NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.6892 8.4449 120.3860 55.8579 30.7302 172.4053 3 L 4.2988 8.0736 127.2804 51.9403 42.8653 175.9261 4 T 4.1222 9.3510 115.2310 60.6363 71.8813 173.7773 5 P 4.1861 0.0000 0.0000 65.8390 31.3193 178.7635 6 E 3.9698 8.1273 116.8162 59.4123 29.3125 179.1719 7 E 3.9020 8.0029 118.0231 59.3644 29.5711 179.4077 8 K 3.8025 8.2181 118.7944 59.7167 32.1105 179.5953 9 S 4.1282 8.1534 115.0882 61.4045 62.7387 176.5868 10 A 4.0192 8.1267 123.6035 54.9866 18.1197 179.8657 11 V 3.3948 7.9205 116.8899 66.4611 31.6042 178.3579 12 T 3.9521 7.9309 115.1971 66.6205 68.0713 176.5072 13 A 4.0118 7.9126 121.3959 55.1188 18.7102 179.1576 14 L 3.8829 8.0255 118.8997 58.0375 42.2308 179.0094 15 W 4.3057 8.8130 128.4249 60.2213 30.3926 177.9772 16 G 3.8468 8.1350 105.1597 47.0835 0.0000 174.6421 17 K 4.5304 7.8256 117.9059 55.1326 32.7713 176.3775 18 V 3.6891 6.9516 120.7652 61.7344 31.9145 175.5805 19 N 4.4340 8.3556 125.9181 52.8509 39.0716 175.3679 20 V 3.4547 8.1013 128.7232 65.8381 31.8031 177.2538 21 D 4.3554 8.0739 118.2011 57.5431 40.7472 178.6285 22 E 3.8638 8.5627 118.9635 59.4936 29.4511 179.6969 23 V 3.6084 8.0791 118.8017 65.5965 31.4594 178.3561 24 G 3.6671 8.4209 106.1293 47.7951 0.0000 175.9838 25 G 3.5882 7.9948 108.6697 47.2389 0.0000 175.4593 26 E 3.8616 8.2069 121.4299 58.9453 29.6348 178.8215 27 A 3.9170 8.2809 121.2398 55.0732 18.4762 179.3851 28 L 3.9622 8.1228 119.1192 58.0610 42.1427 179.2384 29 G 3.6136 8.1716 105.7443 48.1434 0.0000 175.8748 30 R 3.9141 8.2436 121.3799 58.4071 30.0089 178.8650 31 L 4.0776 8.1274 120.3923 58.4330 42.1143 179.2498 32 L 4.1061 7.8748 119.9297 56.7568 41.2141 179.7723 33 V 3.5261 7.4275 117.8306 65.9104 31.6924 178.0000 34 V 3.5866 7.7080 116.8461 64.2134 32.7367 175.5236 35 Y 3.7931 7.3057 116.0152 54.0644 38.0156 174.0246 36 P 4.6924 0.0000 0.0000 64.1661 31.7994 177.7077 37 W 4.3819 8.2069 115.4686 59.3268 28.1210 177.8365 38 T 4.1889 7.6111 110.4418 63.9248 68.0943 175.9942 39 Q 4.4131 8.1951 121.5135 58.0378 28.4473 178.0681 40 R 3.7108 7.5900 117.0855 58.9184 29.1999 177.8468 41 F 4.3195 6.8672 114.7121 57.3494 39.4790 175.5843 42 F 4.5961 7.9825 118.6205 56.8582 39.8900 176.9921 43 E 4.0571 8.4238 122.2276 59.0996 29.4230 178.3661 44 S 4.5474 8.0115 111.0717 59.1269 63.6182 174.7697 45 F 4.5344 8.3538 119.8185 58.6616 39.5967 176.2119 46 G 3.8991 8.2006 106.0301 44.1271 0.0000 172.1799 47 D 4.5741 8.5324 121.7670 54.1407 41.5495 176.9617 48 L 4.8316 8.4480 127.4845 54.6352 42.4937 177.4395 49 S 4.4916 8.1151 113.9230 59.3939 63.8400 174.4450 50 T 4.7196 7.3918 111.3447 58.4489 72.9251 172.4163 51 P 4.1935 0.0000 0.0000 66.2880 31.4243 178.7075 52 D 4.2999 8.0756 116.5869 57.1091 40.5458 178.5073 53 A 3.9676 7.4690 120.1501 55.1073 18.6364 179.4748 54 V 3.6954 7.8884 116.7260 66.6762 31.4251 178.2305 55 M 4.1785 8.1452 117.1852 57.8930 31.8951 178.2184 56 G 3.9341 7.9387 103.2110 43.9639 0.0000 173.3573 57 N 4.3814 7.5742 121.5505 52.7555 39.3996 173.7394 58 P 4.2333 0.0000 0.0000 66.0080 31.1754 178.6777 59 K 3.5715 8.1804 118.2620 58.7520 31.6838 179.5112 60 V 3.6500 7.6995 118.1330 65.9313 31.5680 178.0737 61 K 3.9052 8.0620 117.9517 59.4073 31.9993 179.2329 62 A 3.9738 8.1372 121.2477 55.4624 18.2375 179.2384 63 H 4.3844 8.5862 117.1476 59.1936 29.9000 177.6215 64 G 3.6375 8.4699 108.0855 47.6576 0.0000 175.4195 65 K 3.9148 8.1637 122.0305 59.0944 32.2036 178.8037 66 K 3.9619 7.9787 119.5190 59.4800 32.2225 178.8905 67 V 3.5987 8.0190 118.8622 66.1411 31.5474 177.7375 68 L 4.3885 8.3710 119.7405 57.3467 41.9048 179.0371 69 G 3.7121 8.3362 106.0453 47.9122 0.0000 175.5980 70 A 4.1374 8.1604 123.6809 54.6547 18.1870 179.3745 71 F 4.1088 8.3279 118.2690 61.6016 39.8866 176.9175 72 S 4.2362 9.0012 113.0593 61.7042 62.2274 175.8216 73 D 4.5161 8.4786 121.6535 57.4049 40.4819 179.1093 74 G 3.5875 8.0814 105.7974 47.4076 0.0000 175.5531 75 L 3.8381 7.2580 119.5833 56.7311 41.5876 178.3075 76 A 4.2051 7.3991 118.7033 52.8152 19.5912 176.6945 77 H 4.8823 8.3006 115.3825 54.7647 29.7330 175.3701 78 L 3.9230 7.8770 119.4345 57.3819 42.0029 178.3548 79 D 4.7170 7.9099 116.2116 54.2471 41.7382 176.3564 80 N 5.0142 8.0740 118.3032 51.5189 39.4287 175.5602 81 L 4.1304 7.8385 121.3593 57.6750 42.0070 179.4474 82 K 4.0816 8.0237 117.5882 59.4888 32.2707 179.0567 83 G 3.7083 8.3702 105.8399 48.1201 0.0000 175.7556 84 T 3.6432 7.6095 117.1885 65.6063 68.6866 175.7679 85 F 4.7028 7.9600 116.7452 57.0856 39.3566 177.4608 86 A 4.0755 7.7137 123.3710 55.6586 18.1933 180.4274 87 T 3.8564 7.8319 113.6737 66.8618 68.5403 176.8758 88 L 4.1544 7.9610 120.4111 57.5115 41.6931 179.3076 89 S 4.4134 8.6205 115.0859 60.9904 62.4194 175.7412 90 E 3.8654 8.2789 121.9250 59.1536 29.3022 178.5673 91 L 3.8973 7.9913 120.2339 58.6528 42.2317 178.7931 92 H 4.1973 8.6391 116.4148 58.7943 28.7288 177.3785 93 C 3.4891 7.7975 120.6572 62.4125 31.1361 175.3708 94 D 4.3881 8.2383 119.9739 56.2167 40.5894 177.2945 95 K 4.2089 7.8690 118.8699 57.4653 33.2289 177.0024 96 L 4.2425 7.6856 115.9980 54.5336 42.7608 175.8199 97 H 4.1370 7.1286 113.9206 56.7287 26.5840 175.3261 98 V 4.0446 7.8515 117.9264 60.6968 32.7388 174.7154 99 D 4.3515 8.8364 127.2185 53.9408 41.6006 175.2381 100 P 3.1833 0.0000 0.0000 64.4954 31.8131 177.8043 101 E 3.8508 8.2979 119.2667 59.4887 29.1802 178.3952 102 N 4.2018 7.9143 116.2977 56.4487 38.5376 177.3033 103 F 4.4353 7.3737 118.9999 60.4708 38.9286 178.0650 104 R 3.9478 7.9014 117.3290 59.1707 30.0504 178.6691 105 L 3.7416 7.8990 118.8437 57.8179 41.5288 179.4130 106 L 4.0754 8.2046 120.3722 58.0276 41.9840 179.1793 107 G 3.6663 8.1720 105.6929 48.0801 0.0000 175.4848 108 N 4.5018 8.2362 119.0546 55.6917 38.4378 177.7892 109 V 3.6335 7.9852 119.9460 65.8826 31.5759 177.7128 110 L 3.8531 8.2454 120.4796 58.1789 41.8603 179.1292 111 V 3.5544 7.8066 118.0443 66.2487 31.4279 177.7634 112 C 4.0965 8.1460 116.4292 62.8219 27.9302 176.3680 113 V 3.5196 7.9204 120.0647 65.8695 31.0247 178.0877 114 L 3.9101 8.0526 118.9721 57.6133 41.3153 179.3819 115 A 3.7309 7.3740 120.6495 55.2678 18.0823 179.2074 116 H 4.1188 8.0624 115.9069 59.6082 30.0073 176.6955 117 H 4.0219 8.0114 119.0287 58.5776 29.5072 176.4932 118 F 4.5668 8.4689 118.5900 56.3669 39.7711 177.2022 119 G 3.9262 8.8562 107.6344 46.0034 0.0000 176.7726 120 K 3.9372 9.0448 124.0603 59.1447 32.0061 177.3037 121 E 4.0722 7.8557 117.9411 58.8553 30.0244 177.2291 122 F 4.4905 8.1025 122.7297 57.1145 37.7446 174.9614 123 T 4.1873 7.3201 115.7413 60.2965 71.3872 173.5503 124 P 4.1675 0.0000 0.0000 65.5028 31.3226 177.2325 125 P 4.2347 0.0000 0.0000 65.3982 31.2358 178.8884 126 V 3.5318 7.4678 117.0754 65.7676 31.4248 177.7467 127 Q 3.5770 7.7918 119.4592 59.1272 28.9086 178.2802 128 A 4.0348 8.0136 121.3869 55.0069 18.3813 179.3980 129 A 3.8548 7.9965 119.2022 55.7416 18.4300 179.6084 130 Y 3.9797 8.2772 115.1227 61.0910 37.8846 178.7088 131 Q 4.1213 8.8396 119.6654 58.9144 28.8256 178.9144 132 K 3.9486 8.0268 119.3778 59.3573 31.9919 179.4970 133 V 3.4729 7.6724 118.3377 66.2838 31.5126 178.6436 134 V 3.8262 8.3513 112.1706 64.2254 31.2537 178.5386 135 A 4.1342 8.2548 121.0576 54.9792 18.1705 179.9356 136 G 3.4819 8.1491 104.3752 47.8167 0.0000 176.1951 137 V 3.2366 8.0299 120.7993 65.4779 31.5311 177.9127 138 A 3.9095 8.0174 120.5018 55.3786 18.0236 179.3950 139 N 4.3073 8.2771 113.8460 56.2969 38.9855 177.2659 140 A 4.1641 8.1269 122.2899 55.2435 18.0471 179.7725 141 L 3.8765 8.0696 117.4514 57.3110 41.6228 179.0097 142 A 4.1535 7.9836 119.9303 53.9072 18.5260 178.8285 143 H 4.2965 7.9813 116.0754 58.6116 29.9937 175.8800 144 K 4.4194 8.1527 117.8360 56.3144 32.2715 176.5328 145 Y 4.1527 7.9930 117.6842 58.5626 38.4098 175.8457 146 H 4.4316 8.3789 117.4219 56.2424 28.1673 173.3780 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 2 H 8.44 4.69 0.00 3.10 3.29 0.00 5.69 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.07 4.30 0.00 1.59 1.44 0.81 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.35 4.12 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 1.24 0.00 0.00 5 P 0.00 4.19 0.00 2.16 2.12 0.00 3.59 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 2.10 2.17 0.00 6 E 8.13 3.97 0.00 1.98 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 2.39 2.39 0.00 7 E 8.00 3.90 0.00 2.21 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 2.27 2.30 0.00 8 K 8.22 3.80 0.00 1.86 1.80 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.52 7.81 9 S 8.15 4.13 0.00 4.00 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 10 A 8.13 4.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.92 3.39 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 0.63 0.00 0.00 0.39 0.00 0.00 12 T 7.93 3.95 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 1.25 0.00 0.00 13 A 7.91 4.01 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 14 L 8.03 3.88 0.00 1.85 1.95 -0.09 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.81 4.31 0.00 3.84 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 16 G 8.13 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 0.00 0.00 0.00 17 K 7.83 4.53 0.00 2.03 2.10 0.00 1.72 0.00 0.00 1.58 0.00 0.00 3.31 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.45 7.81 18 V 6.95 3.69 1.06 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 -0.12 0.00 0.00 0.72 0.00 0.00 19 N 8.36 4.43 0.00 2.70 2.57 0.00 0.00 6.83 7.71 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 20 V 8.10 3.45 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 1.32 0.00 0.00 0.93 0.00 0.00 21 D 8.07 4.36 0.00 2.86 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 22 E 8.56 3.86 0.00 2.00 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 0.00 2.26 2.39 0.00 23 V 8.08 3.61 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 0.97 0.00 0.00 0.72 0.00 0.00 24 G 8.42 3.67 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 0.00 0.00 0.00 25 G 7.99 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 26 E 8.21 3.86 0.00 2.13 2.04 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 2.24 2.31 0.00 27 A 8.28 3.92 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 28 L 8.12 3.96 0.00 1.76 1.64 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.17 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 30 R 8.24 3.91 0.00 1.89 1.95 0.00 3.09 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 31 L 8.13 4.08 0.00 1.88 1.89 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.87 4.11 0.00 1.84 1.68 1.05 0.71 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 33 V 7.43 3.53 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 0.72 0.00 0.00 0.93 0.00 0.00 34 V 7.71 3.59 1.56 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 -0.00 0.00 0.00 0.80 0.00 0.00 35 Y 7.31 3.79 0.00 2.45 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 36 P 0.00 4.69 0.00 2.26 2.12 0.00 3.91 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.98 0.00 37 W 8.21 4.38 0.00 3.55 3.47 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 38 T 7.61 4.19 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 1.02 0.00 0.00 39 Q 8.20 4.41 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 40 R 7.59 3.71 0.00 1.65 1.97 0.00 2.98 0.00 0.00 2.67 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.50 0.00 41 F 6.87 4.32 0.00 1.63 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 7.98 4.60 0.00 2.73 1.74 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 43 E 8.42 4.06 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 2.40 2.21 0.00 44 S 8.01 4.55 0.00 4.11 4.08 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 45 F 8.35 4.53 0.00 3.18 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 46 G 8.20 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 0.00 0.00 0.00 47 D 8.53 4.57 0.00 2.66 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 48 L 8.45 4.83 0.00 1.79 1.64 1.01 1.05 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 49 S 8.12 4.49 0.00 3.96 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 50 T 7.39 4.72 4.23 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.13 0.00 3.58 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 2.09 2.17 0.00 52 D 8.08 4.30 0.00 2.70 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.47 3.97 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 54 V 7.89 3.70 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 0.98 0.00 0.00 55 M 8.15 4.18 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.91 0.00 56 G 7.94 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 0.00 0.00 0.00 57 N 7.57 4.38 0.00 2.94 2.84 0.00 0.00 6.83 9.06 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 58 P 0.00 4.23 0.00 2.21 2.24 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 59 K 8.18 3.57 0.00 1.21 0.74 0.00 1.64 0.00 0.00 1.21 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.09 1.17 7.81 60 V 7.70 3.65 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 1.13 0.00 0.00 1.05 0.00 0.00 61 K 8.06 3.91 0.00 1.95 1.80 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.54 7.81 62 A 8.14 3.97 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 63 H 8.59 4.38 0.00 3.55 3.46 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 64 G 8.47 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 65 K 8.16 3.91 0.00 1.85 2.10 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.47 1.67 7.81 66 K 7.98 3.96 0.00 1.96 1.97 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 8.02 3.60 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 0.90 0.00 0.00 68 L 8.37 4.39 0.00 1.94 1.76 0.73 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.34 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 70 A 8.16 4.14 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.33 4.11 0.00 3.09 3.39 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 72 S 9.00 4.24 0.00 4.63 4.32 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 73 D 8.48 4.52 0.00 2.87 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 74 G 8.08 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 75 L 7.26 3.84 0.00 1.45 1.39 -0.66 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.40 4.21 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 77 H 8.30 4.88 0.00 2.99 3.12 0.00 5.63 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 78 L 7.88 3.92 0.00 1.54 1.64 0.76 0.91 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 79 D 7.91 4.72 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 80 N 8.07 5.01 0.00 2.71 2.60 0.00 0.00 7.20 6.18 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 81 L 7.84 4.13 0.00 1.76 1.85 0.89 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.02 4.08 0.00 1.68 1.82 0.00 1.65 0.00 0.00 1.39 0.00 0.00 2.93 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.46 7.81 83 G 8.37 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 84 T 7.61 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 0.39 0.00 0.00 85 F 7.96 4.70 0.00 3.16 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 86 A 7.71 4.08 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 87 T 7.83 3.86 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 1.22 0.00 0.00 88 L 7.96 4.15 0.00 2.00 1.86 1.14 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.62 4.41 0.00 4.15 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 90 E 8.28 3.87 0.00 2.09 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 2.29 2.39 0.00 91 L 7.99 3.90 0.00 1.91 1.86 0.91 1.08 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 92 H 8.64 4.20 0.00 3.61 3.79 0.00 5.86 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 93 C 7.80 3.49 0.00 1.23 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 94 D 8.24 4.39 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 95 K 7.87 4.21 0.00 1.66 1.86 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.36 7.81 96 L 7.69 4.24 0.00 1.75 1.61 0.68 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.13 4.14 0.00 3.49 3.40 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.85 4.04 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 0.12 0.00 0.00 0.33 0.00 0.00 99 D 8.84 4.35 0.00 2.79 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.18 0.00 1.94 1.90 0.00 3.38 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 1.31 0.52 0.00 101 E 8.30 3.85 0.00 2.03 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 2.33 2.40 0.00 102 N 7.91 4.20 0.00 2.41 2.71 0.00 0.00 6.97 7.59 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 0.00 103 F 7.37 4.44 0.00 3.10 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 0.00 104 R 7.90 3.95 0.00 1.96 1.97 0.00 3.29 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.89 0.00 105 L 7.90 3.74 0.00 1.59 1.14 0.74 -0.18 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 0.00 106 L 8.20 4.08 0.00 1.87 1.86 0.92 1.23 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 0.00 107 G 8.17 3.67 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 0.00 0.00 0.00 108 N 8.24 4.50 0.00 2.88 2.95 0.00 0.00 6.69 7.72 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 0.00 109 V 7.99 3.63 2.24 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 1.13 0.00 0.00 1.16 0.00 0.00 110 L 8.25 3.85 0.00 1.73 1.80 0.89 0.33 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 0.00 111 V 7.81 3.55 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 1.29 0.00 0.00 1.18 0.00 0.00 112 C 8.15 4.10 0.00 3.20 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 0.00 113 V 7.92 3.52 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 0.93 0.00 0.00 0.88 0.00 0.00 114 L 8.05 3.91 0.00 0.93 1.11 0.58 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.37 3.73 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 0.00 116 H 8.06 4.12 0.00 3.16 3.43 0.00 5.77 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 0.00 117 H 8.01 4.02 0.00 2.89 2.76 0.00 5.99 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.47 4.57 0.00 3.29 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 G 8.86 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 0.00 0.00 0.00 120 K 9.04 3.94 0.00 1.77 1.92 0.00 1.81 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 121 E 7.86 4.07 0.00 2.11 2.23 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 2.34 2.29 0.00 122 F 8.10 4.49 0.00 3.10 3.17 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 0.00 0.00 0.00 0.00 123 T 7.32 4.19 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 1.31 0.00 0.00 124 P 0.00 4.17 0.00 2.15 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.23 0.00 2.11 2.06 0.00 3.49 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 2.08 2.11 0.00 126 V 7.47 3.53 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 0.95 0.00 0.00 0.89 0.00 0.00 127 Q 7.79 3.58 0.00 1.75 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 128 A 8.01 4.03 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.00 3.85 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 0.00 130 Y 8.28 3.98 0.00 3.34 3.29 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 0.00 131 Q 8.84 4.12 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 132 K 8.03 3.95 0.00 1.95 1.82 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.63 7.81 133 V 7.67 3.47 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 0.95 0.00 0.00 0.69 0.00 0.00 134 V 8.35 3.83 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 1.09 0.00 0.00 1.15 0.00 0.00 135 A 8.25 4.13 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 0.00 136 G 8.15 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 0.00 0.00 0.00 137 V 8.03 3.24 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 0.48 0.00 0.00 0.54 0.00 0.00 138 A 8.02 3.91 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.28 4.31 0.00 2.85 2.90 0.00 0.00 7.06 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 0.00 140 A 8.13 4.16 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 8.07 3.88 0.00 1.13 0.57 -0.08 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.98 4.15 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 0.00 143 H 7.98 4.30 0.00 3.42 3.52 0.00 5.75 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.15 4.42 0.00 1.86 1.85 0.00 1.84 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.74 7.81 145 Y 7.99 4.15 0.00 3.14 2.98 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 0.00 0.00 0.00 146 H 8.38 4.43 0.00 3.21 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00