NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 K 4.3700 8.3149 122.1407 53.6256 34.7082 177.7702 6 S 4.5951 7.4278 116.9766 57.3480 67.5150 170.3273 7 H 4.7130 9.1531 118.5429 55.4267 32.1740 172.0541 8 R 4.5046 8.8093 119.4698 56.6127 33.1321 173.8271 9 G 4.0729 9.0970 110.0836 45.1092 0.0000 173.3040 10 E 4.3697 7.2815 114.8209 54.2234 32.1558 174.2993 11 Y 4.8547 7.7562 115.5501 56.1753 41.8441 175.6396 12 S 4.5760 8.5016 117.6874 58.1352 64.2248 175.3512 13 V 3.9637 8.3517 116.7130 63.8213 31.8050 176.9481 14 C 5.3349 7.8309 114.7295 55.1008 42.2540 173.3960 15 D 5.0881 8.6482 122.0363 53.0172 42.4609 175.7390 16 S 5.3700 8.6651 117.1103 56.4711 66.2573 172.7851 17 E 4.8048 9.5993 118.1203 54.7893 32.9510 174.6363 18 S 5.1228 8.4671 116.5625 57.0446 65.9439 173.1393 19 L 4.4413 8.2611 121.2032 54.6273 44.1619 174.2342 20 W 5.1993 8.7694 120.4364 55.6041 30.4619 176.0004 21 V 4.4640 9.4165 127.2878 61.7963 32.0277 176.1765 22 T 4.7357 8.9192 117.7328 61.7303 69.7290 174.4395 23 D 4.9054 7.9466 120.3672 52.7544 40.2087 175.1318 24 K 4.1525 8.4525 121.5748 57.1547 32.6654 176.2211 25 S 4.9140 8.7776 120.1843 58.5392 65.8264 173.8399 26 S 5.1869 7.9655 112.7159 56.7516 66.0898 172.8956 27 A 4.7379 8.8602 122.2501 50.7673 23.6625 174.5643 28 I 4.8094 8.1625 119.5140 60.0839 39.1383 176.6666 29 D 5.3282 9.0063 128.0864 52.1812 41.2219 176.7955 30 I 3.6240 8.0027 118.5200 63.9783 37.8319 176.9365 31 R 4.2157 8.2233 117.1217 55.7975 29.8649 176.4368 32 G 3.9704 8.1533 105.7035 46.8240 0.0000 173.8071 33 H 4.7628 8.5774 116.9307 53.9833 30.5606 173.6888 34 Q 4.8615 8.3749 122.3290 55.5297 29.7894 175.1937 35 V 4.6347 8.7491 119.2793 59.6838 36.1861 175.1549 36 T 4.6034 8.7162 120.4280 63.4728 69.9090 173.8678 37 V 4.4236 8.5555 126.0320 60.8918 32.6814 175.6046 38 L 4.1256 8.3880 128.8422 55.1085 41.8880 178.0324 39 G 3.9613 8.8555 108.9629 48.3646 0.0000 172.5071 40 E 5.1799 7.9118 116.4148 55.2105 33.6297 174.4042 41 I 4.4373 8.7298 119.9312 59.0600 40.1462 175.7596 42 K 4.3472 8.8137 127.5213 57.0930 32.4341 177.3545 43 T 4.4474 7.7535 119.5854 61.3853 70.2055 174.2544 44 G 3.8155 8.2088 109.6940 49.5204 0.0000 174.8232 45 N 4.1729 8.2153 118.9622 54.0300 36.8243 176.9585 46 S 4.3765 8.8678 117.4507 57.6550 64.2280 170.6006 47 P 4.8199 0.0000 0.0000 62.9038 32.3903 175.6332 48 V 4.4948 8.2951 114.8073 59.5097 34.1856 175.4924 49 K 4.4521 8.6985 124.1086 56.4745 32.9678 176.1782 50 Q 4.3453 8.6663 126.6654 55.0082 29.7504 173.9808 51 Y 5.0154 7.4214 123.5777 55.6877 42.0638 173.9082 52 F 4.9408 9.3807 116.4319 55.9796 43.5443 174.0946 53 Y 4.5512 8.9437 123.8783 56.5753 39.0876 174.2483 54 E 4.8024 8.6086 127.0296 54.7559 32.9458 175.2798 55 T 5.0024 8.2659 116.3033 60.4712 70.6828 172.9330 56 R 4.7539 8.8964 123.6027 54.2920 33.8358 173.4313 57 C 4.7316 8.6368 117.3194 57.0934 40.0727 174.8994 58 K 4.1529 9.1927 123.8216 59.3734 31.8882 176.9404 59 E 4.6503 7.4928 112.7534 55.1890 32.0169 174.8928 60 A 4.4196 8.7425 121.9527 53.6052 18.8925 177.0072 61 R 4.8565 7.4230 111.1954 52.9764 29.3700 172.6410 62 P 4.4761 0.0000 0.0000 65.7589 32.0473 176.9013 63 V 4.3810 6.9253 112.1037 60.3040 33.9857 178.0329 64 K 4.3487 6.8952 117.4017 56.2107 33.4263 176.4605 65 N 4.8130 8.3849 118.4644 53.5929 40.8700 174.7103 66 G 4.4380 6.9111 108.9959 45.5742 0.0000 175.7990 67 C 4.5137 8.5285 124.1949 55.6542 40.6793 172.8328 68 R 4.0269 8.5733 124.3702 58.1136 29.9373 177.1300 69 G 3.9885 8.9592 113.0043 45.2554 0.0000 173.2622 70 I 4.0175 6.8933 120.5722 60.4268 37.9689 176.3820 71 D 4.6741 8.6516 124.6514 54.7761 38.8787 176.0182 72 D 5.0111 8.2674 122.9040 53.9664 40.3366 178.2642 73 K 3.9476 7.7962 120.3227 59.3626 31.7952 176.7729 74 H 4.7858 8.0275 113.0612 55.3185 31.0229 174.3279 75 W 5.4089 8.3108 118.1325 54.7420 33.4277 174.7933 76 N 4.9258 9.2498 121.0193 53.7116 39.5150 174.2219 77 S 5.3782 8.3062 113.6886 58.4277 66.7372 172.8849 78 Q 4.7712 8.3412 117.9324 55.1481 33.6033 174.0621 79 C 5.0981 9.1930 121.3702 56.0965 41.8177 172.6960 80 K 4.7520 9.0264 124.2731 54.4841 34.5853 176.0401 81 T 4.4838 8.5810 121.8619 63.6669 69.0416 173.9088 82 S 4.8300 9.0166 121.0324 56.7529 66.0366 173.4416 83 Q 4.9574 8.3970 120.0089 55.4184 30.9834 174.0401 84 T 4.4505 8.5909 114.8921 61.1821 71.8428 171.4308 85 Y 5.4914 8.3833 120.3394 56.7569 39.6012 175.8204 86 V 5.0394 9.0732 122.3865 61.2361 35.6048 174.7784 87 R 4.2085 8.2997 124.0617 56.0511 31.0207 175.7305 88 A 4.7656 8.7531 122.6716 50.4513 23.5114 174.9989 89 L 3.8454 7.6578 123.2910 54.4003 43.1601 175.9620 90 T 5.1666 8.7401 116.0844 60.5584 73.0066 172.5042 91 S 4.9254 8.7502 115.1882 56.8278 67.3373 172.3838 92 E 4.6902 8.4738 120.9625 54.7924 32.2319 175.5445 93 N 4.1621 9.6833 125.7599 54.8042 36.3225 173.8781 94 N 4.1849 8.2959 110.5824 54.2266 38.0274 173.8325 95 K 4.5498 8.3788 114.6908 56.3390 34.5086 176.2705 96 L 4.8546 7.4422 117.1518 52.6076 41.0347 176.2716 97 V 3.8421 7.9760 113.0036 61.4018 32.7956 177.0428 98 G 3.9148 8.2529 110.7999 46.3607 0.0000 171.2240 99 W 5.0897 8.9009 119.5129 55.9197 30.4025 176.5488 100 R 4.7842 8.8465 121.6186 54.4533 34.9720 173.9355 101 W 5.1679 8.8091 121.4115 55.8065 30.7885 175.5573 102 I 5.2164 9.3534 118.2073 59.1318 40.8657 174.4770 103 R 4.9895 8.3997 122.4770 55.3744 30.9185 176.1122 104 I 4.6846 8.6228 116.5663 58.6938 41.9990 174.2628 105 D 4.7949 8.5164 123.0880 55.1453 41.0254 176.8276 106 T 4.6556 8.9352 116.5376 61.8867 69.7444 172.8690 107 S 4.5964 7.6361 114.0319 57.7881 66.6235 173.5492 108 C 5.3422 8.6251 119.3662 54.9622 42.2799 173.2715 109 V 4.6703 8.8393 118.5164 59.7044 35.9793 173.4382 110 C 5.2014 8.7199 122.2913 55.3339 39.3880 172.4408 111 A 4.8564 9.0436 127.8777 50.1513 21.2804 175.2416 112 L 5.1253 8.3704 121.8274 53.4526 43.9562 176.1829 113 S 4.8996 9.0720 115.5634 56.5934 66.7881 173.2426 114 R 4.3317 8.8178 122.6020 56.0354 30.8478 176.2591 115 K 4.2699 7.9415 123.2751 56.7556 31.6518 176.8961 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 K 8.31 4.37 0.00 1.79 1.65 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 6 S 7.43 4.60 0.00 3.85 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 7 H 9.15 4.71 0.00 3.05 3.10 0.00 5.64 0.00 0.00 0.00 0.00 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.81 4.50 0.00 1.74 1.77 0.00 3.17 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 9 G 9.10 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 0.00 0.00 0.00 10 E 7.28 4.37 0.00 1.94 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 2.08 2.17 0.00 11 Y 7.76 4.85 0.00 2.95 2.88 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 12 S 8.50 4.58 0.00 3.90 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 13 V 8.35 3.96 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 0.75 0.00 0.00 0.92 0.00 0.00 14 C 7.83 5.33 0.00 2.79 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 15 D 8.65 5.09 0.00 2.59 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 16 S 8.67 5.37 0.00 3.86 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 17 E 9.60 4.80 0.00 1.92 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 2.28 2.20 0.00 18 S 8.47 5.12 0.00 3.66 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 19 L 8.26 4.44 0.00 1.63 1.65 0.91 1.24 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 20 W 8.77 5.20 0.00 3.28 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 21 V 9.42 4.46 2.36 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 1.12 0.00 0.00 0.97 0.00 0.00 22 T 8.92 4.74 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 23 D 7.95 4.91 0.00 2.78 2.76 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 24 K 8.45 4.15 0.00 1.79 1.93 0.00 1.14 0.00 0.00 1.48 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.37 7.81 25 S 8.78 4.91 0.00 3.91 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 26 S 7.97 5.19 0.00 3.93 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 27 A 8.86 4.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.16 4.81 1.92 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 1.41 1.47 0.97 0.00 0.00 29 D 9.01 5.33 0.00 3.05 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 30 I 8.00 3.62 1.35 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.34 0.87 0.00 0.00 31 R 8.22 4.22 0.00 1.90 1.91 0.00 3.53 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.51 0.00 32 G 8.15 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 33 H 8.58 4.76 0.00 3.19 3.24 0.00 5.63 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.37 4.86 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 35 V 8.75 4.63 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 0.78 0.00 0.00 0.98 0.00 0.00 36 T 8.72 4.60 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 1.26 0.00 0.00 37 V 8.56 4.42 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 0.96 0.00 0.00 0.91 0.00 0.00 38 L 8.39 4.13 0.00 1.60 1.66 0.86 0.90 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 39 G 8.86 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 40 E 7.91 5.18 0.00 2.05 1.92 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 2.16 2.32 0.00 41 I 8.73 4.44 1.91 0.00 0.00 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 1.06 0.87 1.05 0.00 0.00 42 K 8.81 4.35 0.00 1.62 1.78 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.54 7.81 43 T 7.75 4.45 4.55 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 1.24 0.00 0.00 44 G 8.21 3.82 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 0.00 0.00 0.00 45 N 8.22 4.17 0.00 2.71 2.61 0.00 0.00 6.84 7.57 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 46 S 8.87 4.38 0.00 3.85 3.72 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 47 P 0.00 4.82 0.00 2.18 2.03 0.00 3.79 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 1.99 2.00 0.00 48 V 8.30 4.49 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 0.78 0.00 0.00 0.93 0.00 0.00 49 K 8.70 4.45 0.00 1.77 1.97 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.46 7.81 50 Q 8.67 4.35 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.67 0.00 0.00 0.00 0.00 0.00 2.16 1.89 0.00 51 Y 7.42 5.02 0.00 3.28 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 52 F 9.38 4.94 0.00 3.12 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 53 Y 8.94 4.55 0.00 2.40 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 54 E 8.61 4.80 0.00 1.77 1.67 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 2.30 2.24 0.00 55 T 8.27 5.00 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 1.01 0.00 0.00 56 R 8.90 4.75 0.00 1.79 1.89 0.00 2.79 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.54 0.00 57 C 8.64 4.73 0.00 2.87 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 58 K 9.19 4.15 0.00 1.80 1.87 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.74 1.37 7.81 59 E 7.49 4.65 0.00 2.02 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 0.00 2.18 2.24 0.00 60 A 8.74 4.42 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 61 R 7.42 4.86 0.00 1.99 1.90 0.00 3.11 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 62 P 0.00 4.48 0.00 2.05 2.17 0.00 3.83 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 2.20 2.12 0.00 63 V 6.93 4.38 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 0.76 0.00 0.00 0.92 0.00 0.00 64 K 6.90 4.35 0.00 1.80 1.59 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.09 7.81 65 N 8.38 4.81 0.00 2.72 2.91 0.00 0.00 6.82 7.65 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 66 G 6.91 4.44 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 0.00 67 C 8.53 4.51 0.00 2.97 2.99 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 68 R 8.57 4.03 0.00 1.82 1.97 0.00 3.18 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 69 G 8.96 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 0.00 0.00 0.00 70 I 6.89 4.02 1.91 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.83 0.98 0.00 0.00 71 D 8.65 4.67 0.00 2.86 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 72 D 8.27 5.01 0.00 2.86 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 73 K 7.80 3.95 0.00 1.74 1.62 0.00 1.26 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.46 7.81 74 H 8.03 4.79 0.00 2.82 2.77 0.00 5.81 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 75 W 8.31 5.41 0.00 3.26 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 76 N 9.25 4.93 0.00 2.84 2.79 0.00 0.00 6.48 7.13 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 77 S 8.31 5.38 0.00 3.83 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 78 Q 8.34 4.77 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 79 C 9.19 5.10 0.00 3.02 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 80 K 9.03 4.75 0.00 1.60 1.66 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.36 7.81 81 T 8.58 4.48 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 1.16 0.00 0.00 82 S 9.02 4.83 0.00 3.80 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 83 Q 8.40 4.96 0.00 1.80 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 84 T 8.59 4.45 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 1.26 0.00 0.00 85 Y 8.38 5.49 0.00 2.99 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 86 V 9.07 5.04 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 1.21 0.00 0.00 1.16 0.00 0.00 87 R 8.30 4.21 0.00 1.33 1.79 0.00 3.18 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 88 A 8.75 4.77 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 89 L 7.66 3.85 0.00 0.43 1.00 0.20 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 90 T 8.74 5.17 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 1.19 0.00 0.00 91 S 8.75 4.93 0.00 3.86 3.89 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 92 E 8.47 4.69 0.00 2.02 1.81 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 2.28 2.44 0.00 93 N 9.68 4.16 0.00 2.85 2.82 0.00 0.00 7.11 8.00 0.00 0.00 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 N 8.30 4.18 0.00 2.80 2.86 0.00 0.00 7.08 6.68 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 95 K 8.38 4.55 0.00 1.70 1.79 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.36 7.81 96 L 7.44 4.85 0.00 1.47 1.56 0.92 0.92 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 97 V 7.98 3.84 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 0.61 0.00 0.00 0.90 0.00 0.00 98 G 8.25 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 0.00 0.00 0.00 99 W 8.90 5.09 0.00 3.13 3.07 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 R 8.85 4.78 0.00 1.70 1.78 0.00 3.11 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 101 W 8.81 5.17 0.00 3.20 3.03 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 0.00 102 I 9.35 5.22 1.90 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.93 0.95 0.00 0.00 103 R 8.40 4.99 0.00 1.66 1.74 0.00 3.16 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.81 0.00 104 I 8.62 4.68 1.77 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.17 0.62 0.00 0.00 105 D 8.52 4.79 0.00 2.69 2.76 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 0.00 106 T 8.94 4.66 4.22 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 0.00 0.00 0.00 1.19 0.00 0.00 107 S 7.64 4.60 0.00 3.87 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 0.00 108 C 8.63 5.34 0.00 2.98 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 0.00 109 V 8.84 4.67 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 0.58 0.00 0.00 0.94 0.00 0.00 110 C 8.72 5.20 0.00 2.94 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 0.00 111 A 9.04 4.86 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 0.00 112 L 8.37 5.13 0.00 1.23 1.25 -0.11 0.57 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 0.00 113 S 9.07 4.90 0.00 3.90 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 0.00 114 R 8.82 4.33 0.00 1.89 1.85 0.00 3.12 0.00 0.00 3.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.09 0.00 115 K 7.94 4.27 0.00 1.62 1.67 0.00 1.99 0.00 0.00 1.93 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.63 1.31 7.81