NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Y 4.5051 8.1293 118.4143 57.6407 38.9466 174.8472 16 S 4.2604 8.3765 120.6878 56.6050 63.9219 172.1011 17 N 4.8775 8.9101 117.2695 52.9503 39.3943 176.2125 18 A 4.8402 7.9035 123.0482 52.2851 19.9748 176.7323 19 I 5.0047 8.9473 112.8372 59.2518 42.0731 174.2444 20 V 4.8810 8.7142 122.8405 61.3187 34.3219 174.1901 21 V 4.7952 9.0941 128.9922 61.4402 33.3564 174.5945 22 L 5.0800 9.0786 128.7923 54.5639 43.2612 175.3919 23 C 5.5884 9.0831 121.1337 59.2578 35.4563 172.5385 24 T 5.3697 8.6756 113.0911 59.9654 71.6068 172.7102 25 A 4.6482 8.8136 123.6650 49.3979 22.4133 175.6472 26 P 4.6426 0.0000 0.0000 65.2654 32.0773 176.3205 27 D 4.6369 7.3638 117.5183 51.2660 43.6283 176.0335 28 E 3.9410 8.6700 118.9760 59.1985 29.3689 179.3556 29 A 3.9591 7.9616 120.6965 55.3751 18.5698 179.7752 30 S 4.0696 8.6476 112.6366 61.2722 63.0197 176.4736 31 A 3.9576 7.9255 124.4287 55.1301 18.0587 179.6582 32 Q 3.9154 8.5084 116.9645 59.0934 28.8020 178.6977 33 N 4.3227 8.1570 117.5268 56.1786 38.5179 177.1873 34 L 4.0345 8.0350 121.3808 58.1247 42.2089 178.6410 35 A 4.0626 8.2172 120.5407 55.2686 18.2596 179.3716 36 A 3.9379 8.2907 119.3365 55.4686 18.4857 179.8728 37 Q 3.9201 8.1698 116.4228 59.1836 28.8631 179.2084 38 V 3.1595 8.0980 119.4805 65.9504 31.5605 178.1052 39 L 4.0832 8.2375 118.9494 57.6427 41.2390 179.6928 40 G 3.6086 8.0288 104.9873 47.5150 0.0000 174.8692 41 E 4.0784 7.8800 118.1017 55.6626 30.1328 176.5963 42 K 3.7354 7.8083 118.2246 57.5834 30.0942 176.5012 43 L 4.4016 7.7813 116.7448 54.8179 42.4144 176.7048 44 A 4.6012 7.2886 119.7044 50.7599 22.1012 175.8232 45 A 4.0607 8.7306 122.7349 54.2190 19.6388 177.9221 46 C 4.8561 7.8912 113.8912 58.0575 35.5079 173.0440 47 V 4.6270 8.4207 124.6237 61.3487 33.6927 174.3716 48 T 4.5971 8.6993 124.6684 61.7231 71.0684 173.0831 49 L 4.8646 8.4674 125.8874 53.1538 43.9648 176.5838 50 L 4.6006 8.9092 124.9227 52.4035 42.2744 174.4937 51 P 4.5087 0.0000 0.0000 62.2443 32.7988 176.0300 52 G 3.7520 8.6723 106.3684 46.4142 0.0000 173.7589 53 A 4.5273 7.8009 121.2382 51.5226 20.2913 177.3483 54 T 5.0318 8.4400 115.1328 61.8943 71.5648 173.8627 55 S 4.9401 9.3370 122.3222 56.6722 66.0225 172.9981 56 L 5.4927 8.4678 123.4592 52.4230 44.2005 175.2038 57 Y 4.7442 7.3034 118.3665 56.6033 40.9556 172.2898 58 Y 4.7657 8.9427 118.5494 56.9891 39.5319 175.1321 59 W 4.9961 9.1694 133.5456 56.6040 33.3955 174.8511 60 E 3.3589 9.3415 126.6692 57.4832 26.3605 175.8200 61 G 4.0279 8.5305 105.2196 45.1740 0.0000 173.6592 62 K 4.7422 7.8393 119.3447 54.1648 35.3509 175.3247 63 L 3.6399 8.3449 126.3173 54.7662 42.4339 175.7255 64 E 4.4141 8.6872 126.6095 54.7842 32.3907 175.6090 65 Q 4.2323 8.1282 122.4622 54.8062 31.3162 173.5831 66 E 4.7019 9.0028 125.7775 54.3685 33.9042 175.1410 67 Y 5.0189 8.3550 119.4775 58.3439 39.2063 174.6030 68 E 4.9351 9.4374 121.4493 55.4178 35.3565 173.8048 69 V 4.7060 8.9793 121.2467 61.3649 33.8628 174.1769 70 Q 4.6270 8.8367 129.7790 55.4355 30.4685 174.3291 71 L 5.1481 9.3967 127.0574 53.0658 44.9838 175.6810 72 L 4.9970 8.6603 121.6953 53.2087 45.0432 175.5724 73 F 4.7608 9.5536 124.6757 56.1435 40.7374 175.3820 74 K 4.9564 9.1531 124.9186 55.4967 33.5110 175.1695 75 S 4.3181 8.8355 122.4306 57.4740 66.2187 171.9777 76 N 5.5239 8.6387 114.2447 51.0273 40.8215 175.1240 77 T 3.9405 9.1065 108.8717 64.7649 68.9109 176.4022 78 D 4.3346 7.6913 121.0696 56.9151 41.0465 176.9244 79 H 4.7666 8.2180 113.4591 55.5124 29.5714 175.8808 80 Q 3.9314 7.9714 122.2653 59.5167 28.7462 178.3641 81 Q 3.9183 8.0205 119.7541 59.0813 29.1484 177.7094 82 A 4.0058 7.9381 121.4291 54.8643 18.3689 179.1966 83 L 3.8324 8.1066 118.8825 58.3796 42.2252 179.1023 84 L 3.9023 7.9997 118.9420 58.2229 41.6685 179.8132 85 T 3.8658 8.2749 115.8997 66.6205 68.1502 176.1700 86 Y 3.9094 8.0074 120.4433 60.6942 39.1974 177.6825 87 I 3.8966 8.0260 120.9256 64.5238 37.0421 178.1228 88 K 3.8391 7.8962 118.7711 59.6357 32.0067 178.0169 89 Q 4.2135 7.6165 115.4612 56.7394 29.0823 175.7375 90 H 4.8229 7.8639 117.4322 55.7223 30.0805 172.7685 91 H 4.8983 7.9569 117.7840 53.2886 32.4046 172.6558 92 P 4.1604 0.0000 0.0000 65.5105 31.4007 176.4539 93 Y 4.7461 7.0889 113.2798 57.0671 38.8678 175.3598 94 Q 4.2157 8.6928 123.0610 58.6652 29.7154 176.4050 95 T 4.6429 7.4514 113.2873 60.7529 68.7409 171.4698 96 P 4.5121 0.0000 0.0000 61.8062 32.8851 176.7901 97 E 4.0537 8.5818 121.2394 56.6426 30.7619 175.7639 98 L 4.7960 8.4471 126.5655 53.5890 44.9336 175.0519 99 L 4.7412 8.8210 124.2357 52.7261 45.3217 175.9792 100 V 4.5770 8.5350 124.3439 61.6837 32.6384 174.8297 101 L 4.7552 9.1763 129.3475 52.9272 43.2314 174.8257 102 P 4.8888 0.0000 0.0000 62.6138 32.8136 175.5078 103 V 4.3973 7.8223 120.1401 61.2642 32.8347 175.8404 104 R 3.1598 8.5065 124.8246 58.5215 29.8360 175.3513 105 D 4.6239 6.9534 115.0568 53.4410 43.9788 172.8759 106 G 3.9721 7.7606 108.8480 43.7390 0.0000 172.8907 107 D 4.4804 8.1556 118.8305 53.6189 42.3785 176.4766 108 K 3.9529 8.8185 126.9455 60.5259 32.4915 178.9250 109 D 4.3742 8.1978 119.5988 57.0687 40.7853 177.9840 110 Y 4.1751 8.4763 119.9715 60.8317 38.8156 177.9620 111 L 3.9789 8.4833 120.3522 57.7843 41.7034 179.4907 112 S 4.0599 8.3654 113.2538 61.1419 62.4413 176.1021 113 W 4.0374 8.2150 131.0563 60.1479 30.2094 177.5373 114 L 3.0050 7.8017 119.5595 58.0260 41.8493 178.4045 115 N 4.3085 8.2464 116.3065 56.3565 38.3143 177.3863 116 A 3.9645 7.6149 120.4543 54.9546 18.4650 179.4082 117 S 3.9520 7.2486 112.2948 59.6075 63.1107 174.7242 118 L 4.2745 6.6038 121.0967 53.0396 42.5423 176.5577 119 L 4.0479 7.9286 121.8135 55.7731 41.8949 176.9657 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 15 Y 8.13 4.51 0.00 2.96 3.05 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 16 S 8.38 4.26 0.00 4.00 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 17 N 8.91 4.88 0.00 2.80 3.11 0.00 0.00 5.84 7.46 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 18 A 7.90 4.84 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 19 I 8.95 5.00 1.92 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 1.26 0.96 0.96 0.00 0.00 20 V 8.71 4.88 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 1.01 0.00 0.00 1.00 0.00 0.00 21 V 9.09 4.80 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 0.98 0.00 0.00 0.96 0.00 0.00 22 L 9.08 5.08 0.00 1.66 1.79 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 23 C 9.08 5.59 0.00 3.17 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 24 T 8.68 5.37 4.40 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 1.32 0.00 0.00 25 A 8.81 4.65 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 26 P 0.00 4.64 0.00 2.23 2.35 0.00 3.43 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.72 0.00 27 D 7.36 4.64 0.00 2.78 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 28 E 8.67 3.94 0.00 2.01 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 0.00 2.38 2.35 0.00 29 A 7.96 3.96 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 30 S 8.65 4.07 0.00 3.93 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 31 A 7.93 3.96 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 32 Q 8.51 3.92 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 33 N 8.16 4.32 0.00 2.75 2.88 0.00 0.00 6.68 6.83 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 34 L 8.03 4.03 0.00 1.89 1.98 1.18 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.22 4.06 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 36 A 8.29 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 37 Q 8.17 3.92 0.00 2.45 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 38 V 8.10 3.16 2.39 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 1.08 0.00 0.00 1.06 0.00 0.00 39 L 8.24 4.08 0.00 1.86 1.68 0.95 0.76 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 40 G 8.03 3.61 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 0.00 0.00 0.00 41 E 7.88 4.08 0.00 1.70 1.73 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 2.18 1.57 0.00 42 K 7.81 3.74 0.00 1.89 1.83 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.26 1.31 7.81 43 L 7.78 4.40 0.00 1.46 1.61 0.77 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.29 4.60 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 45 A 8.73 4.06 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 C 7.89 4.86 0.00 3.40 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 47 V 8.42 4.63 1.90 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 -0.02 0.00 0.00 0.89 0.00 0.00 48 T 8.70 4.60 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 1.18 0.00 0.00 49 L 8.47 4.86 0.00 1.44 1.54 0.78 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.91 4.60 0.00 1.60 1.59 0.93 0.84 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 51 P 0.00 4.51 0.00 1.91 1.97 0.00 3.75 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 2.00 2.07 0.00 52 G 8.67 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 53 A 7.80 4.53 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 54 T 8.44 5.03 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 1.12 0.00 0.00 55 S 9.34 4.94 0.00 3.90 3.90 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 56 L 8.47 5.49 0.00 1.46 1.44 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 7.30 4.74 0.00 3.17 3.05 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 58 Y 8.94 4.77 0.00 2.98 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 59 W 9.17 5.00 0.00 3.64 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 9.34 3.36 0.00 2.09 1.90 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 1.86 1.47 0.00 61 G 8.53 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 62 K 7.84 4.74 0.00 1.73 1.68 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.52 7.81 63 L 8.34 3.64 0.00 0.76 1.27 0.40 0.75 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 64 E 8.69 4.41 0.00 1.16 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 2.25 2.30 0.00 65 Q 8.13 4.23 0.00 1.80 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.78 0.00 0.00 0.00 0.00 0.00 2.01 2.23 0.00 66 E 9.00 4.70 0.00 1.97 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 2.13 2.43 0.00 67 Y 8.35 5.02 0.00 2.95 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 68 E 9.44 4.94 0.00 1.96 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 2.40 2.38 0.00 69 V 8.98 4.71 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 0.99 0.00 0.00 0.98 0.00 0.00 70 Q 8.84 4.63 0.00 2.28 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.53 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 71 L 9.40 5.15 0.00 1.83 1.22 1.05 -0.23 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 72 L 8.66 5.00 0.00 1.51 1.58 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 73 F 9.55 4.76 0.00 2.92 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 9.15 4.96 0.00 1.96 1.93 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.46 7.81 75 S 8.84 4.32 0.00 3.90 3.71 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 76 N 8.64 5.52 0.00 3.09 2.85 0.00 0.00 5.74 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 77 T 9.11 3.94 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 1.31 0.00 0.00 78 D 7.69 4.33 0.00 3.03 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 H 8.22 4.77 0.00 3.23 3.25 0.00 5.82 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 7.97 3.93 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 81 Q 8.02 3.92 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 82 A 7.94 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.11 3.83 0.00 1.93 1.85 0.72 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.00 3.90 0.00 1.71 1.69 0.91 0.57 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 85 T 8.27 3.87 4.31 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 1.22 0.00 0.00 86 Y 8.01 3.91 0.00 3.07 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 87 I 8.03 3.90 1.77 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.63 0.89 0.00 0.00 88 K 7.90 3.84 0.00 1.81 2.00 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.52 7.81 89 Q 7.62 4.21 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.19 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 90 H 7.86 4.82 0.00 2.95 3.30 0.00 5.79 0.00 0.00 0.00 0.00 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 H 7.96 4.90 0.00 3.35 3.07 0.00 5.67 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.16 0.00 2.02 2.05 0.00 3.10 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.71 0.00 93 Y 7.09 4.75 0.00 3.01 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.69 4.22 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.27 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 95 T 7.45 4.64 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 1.28 0.00 0.00 96 P 0.00 4.51 0.00 1.98 1.50 0.00 3.76 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 1.92 1.83 0.00 97 E 8.58 4.05 0.00 2.06 1.90 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 2.57 2.37 0.00 98 L 8.45 4.80 0.00 1.50 1.53 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.82 4.74 0.00 1.61 1.56 0.95 0.75 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 0.00 100 V 8.53 4.58 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 0.83 0.00 0.00 0.94 0.00 0.00 101 L 9.18 4.76 0.00 1.71 1.61 0.96 0.89 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 0.00 102 P 0.00 4.89 0.00 2.33 2.16 0.00 3.78 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 103 V 7.82 4.40 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 0.88 0.00 0.00 0.99 0.00 0.00 104 R 8.51 3.16 0.00 0.76 1.21 0.00 2.92 0.00 0.00 3.03 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.37 0.00 105 D 6.95 4.62 0.00 2.50 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 0.00 106 G 7.76 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 0.00 0.00 0.00 107 D 8.16 4.48 0.00 2.83 2.67 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 0.00 108 K 8.82 3.95 0.00 2.05 2.10 0.00 1.58 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.58 7.81 109 D 8.20 4.37 0.00 2.99 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 0.00 110 Y 8.48 4.18 0.00 3.13 3.19 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 0.00 111 L 8.48 3.98 0.00 1.89 1.73 1.02 0.77 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 0.00 112 S 8.37 4.06 0.00 3.98 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 0.00 113 W 8.22 4.04 0.00 3.40 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 0.00 114 L 7.80 3.00 0.00 1.22 1.64 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.25 4.31 0.00 2.67 2.78 0.00 0.00 7.00 7.63 0.00 0.00 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 A 7.61 3.96 1.23 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 0.00 0.00 0.00 117 S 7.25 3.95 0.00 3.32 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 0.00 118 L 6.60 4.27 0.00 1.54 1.03 0.80 0.80 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 0.00 119 L 7.93 4.05 0.00 1.68 1.62 0.89 0.65 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