NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 V 4.1474 8.0549 120.3187 61.2702 32.9984 174.7783 4 R 4.2210 8.4169 121.3815 55.9789 31.2431 174.1131 5 S 5.4580 9.0080 118.3238 56.6945 67.5849 172.6521 6 L 4.9815 8.8541 124.2594 53.3907 44.4555 175.4126 7 N 5.4091 9.1505 123.0661 52.8598 40.2568 173.7176 8 C 5.0306 8.2042 113.5761 57.8775 32.5471 172.6898 9 T 5.0863 8.4928 111.2270 60.0861 71.7079 172.7694 10 L 5.3673 8.5818 121.4357 53.0952 44.9156 175.9661 11 R 5.0180 9.4055 122.2623 54.4581 34.1587 174.4939 12 D 4.5297 8.8365 125.3750 52.5109 41.0486 176.9251 13 S 4.2733 8.0255 112.2241 59.7846 62.8346 174.7542 14 Q 4.4064 8.4777 120.2454 55.7330 28.9249 176.1930 15 Q 4.0932 8.1852 117.3321 56.2923 28.2707 172.9958 16 K 4.2749 7.5757 116.3830 56.1051 33.1947 176.8472 17 S 4.9304 8.7306 121.0149 57.8019 65.1699 172.9391 18 L 5.3320 8.3803 121.2232 53.3876 44.3260 176.0256 19 V 4.7377 8.5683 114.9906 59.5835 36.6694 174.8927 20 M 4.5164 8.4946 122.8798 55.3293 31.2439 175.9451 21 S 4.2009 8.2121 122.1689 58.2796 63.1087 177.2101 22 G 4.3224 8.0587 112.2600 43.3137 0.0000 171.6058 23 P 4.0188 0.0000 0.0000 65.6663 31.0458 176.9789 24 Y 4.8582 7.6026 112.6119 58.0043 40.7141 174.0582 25 E 4.9055 8.1058 119.2269 54.5938 33.9308 174.6606 26 L 5.1555 8.5211 122.1733 53.3112 44.5975 175.5447 27 K 5.1943 9.3403 120.7238 54.5710 36.4599 174.8669 28 A 5.4363 8.7485 124.3816 50.1911 21.9581 175.3465 29 L 4.7739 8.6139 120.9736 54.4192 44.5362 174.9032 30 H 4.3685 9.1060 118.5240 56.1761 28.7094 174.9366 31 L 4.7936 8.3067 123.2874 53.2029 44.1931 175.6904 32 Q 4.4932 8.4378 120.4656 55.9839 32.6426 174.6725 33 G 3.9361 8.6348 106.6096 44.8448 0.0000 174.4680 34 Q 4.1386 8.5777 116.4493 58.2939 29.1830 177.3892 35 D 4.2927 8.0585 119.9621 57.1081 41.1125 177.1970 36 M 4.0943 7.7112 118.2825 58.2440 31.8210 177.5500 37 E 3.9778 8.1403 117.9242 59.5586 29.5698 178.5497 38 Q 4.1555 7.7288 115.1440 56.0820 29.1567 175.8972 39 Q 4.4383 7.1372 120.2046 55.1534 29.8742 175.7581 40 V 3.4675 7.9982 122.2710 63.0284 32.2250 175.2179 41 V 4.1954 8.0460 127.9756 61.8420 32.9661 174.8201 42 F 4.8618 8.9589 127.1798 56.8403 40.9606 175.1841 43 S 4.8939 8.8299 117.9977 57.3656 64.3867 172.9291 44 M 4.7322 8.7779 126.8503 54.8116 33.1826 174.8367 45 S 5.0448 8.8642 123.3765 56.9838 65.6071 174.0525 46 F 4.9555 8.8126 123.7993 57.0375 38.0904 175.4751 47 V 4.6635 7.9229 115.7359 58.8764 34.4228 175.7437 48 Q 4.0652 8.8169 121.2473 56.0932 28.7925 177.0226 49 G 3.8829 7.9166 109.3456 46.4935 0.0000 172.7738 50 E 4.2516 8.8847 124.0008 55.3903 28.8577 175.2892 51 E 5.1240 8.5511 121.7032 53.5835 31.2249 175.3537 52 S 4.8837 8.2130 117.9080 55.9551 65.5291 173.7035 53 N 4.4313 8.6609 117.3067 56.1338 38.6228 176.4288 54 D 4.4450 8.0595 117.2596 55.4124 41.6301 175.2558 55 K 4.8832 7.7571 119.7072 54.6674 34.6164 174.5441 56 I 4.9719 9.0408 129.3218 58.6832 39.9337 173.3677 57 P 5.1777 0.0000 0.0000 62.5464 33.0940 175.4653 58 V 4.8263 9.4816 115.3068 59.8435 36.4340 174.1327 59 A 5.2982 8.9512 124.6775 50.6279 21.9374 176.3722 60 L 4.6833 8.8782 120.8459 53.2716 43.2718 175.9340 61 G 3.8078 9.0849 111.8824 43.8562 0.0000 170.6892 62 L 4.1416 7.9380 120.2347 53.7320 42.5399 177.3268 63 K 3.6489 8.3166 122.4879 58.7182 31.7301 176.6598 64 E 4.7082 7.6414 121.8771 55.8834 30.5461 176.0701 65 K 4.5733 7.4101 115.7864 54.3393 36.0972 177.0906 66 N 4.7744 8.3768 121.0454 52.5480 36.0851 174.4485 67 L 5.4080 7.2813 118.9270 53.8273 45.8905 177.0095 68 Y 5.0737 8.8432 120.6654 55.8032 41.6130 174.9982 69 L 4.9928 8.9638 123.3477 55.0055 43.0602 176.3656 70 S 4.9927 9.4761 117.3203 56.8214 67.0506 172.7118 71 S 5.5718 8.6132 117.7200 56.9713 64.4357 174.2053 72 V 4.5955 9.0052 123.8054 59.7285 35.2090 174.5534 73 L 4.3764 8.6713 123.0211 54.8952 42.0483 177.3264 74 K 4.3011 9.0422 124.2147 55.1938 33.3857 175.8221 75 D 4.4275 8.2876 127.4940 55.5404 36.8973 174.8874 76 D 4.5768 8.1233 111.4858 55.1184 39.0429 174.0049 77 K 4.3518 7.1989 117.3726 53.5552 35.9630 174.3204 78 P 3.9643 0.0000 0.0000 63.0527 31.6652 175.9299 79 T 4.7533 8.8246 120.0529 61.6403 73.1071 172.7241 80 L 5.0235 8.7810 128.0035 54.7237 42.9357 175.6576 81 Q 4.8262 9.0689 123.4421 54.3461 32.7607 173.9210 82 L 4.9641 8.6561 120.1783 54.2035 42.9041 175.8156 83 E 4.8682 9.6070 125.0183 54.3168 32.6136 175.2123 84 S 5.0165 8.8614 122.4049 58.7834 63.7526 173.7332 85 V 4.4306 8.2778 115.9048 58.8474 35.9714 174.9752 86 D 4.3579 8.7019 121.5013 54.1870 40.9248 175.1903 87 P 4.6381 0.0000 0.0000 64.1972 31.4888 177.0479 88 K 4.2988 8.8750 118.7265 57.6863 32.6233 177.0575 89 N 4.7236 8.0604 113.6387 53.1729 39.2624 174.4577 90 Y 4.4927 7.5917 115.5659 55.2999 41.5584 173.3719 91 P 4.6886 0.0000 0.0000 61.9831 32.8795 175.0037 92 K 4.5868 7.8099 117.1039 54.0994 35.7656 176.8623 93 K 4.0299 8.5734 121.6288 59.3225 32.3181 176.7203 94 K 4.7717 7.5353 121.4607 55.1800 30.6116 175.5065 95 M 4.3880 7.8831 122.6197 53.9428 33.3492 176.3967 96 E 4.1921 8.7479 120.0815 56.1098 30.5597 178.3857 97 K 3.8906 8.5484 122.8013 59.3257 32.6638 179.3153 98 R 3.6182 7.6089 115.0145 58.6489 29.4186 177.6452 99 F 4.9945 7.5662 114.6253 56.9041 39.2863 174.9385 100 V 4.5505 7.4475 122.5904 61.1223 33.4721 174.3894 101 F 5.4038 8.9902 126.1006 55.7790 42.3621 174.3683 102 N 5.0986 9.5299 121.2434 52.1113 39.8703 174.4290 103 K 4.2849 9.2920 127.7368 55.9939 33.5695 175.5829 104 I 5.4909 8.0788 129.2003 58.9771 39.3335 174.7052 105 E 4.6647 8.7396 127.5017 55.2151 30.1465 177.5600 106 I 4.4395 8.1010 126.1738 59.6061 38.4026 173.7577 107 N 3.9950 8.1187 121.0606 54.5505 36.0159 173.5661 108 N 4.1724 7.9554 111.8749 53.7352 37.7911 174.5838 109 K 4.7904 7.4622 117.1159 54.9508 35.2205 175.0389 110 L 5.1180 8.7766 121.7687 53.1239 44.7613 175.5128 111 E 5.1803 8.5048 121.2436 54.6605 33.3575 175.3747 112 F 4.9048 8.8932 120.9456 55.7058 41.8578 173.2099 113 E 4.5448 9.1698 125.9704 55.1460 30.2787 175.3697 114 S 4.3153 9.3612 122.5770 57.9915 62.9683 174.5702 115 A 4.0098 8.3216 129.7010 55.2903 18.1571 178.7479 116 Q 3.5473 7.2704 112.6619 57.9966 29.3472 175.6502 117 F 4.8523 8.1321 118.6383 54.6027 39.8218 172.7508 118 P 4.6738 0.0000 0.0000 63.8258 31.6718 176.1936 119 N 4.0767 9.6112 118.5043 53.9765 37.0524 173.7248 120 W 4.8452 8.0862 117.9002 55.5368 31.2469 175.0842 121 Y 5.3002 9.2150 121.7638 55.7174 41.3473 175.0522 122 I 4.1643 8.5724 123.5698 62.6091 37.8049 175.6681 123 S 5.0931 8.8979 122.6393 56.7434 67.1213 173.2550 124 T 4.9040 8.4264 111.7677 59.7222 72.0274 173.9053 125 S 4.7300 8.8905 118.2178 58.3344 63.6744 174.6502 126 Q 4.0352 8.6740 123.6724 58.9246 29.1474 176.9938 127 A 4.2501 7.8165 119.4793 51.2223 19.4598 176.5363 128 E 3.8449 8.6961 119.8327 58.3166 30.0472 177.6261 129 N 4.3139 8.5918 117.9008 54.5056 36.9575 174.0116 130 M 4.6958 7.3177 116.3167 53.1113 34.4909 174.1182 131 P 5.3801 0.0000 0.0000 61.9699 32.4409 176.5644 132 V 4.1533 8.5405 123.6009 63.3632 32.1715 174.9176 133 F 5.2266 8.5358 121.6120 54.9284 42.2143 173.1003 134 L 4.9324 8.9488 121.7037 54.5658 42.7828 175.8867 135 G 4.4331 9.2187 113.7825 43.5301 0.0000 173.3055 136 G 2.6216 8.2256 111.0098 44.6690 0.0000 173.4135 137 T 4.2839 7.1937 113.8989 59.5808 67.8960 172.8016 138 K 3.9924 8.1680 127.9184 56.2557 32.9449 176.4309 139 G 3.2831 10.0164 110.5786 46.4038 0.0000 173.6933 140 G 3.9381 8.1733 112.6149 46.7656 0.0000 171.7510 141 Q 4.3448 7.8574 115.2985 57.0828 30.6957 174.9783 142 D 4.8310 7.8460 118.2927 52.2664 42.4860 176.0539 143 I 4.0469 8.3806 123.5161 60.9846 37.7304 176.7810 144 T 4.7833 8.3173 113.4313 60.8919 70.1160 173.1209 145 D 5.4705 7.4809 121.8218 51.8195 42.7548 174.8837 146 F 5.1058 9.4607 118.4321 56.1100 43.7765 174.0620 147 T 4.8743 9.1368 111.6249 60.6296 71.5098 172.8731 148 M 5.1139 8.5253 122.0270 53.9490 34.5771 174.6739 149 Q 4.7690 8.6339 124.3293 54.0363 32.0703 174.9751 150 F 4.9704 8.9785 121.4421 57.3240 40.2701 176.0631 151 V 4.1572 8.0484 114.0322 61.5510 31.4247 175.6702 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 3 V 8.05 4.15 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 0.95 0.00 0.00 1.06 0.00 0.00 4 R 8.42 4.22 0.00 2.01 1.98 0.00 3.07 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 5 S 9.01 5.46 0.00 3.79 3.80 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 6 L 8.85 4.98 0.00 2.10 1.68 1.12 1.05 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 7 N 9.15 5.41 0.00 2.76 2.74 0.00 0.00 7.20 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 8 C 8.20 5.03 0.00 2.88 2.83 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 9 T 8.49 5.09 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 1.21 0.00 0.00 10 L 8.58 5.37 0.00 1.51 1.61 0.83 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 11 R 9.41 5.02 0.00 1.83 1.74 0.00 3.12 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 12 D 8.84 4.53 0.00 2.23 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 0.00 0.00 0.00 13 S 8.03 4.27 0.00 3.86 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 14 Q 8.48 4.41 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 5.82 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 15 Q 8.19 4.09 0.00 2.22 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.46 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 16 K 7.58 4.27 0.00 1.77 1.82 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.84 1.35 7.81 17 S 8.73 4.93 0.00 3.82 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.38 5.33 0.00 1.73 1.62 1.07 0.89 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 19 V 8.57 4.74 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 0.72 0.00 0.00 0.93 0.00 0.00 20 M 8.49 4.52 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 21 S 8.21 4.20 0.00 3.85 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.06 4.32 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 0.00 23 P 0.00 4.02 0.00 1.47 1.99 0.00 3.82 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 2.27 2.07 0.00 24 Y 7.60 4.86 0.00 3.00 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 25 E 8.11 4.91 0.00 2.00 1.84 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 2.36 2.38 0.00 26 L 8.52 5.16 0.00 1.65 1.62 1.04 0.60 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 27 K 9.34 5.19 0.00 1.63 1.68 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.38 7.81 28 A 8.75 5.44 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.61 4.77 0.00 1.91 1.74 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 30 H 9.11 4.37 0.00 3.10 3.33 0.00 5.81 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.31 4.79 0.00 1.61 1.56 0.99 0.91 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 32 Q 8.44 4.49 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 33 G 8.63 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.58 4.14 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 35 D 8.06 4.29 0.00 2.89 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 36 M 7.71 4.09 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 37 E 8.14 3.98 0.00 2.13 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 0.00 2.38 2.32 0.00 38 Q 7.73 4.16 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.66 2.35 0.00 39 Q 7.14 4.44 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 40 V 8.00 3.47 1.84 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 -0.04 0.00 0.00 0.82 0.00 0.00 41 V 8.05 4.20 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 0.96 0.00 0.00 0.87 0.00 0.00 42 F 8.96 4.86 0.00 2.94 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 43 S 8.83 4.89 0.00 3.90 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 44 M 8.78 4.73 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 1.98 0.00 45 S 8.86 5.04 0.00 3.82 3.77 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 46 F 8.81 4.96 0.00 2.97 3.11 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 0.00 0.00 0.00 0.00 47 V 7.92 4.66 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 0.75 0.00 0.00 0.97 0.00 0.00 48 Q 8.82 4.07 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 49 G 7.92 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.88 4.25 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 2.29 2.29 0.00 51 E 8.55 5.12 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 2.19 2.23 0.00 52 S 8.21 4.88 0.00 3.85 3.77 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 53 N 8.66 4.43 0.00 2.76 2.87 0.00 0.00 6.83 8.06 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 54 D 8.06 4.45 0.00 2.81 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.76 4.88 0.00 1.81 1.68 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.41 7.81 56 I 9.04 4.97 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.97 1.18 0.00 0.00 57 P 0.00 5.18 0.00 2.16 2.21 0.00 3.72 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.01 0.00 58 V 9.48 4.83 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 0.61 0.00 0.00 1.14 0.00 0.00 59 A 8.95 5.30 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 60 L 8.88 4.68 0.00 1.35 1.28 -0.21 0.40 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 61 G 9.08 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 62 L 7.94 4.14 0.00 1.40 1.33 0.71 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.32 3.65 0.00 1.81 1.67 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.50 7.81 64 E 7.64 4.71 0.00 1.87 1.80 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 2.15 2.26 0.00 65 K 7.41 4.57 0.00 1.59 1.54 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.25 1.19 7.81 66 N 8.38 4.77 0.00 2.95 3.02 0.00 0.00 5.97 6.67 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 67 L 7.28 5.41 0.00 1.43 1.53 0.72 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.84 5.07 0.00 2.65 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 69 L 8.96 4.99 0.00 1.77 1.74 0.63 0.65 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 70 S 9.48 4.99 0.00 3.52 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 71 S 8.61 5.57 0.00 3.74 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 72 V 9.01 4.60 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 0.72 0.00 0.00 0.86 0.00 0.00 73 L 8.67 4.38 0.00 1.60 1.65 0.97 0.60 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 74 K 9.04 4.30 0.00 1.60 1.68 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.36 7.81 75 D 8.29 4.43 0.00 2.92 2.87 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 76 D 8.12 4.58 0.00 2.77 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 77 K 7.20 4.35 0.00 1.60 1.52 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.30 1.36 7.81 78 P 0.00 3.96 0.00 0.49 0.49 0.00 2.22 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 79 T 8.82 4.75 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 1.25 0.00 0.00 80 L 8.78 5.02 0.00 1.86 1.72 1.17 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.07 4.83 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 82 L 8.66 4.96 0.00 1.95 1.86 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 83 E 9.61 4.87 0.00 2.22 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 0.00 2.28 2.31 0.00 84 S 8.86 5.02 0.00 3.88 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 85 V 8.28 4.43 1.66 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 0.12 0.00 0.00 0.66 0.00 0.00 86 D 8.70 4.36 0.00 2.78 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 87 P 0.00 4.64 0.00 2.26 2.19 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 88 K 8.87 4.30 0.00 1.93 1.92 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.57 7.81 89 N 8.06 4.72 0.00 2.83 2.62 0.00 0.00 6.76 6.74 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 90 Y 7.59 4.49 0.00 2.92 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 91 P 0.00 4.69 0.00 2.23 2.24 0.00 3.79 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 92 K 7.81 4.59 0.00 1.54 1.55 0.00 1.51 0.00 0.00 1.29 0.00 0.00 2.30 0.00 0.00 2.33 0.00 0.00 0.00 0.00 1.02 0.58 7.81 93 K 8.57 4.03 0.00 1.79 1.79 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.46 7.81 94 K 7.54 4.77 0.00 1.73 1.68 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.43 7.81 95 M 7.88 4.39 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.63 0.00 96 E 8.75 4.19 0.00 2.26 1.82 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 2.47 2.41 0.00 97 K 8.55 3.89 0.00 1.67 1.83 0.00 1.62 0.00 0.00 1.77 0.00 0.00 2.77 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.32 7.81 98 R 7.61 3.62 0.00 1.85 1.85 0.00 2.65 0.00 0.00 3.03 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.50 0.00 99 F 7.57 4.99 0.00 3.20 3.04 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 0.00 100 V 7.45 4.55 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 0.94 0.00 0.00 0.97 0.00 0.00 101 F 8.99 5.40 0.00 3.22 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 0.00 102 N 9.53 5.10 0.00 2.69 2.81 0.00 0.00 6.50 7.86 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 0.00 103 K 9.29 4.28 0.00 1.88 1.82 0.00 1.63 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 0.91 7.81 104 I 8.08 5.49 1.86 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.65 0.92 0.00 0.00 105 E 8.74 4.66 0.00 1.85 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 2.28 2.33 0.00 106 I 8.10 4.44 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.58 0.87 0.00 0.00 107 N 8.12 3.99 0.00 2.84 2.91 0.00 0.00 7.35 7.79 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 0.00 108 N 7.96 4.17 0.00 2.89 2.92 0.00 0.00 7.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 7.46 4.79 0.00 1.68 1.69 0.00 1.59 0.00 0.00 2.13 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.44 7.81 110 L 8.78 5.12 0.00 1.59 1.01 0.98 1.10 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 0.00 111 E 8.50 5.18 0.00 1.91 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 2.29 2.19 0.00 112 F 8.89 4.90 0.00 2.79 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 0.00 113 E 9.17 4.54 0.00 2.08 1.82 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 2.14 1.53 0.00 114 S 9.36 4.32 0.00 3.99 3.99 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 0.00 0.00 0.00 115 A 8.32 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.27 3.55 0.00 1.58 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.77 0.00 0.00 0.00 0.00 0.00 1.37 1.16 0.00 117 F 8.13 4.85 0.00 2.96 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 0.00 118 P 0.00 4.67 0.00 2.13 2.03 0.00 3.97 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 2.07 2.12 0.00 119 N 9.61 4.08 0.00 2.90 2.96 0.00 0.00 6.93 7.94 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 0.00 120 W 8.09 4.85 0.00 3.54 3.31 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 0.00 121 Y 9.22 5.30 0.00 2.89 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 0.00 122 I 8.57 4.16 1.79 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.37 0.64 0.00 0.00 123 S 8.90 5.09 0.00 2.72 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 0.00 124 T 8.43 4.90 4.30 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 1.33 0.00 0.00 125 S 8.89 4.73 0.00 4.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.67 4.04 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 127 A 7.82 4.25 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.70 3.84 0.00 2.03 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 2.46 2.36 0.00 129 N 8.59 4.31 0.00 2.93 2.95 0.00 0.00 6.92 7.67 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 0.00 130 M 7.32 4.70 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.90 0.00 131 P 0.00 5.38 0.00 2.07 2.20 0.00 3.79 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 132 V 8.54 4.15 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 0.83 0.00 0.00 1.01 0.00 0.00 133 F 8.54 5.23 0.00 3.25 3.12 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 0.00 134 L 8.95 4.93 0.00 1.98 1.96 1.25 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 135 G 9.22 4.43 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 0.00 136 G 8.23 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 0.00 0.00 0.00 137 T 7.19 4.28 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 1.10 0.00 0.00 138 K 8.17 3.99 0.00 1.66 1.54 0.00 0.61 0.00 0.00 1.45 0.00 0.00 2.73 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.89 1.07 7.81 139 G 10.02 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 0.00 0.00 0.00 140 G 8.17 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Q 7.86 4.34 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.72 6.76 0.00 0.00 0.00 0.00 0.00 2.50 2.31 0.00 142 D 7.85 4.83 0.00 2.80 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.38 4.05 1.71 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.58 0.61 0.00 0.00 144 T 8.32 4.78 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 1.13 0.00 0.00 145 D 7.48 5.47 0.00 2.70 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 0.00 146 F 9.46 5.11 0.00 3.11 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 T 9.14 4.87 4.28 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 1.24 0.00 0.00 148 M 8.53 5.11 0.00 1.90 1.95 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.07 0.00 149 Q 8.63 4.77 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 150 F 8.98 4.97 0.00 2.91 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 0.00 151 V 8.05 4.16 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 0.67 0.00 0.00 0.97 0.00 0.00