NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5445 8.2931 120.3492 54.9826 33.5010 176.7590 2 G 4.0870 8.4750 113.9444 44.7364 0.0000 172.2665 3 S 3.8303 8.9884 117.8921 59.0595 60.8349 169.4772 4 S 4.3196 7.4053 116.0732 57.5027 61.7617 173.7713 5 H 4.6252 8.2273 128.3103 55.2499 30.4342 171.4638 6 H 4.7626 8.2870 123.3377 54.7814 30.0336 176.4867 7 H 4.5802 8.2233 120.5609 54.4544 27.1192 172.9038 8 H 4.2428 7.9945 124.3492 56.9822 30.2413 174.3891 9 H 4.4088 8.2833 125.6044 57.2409 29.1670 174.8486 10 H 4.5832 7.5045 114.6073 55.4921 32.7204 173.5515 11 S 4.2778 9.2716 124.0453 62.0095 63.0525 176.0154 12 S 3.6864 8.1322 112.1804 58.8237 59.8027 171.8177 13 G 4.1544 9.1161 109.9715 46.1608 0.0000 174.9140 14 R 4.3366 8.1678 117.8588 57.4214 31.3668 176.6012 15 E 4.5700 8.0487 114.9766 56.3414 29.6549 177.2440 16 N 4.6884 8.0475 115.2550 54.6564 37.5191 175.6552 17 L 4.1238 7.6483 118.8257 56.7309 42.2312 176.3291 18 Y 4.8219 7.4603 116.4181 56.7711 39.0718 175.2325 19 F 4.8808 8.7901 118.3064 57.0470 38.3341 175.9506 20 Q 3.9111 7.6191 118.9628 56.8315 28.4835 176.7402 21 G 3.8400 7.8794 106.1040 46.1817 0.0000 174.2666 22 H 4.3864 7.9196 120.4893 55.3252 30.5502 174.6049 23 M 4.0243 8.2402 126.7118 55.9281 32.3567 175.6036 24 C 4.6136 8.1578 121.5134 57.2078 36.0284 173.9894 25 I 3.6338 8.2789 122.7122 64.2323 37.3068 177.5141 26 Q 3.5882 7.9289 119.9428 58.7778 28.9376 177.8480 27 K 3.7671 7.7659 120.2582 59.3009 32.2538 178.7368 28 V 3.4718 7.5762 118.2089 66.0502 31.6171 177.9639 29 I 4.0077 7.2583 120.2333 63.6792 36.9567 177.8802 30 E 3.7133 8.0166 120.1023 59.5232 29.4374 178.5233 31 D 4.2481 8.0595 117.8088 56.9441 41.3291 178.2873 32 K 3.8884 8.0228 119.4067 59.4344 32.1026 179.3791 33 L 4.0635 7.7601 119.6839 58.6235 40.3632 179.1364 34 S 4.0306 8.0377 114.3109 61.4126 62.0890 176.3216 35 S 4.1455 8.0834 116.7072 60.8141 62.5243 176.1474 36 A 4.2497 7.2042 121.9207 54.7176 19.0118 179.0979 37 L 4.3364 8.1018 114.9076 54.0845 43.3532 177.1393 38 K 3.9114 7.6447 116.2352 56.6100 28.1624 170.9926 39 P 4.7892 0.0000 0.0000 61.4774 32.8068 178.1465 40 T 4.2215 8.5069 114.0592 64.1281 69.4423 174.3586 41 F 4.9235 7.8920 121.7028 56.3118 43.3640 173.3910 42 L 4.7023 7.2648 126.1796 53.4865 44.7258 174.4172 43 E 4.2917 8.8477 128.2451 54.2880 31.8665 174.3380 44 L 4.9124 8.2438 126.3498 53.0106 44.1116 175.8576 45 V 4.4887 8.5653 124.0236 60.6319 35.0381 174.1084 46 D 4.7076 8.7390 126.6748 54.2904 41.4784 175.9612 47 K 4.5366 8.4660 128.0800 54.1663 30.5557 174.5513 48 S 4.2257 8.0053 119.5599 57.9313 63.6691 175.3361 49 C 4.2762 8.7011 126.1525 61.1750 31.6714 173.0480 50 G 3.3880 6.2956 111.9651 45.0883 0.0000 172.6812 51 C 4.2217 7.5958 122.0202 57.9892 31.2032 173.8195 52 G 3.8588 8.3725 114.9256 44.3715 0.0000 171.2036 53 T 3.9640 8.0058 115.0606 63.7163 69.0693 174.7514 54 S 4.6246 8.0337 120.8103 56.7554 67.8080 172.7801 55 F 5.2574 8.5724 120.5739 55.7484 41.7865 174.1031 56 D 5.0871 9.3848 123.4117 52.5259 43.4387 174.2055 57 A 5.1019 8.4857 129.1793 50.1685 21.6650 175.1478 58 V 4.4710 8.6968 124.2682 61.9546 33.0105 174.8994 59 I 4.4656 8.7281 122.7033 59.6391 40.2407 175.2702 60 V 4.9047 8.5405 123.7109 60.2558 33.6013 173.6633 61 S 5.0547 8.2137 121.2299 55.6330 65.7405 174.5016 62 N 4.5260 9.1534 123.4563 55.8652 38.1735 176.9804 63 N 4.4432 8.2738 118.0018 55.7720 39.1700 175.6368 64 F 4.5752 8.2575 117.8475 57.4759 39.5886 176.7454 65 E 4.3241 8.0264 116.8913 57.8222 29.7784 177.4173 66 D 4.4488 8.0230 118.5578 54.6514 41.1796 176.6125 67 K 4.2814 7.6405 116.6547 58.0265 30.1512 177.5967 68 K 4.2250 7.2668 120.4957 56.0306 30.3363 177.3643 69 L 3.9627 8.1677 125.3720 58.0076 42.3764 178.3161 70 L 4.0606 7.7857 119.2583 58.6636 40.5119 178.5795 71 D 4.2540 7.9521 118.8405 57.1289 41.2613 178.2532 72 R 3.6973 8.1422 116.9011 59.1269 29.3360 178.3853 73 H 4.1712 8.2677 119.3418 59.1266 29.9495 177.4506 74 R 3.8837 8.2788 118.2868 59.1984 29.2590 178.7925 75 L 3.8808 7.9534 119.6849 57.4543 41.6636 179.4756 76 V 3.6373 7.9738 118.3340 66.3882 31.6065 177.9025 77 N 4.4879 8.3091 115.9483 56.3459 38.0378 177.7039 78 T 3.8691 7.5262 116.7605 66.5788 68.8503 176.4876 79 I 3.9533 7.5614 121.1039 64.0449 37.3335 177.8434 80 L 4.1792 8.2737 118.2345 55.5770 41.1935 178.5806 81 K 3.7795 7.6459 119.8899 60.2437 32.3766 177.9760 82 E 4.0924 7.9548 117.8979 58.8720 29.6195 178.5678 83 E 3.7445 7.7892 119.1472 59.5699 29.5988 178.8157 84 L 3.9946 7.9589 118.8498 58.1756 41.4421 179.5537 85 Q 4.0323 7.7521 116.9031 58.2202 28.6809 177.1844 86 N 4.8465 8.0456 114.6905 52.8641 39.3772 174.7053 87 I 4.7659 7.6965 119.5790 59.4953 40.4957 175.2516 88 H 4.1856 9.1094 124.0394 58.9841 29.6778 175.4391 89 A 4.4390 7.8298 121.9101 51.2453 21.7048 174.7352 90 F 5.2763 8.9927 125.4001 57.3951 40.9368 175.0806 91 S 4.9169 8.5862 122.7747 56.8207 65.8078 173.0963 92 M 5.0399 8.2480 119.0239 53.4712 34.5304 174.5532 93 K 4.5027 9.0004 121.7185 54.7169 34.4129 175.1908 94 C 4.5070 8.5239 121.5180 57.9526 30.4853 172.6289 95 H 5.2224 8.8369 119.9002 54.4921 33.7626 172.2923 96 T 4.9360 8.3308 108.9570 59.2853 71.6077 173.6609 97 P 4.5143 0.0000 0.0000 65.3374 31.3191 179.1505 98 L 3.9921 7.8874 117.8320 58.0181 41.3050 179.1031 99 E 4.1410 7.8504 117.6235 59.1336 29.4207 178.7299 100 Y 4.0944 8.4685 120.3800 60.6344 38.7986 177.2636 101 D 4.0618 8.4114 119.3141 57.1358 41.1315 178.4023 102 K 3.8482 7.5347 117.5262 59.5479 31.8771 179.3042 103 L 3.8443 7.1839 117.4218 57.4097 41.5905 179.2895 104 K 3.9389 7.3484 117.5668 59.4913 32.8929 179.1520 105 S 4.2377 8.0248 115.8730 60.1017 63.1127 174.4612 106 K 4.3068 8.6417 116.1637 59.5027 34.2637 175.4552 107 G 3.5131 7.3906 112.7643 44.7401 0.0000 173.6350 108 S 4.1490 7.4628 120.7368 58.5058 63.9987 173.7045 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 M 8.29 4.54 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 2 G 8.47 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 3 S 8.99 3.83 0.00 4.04 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 4 S 7.41 4.32 0.00 3.97 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 H 8.23 4.63 0.00 3.05 3.15 0.00 5.79 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 H 8.29 4.76 0.00 3.16 3.13 0.00 5.76 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 H 8.22 4.58 0.00 3.29 3.34 0.00 5.53 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 H 7.99 4.24 0.00 3.09 3.28 0.00 5.92 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 H 8.28 4.41 0.00 3.13 3.25 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 H 7.50 4.58 0.00 3.01 3.13 0.00 5.77 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 9.27 4.28 0.00 4.31 3.98 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 12 S 8.13 3.69 0.00 3.98 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 13 G 9.12 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.17 4.34 0.00 1.87 2.05 0.00 3.23 0.00 0.00 3.33 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 15 E 8.05 4.57 0.00 2.25 2.25 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 2.35 2.27 0.00 16 N 8.05 4.69 0.00 2.85 3.00 0.00 0.00 6.46 7.80 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 17 L 7.65 4.12 0.00 1.24 1.46 0.94 0.79 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 18 Y 7.46 4.82 0.00 3.00 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 19 F 8.79 4.88 0.00 3.25 3.28 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 20 Q 7.62 3.91 0.00 1.82 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.31 0.00 0.00 0.00 0.00 0.00 1.93 1.50 0.00 21 G 7.88 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 0.00 0.00 0.00 22 H 7.92 4.39 0.00 3.15 3.26 0.00 5.94 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 M 8.24 4.02 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 24 C 8.16 4.61 0.00 2.97 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 25 I 8.28 3.63 1.88 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 1.56 1.04 0.97 0.00 0.00 26 Q 7.93 3.59 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.71 0.00 0.00 0.00 0.00 0.00 2.14 1.81 0.00 27 K 7.77 3.77 0.00 1.90 1.74 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.50 7.81 28 V 7.58 3.47 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 0.86 0.00 0.00 0.96 0.00 0.00 29 I 7.26 4.01 1.58 0.00 0.00 0.75 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 1.91 0.51 0.00 0.00 30 E 8.02 3.71 0.00 1.83 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 2.15 2.26 0.00 31 D 8.06 4.25 0.00 2.80 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 32 K 8.02 3.89 0.00 2.09 1.75 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.54 7.81 33 L 7.76 4.06 0.00 1.90 1.91 0.88 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.04 4.03 0.00 3.99 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 35 S 8.08 4.15 0.00 3.97 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 36 A 7.20 4.25 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 37 L 8.10 4.34 0.00 1.77 2.12 1.20 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.64 3.91 0.00 1.94 1.87 0.00 1.74 0.00 0.00 1.94 0.00 0.00 3.11 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.49 7.81 39 P 0.00 4.79 0.00 2.38 2.14 0.00 3.71 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 40 T 8.51 4.22 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 1.26 0.00 0.00 41 F 7.89 4.92 0.00 2.81 2.45 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 42 L 7.26 4.70 0.00 1.41 1.18 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.85 4.29 0.00 2.23 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 44 L 8.24 4.91 0.00 1.34 1.55 0.62 0.64 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 45 V 8.57 4.49 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 0.89 0.00 0.00 0.96 0.00 0.00 46 D 8.74 4.71 0.00 2.65 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.47 4.54 0.00 1.71 1.58 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.49 7.81 48 S 8.01 4.23 0.00 3.86 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 C 8.70 4.28 0.00 2.95 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 50 G 6.30 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 0.00 0.00 0.00 51 C 7.60 4.22 0.00 2.84 2.56 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 0.00 52 G 8.37 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 53 T 8.01 3.96 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 0.66 0.00 0.00 54 S 8.03 4.62 0.00 3.96 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 55 F 8.57 5.26 0.00 3.28 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 56 D 9.38 5.09 0.00 2.56 2.45 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 57 A 8.49 5.10 1.20 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 0.00 0.00 58 V 8.70 4.47 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 1.10 0.00 0.00 0.96 0.00 0.00 59 I 8.73 4.47 1.66 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.33 0.79 0.00 0.00 60 V 8.54 4.90 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.72 0.00 0.00 61 S 8.21 5.05 0.00 3.93 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 62 N 9.15 4.53 0.00 2.85 2.93 0.00 0.00 6.82 6.97 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 63 N 8.27 4.44 0.00 2.90 3.11 0.00 0.00 6.27 6.75 0.00 0.00 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 F 8.26 4.58 0.00 3.09 3.12 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 0.00 0.00 0.00 0.00 65 E 8.03 4.32 0.00 2.18 2.16 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 2.49 2.70 0.00 66 D 8.02 4.45 0.00 2.81 2.66 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 0.00 0.00 0.00 0.00 67 K 7.64 4.28 0.00 1.92 1.94 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.56 7.81 68 K 7.27 4.22 0.00 1.50 1.72 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.53 7.81 69 L 8.17 3.96 0.00 1.68 1.65 0.90 0.57 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 70 L 7.79 4.06 0.00 1.88 1.91 0.91 0.63 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 71 D 7.95 4.25 0.00 2.77 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 72 R 8.14 3.70 0.00 1.30 1.77 0.00 3.11 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.71 0.00 73 H 8.27 4.17 0.00 3.40 3.57 0.00 5.78 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.28 3.88 0.00 2.05 2.23 0.00 2.91 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.64 0.00 75 L 7.95 3.88 0.00 1.74 1.72 0.90 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.97 3.64 2.32 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 1.12 0.00 0.00 1.23 0.00 0.00 77 N 8.31 4.49 0.00 2.73 2.80 0.00 0.00 7.07 6.50 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 78 T 7.53 3.87 4.36 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 1.19 0.00 0.00 79 I 7.56 3.95 1.84 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 1.49 0.89 0.87 0.00 0.00 80 L 8.27 4.18 0.00 1.85 1.66 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 81 K 7.65 3.78 0.00 1.89 2.03 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.52 7.81 82 E 7.95 4.09 0.00 2.00 1.94 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 2.37 2.32 0.00 83 E 7.79 3.74 0.00 2.16 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 1.91 2.11 0.00 84 L 7.96 3.99 0.00 1.73 1.74 0.95 1.34 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 85 Q 7.75 4.03 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.76 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 86 N 8.05 4.85 0.00 2.79 2.84 0.00 0.00 6.98 6.97 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 87 I 7.70 4.77 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.81 1.27 0.00 0.00 88 H 9.11 4.19 0.00 3.09 3.34 0.00 5.95 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 89 A 7.83 4.44 1.26 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 0.00 0.00 90 F 8.99 5.28 0.00 3.08 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 91 S 8.59 4.92 0.00 3.75 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 92 M 8.25 5.04 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 93 K 9.00 4.50 0.00 1.67 1.72 0.00 1.47 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.35 7.81 94 C 8.52 4.51 0.00 2.89 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 95 H 8.84 5.22 0.00 3.25 3.19 0.00 5.58 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.33 4.94 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 1.39 0.00 0.00 97 P 0.00 4.51 0.00 2.25 2.25 0.00 3.67 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 2.18 2.25 0.00 98 L 7.89 3.99 0.00 1.69 1.73 0.95 1.04 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 99 E 7.85 4.14 0.00 2.13 1.91 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 2.34 2.35 0.00 100 Y 8.47 4.09 0.00 3.01 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 0.00 101 D 8.41 4.06 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 0.00 102 K 7.53 3.85 0.00 2.09 1.79 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 103 L 7.18 3.84 0.00 1.55 1.65 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 104 K 7.35 3.94 0.00 1.57 1.16 0.00 1.24 0.00 0.00 0.92 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.98 1.19 7.81 105 S 8.02 4.24 0.00 3.81 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 0.00 106 K 8.64 4.31 0.00 1.78 1.83 0.00 1.54 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.29 7.81 107 G 7.39 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.46 4.15 0.00 3.79 3.68 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