NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2170 8.1727 120.1324 56.7950 34.7629 174.0741 2 V 4.4976 8.1136 122.4666 60.9167 32.2051 174.6981 3 F 4.4006 9.3103 128.2738 57.2119 40.0669 175.0272 4 E 4.0369 8.9989 123.6510 56.1844 30.5922 177.2242 5 R 3.3368 8.9670 125.0927 60.2294 30.0812 179.6649 6 C 4.3339 8.2826 115.3806 59.6465 41.4003 175.5136 7 E 3.8955 8.3869 121.2241 59.2421 29.1918 178.7150 8 L 3.5465 8.0643 120.0743 57.8596 42.0979 178.6571 9 A 3.9511 7.7923 120.7270 55.4174 18.3209 179.9129 10 R 3.9140 8.0390 116.4635 59.4730 29.9222 179.4468 11 T 3.8557 7.9203 115.6313 66.7066 68.5561 176.7133 12 L 3.8584 8.1839 121.2750 57.4671 41.5760 179.5108 13 K 3.9223 8.1199 119.6384 59.6504 31.9603 179.1456 14 R 4.0010 7.9380 117.0651 58.6719 29.9933 177.9991 15 L 4.4246 7.2723 116.4827 54.1857 41.8169 177.1291 16 G 3.8720 7.8264 107.0524 46.4012 0.0000 174.8921 17 M 3.8924 7.7965 120.5139 56.3559 32.2673 175.6846 18 D 4.4207 7.9424 117.7989 56.0206 40.7273 175.7345 19 G 3.9691 9.4728 115.8690 45.1736 0.0000 171.1877 20 Y 4.1158 8.2131 121.5233 59.2563 39.2612 176.7653 21 R 3.5626 8.8350 127.5843 57.2389 27.6971 177.0585 22 G 3.8233 8.1644 104.7408 45.3395 0.0000 173.3915 23 I 4.0993 7.5636 122.0087 59.0861 38.0476 175.7928 24 S 4.5955 8.3339 120.4332 57.7539 63.7983 174.9419 25 L 4.2395 8.7452 123.0753 58.6349 41.6442 179.4537 26 A 4.1481 8.1116 120.1280 55.1196 18.3258 179.2381 27 N 4.4145 8.1773 114.8585 56.2749 38.5297 177.6781 28 W 4.2197 8.0134 119.9326 59.8923 29.1149 178.2775 29 M 4.1627 8.5781 119.0123 58.6771 31.4860 177.9037 30 C 3.2520 8.1176 118.6525 59.1549 44.6336 175.2604 31 L 3.9542 8.1863 121.6726 58.3490 41.7105 178.9157 32 A 4.1499 8.4118 120.7714 54.8448 18.2399 179.4512 33 K 2.7428 8.2827 118.4597 59.3476 32.0554 179.1009 34 W 4.1706 7.6792 117.2352 59.0991 29.0973 178.4404 35 E 4.3160 8.3462 118.7043 58.7838 29.1440 177.8710 36 S 4.5223 7.6012 108.1203 56.4547 64.7594 173.8719 37 G 3.4571 8.3457 109.0210 47.0215 0.0000 173.2704 38 Y 3.6621 7.6465 112.9454 58.7208 34.9896 168.8172 39 N 5.3239 8.0637 119.2391 51.9683 40.2893 175.4945 40 T 4.0912 8.9458 117.4684 63.7822 69.2401 176.0761 41 R 4.3916 8.0510 116.7156 55.9795 30.4135 176.3432 42 A 4.3051 7.8825 122.7852 52.4351 19.3475 176.4862 43 T 4.9695 8.5111 112.1695 59.7509 72.1153 173.0526 44 N 4.9200 8.8150 121.8668 52.0419 42.2004 172.4115 45 Y 4.5927 8.7175 127.9366 57.4552 40.6989 173.9105 46 N 4.7409 8.6131 125.0541 51.2214 38.3876 175.3189 47 A 3.7627 8.3224 127.5349 54.8659 18.9407 179.2057 48 G 3.8046 8.1494 104.1327 48.2714 0.0000 173.8695 49 D 4.7179 7.4646 114.9058 51.9573 40.1911 175.8502 50 R 4.0510 8.2371 116.1758 57.0323 28.2011 175.9885 51 S 4.8610 7.8523 113.7500 57.4601 66.0452 172.8069 52 T 5.1011 8.8159 115.5032 61.9657 72.6287 173.0789 53 D 5.4639 9.0843 125.3110 53.4300 43.2283 175.0625 54 Y 4.7207 9.0262 120.0639 57.4452 41.4789 177.2053 55 G 4.5306 9.4312 112.5293 46.3524 0.0000 173.6433 56 I 3.8318 8.2217 117.0854 62.7179 38.1091 177.6255 57 F 4.7225 8.0011 115.9371 56.4122 39.9986 175.1999 58 Q 3.5357 7.8865 119.2151 57.0839 26.5594 173.8722 59 I 4.4551 8.2352 119.1164 61.0511 39.4167 176.6893 60 N 5.5837 9.1622 125.5596 53.0170 40.0127 175.8067 61 S 4.6282 9.0878 120.0660 60.3980 63.4087 175.4689 62 R 3.7719 8.9166 122.3530 58.7533 30.3726 177.8114 63 Y 4.0477 7.8425 114.8414 57.6568 40.4906 176.8635 64 W 4.9757 8.1161 118.6022 57.4158 31.9823 173.8672 65 C 5.6032 8.0722 112.1465 53.7170 46.6305 172.4869 66 N 4.8329 9.0401 119.6729 52.2736 39.7884 174.8886 67 D 4.8991 8.7689 124.0840 52.4903 40.1970 177.4267 68 G 4.0856 8.5167 108.8870 45.9238 0.0000 174.8268 69 K 4.4745 8.0809 115.8776 56.5755 33.1089 175.6783 70 T 4.4882 7.7271 117.6280 61.1187 69.4199 172.1756 71 P 4.1886 0.0000 0.0000 63.9036 31.7408 176.7355 72 G 3.7725 8.8965 109.2676 45.6790 0.0000 173.4008 73 A 4.1338 7.4128 122.1458 51.7626 18.8975 177.3725 74 V 4.4699 7.9518 113.0032 59.6327 35.5168 176.1786 75 N 4.9381 8.0327 115.8837 52.0412 38.4266 174.3737 76 A 4.0494 8.6121 123.7913 55.0231 19.1107 178.4525 77 C 4.3853 8.6356 111.4904 57.5784 40.9792 173.3003 78 H 4.0848 8.0576 115.1581 56.2427 27.4307 174.2547 79 L 4.7974 8.3994 119.3987 53.1878 46.4025 176.7582 80 S 4.5232 8.5163 116.2110 58.5285 63.0760 176.0097 81 C 3.9681 8.6352 124.7286 59.5582 40.5616 176.2459 82 S 3.9607 7.9179 115.0329 61.3949 61.6446 175.9538 83 A 4.1311 8.0643 122.5418 54.2205 18.3444 177.8957 84 L 4.5062 7.7740 116.5958 54.8825 41.8221 177.5182 85 L 5.1060 7.7800 117.1235 54.4969 42.3995 176.8230 86 Q 4.3065 7.8995 117.6962 55.5632 29.4291 176.0658 87 D 4.4321 8.6199 120.4987 57.2913 41.1155 176.9871 88 N 4.5592 8.0880 117.9835 53.4377 39.4438 174.6259 89 I 4.3637 8.3917 118.5990 60.9243 38.1049 177.1949 90 A 3.9307 8.4615 125.0639 56.1309 18.1339 180.3594 91 D 4.2692 8.0887 116.5483 57.3770 40.8889 178.7172 92 A 4.0777 7.9768 120.9446 55.1378 18.3671 179.7409 93 V 3.3915 8.3376 117.0722 65.9464 31.5916 178.0649 94 A 3.8114 8.1986 120.9268 55.2928 18.0734 178.8493 95 C 4.1930 8.4757 116.8973 59.6065 37.9649 175.5255 96 A 3.9303 8.2963 122.8580 55.1688 17.5980 179.7907 97 K 3.8596 7.8245 116.4740 59.3367 32.3429 179.2265 98 R 4.0549 7.8369 119.1044 59.3073 30.0953 178.5031 99 V 2.2929 7.5132 118.2322 65.7379 31.1164 177.6911 100 V 3.9777 7.2752 107.5320 61.9445 31.6518 177.7593 101 R 4.2199 7.6816 117.6964 56.9020 30.5761 176.4028 102 D 4.7690 7.4224 119.2238 52.5992 42.0637 175.4572 103 P 4.2434 0.0000 0.0000 66.0971 31.4707 178.4006 104 Q 4.0482 8.1961 116.3524 56.7270 30.0476 177.5488 105 G 3.5867 7.8516 107.2308 46.5859 0.0000 176.6014 106 I 3.7762 7.7278 122.6229 62.7473 37.8748 177.4503 107 R 4.2600 7.2520 117.7792 58.1841 30.0224 177.4199 108 A 3.9296 7.7238 121.2193 54.3479 18.5266 177.8195 109 W 4.7481 8.2029 116.6686 55.5649 29.9501 177.6481 110 V 3.7484 8.7468 123.4924 65.9772 30.9256 177.7081 111 A 4.0185 8.2592 120.2117 54.7374 18.1286 179.2414 112 W 3.9431 8.3029 126.8849 60.5955 30.5523 178.4680 113 R 3.9358 8.0735 117.9853 58.7557 29.6699 178.3547 114 N 4.3409 8.1132 115.1528 55.6637 38.6942 176.8338 115 R 3.9983 7.7281 116.0440 55.8688 31.7792 176.0346 116 C 4.4989 7.0839 113.6159 57.9669 40.6194 174.2477 117 Q 3.2423 6.7272 120.7577 57.2519 28.7492 176.1422 118 N 4.1699 8.6325 119.8712 54.0434 36.2366 173.8128 119 R 4.4538 7.3233 116.1361 54.0927 32.6829 175.5291 120 D 4.5650 8.4432 118.9792 54.1638 40.7121 175.8299 121 V 4.6326 8.2202 119.1836 61.2486 32.5059 178.3157 122 R 4.0772 8.3303 122.7837 59.1925 30.2534 179.0234 123 Q 4.0025 8.1397 115.6625 59.2371 28.5576 178.3088 124 Y 4.1213 7.6430 115.1514 60.1434 38.2505 177.1670 125 V 4.3182 7.7413 110.6267 60.5834 32.5872 175.1481 126 Q 4.1165 7.6454 122.4100 57.5833 28.9584 176.7840 127 G 3.9749 8.9535 113.1578 45.9663 0.0000 174.3137 128 C 4.4217 8.0481 115.8039 56.8743 40.5348 173.9967 129 G 3.8574 8.1165 107.2984 46.6922 0.0000 174.1942 130 V 4.0005 7.8845 118.0918 61.0716 31.9908 175.8694 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 1 K 8.17 4.22 0.00 1.63 2.11 0.00 1.06 0.00 0.00 1.08 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.14 7.81 2 V 8.11 4.50 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 0.87 0.00 0.00 0.95 0.00 0.00 3 F 9.31 4.40 0.00 2.82 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 4 E 9.00 4.04 0.00 2.06 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 2.32 2.41 0.00 5 R 8.97 3.34 0.00 1.97 1.92 0.00 3.43 0.00 0.00 3.44 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 6 C 8.28 4.33 0.00 3.25 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 7 E 8.39 3.90 0.00 2.09 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 2.72 2.46 0.00 8 L 8.06 3.55 0.00 1.37 1.39 -0.17 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.79 3.95 1.32 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 10 R 8.04 3.91 0.00 2.01 1.99 0.00 3.14 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.92 3.86 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 1.21 0.00 0.00 12 L 8.18 3.86 0.00 1.72 1.59 0.94 0.40 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 13 K 8.12 3.92 0.00 1.94 1.92 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.49 7.81 14 R 7.94 4.00 0.00 1.97 1.97 0.00 3.20 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 15 L 7.27 4.42 0.00 1.60 1.56 0.88 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 16 G 7.83 3.87 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 0.00 0.00 0.00 17 M 7.80 3.89 0.00 1.33 1.98 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 18 D 7.94 4.42 0.00 2.67 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 19 G 9.47 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 20 Y 8.21 4.12 0.00 3.36 3.16 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 R 8.83 3.56 0.00 1.66 1.77 0.00 3.14 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.68 0.00 22 G 8.16 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 23 I 7.56 4.10 1.87 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.65 -0.29 0.00 0.00 24 S 8.33 4.60 0.00 4.07 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 25 L 8.75 4.24 0.00 2.03 1.82 0.99 1.78 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 26 A 8.11 4.15 1.52 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 0.00 0.00 27 N 8.18 4.41 0.00 2.82 2.72 0.00 0.00 6.93 7.26 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 28 W 8.01 4.22 0.00 3.56 3.15 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 29 M 8.58 4.16 0.00 2.18 2.39 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.93 0.00 30 C 8.12 3.25 0.00 2.49 3.14 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 0.00 0.00 0.00 31 L 8.19 3.95 0.00 1.82 1.88 0.54 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.41 4.15 1.46 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 0.00 0.00 0.00 33 K 8.28 2.74 0.00 1.70 1.52 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.25 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.60 1.48 7.81 34 W 7.68 4.17 0.00 3.32 3.24 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 0.00 0.00 0.00 0.00 35 E 8.35 4.32 0.00 2.03 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 2.57 2.41 0.00 36 S 7.60 4.52 0.00 4.03 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 37 G 8.35 3.46 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 0.00 0.00 0.00 0.00 38 Y 7.65 3.66 0.00 3.23 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 39 N 8.06 5.32 0.00 2.83 2.83 0.00 0.00 7.02 6.59 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 40 T 8.95 4.09 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 1.46 0.00 0.00 41 R 8.05 4.39 0.00 1.99 2.10 0.00 3.08 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.59 0.00 42 A 7.88 4.31 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 43 T 8.51 4.97 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 1.22 0.00 0.00 44 N 8.82 4.92 0.00 2.82 2.81 0.00 0.00 6.83 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 45 Y 8.72 4.59 0.00 3.08 2.84 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 46 N 8.61 4.74 0.00 2.64 2.61 0.00 0.00 6.53 7.03 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 47 A 8.32 3.76 1.32 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 48 G 8.15 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 0.00 0.00 0.00 49 D 7.46 4.72 0.00 2.71 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 50 R 8.24 4.05 0.00 2.04 2.21 0.00 3.15 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.54 0.00 51 S 7.85 4.86 0.00 3.94 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 52 T 8.82 5.10 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 0.69 0.00 0.00 53 D 9.08 5.46 0.00 2.69 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 54 Y 9.03 4.72 0.00 3.07 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 55 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 56 I 8.22 3.83 1.70 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.28 0.07 0.00 0.00 57 F 8.00 4.72 0.00 3.22 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 58 Q 7.89 3.54 0.00 2.54 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.71 0.00 59 I 8.24 4.46 2.15 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.11 1.13 0.00 0.00 60 N 9.16 5.58 0.00 3.09 3.02 0.00 0.00 6.98 7.27 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 61 S 9.09 4.63 0.00 4.06 4.38 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.92 3.77 0.00 1.68 1.76 0.00 2.80 0.00 0.00 2.84 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 63 Y 7.84 4.05 0.00 1.88 1.47 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.12 4.98 0.00 3.55 3.23 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 65 C 8.07 5.60 0.00 3.04 3.18 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 66 N 9.04 4.83 0.00 2.84 2.71 0.00 0.00 7.05 9.18 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 67 D 8.77 4.90 0.00 2.84 2.63 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 0.00 0.00 0.00 0.00 68 G 8.52 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 0.00 0.00 0.00 69 K 8.08 4.47 0.00 1.89 1.90 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.46 7.81 70 T 7.73 4.49 4.24 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 0.00 0.00 0.00 1.18 0.00 0.00 71 P 0.00 4.19 0.00 2.16 2.06 0.00 3.86 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 72 G 8.90 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 0.00 0.00 0.00 73 A 7.41 4.13 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.95 4.47 2.01 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 0.64 0.00 0.00 0.83 0.00 0.00 75 N 8.03 4.94 0.00 2.72 2.63 0.00 0.00 6.77 7.73 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 76 A 8.61 4.05 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 77 C 8.64 4.39 0.00 3.29 3.16 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 78 H 8.06 4.08 0.00 3.32 3.40 0.00 5.51 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.40 4.80 0.00 1.69 1.53 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.52 4.52 0.00 3.83 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 81 C 8.64 3.97 0.00 2.21 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 82 S 7.92 3.96 0.00 3.89 3.85 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 83 A 8.06 4.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.77 4.51 0.00 1.95 1.83 1.04 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.78 5.11 0.00 1.78 1.72 1.13 1.01 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 86 Q 7.90 4.31 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.52 7.07 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 87 D 8.62 4.43 0.00 2.63 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 88 N 8.09 4.56 0.00 2.70 2.75 0.00 0.00 6.90 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 89 I 8.39 4.36 1.79 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.01 1.00 0.00 0.00 90 A 8.46 3.93 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 91 D 8.09 4.27 0.00 2.72 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 92 A 7.98 4.08 1.40 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 0.00 0.00 0.00 93 V 8.34 3.39 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 0.80 0.00 0.00 0.86 0.00 0.00 94 A 8.20 3.81 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 95 C 8.48 4.19 0.00 3.11 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 96 A 8.30 3.93 0.80 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 0.00 0.00 97 K 7.82 3.86 0.00 1.54 1.26 0.00 1.24 0.00 0.00 0.69 0.00 0.00 2.34 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.94 7.81 98 R 7.84 4.05 0.00 1.95 2.12 0.00 3.28 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.97 0.00 99 V 7.51 2.29 1.71 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 -0.32 0.00 0.00 -0.75 0.00 0.00 100 V 7.28 3.98 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 1.08 0.00 0.00 1.47 0.00 0.00 101 R 7.68 4.22 0.00 2.06 2.04 0.00 3.24 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.09 0.00 102 D 7.42 4.77 0.00 3.14 2.63 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 0.00 0.00 0.00 0.00 103 P 0.00 4.24 0.00 2.01 2.12 0.00 3.68 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 2.02 2.12 0.00 104 Q 8.20 4.05 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.92 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.85 3.59 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 0.00 0.00 0.00 106 I 7.73 3.78 1.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.73 -0.77 0.00 0.00 107 R 7.25 4.26 0.00 1.99 2.04 0.00 3.24 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.68 0.00 108 A 7.72 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.20 4.75 0.00 3.47 3.24 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 0.00 0.00 0.00 0.00 110 V 8.75 3.75 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 1.09 0.00 0.00 1.01 0.00 0.00 111 A 8.26 4.02 1.50 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 0.00 0.00 112 W 8.30 3.94 0.00 3.39 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.07 3.94 0.00 2.01 1.98 0.00 3.40 0.00 0.00 2.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.86 0.00 114 N 8.11 4.34 0.00 2.66 2.69 0.00 0.00 6.94 7.18 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 0.00 115 R 7.73 4.00 0.00 1.20 0.66 0.00 2.21 0.00 0.00 2.36 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.04 0.00 116 C 7.08 4.50 0.00 1.68 2.63 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 0.00 0.00 0.00 0.00 117 Q 6.73 3.24 0.00 0.93 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.18 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 118 N 8.63 4.17 0.00 2.79 2.82 0.00 0.00 6.90 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 0.00 119 R 7.32 4.45 0.00 1.87 1.81 0.00 3.13 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 120 D 8.44 4.56 0.00 2.62 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 0.00 121 V 8.22 4.63 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.04 0.00 0.00 122 R 8.33 4.08 0.00 2.01 2.01 0.00 3.16 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 123 Q 8.14 4.00 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.89 0.00 0.00 0.00 0.00 0.00 1.95 1.63 0.00 124 Y 7.64 4.12 0.00 3.12 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 0.00 125 V 7.74 4.32 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 0.99 0.00 0.00 1.05 0.00 0.00 126 Q 7.65 4.12 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.65 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 127 G 8.95 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 0.00 128 C 8.05 4.42 0.00 3.03 3.14 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 0.00 0.00 0.00 129 G 8.12 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 0.00 130 V 7.88 4.00 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 0.80 0.00 0.00 0.96 0.00 0.00