NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4410 8.3349 115.4131 57.7930 64.3599 173.1476 2 L 4.1461 8.3555 123.0029 52.8786 42.2987 176.1821 3 S 4.6666 9.2917 119.6486 57.0062 67.2528 174.7403 4 D 4.3258 8.4655 120.8585 57.3806 40.5287 178.9882 5 K 3.9300 7.9798 119.6248 59.6165 32.2938 178.4872 6 D 4.4543 7.6612 120.0561 56.7647 40.7443 178.8720 7 K 3.9176 8.3175 118.9724 59.4664 31.9664 179.3018 8 A 4.0139 8.0706 120.7221 54.7702 18.1835 179.6062 9 A 3.9075 7.7911 119.3021 55.2311 18.4616 180.1049 10 V 3.4428 7.8343 116.7824 66.0861 31.5964 178.4927 11 R 3.9213 8.0510 117.6369 59.1014 29.6727 178.8604 12 A 3.9627 8.0258 119.6918 55.0675 18.6491 179.1480 13 L 3.9914 8.1451 119.0195 58.1765 42.1731 178.9331 14 W 4.0768 8.7737 128.8234 60.3383 30.3618 177.5318 15 S 4.1403 8.0592 112.4342 59.9166 62.5792 175.5206 16 K 4.1603 7.8238 122.1875 57.6801 32.9981 177.6920 17 I 3.6878 6.8861 111.1547 61.0031 38.3218 177.5318 18 G 2.4656 7.1845 108.9595 47.4984 0.0000 175.6428 19 K 3.9850 7.6679 119.2581 59.1155 32.7020 178.1869 20 S 4.6581 7.8342 114.9149 58.1920 63.0154 175.4433 21 A 4.0178 7.7154 127.1002 55.7006 18.0102 180.2960 22 D 4.2996 8.1381 116.2244 57.6028 41.0134 178.7746 23 A 4.0180 7.9776 120.6330 55.2096 18.3116 179.6213 24 I 3.8164 7.9296 118.4853 64.3536 37.2004 178.8713 25 G 3.6335 8.3281 106.7115 47.7593 0.0000 175.0437 26 N 4.2549 8.2138 119.8797 56.5599 38.9926 176.3871 27 D 4.3263 8.2107 119.0265 57.1206 41.1958 178.0352 28 A 4.0041 8.3188 121.5376 55.3281 18.4690 179.6275 29 L 3.9529 7.9791 117.4619 57.9468 41.4746 180.0830 30 S 4.1225 7.9876 114.6694 61.5765 62.8275 176.8549 31 R 3.9254 8.1271 120.7032 59.5057 29.7956 178.5067 32 M 4.3116 8.3328 118.1413 59.2478 31.9651 178.4160 33 I 3.9144 7.6208 119.6175 63.6074 37.2723 178.4690 34 V 3.7581 7.6272 118.4607 66.0806 31.6141 178.1225 35 V 3.7094 8.2048 116.6290 64.1778 32.6979 175.4924 36 Y 4.7198 8.0281 116.6400 54.0699 38.1373 173.7192 37 P 4.2632 0.0000 0.0000 65.6954 31.6137 177.2184 38 Q 4.1978 8.1772 114.3420 58.3700 28.2597 177.6107 39 T 4.5079 8.3960 112.1051 63.5247 69.2649 176.8065 40 K 4.1075 8.1330 122.1636 59.9455 31.8526 178.5764 41 T 3.6391 7.8482 111.6985 65.5439 67.0239 174.8993 42 Y 3.9974 7.1025 117.0178 59.2687 38.0404 176.2887 43 F 4.0709 7.6752 118.1850 56.7508 39.4774 177.1794 44 S 4.3214 7.8277 116.1924 60.4166 62.9086 174.8084 45 H 4.4275 7.8526 115.8978 57.1072 28.8774 175.6001 46 W 4.6489 7.4222 121.1242 55.4052 29.6408 174.8211 47 P 4.3839 0.0000 0.0000 64.8141 31.1364 176.0496 48 D 4.8305 8.0723 117.5850 52.3472 43.5835 175.7620 49 V 4.6772 8.4220 126.8537 61.6341 31.6353 174.0442 50 T 4.8058 7.5279 109.1145 59.0523 72.4171 174.4243 51 P 4.3501 0.0000 0.0000 66.0182 31.6344 178.1046 52 G 3.6428 8.5325 105.6364 48.9160 0.0000 174.3326 53 S 3.8479 7.9620 113.3027 55.1733 63.9449 173.2407 54 P 4.2210 0.0000 0.0000 65.7453 31.1592 178.5300 55 H 3.6307 7.6829 116.1881 58.4833 28.4793 177.7378 56 I 3.6099 7.3291 121.0732 64.1591 36.8618 178.2577 57 K 4.0475 8.0294 119.1877 58.7515 31.9927 178.8824 58 A 4.0623 7.9935 121.1031 55.5929 18.3937 179.3054 59 H 4.3380 8.4578 117.0455 59.0505 29.9904 177.5136 60 G 3.7352 8.6026 108.3484 47.7725 0.0000 175.8330 61 K 4.0655 7.8343 120.5287 59.1947 31.8649 179.6089 62 K 4.0129 7.9428 117.2215 59.3575 32.2634 179.1217 63 V 3.7655 7.7954 118.3985 66.4090 31.5757 178.0150 64 M 4.3545 8.0937 117.3240 57.6216 31.7521 178.7146 65 G 3.8238 8.0726 106.0244 47.1517 0.0000 176.2553 66 G 3.6178 8.2285 108.4196 47.6728 0.0000 175.9893 67 I 3.6024 7.6149 121.5105 64.1074 37.3525 178.0897 68 A 3.4423 7.9464 121.5659 54.8155 18.1355 179.4191 69 L 3.8099 7.9122 118.4512 58.3353 42.2209 178.9286 70 A 3.9672 8.0794 120.8464 55.3231 18.0270 179.6944 71 V 3.3633 7.9831 116.2091 66.0633 31.5822 178.1187 72 S 4.3321 7.7286 112.1742 59.8854 63.1818 174.8837 73 K 4.5595 7.6207 122.1336 55.9608 32.2923 177.9308 74 I 3.7971 7.1743 120.8604 63.6735 37.9253 176.6793 75 D 4.5575 7.9940 118.4904 56.6735 41.2478 176.4816 76 D 4.6921 8.0006 118.4329 52.1386 42.7452 175.2512 77 L 3.9341 8.2311 124.6038 56.8588 41.7704 177.9901 78 K 3.7529 8.0413 118.2046 60.2376 31.7530 178.3313 79 T 4.1223 9.1735 116.3817 66.5837 68.1934 177.2143 80 G 3.7082 8.1791 106.5240 46.6811 0.0000 174.1777 81 L 4.6049 7.9094 119.2436 54.4999 42.6569 177.5596 82 M 3.9256 7.8078 119.9659 59.2146 31.8938 178.2999 83 E 3.9700 8.1060 117.7488 59.4188 29.7159 179.2326 84 L 4.0107 7.8730 118.5361 57.4957 41.5655 179.4543 85 S 3.9976 8.0047 113.3127 61.3456 62.3614 175.5365 86 E 3.6338 8.1676 122.0869 59.3072 29.2986 178.5777 87 Q 3.9022 8.2311 119.4581 59.7465 29.1280 178.1474 88 H 4.1644 8.3038 116.9004 58.4470 28.4261 177.8671 89 A 3.0227 7.8772 122.8719 54.8532 17.8924 178.8409 90 Y 4.5020 7.3340 112.9230 59.0607 38.8060 177.2406 91 K 4.2049 7.8738 119.4974 58.4562 32.8433 177.3256 92 L 4.2111 7.8888 116.1128 54.4770 42.6670 176.6787 93 R 3.9783 7.7983 116.0607 55.7541 27.4572 176.6267 94 V 3.3867 8.0628 116.6717 61.6103 32.6392 175.0397 95 D 4.4114 8.4332 127.5671 53.6309 41.5739 175.3953 96 P 3.5418 0.0000 0.0000 65.1988 30.9236 178.3501 97 A 3.8951 7.9239 119.9849 54.6466 18.4882 178.5645 98 N 4.3043 7.4307 114.3929 54.8709 38.6773 177.3290 99 F 4.2894 7.1320 120.5378 60.4488 39.0256 177.5874 100 K 4.0491 8.0101 117.8988 59.7937 32.3976 179.1888 101 I 3.3768 7.4868 120.5130 64.1227 37.0344 177.8912 102 L 3.9811 7.7618 121.0636 58.1977 41.8807 178.7031 103 N 4.3376 8.1736 116.4930 56.6481 38.5246 176.8261 104 H 4.2562 8.3706 119.5570 59.5176 29.9329 177.1458 105 C 4.2059 8.1279 118.6353 62.7545 27.9355 176.1331 106 I 3.7768 8.0212 121.6402 64.3249 36.6738 178.4501 107 L 3.8291 8.0212 119.8716 57.5649 41.4284 179.7801 108 V 3.4901 7.7712 118.1489 65.8681 31.5191 178.0592 109 V 3.5290 8.0892 118.3096 66.3580 31.3096 177.9215 110 I 3.8002 8.0954 119.6560 64.6012 36.6093 178.3967 111 S 4.1142 7.5549 113.4340 61.3068 62.2673 175.9617 112 T 4.0492 7.7729 112.0495 64.7967 68.6970 176.2725 113 M 3.9822 7.8886 120.5511 56.2847 33.7399 176.7199 114 F 4.9436 8.3144 116.7068 54.9900 39.4921 173.7877 115 P 4.3894 0.0000 0.0000 65.6432 31.8925 178.7414 116 K 4.1676 8.1471 119.1094 59.2181 32.4532 177.6477 117 E 4.1701 8.3200 117.1451 59.2021 30.1115 177.6711 118 F 4.6495 8.1870 121.8986 57.6823 37.4903 174.7005 119 T 4.2385 7.3605 116.1400 60.2143 71.6014 173.7152 120 P 4.0698 0.0000 0.0000 66.0409 30.7765 178.4237 121 E 3.9316 8.0913 117.6215 58.9712 29.3693 178.9274 122 A 3.8259 7.6854 120.5557 54.9119 18.5244 179.0306 123 H 3.7147 7.9846 117.3326 59.3116 29.8699 177.8248 124 V 3.6466 7.7085 120.8226 65.0597 30.6055 178.5320 125 S 4.2482 7.6748 115.5964 61.0954 62.5989 176.3803 126 L 4.1660 8.1933 123.1598 58.2115 41.8991 178.4742 127 D 4.3790 8.7874 118.4729 57.4548 41.1779 178.4548 128 K 4.0557 8.3662 119.0582 59.1858 31.9426 179.1917 129 F 4.1568 8.5280 121.2201 61.4983 39.4158 177.3099 130 L 3.6746 8.8668 119.1997 57.7419 41.3050 179.8131 131 S 4.1913 8.2619 115.5161 61.2669 62.7009 176.8014 132 G 3.5177 7.8515 108.6196 47.6642 0.0000 175.9358 133 V 3.2811 7.4753 120.5399 65.4188 31.4963 177.9303 134 A 3.6348 7.8566 120.4771 55.0785 18.0242 179.4973 135 L 3.8262 7.9340 116.2138 57.9021 41.8631 179.3528 136 A 4.0467 8.2050 120.9350 55.2467 18.1042 179.7667 137 L 3.7331 7.7376 116.3549 57.4371 41.8279 179.0285 138 A 4.2555 7.8883 119.7336 53.2846 18.2059 178.7221 139 E 3.8888 7.5232 118.1371 59.3256 29.7004 177.9798 140 R 4.4172 7.6229 113.8846 56.3992 30.3524 177.1517 141 Y 3.9229 8.1240 118.1775 60.7326 38.1232 176.2710 142 R 4.2630 7.8239 119.7502 56.6589 29.0642 174.4747 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 S 8.33 4.44 0.00 3.99 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 2 L 8.36 4.15 0.00 1.78 1.68 1.11 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.29 4.67 0.00 4.06 4.01 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 4 D 8.47 4.33 0.00 2.74 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 5 K 7.98 3.93 0.00 1.81 1.80 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.53 7.81 6 D 7.66 4.45 0.00 3.03 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 7 K 8.32 3.92 0.00 1.92 1.83 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.60 7.81 8 A 8.07 4.01 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 9 A 7.79 3.91 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 10 V 7.83 3.44 1.95 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 0.07 0.00 0.00 0.83 0.00 0.00 11 R 8.05 3.92 0.00 1.88 1.97 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 12 A 8.03 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 13 L 8.15 3.99 0.00 1.86 1.85 0.92 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.77 4.08 0.00 3.41 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 15 S 8.06 4.14 0.00 4.05 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 16 K 7.82 4.16 0.00 1.69 1.61 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.34 1.35 7.81 17 I 6.89 3.69 1.24 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 1.36 -0.08 -0.36 0.00 0.00 18 G 7.18 2.47 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 0.00 0.00 0.00 19 K 7.67 3.99 0.00 1.87 1.87 0.00 1.55 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.53 7.81 20 S 7.83 4.66 0.00 4.08 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 21 A 7.72 4.02 1.44 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 22 D 8.14 4.30 0.00 2.74 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 23 A 7.98 4.02 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 24 I 7.93 3.82 2.09 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.87 0.99 0.00 0.00 25 G 8.33 3.63 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 0.00 0.00 0.00 26 N 8.21 4.25 0.00 2.85 2.98 0.00 0.00 6.91 8.02 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 27 D 8.21 4.33 0.00 2.80 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 28 A 8.32 4.00 1.43 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 29 L 7.98 3.95 0.00 1.72 1.67 1.01 0.94 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 30 S 7.99 4.12 0.00 4.07 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 31 R 8.13 3.93 0.00 2.07 2.04 0.00 3.16 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.98 0.00 32 M 8.33 4.31 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.76 0.00 33 I 7.62 3.91 2.03 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.27 0.98 0.00 0.00 34 V 7.63 3.76 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 0.97 0.00 0.00 35 V 8.20 3.71 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 0.16 0.00 0.00 0.89 0.00 0.00 36 Y 8.03 4.72 0.00 3.25 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 37 P 0.00 4.26 0.00 2.17 2.16 0.00 3.63 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 2.12 2.19 0.00 38 Q 8.18 4.20 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.01 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 39 T 8.40 4.51 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 1.32 0.00 0.00 40 K 8.13 4.11 0.00 1.86 1.95 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.54 1.53 7.81 41 T 7.85 3.64 4.01 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 0.45 0.00 0.00 42 Y 7.10 4.00 0.00 2.02 2.31 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 43 F 7.68 4.07 0.00 2.82 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 0.00 0.00 0.00 0.00 44 S 7.83 4.32 0.00 3.94 3.93 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 0.00 0.00 0.00 45 H 7.85 4.43 0.00 3.32 3.41 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 W 7.42 4.65 0.00 3.47 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 47 P 0.00 4.38 0.00 2.22 2.23 0.00 3.51 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 48 D 8.07 4.83 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.42 4.68 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 1.07 0.00 0.00 1.19 0.00 0.00 50 T 7.53 4.81 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 1.24 0.00 0.00 51 P 0.00 4.35 0.00 2.07 2.17 0.00 3.74 0.00 0.00 2.34 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 52 G 8.53 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.96 3.85 0.00 4.12 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 54 P 0.00 4.22 0.00 2.11 2.18 0.00 3.69 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.94 0.00 55 H 7.68 3.63 0.00 2.73 1.60 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.33 3.61 1.98 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 1.77 0.63 0.93 0.00 0.00 57 K 8.03 4.05 0.00 1.81 1.81 0.00 1.62 0.00 0.00 1.52 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.46 7.81 58 A 7.99 4.06 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 59 H 8.46 4.34 0.00 3.44 3.49 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.60 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 0.00 0.00 0.00 61 K 7.83 4.07 0.00 1.93 1.89 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.48 0.00 0.00 0.00 0.00 1.63 1.68 7.81 62 K 7.94 4.01 0.00 1.85 1.92 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.49 1.55 7.81 63 V 7.80 3.77 2.10 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 1.16 0.00 0.00 0.97 0.00 0.00 64 M 8.09 4.35 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.93 0.00 65 G 8.07 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 66 G 8.23 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 67 I 7.61 3.60 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.86 0.74 0.00 0.00 68 A 7.95 3.44 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 3.81 0.00 1.85 1.87 0.91 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.08 3.97 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 71 V 7.98 3.36 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 0.56 0.00 0.00 0.06 0.00 0.00 72 S 7.73 4.33 0.00 4.09 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 73 K 7.62 4.56 0.00 1.79 1.80 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.46 7.81 74 I 7.17 3.80 2.07 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.99 0.91 0.00 0.00 75 D 7.99 4.56 0.00 2.71 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 76 D 8.00 4.69 0.00 2.61 2.48 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 77 L 8.23 3.93 0.00 1.66 1.59 0.76 0.80 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 78 K 8.04 3.75 0.00 1.71 1.98 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.54 7.81 79 T 9.17 4.12 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 1.20 0.00 0.00 80 G 8.18 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 0.00 0.00 0.00 81 L 7.91 4.60 0.00 1.57 1.54 0.75 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 82 M 7.81 3.93 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.65 0.00 83 E 8.11 3.97 0.00 2.05 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 2.40 2.40 0.00 84 L 7.87 4.01 0.00 1.80 1.73 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.00 4.00 0.00 3.91 4.01 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 86 E 8.17 3.63 0.00 2.11 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 0.00 2.38 2.49 0.00 87 Q 8.23 3.90 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 88 H 8.30 4.16 0.00 3.47 3.60 0.00 5.86 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.88 3.02 -0.29 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 90 Y 7.33 4.50 0.00 2.92 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 91 K 7.87 4.20 0.00 1.73 2.00 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.45 7.81 92 L 7.89 4.21 0.00 1.60 1.61 0.70 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.80 3.98 0.00 1.95 2.00 0.00 3.28 0.00 0.00 2.25 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.58 0.00 94 V 8.06 3.39 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 0.00 0.00 0.00 0.53 0.00 0.00 95 D 8.43 4.41 0.00 2.82 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 96 P 0.00 3.54 0.00 1.91 0.99 0.00 3.61 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.67 0.00 97 A 7.92 3.90 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 98 N 7.43 4.30 0.00 2.32 2.64 0.00 0.00 6.83 8.03 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 99 F 7.13 4.29 0.00 2.94 2.95 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 0.00 100 K 8.01 4.05 0.00 1.96 2.06 0.00 1.48 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.45 7.81 101 I 7.49 3.38 1.74 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.26 -0.22 0.00 0.00 102 L 7.76 3.98 0.00 1.80 1.84 0.98 0.85 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 0.00 103 N 8.17 4.34 0.00 3.03 2.89 0.00 0.00 6.63 8.22 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 0.00 104 H 8.37 4.26 0.00 3.29 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 C 8.13 4.21 0.00 3.23 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 0.00 106 I 8.02 3.78 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.71 0.96 0.00 0.00 107 L 8.02 3.83 0.00 1.88 1.72 1.09 0.74 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 0.00 108 V 7.77 3.49 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 0.98 0.00 0.00 0.87 0.00 0.00 109 V 8.09 3.53 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 0.99 0.00 0.00 1.01 0.00 0.00 110 I 8.10 3.80 1.35 0.00 0.00 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 1.41 0.64 0.56 0.00 0.00 111 S 7.55 4.11 0.00 3.90 4.02 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 0.00 112 T 7.77 4.05 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 1.23 0.00 0.00 113 M 7.89 3.98 0.00 1.25 1.98 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 114 F 8.31 4.94 0.00 3.08 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 0.00 115 P 0.00 4.39 0.00 2.22 2.23 0.00 3.85 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 2.02 1.96 0.00 116 K 8.15 4.17 0.00 1.79 1.95 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.44 7.81 117 E 8.32 4.17 0.00 2.11 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 2.31 2.39 0.00 118 F 8.19 4.65 0.00 3.08 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 0.00 119 T 7.36 4.24 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 1.21 0.00 0.00 120 P 0.00 4.07 0.00 2.22 2.29 0.00 3.66 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 2.03 2.02 0.00 121 E 8.09 3.93 0.00 2.03 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 0.00 2.38 2.41 0.00 122 A 7.69 3.83 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 0.00 123 H 7.98 3.71 0.00 2.34 3.16 0.00 5.62 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.71 3.65 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 0.82 0.00 0.00 0.92 0.00 0.00 125 S 7.67 4.25 0.00 3.85 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 0.00 126 L 8.19 4.17 0.00 2.03 1.94 1.15 1.28 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 0.00 127 D 8.79 4.38 0.00 3.07 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 0.00 128 K 8.37 4.06 0.00 2.08 1.89 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.66 7.81 129 F 8.53 4.16 0.00 3.13 3.26 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 0.00 130 L 8.87 3.67 0.00 1.72 1.87 1.02 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.26 4.19 0.00 4.00 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 0.00 132 G 7.85 3.52 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 0.00 133 V 7.48 3.28 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 0.81 0.00 0.00 0.26 0.00 0.00 134 A 7.86 3.63 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 0.00 0.00 0.00 0.00 0.00 135 L 7.93 3.83 0.00 1.77 1.67 0.88 0.78 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 0.00 136 A 8.21 4.05 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 0.00 137 L 7.74 3.73 0.00 0.67 0.68 0.37 0.48 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 0.00 138 A 7.89 4.26 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 0.00 139 E 7.52 3.89 0.00 1.94 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 2.44 0.00 140 R 7.62 4.42 0.00 1.58 1.80 0.00 3.40 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 141 Y 8.12 3.92 0.00 3.15 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 0.00 142 R 7.82 4.26 0.00 1.93 1.93 0.00 3.10 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00