NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2956 8.2649 123.5793 51.9971 19.7389 179.4625 2 I 4.4602 8.5543 120.8276 59.0250 40.0998 172.5040 3 S 4.9174 9.1886 119.7653 56.8394 67.1991 172.7628 4 C 4.7545 8.5308 118.4447 55.2027 41.9431 174.8841 5 G 3.8699 8.4484 111.4983 44.5339 0.0000 172.8532 6 S 4.1717 8.7365 115.2473 58.2563 63.0048 173.2486 7 P 3.9259 0.0000 0.0000 61.4024 31.6816 174.3499 8 P 4.3027 0.0000 0.0000 61.8520 31.7417 175.0148 9 P 4.5182 0.0000 0.0000 62.3948 31.9312 175.4164 10 I 4.4391 7.9156 117.9411 58.6914 40.1841 174.2192 11 L 4.0826 8.5147 130.1827 56.1880 42.7692 175.8643 12 N 3.9855 8.9537 121.7461 53.6911 35.8962 173.8190 13 G 4.4416 7.4404 105.8348 44.8956 0.0000 172.2285 14 R 4.6695 8.6575 114.4311 54.9865 33.4292 173.8506 15 I 4.6178 7.8804 120.0635 58.8420 39.3219 176.0332 16 S 4.2052 8.8014 122.1372 58.5213 63.3323 173.8454 17 Y 3.7740 8.8238 123.8083 58.3606 38.9193 175.0362 18 Y 4.8675 6.5081 123.3980 55.0297 41.2726 174.8410 19 S 4.5640 8.5647 115.8475 57.3807 64.8792 173.2893 20 T 4.6231 8.1000 111.2394 59.1168 70.4503 172.3544 21 P 4.6567 0.0000 0.0000 62.4955 33.4442 175.3260 22 I 4.4266 8.2241 120.0078 59.7811 38.5347 175.4806 23 A 4.7307 8.4343 129.2753 50.7449 20.2420 177.0355 24 V 3.7190 7.6103 113.8334 63.1767 32.1206 176.9334 25 G 4.0233 9.3247 112.8782 45.5059 0.0000 174.2727 26 T 4.1790 7.8533 117.1848 63.4857 69.6275 173.7200 27 V 5.1112 8.5105 125.5499 61.1176 33.7342 174.5626 28 I 4.7616 9.0782 120.7887 59.1188 41.3355 174.3221 29 R 5.1608 8.4608 121.6196 54.8445 33.0436 174.5133 30 Y 5.0414 9.2743 122.2436 56.9984 39.8648 175.1470 31 S 4.7436 8.7759 115.4827 57.5637 66.9054 172.1835 32 C 5.2674 8.5765 118.1325 54.7823 37.8826 173.7555 33 S 4.3100 8.3864 116.7572 58.5856 63.3164 175.5958 34 G 3.6934 8.8889 108.1705 47.6064 0.0000 174.3871 35 T 4.3068 7.9989 109.6259 61.1963 69.0484 173.5139 36 F 5.3081 7.8693 119.5215 56.1786 43.2757 174.2979 37 R 4.6767 9.1825 118.7560 54.2538 33.5219 174.8444 38 L 4.6018 8.6004 125.5739 54.8173 43.2370 175.6618 39 I 4.1613 8.5544 127.5943 60.8229 39.5353 175.0450 40 G 3.0710 6.8222 112.3620 43.2405 0.0000 172.4314 41 E 3.8920 7.5479 120.1858 55.7712 30.1579 176.7197 42 K 4.1958 8.6672 124.7439 58.4941 34.2786 176.1853 43 S 5.3874 7.9999 117.6585 56.7721 64.7626 173.5406 44 L 5.0527 8.9960 124.6464 52.8841 44.5453 175.1130 45 L 5.3108 9.1687 124.5742 53.4147 45.1900 174.2234 46 C 4.2647 8.9689 126.9723 55.6905 40.6075 172.3644 47 I 4.9679 8.6125 119.2318 59.4347 41.6147 173.7021 48 T 4.8382 8.2194 115.7461 60.5198 69.1490 173.4326 49 K 4.3540 8.9381 127.1915 56.8997 33.6604 176.8185 50 D 4.7818 7.7594 116.0207 52.1800 39.7611 176.4897 51 K 3.8331 8.1044 115.8562 57.5899 30.3358 175.3977 52 V 4.1824 7.7021 115.7224 64.4384 33.1070 175.6308 53 D 4.6122 8.6578 119.2750 53.5401 41.5730 175.9375 54 G 4.1059 8.3125 109.7868 44.0241 0.0000 172.4651 55 T 4.7086 8.8808 118.6785 59.9039 71.5164 172.4955 56 W 4.7402 8.4681 124.8342 56.1104 30.1264 177.1440 57 D 4.4055 9.2001 123.8239 55.2971 39.2853 176.1060 58 K 4.6112 7.6013 117.4298 54.4348 36.4679 173.7204 59 P 4.4275 0.0000 0.0000 61.8381 32.1793 176.1295 60 A 3.3368 8.0283 122.3418 51.5009 18.6767 175.7823 61 P 4.3915 0.0000 0.0000 62.3594 32.9085 175.1132 62 K 4.6639 8.6015 118.2163 54.7457 36.1748 174.9019 63 C 5.2262 8.6673 119.2711 55.5433 37.4629 172.8204 64 E 4.9521 9.1850 126.1379 54.2233 31.5011 174.4467 65 Y 3.6085 9.0685 127.7978 57.8041 39.2671 175.6469 66 F 4.4373 7.9990 129.3456 58.8520 40.3779 174.0921 67 N 4.4011 8.5878 123.5364 51.0465 39.9875 174.6689 68 K 3.5946 7.3177 125.5869 59.0629 32.8067 177.7842 69 Y 4.1909 7.8344 116.7250 59.5597 38.3613 176.1280 70 S 4.3866 7.8307 117.2921 58.9656 64.0622 173.8922 71 S 4.6980 9.6864 119.8576 57.5173 64.7307 172.5374 72 C 4.7276 8.7475 125.9913 55.1678 40.9778 172.5227 73 P 4.7334 0.0000 0.0000 61.8681 31.9976 175.6215 74 E 4.3133 8.8621 120.7538 55.6723 29.8482 174.8321 75 P 4.4182 0.0000 0.0000 62.5534 32.1252 175.6087 76 I 4.4707 8.0815 121.3972 59.3689 40.1866 175.0810 77 V 3.9723 7.7893 123.4527 59.8773 33.0729 172.9315 78 P 4.2403 0.0000 0.0000 64.0650 31.6376 177.0404 79 G 2.8743 8.8827 110.2686 45.0919 0.0000 172.4892 80 G 4.4086 7.7946 107.4651 43.7412 0.0000 171.3542 81 Y 5.0509 8.6351 116.1584 54.9868 41.6874 174.4446 82 K 3.7572 8.7607 122.6117 56.7288 32.4522 176.1681 83 I 4.2778 8.5152 127.7642 62.2776 39.1133 176.1631 84 R 4.5427 7.6103 118.5325 54.8545 34.6896 175.3338 85 G 4.3678 9.3735 108.9920 45.5989 0.0000 173.3669 86 S 4.6107 8.3191 116.1073 56.2654 65.6852 173.8012 87 T 3.1219 7.9469 122.9642 62.6231 68.8623 172.3572 88 P 4.3628 0.0000 0.0000 62.5900 33.2295 175.1163 89 Y 4.8189 8.3035 119.0955 57.2448 39.3814 175.4299 90 R 4.9622 9.4893 124.0797 53.2664 33.5555 175.4749 91 H 4.3583 8.8455 119.3815 58.5757 29.7958 175.0565 92 G 4.1667 9.4812 116.1433 45.4103 0.0000 173.3963 93 D 4.9131 8.3489 120.2126 54.5355 42.1035 175.4488 94 S 5.1291 8.5009 114.3484 56.9468 66.6862 173.1058 95 V 4.4365 7.8077 111.5251 59.9676 36.1316 174.7321 96 T 4.8483 8.1080 118.4724 61.8097 72.2787 173.1652 97 F 5.1293 9.0651 122.7877 55.6998 42.7814 174.2858 98 A 4.6218 8.3784 120.2244 50.6502 22.6219 174.9012 99 C 4.9857 8.6335 117.1876 55.9927 42.2839 173.9525 100 K 4.5445 9.3109 122.7603 55.8210 33.6261 176.5808 101 T 4.0950 8.4538 117.4386 66.0791 68.7417 174.4312 102 N 4.3023 9.2092 121.5484 53.1156 35.9571 173.2990 103 F 5.5475 8.2518 116.3025 55.5583 42.3449 174.7381 104 S 4.8750 9.2609 115.9962 56.7664 65.8259 172.6532 105 M 4.7873 8.5925 122.1237 54.8865 33.4789 174.5528 106 N 4.7624 9.4203 124.8507 54.0565 41.5373 172.7850 107 G 3.7413 8.8969 111.5102 44.1103 0.0000 171.9218 108 N 4.6621 8.4276 116.3971 52.7249 39.3118 175.9361 109 K 4.2834 8.6410 120.9351 58.5798 34.0533 176.4289 110 S 5.0267 8.0037 116.3368 56.7428 66.2122 173.6133 111 V 4.8273 7.9908 115.6663 59.4228 36.1831 174.4177 112 W 5.2087 9.0953 120.7720 55.0048 33.1062 175.5741 113 C 3.8767 9.6057 124.5281 56.0240 44.9316 173.4536 114 Q 4.7749 8.6039 125.8402 54.6430 29.5940 177.0011 115 A 4.0753 9.2221 122.8626 54.7241 18.3298 178.5019 116 N 4.6052 8.0204 110.4619 52.8933 37.3068 175.7755 117 N 4.1886 8.0426 114.2720 54.1914 37.4657 174.2998 118 M 4.4099 8.1735 118.8954 53.9028 33.3588 175.7534 119 W 4.6666 8.7809 121.1302 57.5381 30.1248 176.6175 120 G 3.8151 9.5557 108.0753 45.8803 0.0000 172.5625 121 P 4.3833 0.0000 0.0000 65.2312 31.4319 177.3040 122 T 4.4933 7.6209 113.3739 61.9085 70.4904 174.2006 123 R 4.3091 8.1660 120.6678 55.6279 30.8386 176.7949 124 L 4.0471 8.3466 119.9887 54.5713 42.1386 175.6762 125 P 4.5123 0.0000 0.0000 63.1633 32.4460 175.1855 126 T 4.5618 8.8860 115.2079 60.4258 70.8327 172.0260 127 C 5.4729 8.7171 124.4359 55.3471 38.0919 173.5012 128 V 4.6721 8.6534 124.5602 59.5581 33.7555 175.4974 129 S 3.9759 8.6842 117.8258 58.4586 62.2350 174.4144 130 V 3.4816 7.7114 126.8408 65.4921 32.1456 176.1491 131 F 4.4807 7.5712 120.8056 55.8959 38.9116 173.9690 132 P 4.2146 0.0000 0.0000 66.1800 30.6641 177.4255 133 L 4.3872 7.9132 114.8416 54.5191 41.4934 176.8217 134 E 5.3064 7.8666 123.6612 55.6092 30.4767 175.3197 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 A 8.26 4.30 1.04 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 0.00 0.00 2 I 8.55 4.46 1.81 0.00 0.00 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 1.36 0.92 0.83 0.00 0.00 3 S 9.19 4.92 0.00 3.91 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 4 C 8.53 4.75 0.00 2.26 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 5 G 8.45 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 6 S 8.74 4.17 0.00 3.92 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 7 P 0.00 3.93 0.00 1.49 0.55 0.00 3.71 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.16 0.00 8 P 0.00 4.30 0.00 1.96 1.97 0.00 3.41 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.03 0.00 9 P 0.00 4.52 0.00 2.17 2.04 0.00 3.69 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 1.97 1.94 0.00 10 I 7.92 4.44 2.13 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.44 1.00 0.00 0.00 11 L 8.51 4.08 0.00 1.58 1.48 0.89 1.04 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 12 N 8.95 3.99 0.00 2.28 1.50 0.00 0.00 6.79 7.64 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 13 G 7.44 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 14 R 8.66 4.67 0.00 1.78 1.94 0.00 2.71 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 15 I 7.88 4.62 1.69 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.29 0.12 0.55 0.00 0.00 16 S 8.80 4.21 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 17 Y 8.82 3.77 0.00 2.89 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 18 Y 6.51 4.87 0.00 3.05 2.81 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 19 S 8.56 4.56 0.00 4.05 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 20 T 8.10 4.62 4.28 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 1.23 0.00 0.00 21 P 0.00 4.66 0.00 2.10 2.14 0.00 3.51 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 22 I 8.22 4.43 2.13 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.81 0.93 0.00 0.00 23 A 8.43 4.73 1.22 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 0.00 0.00 0.00 24 V 7.61 3.72 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 0.56 0.00 0.00 0.88 0.00 0.00 25 G 9.32 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 0.00 0.00 0.00 26 T 7.85 4.18 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 1.33 0.00 0.00 27 V 8.51 5.11 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 0.91 0.00 0.00 1.00 0.00 0.00 28 I 9.08 4.76 1.61 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.49 0.70 0.00 0.00 29 R 8.46 5.16 0.00 1.79 1.86 0.00 3.14 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 30 Y 9.27 5.04 0.00 2.65 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 31 S 8.78 4.74 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 32 C 8.58 5.27 0.00 2.90 3.08 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 33 S 8.39 4.31 0.00 4.01 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 34 G 8.89 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.00 4.31 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 1.18 0.00 0.00 36 F 7.87 5.31 0.00 2.97 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 9.18 4.68 0.00 1.33 1.67 0.00 3.18 0.00 0.00 2.95 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 38 L 8.60 4.60 0.00 1.62 1.54 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.55 4.16 1.83 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.99 0.98 0.00 0.00 40 G 6.82 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 0.00 0.00 0.00 41 E 7.55 3.89 0.00 2.00 1.77 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 2.35 2.58 0.00 42 K 8.67 4.20 0.00 2.11 2.04 0.00 1.57 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.55 1.53 7.81 43 S 8.00 5.39 0.00 3.77 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 44 L 9.00 5.05 0.00 1.70 1.90 0.80 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 45 L 9.17 5.31 0.00 1.83 1.78 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 46 C 8.97 4.26 0.00 1.84 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 47 I 8.61 4.97 1.81 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 1.18 0.59 0.91 0.00 0.00 48 T 8.22 4.84 4.17 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 1.16 0.00 0.00 49 K 8.94 4.35 0.00 1.75 1.82 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.38 7.81 50 D 7.76 4.78 0.00 2.84 2.81 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 51 K 8.10 3.83 0.00 1.94 1.91 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.48 7.81 52 V 7.70 4.18 2.06 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 0.79 0.00 0.00 0.94 0.00 0.00 53 D 8.66 4.61 0.00 2.74 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.31 4.11 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 0.00 55 T 8.88 4.71 4.18 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 1.16 0.00 0.00 56 W 8.47 4.74 0.00 3.38 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 57 D 9.20 4.41 0.00 2.70 2.81 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 58 K 7.60 4.61 0.00 1.52 1.66 0.00 1.63 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.45 7.81 59 P 0.00 4.43 0.00 2.09 2.01 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.92 0.00 60 A 8.03 3.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.39 0.00 1.79 1.86 0.00 2.20 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 62 K 8.60 4.66 0.00 1.66 1.68 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.31 7.81 63 C 8.67 5.23 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 64 E 9.19 4.95 0.00 2.18 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 0.00 2.36 2.35 0.00 65 Y 9.07 3.61 0.00 2.89 2.86 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 66 F 8.00 4.44 0.00 2.75 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 67 N 8.59 4.40 0.00 2.58 2.43 0.00 0.00 6.97 6.04 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 68 K 7.32 3.59 0.00 1.58 1.36 0.00 1.28 0.00 0.00 1.46 0.00 0.00 2.19 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.75 0.21 7.81 69 Y 7.83 4.19 0.00 3.05 3.04 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 70 S 7.83 4.39 0.00 3.74 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 71 S 9.69 4.70 0.00 3.80 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 C 8.75 4.73 0.00 2.30 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 0.00 0.00 0.00 0.00 73 P 0.00 4.73 0.00 2.33 2.16 0.00 3.92 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 2.24 2.06 0.00 74 E 8.86 4.31 0.00 2.21 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 0.00 2.40 2.47 0.00 75 P 0.00 4.42 0.00 1.96 0.71 0.00 3.57 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.74 0.00 76 I 8.08 4.47 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.72 0.88 0.00 0.00 77 V 7.79 3.97 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 0.76 0.00 0.00 -0.26 0.00 0.00 78 P 0.00 4.24 0.00 1.98 1.91 0.00 3.64 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.02 0.00 79 G 8.88 2.87 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 80 G 7.79 4.41 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 0.00 81 Y 8.64 5.05 0.00 3.04 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 82 K 8.76 3.76 0.00 1.39 1.60 0.00 1.78 0.00 0.00 1.44 0.00 0.00 2.65 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.13 0.94 7.81 83 I 8.52 4.28 1.65 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.54 0.82 0.00 0.00 84 R 7.61 4.54 0.00 1.53 1.66 0.00 3.00 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.50 0.00 85 G 9.37 4.37 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 0.00 86 S 8.32 4.61 0.00 3.75 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 87 T 7.95 3.12 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 88 P 0.00 4.36 0.00 2.03 1.98 0.00 3.66 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 1.91 1.95 0.00 89 Y 8.30 4.82 0.00 3.32 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 90 R 9.49 4.96 0.00 1.97 1.97 0.00 3.38 0.00 0.00 3.22 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.48 0.00 91 H 8.85 4.36 0.00 3.25 3.54 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 G 9.48 4.17 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 0.00 0.00 0.00 93 D 8.35 4.91 0.00 2.96 2.87 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 94 S 8.50 5.13 0.00 2.72 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 95 V 7.81 4.44 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 -0.03 0.00 0.00 -0.20 0.00 0.00 96 T 8.11 4.85 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 1.17 0.00 0.00 97 F 9.07 5.13 0.00 2.62 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.38 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 C 8.63 4.99 0.00 2.94 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 0.00 100 K 9.31 4.54 0.00 1.74 1.85 0.00 1.54 0.00 0.00 1.61 0.00 0.00 2.76 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.62 7.81 101 T 8.45 4.09 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 1.26 0.00 0.00 102 N 9.21 4.30 0.00 2.79 2.70 0.00 0.00 6.92 8.13 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 0.00 103 F 8.25 5.55 0.00 2.97 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 0.00 104 S 9.26 4.87 0.00 3.79 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 0.00 105 M 8.59 4.79 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 106 N 9.42 4.76 0.00 2.72 2.63 0.00 0.00 7.10 7.89 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 0.00 107 G 8.90 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 0.00 108 N 8.43 4.66 0.00 2.80 2.86 0.00 0.00 6.85 7.61 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 0.00 109 K 8.64 4.28 0.00 2.00 2.05 0.00 1.42 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.44 7.81 110 S 8.00 5.03 0.00 3.68 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 0.00 111 V 7.99 4.83 2.51 0.00 0.00 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 0.57 0.00 0.00 112 W 9.10 5.21 0.00 3.44 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 0.00 113 C 9.61 3.88 0.00 2.09 3.04 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 0.00 114 Q 8.60 4.77 0.00 2.40 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.53 0.00 0.00 0.00 0.00 0.00 2.44 2.60 0.00 115 A 9.22 4.08 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 0.00 116 N 8.02 4.61 0.00 2.81 2.90 0.00 0.00 6.09 8.04 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 0.00 117 N 8.04 4.19 0.00 2.87 2.96 0.00 0.00 6.87 7.24 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 0.00 118 M 8.17 4.41 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 119 W 8.78 4.67 0.00 3.33 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 0.00 120 G 9.56 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 0.00 121 P 0.00 4.38 0.00 2.11 2.13 0.00 4.02 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 122 T 7.62 4.49 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 123 R 8.17 4.31 0.00 1.81 1.86 0.00 3.24 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 124 L 8.35 4.05 0.00 1.54 1.41 0.75 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.51 0.00 1.96 2.24 0.00 3.40 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 126 T 8.89 4.56 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 127 C 8.72 5.47 0.00 2.91 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 0.00 128 V 8.65 4.67 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 0.81 0.00 0.00 0.95 0.00 0.00 129 S 8.68 3.98 0.00 3.73 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 0.00 130 V 7.71 3.48 1.21 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 0.36 0.00 0.00 0.66 0.00 0.00 131 F 7.57 4.48 0.00 3.28 2.93 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 0.00 132 P 0.00 4.21 0.00 2.19 2.23 0.00 3.90 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 133 L 7.91 4.39 0.00 1.68 1.75 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 134 E 7.87 5.31 0.00 1.93 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 2.22 2.21 0.00