NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 E 4.1295 8.4444 120.2185 55.5381 31.7403 171.7676 9 V 3.1903 7.6499 124.4241 61.3590 33.0814 169.1438 10 Q 4.8391 8.6554 129.7792 54.4184 32.4359 173.9165 11 D 5.2641 8.7635 125.0714 54.3445 41.8225 176.0297 12 V 4.3047 8.3071 120.7136 60.4000 34.9019 175.1513 13 N 4.7168 8.2768 118.2738 52.3998 39.2116 174.6359 14 D 4.3652 8.7709 115.8103 58.0820 41.3101 178.0803 15 S 4.2495 8.2981 114.9658 61.2290 63.0278 175.9903 16 S 4.2887 7.7799 113.1706 58.2622 63.2068 175.4642 17 W 4.1232 7.8592 133.0046 60.8056 30.1556 177.5468 18 K 3.8683 8.1998 117.5063 59.6577 31.3244 178.7639 19 E 3.9805 8.0119 117.3428 59.2585 29.8405 178.2203 20 F 4.0132 8.5363 117.2831 59.4926 38.9542 176.1871 21 V 3.8535 7.0353 114.0326 64.4227 32.8541 176.9786 22 L 3.8976 7.1627 117.2382 56.8365 42.2944 177.4843 23 E 4.6681 7.4817 116.6176 54.7808 29.6665 175.1818 24 S 4.7267 7.3592 114.3897 56.2062 64.8885 174.2159 25 E 4.2749 8.7071 125.6665 57.7329 29.3624 176.9031 26 V 4.5043 7.4500 117.2305 59.2386 34.7461 172.1403 27 P 4.4824 0.0000 0.0000 63.6121 32.3368 175.1949 28 V 4.7673 9.3408 124.1305 61.4425 34.6330 174.3333 29 M 4.7195 8.6551 126.1648 53.7332 34.5480 173.7587 30 V 4.5002 8.4808 126.9264 61.9109 33.7845 174.1440 31 D 5.0701 9.1137 128.1341 52.6242 42.7080 175.0490 32 F 5.1502 9.3237 126.8960 56.9533 40.1958 175.1778 33 W 5.5730 9.4110 119.8875 55.0545 32.5361 173.5132 34 A 4.3375 8.3884 120.5939 49.2552 21.1244 175.8034 35 P 3.1399 0.0000 0.0000 64.3179 31.4106 177.1798 36 W 5.1010 7.4482 116.4590 56.5443 29.3422 174.8906 37 C 4.8378 7.8553 118.7622 57.0659 32.6650 173.7128 38 G 3.7347 8.2196 115.7875 47.6432 0.0000 173.1887 39 P 4.1321 0.0000 0.0000 65.2420 31.4697 178.5819 40 S 4.4035 7.8169 113.5793 60.8845 62.5340 176.0702 41 K 4.2869 8.5653 120.2079 57.5390 32.6601 178.2026 42 L 4.2463 7.8464 119.0861 57.1500 41.8559 178.7489 43 I 3.9630 7.8728 112.4799 63.2541 37.9031 177.7512 44 A 3.8513 7.4594 123.0442 54.7355 18.1773 177.9489 45 P 4.1863 0.0000 0.0000 65.8319 31.4173 178.7309 46 V 3.6159 7.6432 117.6620 65.6870 31.4861 177.8936 47 I 3.6408 8.4704 120.1244 64.6293 36.7159 178.0659 48 D 4.3221 8.0481 119.6325 57.4356 40.2939 178.6663 49 E 3.9756 8.7254 120.1135 59.1490 29.5378 178.8981 50 L 4.1657 7.8943 118.7793 57.6100 41.5366 178.9922 51 A 3.9715 7.7767 119.8845 55.2555 18.2878 179.4378 52 K 4.1912 7.3621 117.1105 58.4258 32.3420 178.8779 53 E 4.0128 7.7968 118.8506 58.2417 30.1018 177.0348 54 Y 4.6812 8.3122 117.1629 56.9626 38.7726 175.9064 55 S 4.3412 8.0418 115.8304 60.1890 63.6733 175.2813 56 G 4.3345 9.0067 116.7911 46.0848 0.0000 175.0134 57 K 4.2009 8.0872 118.0135 58.6136 32.3098 177.0922 58 I 4.9013 7.8033 109.3975 59.0671 41.0395 174.4762 59 A 4.4219 8.4301 125.5046 50.5560 20.2166 176.0726 60 V 4.5612 7.7058 121.9870 61.1912 34.5399 173.9698 61 Y 5.2590 8.3797 123.6380 56.3317 42.8897 174.1544 62 K 4.6797 8.6840 122.3114 55.0892 34.2027 175.2501 63 L 4.8495 8.8057 128.1954 53.1064 44.4236 174.7027 64 N 5.1684 8.8818 126.5036 53.4658 39.4848 175.8304 65 T 3.9867 8.7204 117.4589 64.9489 68.9987 175.8714 66 D 4.4737 8.8035 122.3555 57.2550 41.1076 177.6466 67 E 4.0693 8.2012 116.9995 58.4333 30.1591 176.9392 68 A 4.8210 7.6994 121.8613 49.1524 18.7682 174.4572 69 P 4.4907 0.0000 0.0000 64.9599 31.8612 178.9510 70 G 3.6179 8.0735 105.2094 47.7656 0.0000 175.4923 71 I 3.4718 7.3354 120.9036 63.9758 37.0715 178.2330 72 A 4.1357 7.5806 120.1490 55.8044 18.2410 179.8639 73 T 3.7888 8.1541 114.2149 66.7669 68.2710 176.8080 74 Q 3.9063 8.0174 120.6582 58.1276 28.9995 176.2377 75 Y 4.5292 7.6614 115.0024 56.5400 38.8030 174.9709 76 N 4.0778 7.7577 116.6529 54.3223 37.9334 174.9630 77 I 3.6420 7.8415 117.8459 61.5357 37.4351 174.8890 78 R 4.3338 7.7894 123.0826 57.0517 33.1717 175.9246 79 S 4.2592 8.1733 114.7523 58.3875 63.6812 173.6669 80 I 4.6872 8.0550 120.5265 58.1158 40.2938 173.3447 81 P 5.0455 0.0000 0.0000 62.6581 33.2561 174.9477 82 T 5.0561 8.4965 116.9086 61.9333 72.3672 172.7827 83 V 4.6896 8.9232 127.2530 61.6150 33.2104 174.3871 84 L 5.2061 8.8939 129.7491 53.3101 45.3404 174.7454 85 F 5.3500 8.5394 122.2389 55.6707 42.3585 174.0133 86 F 5.4956 9.3570 122.4974 54.5863 41.7999 174.1539 87 K 4.4146 8.4298 125.0213 54.4307 33.9246 175.7694 88 N 4.0285 9.2829 127.0702 54.7526 35.5585 175.4187 89 G 4.0587 8.0230 101.5768 46.0655 0.0000 171.9942 90 E 4.6445 7.7374 119.5856 54.2104 31.2001 175.4665 91 R 3.4324 8.6159 123.6819 56.1063 29.8684 175.4285 92 K 4.3862 8.5036 125.6516 57.7079 33.5866 177.1160 93 E 4.7914 7.9401 119.3400 54.4559 33.5463 174.1683 94 S 4.7629 8.8656 121.4729 56.9869 65.6098 173.2410 95 I 4.6111 8.7439 126.1684 59.4423 39.8089 174.9565 96 I 4.7108 8.7238 126.9672 60.9303 39.6692 176.3851 97 G 3.7579 9.1673 112.4253 44.7096 0.0000 173.6930 98 A 4.3980 7.9562 119.9385 50.7160 17.1775 177.1110 99 V 3.8227 7.4201 120.8412 61.1296 33.1875 174.3188 100 P 4.4970 0.0000 0.0000 61.9000 32.2763 177.0014 101 K 3.8655 8.9125 121.4610 60.1422 31.7534 178.8954 102 S 4.1760 8.0842 113.6556 62.0051 62.6352 176.6123 103 T 3.9266 7.8811 118.9051 66.1407 67.9629 176.9353 104 L 4.1749 7.8720 119.7754 57.8705 42.1348 179.1416 105 T 3.9559 8.4101 116.1589 66.9623 68.2752 176.2366 106 D 4.3598 7.9748 119.1454 57.6550 40.7094 179.0061 107 S 3.9095 7.7186 115.4662 61.1940 62.6594 176.6678 108 I 3.6383 7.2758 122.1807 64.3245 36.5333 178.3297 109 E 3.9712 7.8129 117.9867 58.7665 29.4949 178.4641 110 K 4.0985 7.1339 116.7368 57.1229 32.8890 176.4400 111 Y 4.7681 7.0035 115.7455 56.4259 38.5767 175.4506 112 L 4.2316 8.0198 122.7868 54.9291 42.8318 176.0653 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 8 E 8.44 4.13 0.00 1.95 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 0.00 2.19 2.24 0.00 9 V 7.65 3.19 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 0.59 0.00 0.00 0.90 0.00 0.00 10 Q 8.66 4.84 0.00 2.53 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 11 D 8.76 5.26 0.00 2.62 2.61 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 0.00 0.00 0.00 0.00 12 V 8.31 4.30 1.78 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 0.84 0.00 0.00 0.58 0.00 0.00 13 N 8.28 4.72 0.00 2.90 2.87 0.00 0.00 7.07 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 14 D 8.77 4.37 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 15 S 8.30 4.25 0.00 3.94 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 16 S 7.78 4.29 0.00 2.72 3.43 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 17 W 7.86 4.12 0.00 3.58 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.20 3.87 0.00 1.84 1.87 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.63 1.50 7.81 19 E 8.01 3.98 0.00 2.03 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 2.30 2.40 0.00 20 F 8.54 4.01 0.00 2.53 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 0.00 0.00 0.00 21 V 7.04 3.85 0.67 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 -0.59 0.00 0.00 0.03 0.00 0.00 22 L 7.16 3.90 0.00 1.73 1.67 1.10 0.87 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 23 E 7.48 4.67 0.00 1.96 1.83 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 2.21 2.17 0.00 24 S 7.36 4.73 0.00 3.95 3.74 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 25 E 8.71 4.27 0.00 1.99 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 2.29 2.22 0.00 26 V 7.45 4.50 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 0.62 0.00 0.00 1.01 0.00 0.00 27 P 0.00 4.48 0.00 2.15 2.05 0.00 3.58 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 2.35 2.15 0.00 28 V 9.34 4.77 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.09 0.00 0.00 29 M 8.66 4.72 0.00 2.02 1.93 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 1.60 2.07 0.00 30 V 8.48 4.50 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 0.83 0.00 0.00 1.05 0.00 0.00 31 D 9.11 5.07 0.00 2.70 2.41 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 32 F 9.32 5.15 0.00 3.29 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 33 W 9.41 5.57 0.00 3.49 3.09 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 34 A 8.39 4.34 1.09 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 0.00 0.00 35 P 0.00 3.14 0.00 0.77 1.25 0.00 3.36 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.33 0.00 36 W 7.45 5.10 0.00 3.22 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 37 C 7.86 4.84 0.00 2.96 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.22 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 39 P 0.00 4.13 0.00 2.23 2.20 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.26 0.00 40 S 7.82 4.40 0.00 4.38 4.34 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 41 K 8.57 4.29 0.00 1.96 1.92 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.59 7.81 42 L 7.85 4.25 0.00 1.65 1.75 1.01 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 43 I 7.87 3.96 1.88 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 1.72 0.91 0.94 0.00 0.00 44 A 7.46 3.85 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 45 P 0.00 4.19 0.00 2.27 2.30 0.00 3.64 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 2.17 2.02 0.00 46 V 7.64 3.62 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 1.10 0.00 0.00 1.00 0.00 0.00 47 I 8.47 3.64 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.85 0.80 0.00 0.00 48 D 8.05 4.32 0.00 2.76 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 49 E 8.73 3.98 0.00 2.21 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 0.00 2.32 2.41 0.00 50 L 7.89 4.17 0.00 1.86 1.79 0.96 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.78 3.97 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 52 K 7.36 4.19 0.00 1.62 1.85 0.00 1.65 0.00 0.00 1.46 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.27 7.81 53 E 7.80 4.01 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.12 0.00 54 Y 8.31 4.68 0.00 3.06 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 55 S 8.04 4.34 0.00 3.86 3.78 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 56 G 9.01 4.33 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 0.00 57 K 8.09 4.20 0.00 2.12 2.05 0.00 1.88 0.00 0.00 1.88 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.48 7.81 58 I 7.80 4.90 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.67 0.93 0.00 0.00 59 A 8.43 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 60 V 7.71 4.56 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 0.88 0.00 0.00 0.84 0.00 0.00 61 Y 8.38 5.26 0.00 3.00 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 62 K 8.68 4.68 0.00 1.61 1.42 0.00 1.26 0.00 0.00 0.66 0.00 0.00 2.27 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.94 1.13 7.81 63 L 8.81 4.85 0.00 1.52 0.95 0.77 0.16 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 64 N 8.88 5.17 0.00 3.08 2.73 0.00 0.00 6.91 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.72 3.99 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 1.38 0.00 0.00 66 D 8.80 4.47 0.00 2.66 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.20 4.07 0.00 1.95 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 2.29 2.26 0.00 68 A 7.70 4.82 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.49 0.00 2.26 2.30 0.00 3.72 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 2.04 2.01 0.00 70 G 8.07 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 71 I 7.34 3.47 1.66 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.64 0.25 0.00 0.00 72 A 7.58 4.14 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 73 T 8.15 3.79 4.39 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 1.17 0.00 0.00 74 Q 8.02 3.91 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.09 0.00 0.00 0.00 0.00 0.00 1.92 2.18 0.00 75 Y 7.66 4.53 0.00 2.97 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 76 N 7.76 4.08 0.00 2.75 2.79 0.00 0.00 7.10 8.17 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 77 I 7.84 3.64 1.78 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.11 0.76 0.00 0.00 78 R 7.79 4.33 0.00 1.74 1.73 0.00 3.20 0.00 0.00 3.14 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.71 0.00 79 S 8.17 4.26 0.00 3.83 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 80 I 8.06 4.69 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.90 0.97 0.00 0.00 81 P 0.00 5.05 0.00 2.24 2.36 0.00 3.86 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.92 0.00 82 T 8.50 5.06 4.11 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 1.09 0.00 0.00 83 V 8.92 4.69 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 0.61 0.00 0.00 0.94 0.00 0.00 84 L 8.89 5.21 0.00 2.15 1.77 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.54 5.35 0.00 3.01 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 86 F 9.36 5.50 0.00 2.90 2.86 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 87 K 8.43 4.41 0.00 1.40 1.52 0.00 2.00 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.41 7.81 88 N 9.28 4.03 0.00 2.96 2.84 0.00 0.00 6.97 7.83 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 89 G 8.02 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 0.00 0.00 0.00 90 E 7.74 4.64 0.00 2.21 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 2.50 0.00 91 R 8.62 3.43 0.00 1.85 1.88 0.00 3.29 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.45 0.00 92 K 8.50 4.39 0.00 1.47 1.78 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.25 7.81 93 E 7.94 4.79 0.00 2.21 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 2.42 2.41 0.00 94 S 8.87 4.76 0.00 3.75 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 95 I 8.74 4.61 1.96 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.00 0.97 0.00 0.00 96 I 8.72 4.71 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.58 0.92 0.00 0.00 97 G 9.17 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 98 A 7.96 4.40 1.29 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 0.00 0.00 99 V 7.42 3.82 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 0.87 0.00 0.00 1.04 0.00 0.00 100 P 0.00 4.50 0.00 2.24 1.97 0.00 3.71 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 2.13 2.09 0.00 101 K 8.91 3.87 0.00 1.84 1.87 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.59 7.81 102 S 8.08 4.18 0.00 4.10 4.13 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 0.00 103 T 7.88 3.93 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 0.00 104 L 7.87 4.17 0.00 1.84 1.82 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.41 3.96 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 1.28 0.00 0.00 106 D 7.97 4.36 0.00 2.73 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 0.00 107 S 7.72 3.91 0.00 3.77 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 0.00 108 I 7.28 3.64 1.62 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.09 0.24 0.00 0.00 109 E 7.81 3.97 0.00 1.83 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 2.31 2.43 0.00 110 K 7.13 4.10 0.00 1.34 0.90 0.00 1.56 0.00 0.00 1.43 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.05 1.22 7.81 111 Y 7.00 4.77 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.02 4.23 0.00 1.58 1.51 0.96 0.96 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