94 4.08 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 0.86 0.00 0.00 0.95 0.00 0.00 56 G 8.67 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 0.00 0.00 0.00 57 Q 7.97 4.42 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.02 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 58 P 0.00 4.59 0.00 2.11 1.98 0.00 3.88 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.00 0.00 59 A 8.51 4.31 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 60 R 7.73 3.71 0.00 1.61 1.88 0.00 2.85 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.66 0.00 61 E 7.80 4.06 0.00 2.13 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 2.30 2.26 0.00 62 V 7.63 3.67 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 nan 0.00 0.00 1.00 0.00 0.00 63 Y 8.29 5.02 0.00 3.26 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 64 P 0.00 4.53 0.00 2.24 2.32 0.00 3.96 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.91 0.00 65 E 8.26 4.07 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 66 L 8.06 4.29 0.00 1.93 1.53 0.65 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.05 4.46 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 68 G 9.25 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.05 4.30 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 5.84 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 70 Q 8.23 4.05 0.00 2.57 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 71 I 7.33 3.30 1.13 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.58 0.28 0.00 0.00 72 Y 7.36 4.19 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 73 E 8.42 4.01 0.00 2.13 2.26 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 2.47 2.46 0.00 74 M 7.85 4.10 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 3.04 0.00 75 L 8.09 3.91 0.00 1.67 1.23 0.76 1.13 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 76 D 8.63 4.53 0.00 2.95 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.09 3.95 0.00 2.13 2.27 0.00 3.17 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 78 V 7.77 3.86 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 1.25 0.00 0.00 1.14 0.00 0.00 79 Y 8.09 4.00 0.00 3.07 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.54 4.17 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.61 0.00 0.00 0.00 0.00 0.00 2.54 2.68 0.00 81 T 8.23 4.34 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 82 G 8.15 3.86 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 0.00 0.00 0.00 83 E 8.10 4.23 0.00 2.10 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 2.33 2.29 0.00 84 P 0.00 4.77 0.00 1.96 2.09 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 85 Q 9.00 4.87 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 86 S 8.59 4.65 0.00 3.68 3.67 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 87 G 7.43 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 88 S 8.47 5.17 0.00 3.84 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 89 E 9.59 3.98 0.00 2.18 2.12 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 2.24 2.25 0.00 90 W 8.79 4.32 0.00 3.84 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 91 R 8.58 4.75 0.00 1.75 1.71 0.00 3.37 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.55 0.00 92 L 9.19 4.85 0.00 2.05 1.72 0.82 0.88 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 93 Q 8.79 4.98 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 94 T 8.76 4.35 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 -0.06 0.00 0.00 95 D 8.35 5.02 0.00 2.70 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Y 8.83 4.14 0.00 2.96 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 97 D 8.53 4.55 0.00 2.70 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.77 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 99 S 7.86 4.53 0.00 3.99 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.51 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.20 4.05 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 0.84 0.00 0.00 0.93 0.00 0.00 102 E 9.72 4.89 0.00 2.06 2.05 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 2.45 2.44 0.00 103 E 8.80 4.89 0.00 2.02 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 1.98 2.19 0.00 104 R 9.11 4.77 0.00 1.71 1.17 0.00 2.34 0.00 0.00 3.04 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.41 0.00 105 Y 8.28 5.25 0.00 2.64 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 0.00 106 F 9.25 5.39 0.00 3.06 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 0.00 107 D 9.02 5.46 0.00 2.67 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 8.25 5.36 0.00 3.11 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 0.00 109 V 8.84 5.02 2.11 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 1.00 0.00 0.00 0.90 0.00 0.00 110 V 9.39 5.18 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 0.98 0.00 0.00 0.99 0.00 0.00 111 T 8.82 5.15 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 1.24 0.00 0.00 112 P 0.00 4.97 0.00 2.08 2.09 0.00 3.73 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 1.99 2.09 0.00 113 R 8.97 4.60 0.00 2.08 1.93 0.00 3.14 0.00 0.00 3.48 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 114 R 8.57 4.95 0.00 1.84 1.83 0.00 3.26 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 115 R 8.81 4.26 0.00 2.04 1.86 0.00 3.13 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.70 0.00 116 A 8.58 3.98 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 0.00 117 D 8.02 4.51 0.00 2.79 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 0.00 118 G 8.28 3.96 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 0.00 0.00 0.00 119 S 8.29 4.29 0.00 3.97 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 7.89 4.61 1.37 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.45 0.69 0.00 0.00 121 E 8.90 4.49 0.00 2.15 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 0.00 2.40 2.27 0.00 122 G 7.11 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 0.00 123 V 7.52 5.21 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 0.92 0.00 0.00 0.95 0.00 0.00 124 Q 9.03 5.18 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.66 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 125 L 9.11 5.22 0.00 1.85 1.82 0.92 1.13 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 0.00 126 I 8.48 4.99 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.62 0.95 0.00 0.00 127 V 8.57 5.06 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 0.77 0.00 0.00 0.90 0.00 0.00 128 D 9.11 4.92 0.00 2.61 2.52 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 0.00 129 D 8.82 4.59 0.00 2.57 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 0.00 130 V 8.38 4.30 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 0.86 0.00 0.00 0.95 0.00 0.00 131 T 8.11 3.93 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 132 S 7.91 4.12 0.00 4.01 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 0.00 133 R 7.83 3.77 0.00 1.84 2.05 0.00 3.14 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 134 V 7.63 3.36 1.74 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 0.39 0.00 0.00 0.55 0.00 0.00 135 R 7.96 3.83 0.00 1.83 1.93 0.00 3.34 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.79 0.00 136 A 8.20 3.94 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 0.00 137 R 8.16 3.78 0.00 1.89 2.01 0.00 3.06 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.63 0.00 138 Q 8.20 4.08 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 139 A 8.29 3.95 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 0.00 140 A 8.12 3.95 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 E 8.54 3.88 0.00 2.14 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 0.00 2.31 2.38 0.00 142 A 8.14 4.39 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.00 3.82 0.00 1.95 2.06 0.00 3.15 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 144 V 7.79 3.63 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 145 E 8.37 3.91 0.00 2.22 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 2.33 2.39 0.00 146 E 8.09 4.05 0.00 1.95 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 0.00 2.34 2.38 0.00 147 L 8.11 4.17 0.00 1.74 1.71 0.92 0.87 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 0.00 148 S 8.27 4.24 0.00 4.01 4.06 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 0.00 149 E 7.59 4.37 0.00 2.17 2.08 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 2.30 2.42 0.00 150 R 7.25 4.28 0.00 1.93 1.88 0.00 3.21 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 151 Y 7.86 4.67 0.00 3.07 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 0.00 152 R 8.43 4.23 0.00 1.82 1.90 0.00 3.33 0.00 0.00 3.08 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 153 N 7.86 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