NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4504 8.2893 120.3460 54.6050 34.4126 175.0629 2 K 4.3986 7.7621 115.6902 56.1308 34.3366 175.9466 3 N 4.5864 7.9571 118.9707 52.4452 37.9718 174.1840 4 T 4.4838 8.0801 111.0286 59.6456 70.4971 174.8095 5 G 3.8290 8.6445 115.5586 46.3503 0.0000 173.5486 6 D 4.8287 7.6733 120.2813 52.0351 37.8493 176.5122 7 E 4.1193 7.9030 120.3480 57.8375 30.4079 177.4641 8 V 4.8832 8.8068 118.3834 59.4947 35.1849 175.5216 9 V 4.9016 8.9337 115.6929 59.5342 35.8798 174.6191 10 A 4.7128 9.0795 126.8126 51.0757 20.3717 176.4312 11 I 4.3180 9.0133 125.1927 60.5986 38.7585 175.2153 12 I 4.8211 8.9235 130.1237 59.8496 38.7568 175.2372 13 S 5.3084 9.2218 122.1315 56.6006 66.3848 172.9394 14 Q 5.0126 8.8221 122.4507 55.8218 32.2042 176.1901 15 N 4.3621 9.9964 121.0800 53.1103 38.3189 174.6562 16 G 4.2164 7.5324 108.7770 44.9979 0.0000 173.4828 17 K 4.8051 7.9196 117.3135 54.5841 35.4956 175.2657 18 V 4.1580 8.4135 121.6557 63.0292 31.7477 175.4139 19 I 4.4210 8.0370 120.5868 61.4805 39.5721 175.5990 20 R 4.5602 7.6328 120.2693 55.6627 33.3343 173.1563 21 E 5.6066 8.5127 121.4588 54.8576 32.5459 174.0899 22 I 4.4736 8.2498 125.4156 58.3642 39.7708 173.3534 23 P 4.5914 0.0000 0.0000 62.8822 31.8660 175.5435 24 L 4.3090 8.5717 123.7567 56.8084 42.5524 176.8038 25 T 3.9816 7.6922 114.1041 65.4089 68.7594 174.1271 26 G 4.0882 9.3429 115.5951 45.9583 0.0000 173.8152 27 H 4.4372 8.0887 120.5088 55.3836 27.7929 174.5957 28 K 4.4722 7.8738 123.3924 56.3262 34.4233 178.8144 29 G 3.7566 8.5299 106.4429 44.3674 0.0000 171.3337 30 N 5.5725 8.3659 116.2957 52.0397 41.9379 174.6722 31 E 4.9295 9.1939 124.1937 55.1152 33.6517 173.7540 32 Q 5.3246 8.7505 123.7999 54.3957 32.9962 174.5272 33 F 5.0027 8.6467 115.9384 56.0707 41.8189 173.1581 34 T 4.7832 8.6429 118.7926 62.2227 69.8516 174.6085 35 I 4.2356 9.0182 129.7137 60.5753 37.8985 175.0009 36 K 4.3430 8.7075 127.2454 55.1347 32.9077 175.1252 37 G 3.9323 9.1732 113.0023 44.5518 0.0000 175.1180 38 K 4.5923 7.5211 121.0611 53.0008 35.4579 174.0051 39 G 3.9652 8.6725 108.6814 46.5375 0.0000 173.5029 40 A 3.6777 8.5457 126.7843 52.0281 17.2342 177.1583 41 Q 4.5122 8.0347 116.7151 55.0946 28.6126 174.7622 42 Y 5.3487 8.4676 121.6704 55.5504 42.6770 174.0962 43 N 4.8238 9.1255 116.8083 51.4119 42.5676 173.9578 44 L 4.6551 9.0477 128.3352 54.6623 42.8030 175.3192 45 M 4.6548 8.2792 126.9584 53.8296 34.4160 175.1852 46 E 5.0276 8.9468 122.7435 54.5545 33.3061 174.3617 47 V 4.8645 9.3057 128.1085 61.6240 33.0386 174.2305 48 D 5.0097 9.2079 128.9776 52.4607 42.1256 175.4361 49 G 3.4369 8.9502 117.6858 46.5784 0.0000 172.8066 50 E 4.2176 8.5002 110.4039 56.7115 28.2602 175.1533 51 R 5.0025 7.4845 114.1637 54.9047 33.3275 173.5566 52 I 5.3806 9.0804 121.2610 59.6969 41.6649 174.1415 53 R 4.7584 8.6237 122.6082 54.9853 33.5056 173.8780 54 I 4.1183 7.8929 120.5253 60.4758 36.6870 176.2121 55 K 3.9848 8.8913 130.7323 58.9453 32.9563 176.9046 56 E 4.8782 7.7879 116.8884 55.6050 32.5654 174.6050 57 D 4.2214 8.4758 124.0836 52.1071 41.9772 175.6213 58 N 4.6644 7.1781 117.0797 51.3800 34.8820 174.4725 59 S 4.7145 7.2833 116.8024 56.2462 66.2987 174.3794 60 P 4.4025 0.0000 0.0000 65.2615 30.3958 177.5972 61 D 4.3206 7.7771 117.5100 57.3609 41.0979 178.4272 62 Q 3.6179 8.1125 115.8791 56.6466 27.2127 176.2739 63 V 3.6037 7.3181 118.4465 66.3974 31.4710 177.7249 64 G 3.5056 7.9870 104.5605 47.6418 0.0000 175.6239 65 V 3.4869 7.3511 119.8441 65.8113 31.5917 177.9948 66 K 4.0695 7.8315 116.8775 59.4798 31.9911 178.6825 67 M 4.1212 7.9154 118.6151 58.7909 32.4667 177.9262 68 G 3.3832 8.1344 107.0198 45.6598 0.0000 174.9288 69 W 4.5415 8.5301 125.5272 56.9315 28.7083 175.3055 70 K 4.7503 8.8440 124.0735 54.9070 33.7235 178.1876 71 S 4.6612 8.6465 113.3562 59.1448 65.2539 173.9909 72 K 4.5093 8.3733 120.6868 54.1692 34.6322 175.1706 73 A 4.2610 8.5556 124.5843 56.1581 17.9545 176.2985 74 G 3.6322 8.3368 113.4851 46.4518 0.0000 173.4553 75 D 4.7877 8.4092 121.4945 54.5646 42.0296 175.6803 76 T 4.9934 8.1597 109.9314 60.2628 72.5615 173.1482 77 I 4.4091 8.5135 122.9477 59.6024 40.7788 174.6502 78 V 4.5660 8.3824 126.9088 61.4020 33.9394 174.9285 79 C 4.6377 9.0525 126.6909 57.5494 28.9229 174.8398 80 L 4.0252 8.3806 124.1222 57.0788 41.7064 178.0416 81 P 4.2637 0.0000 0.0000 65.0691 31.2665 176.4471 82 H 4.8404 8.0326 112.1251 54.4990 29.7925 173.9091 83 K 3.8213 8.1463 118.8991 57.3444 30.2520 174.4548 84 V 4.6943 7.8958 118.8942 61.4294 33.2573 174.0317 85 F 5.1256 9.4977 131.2014 56.3344 42.0990 173.8406 86 V 5.5521 8.5548 126.1732 60.0247 34.5507 173.9621 87 E 5.0645 8.6403 124.2212 54.6254 33.4926 174.1801 88 I 4.9867 8.6182 123.4303 59.8064 39.1228 174.8696 89 K 4.9335 8.8683 126.1198 54.9925 35.9115 175.4115 90 S 4.9710 8.7249 116.3460 57.6515 63.1349 174.3074 91 T 4.0622 8.9346 116.3520 64.4262 69.0151 175.4437 92 Q 4.1802 7.8975 121.1595 56.1449 26.9434 175.2270 93 K 3.8178 8.3409 123.4211 57.9596 30.1548 176.4552 94 D 4.5481 7.3981 118.2048 54.4789 38.5584 174.8911 95 S 4.3860 8.0245 117.8362 57.3509 61.7930 174.1039 96 K 4.4148 7.9926 124.1170 54.4443 33.6756 176.6988 97 D 4.4468 8.4412 120.9471 53.9409 40.4212 175.5559 98 P 4.4248 0.0000 0.0000 61.4262 29.9728 173.4941 99 D 4.4059 8.1342 123.6848 55.3117 40.6873 175.6190 100 T 4.4180 8.2470 122.4828 63.6042 68.8554 176.5982 101 D 4.6048 7.6165 122.5660 53.8142 38.4416 175.3017 102 L 4.7929 7.6180 123.7093 53.9975 43.7134 175.7694 103 I 4.3308 8.0596 119.6601 60.1507 37.9947 177.0580 104 V 3.8188 8.4400 119.3892 60.6495 32.5413 174.2085 105 P 4.1753 0.0000 0.0000 63.2041 31.3665 176.0784 106 N 4.6332 8.6155 121.4878 52.5294 39.3184 175.0935 107 L 4.2213 8.3552 123.5935 54.1741 42.2059 177.2464 108 E 4.2023 8.5734 121.3778 55.7132 28.7845 175.7706 109 H 4.8182 8.1583 124.2281 53.7536 26.2504 174.5713 110 H 4.9422 7.4609 127.2768 56.9823 32.1748 173.1177 111 H 4.2625 7.8044 113.5388 56.8050 27.2596 173.2894 112 H 4.6525 8.2251 133.7714 57.2750 31.6253 173.5464 113 H 4.5428 7.4908 110.8631 54.7529 31.2528 173.4015 114 H 4.2829 9.0802 118.7090 56.6978 29.6014 174.7865 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 4.45 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 2 K 7.76 4.40 0.00 1.90 1.78 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.28 1.46 7.81 3 N 7.96 4.59 0.00 2.71 2.83 0.00 0.00 6.84 7.54 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 4 T 8.08 4.48 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 1.24 0.00 0.00 5 G 8.64 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 0.00 0.00 0.00 6 D 7.67 4.83 0.00 2.80 2.73 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 7 E 7.90 4.12 0.00 1.95 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 2.40 2.56 0.00 8 V 8.81 4.88 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 0.83 0.00 0.00 1.02 0.00 0.00 9 V 8.93 4.90 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 0.75 0.00 0.00 0.99 0.00 0.00 10 A 9.08 4.71 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 11 I 9.01 4.32 1.98 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.16 0.96 0.00 0.00 12 I 8.92 4.82 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 1.60 0.69 1.04 0.00 0.00 13 S 9.22 5.31 0.00 3.93 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 14 Q 8.82 5.01 0.00 2.14 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.02 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 15 N 10.00 4.36 0.00 2.94 2.97 0.00 0.00 7.18 8.33 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 16 G 7.53 4.22 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 0.00 17 K 7.92 4.81 0.00 1.90 1.87 0.00 1.53 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.57 1.44 7.81 18 V 8.41 4.16 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 0.85 0.00 0.00 0.96 0.00 0.00 19 I 8.04 4.42 1.90 0.00 0.00 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 1.30 0.87 1.01 0.00 0.00 20 R 7.63 4.56 0.00 1.86 1.68 0.00 3.05 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.33 0.00 21 E 8.51 5.61 0.00 2.00 1.86 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 2.14 2.15 0.00 22 I 8.25 4.47 1.81 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.17 0.81 0.00 0.00 23 P 0.00 4.59 0.00 2.19 2.06 0.00 3.69 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 2.00 1.98 0.00 24 L 8.57 4.31 0.00 1.76 1.93 0.96 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 25 T 7.69 3.98 4.25 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 1.22 0.00 0.00 26 G 9.34 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 27 H 8.09 4.44 0.00 3.25 3.43 0.00 5.58 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 7.87 4.47 0.00 1.87 1.77 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.39 7.81 29 G 8.53 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 0.00 0.00 0.00 30 N 8.37 5.57 0.00 2.89 2.71 0.00 0.00 6.99 8.09 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 31 E 9.19 4.93 0.00 2.22 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 2.40 2.42 0.00 32 Q 8.75 5.32 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.46 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 33 F 8.65 5.00 0.00 3.07 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 34 T 8.64 4.78 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 1.31 0.00 0.00 35 I 9.02 4.24 1.93 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.91 1.02 0.00 0.00 36 K 8.71 4.34 0.00 1.66 1.77 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.47 7.81 37 G 9.17 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 38 K 7.52 4.59 0.00 1.83 1.70 0.00 1.67 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.47 7.81 39 G 8.67 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.55 3.68 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.03 4.51 0.00 1.97 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.65 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 42 Y 8.47 5.35 0.00 2.99 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 43 N 9.13 4.82 0.00 2.65 2.63 0.00 0.00 6.91 7.01 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 44 L 9.05 4.66 0.00 1.83 1.75 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 45 M 8.28 4.65 0.00 1.42 0.57 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 46 E 8.95 5.03 0.00 1.93 1.68 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 2.38 2.45 0.00 47 V 9.31 4.86 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 0.93 0.00 0.00 1.14 0.00 0.00 48 D 9.21 5.01 0.00 2.87 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 49 G 8.95 3.44 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 50 E 8.50 4.22 0.00 2.15 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 2.46 2.22 0.00 51 R 7.48 5.00 0.00 2.27 2.02 0.00 2.21 0.00 0.00 2.89 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.41 0.00 52 I 9.08 5.38 1.99 0.00 0.00 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 1.30 1.68 1.02 0.00 0.00 53 R 8.62 4.76 0.00 1.42 1.42 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.19 0.00 54 I 7.89 4.12 1.72 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 1.09 0.42 0.84 0.00 0.00 55 K 8.89 3.98 0.00 1.64 1.86 0.00 1.93 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.33 7.81 56 E 7.79 4.88 0.00 2.04 1.70 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 2.19 2.19 0.00 57 D 8.48 4.22 0.00 2.67 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 58 N 7.18 4.66 0.00 2.84 2.89 0.00 0.00 6.77 7.78 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 59 S 7.28 4.71 0.00 3.81 3.66 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 60 P 0.00 4.40 0.00 2.18 2.20 0.00 3.71 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 1.96 1.97 0.00 61 D 7.78 4.32 0.00 2.71 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 62 Q 8.11 3.62 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 63 V 7.32 3.60 2.26 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 1.04 0.00 0.00 0.89 0.00 0.00 64 G 7.99 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 65 V 7.35 3.49 2.17 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 0.76 0.00 0.00 0.89 0.00 0.00 66 K 7.83 4.07 0.00 1.89 1.81 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.55 7.81 67 M 7.92 4.12 0.00 1.91 2.15 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.82 0.00 68 G 8.13 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 W 8.53 4.54 0.00 3.30 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 70 K 8.84 4.75 0.00 1.78 1.70 0.00 1.93 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.51 1.45 7.81 71 S 8.65 4.66 0.00 4.11 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 72 K 8.37 4.51 0.00 1.96 1.72 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.49 7.81 73 A 8.56 4.26 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 74 G 8.34 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 75 D 8.41 4.79 0.00 2.72 2.59 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 76 T 8.16 4.99 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 1.19 0.00 0.00 77 I 8.51 4.41 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.03 0.81 0.00 0.00 78 V 8.38 4.57 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 0.90 0.00 0.00 0.70 0.00 0.00 79 C 9.05 4.64 0.00 2.80 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 80 L 8.38 4.03 0.00 1.71 1.73 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 81 P 0.00 4.26 0.00 1.93 2.12 0.00 3.47 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 2.03 2.11 0.00 82 H 8.03 4.84 0.00 3.21 3.27 0.00 5.87 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.15 3.82 0.00 1.97 1.90 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.38 7.81 84 V 7.90 4.69 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.06 0.00 0.00 85 F 9.50 5.13 0.00 3.05 2.85 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 86 V 8.55 5.55 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 0.98 0.00 0.00 0.94 0.00 0.00 87 E 8.64 5.06 0.00 2.07 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 0.00 2.44 2.38 0.00 88 I 8.62 4.99 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.75 0.94 0.00 0.00 89 K 8.87 4.93 0.00 1.81 1.89 0.00 1.32 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.35 7.81 90 S 8.72 4.97 0.00 3.91 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 91 T 8.93 4.06 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 1.28 0.00 0.00 92 Q 7.90 4.18 0.00 2.26 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.32 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 93 K 8.34 3.82 0.00 1.90 1.91 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.36 1.35 7.81 94 D 7.40 4.55 0.00 2.68 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 S 8.02 4.39 0.00 3.91 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 96 K 7.99 4.41 0.00 1.76 1.75 0.00 1.77 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.46 7.81 97 D 8.44 4.45 0.00 2.65 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 98 P 0.00 4.42 0.00 2.18 2.09 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 99 D 8.13 4.41 0.00 2.63 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 0.00 100 T 8.25 4.42 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 1.21 0.00 0.00 101 D 7.62 4.60 0.00 2.86 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 0.00 102 L 7.62 4.79 0.00 1.75 1.69 0.92 0.75 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 0.00 103 I 8.06 4.33 1.88 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 1.39 1.03 0.92 0.00 0.00 104 V 8.44 3.82 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 0.67 0.00 0.00 0.94 0.00 0.00 105 P 0.00 4.18 0.00 2.04 2.04 0.00 3.67 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 2.03 2.13 0.00 106 N 8.62 4.63 0.00 2.73 2.78 0.00 0.00 7.23 7.87 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 0.00 107 L 8.36 4.22 0.00 1.67 1.65 1.00 1.00 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 0.00 108 E 8.57 4.20 0.00 2.10 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 0.00 2.43 2.27 0.00 109 H 8.16 4.82 0.00 3.28 3.39 0.00 5.62 0.00 0.00 0.00 0.00 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 H 7.46 4.94 0.00 3.09 3.19 0.00 5.67 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 0.00 111 H 7.80 4.26 0.00 3.31 3.45 0.00 5.70 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 H 8.23 4.65 0.00 3.10 3.25 0.00 5.77 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 7.49 4.54 0.00 3.29 3.26 0.00 5.82 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 0.00 114 H 9.08 4.28 0.00 3.13 3.31 0.00 5.95 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