NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9907 8.0549 120.3105 61.7964 32.6281 175.0111 2 H 4.4371 8.6487 119.0520 52.5953 28.6194 172.9345 3 L 4.8035 8.1158 124.2526 53.2422 44.2477 176.5408 4 T 4.0164 8.1152 113.7275 61.3818 69.1475 173.3351 5 P 4.1803 0.0000 0.0000 66.0571 31.3185 179.2203 6 V 3.6186 7.6971 117.3067 64.7705 31.4208 178.1291 7 E 3.9969 8.0111 118.6641 58.6757 29.4723 178.8097 8 K 3.9035 8.1606 119.9985 59.3893 32.1890 179.1053 9 S 4.2578 8.3197 115.5044 61.2255 62.7191 176.4029 10 A 4.0448 7.9813 123.5884 55.1525 17.9771 180.1312 11 V 3.5594 7.7512 111.0860 64.7109 31.5609 178.9785 12 T 3.9847 7.6319 113.9960 66.4077 68.0315 176.8106 13 A 4.0991 7.9064 122.2616 54.9520 18.2937 179.1503 14 L 4.0456 7.9273 118.9023 57.9652 42.3482 178.9310 15 W 4.4286 8.9356 128.7336 60.0828 30.4154 178.3293 16 G 3.7751 8.2480 105.3558 47.0549 0.0000 174.8850 17 K 4.4769 7.5754 117.0745 55.4586 32.7141 177.3886 18 V 3.8804 6.8211 119.2486 61.1895 32.2287 176.2334 19 N 4.4985 8.2174 120.5678 52.6651 37.5535 176.1178 20 V 4.0449 8.0452 116.7868 61.7249 31.4847 176.3425 21 D 4.6861 8.4114 118.2731 55.3496 42.9200 177.4710 22 E 5.0964 7.9942 115.7028 56.4484 30.2631 177.5998 23 V 3.9467 7.4326 120.4243 65.1124 32.2325 177.9983 24 G 3.6953 7.9013 105.1087 47.7413 0.0000 175.6868 25 G 3.5860 7.5835 106.8652 46.9774 0.0000 175.2967 26 E 4.0242 7.9428 120.8956 58.5257 29.2828 178.3037 27 A 3.8821 8.1524 121.4578 55.1113 18.5966 179.4053 28 L 4.0935 8.2600 118.9040 57.6746 42.2571 179.2814 29 G 3.5786 7.7286 106.1942 47.5660 0.0000 175.8201 30 R 4.1063 7.9812 119.6844 57.8707 30.1332 178.7602 31 L 4.0500 7.4834 120.0603 58.2298 41.9650 178.9206 32 L 3.9968 7.4979 118.0209 57.1541 41.2859 179.3772 33 V 3.6355 7.0434 116.4950 65.2429 31.7099 177.7808 34 V 3.6152 7.3897 116.9722 63.9212 32.8683 175.6131 35 Y 3.7099 7.0840 117.0738 54.1929 37.6531 174.0341 36 P 4.5389 0.0000 0.0000 64.1997 31.5317 177.3590 37 W 4.5546 8.0468 113.9976 58.6804 28.5731 177.2904 38 T 4.6862 7.6770 110.2334 63.3736 68.8725 176.5134 39 Q 4.2893 8.2389 121.4932 58.6706 28.4633 178.1654 40 R 3.9291 8.1451 119.3701 58.9377 30.2996 177.1389 41 F 4.1697 8.0159 114.4992 58.3741 39.7613 175.6038 42 F 4.6005 7.4854 118.4013 56.4074 38.7615 175.6466 43 E 4.2541 7.9058 121.5261 58.7789 30.2744 179.0314 44 S 4.7571 8.2588 111.6159 58.5590 63.2096 174.3333 45 F 4.4567 8.3150 121.2999 57.4313 40.2509 173.7842 46 G 3.8797 8.4319 114.4481 46.1754 0.0000 171.4164 47 D 4.2552 8.8944 122.4231 54.8268 38.9719 172.7583 48 L 4.9651 7.9817 128.3327 54.2412 43.2375 178.8596 49 S 4.3145 8.3385 116.1694 60.5940 63.5440 174.4344 50 T 4.7257 7.4800 109.8241 58.0085 71.5387 172.8150 51 P 4.1970 0.0000 0.0000 66.3679 30.5370 178.4231 52 D 4.3669 8.1747 117.6616 56.4417 40.5332 177.6210 53 A 4.3875 7.9237 120.3028 53.4513 19.5393 179.2022 54 V 3.7207 7.5249 116.0508 66.3161 31.8261 177.7157 55 M 4.2990 8.0032 117.4900 57.5483 33.3129 177.8580 56 G 3.8628 7.3620 107.6278 43.9701 0.0000 173.9791 57 N 4.8175 7.5045 116.6721 50.5958 42.5936 171.9359 58 P 4.2858 0.0000 0.0000 65.8585 31.2766 178.6340 59 K 3.7209 7.7818 117.2349 59.0294 31.8599 179.4754 60 V 3.7792 7.6873 117.9958 66.0373 31.4039 177.8761 61 K 3.8839 7.8163 116.5668 59.6250 32.0240 178.8804 62 A 4.1487 8.0898 120.8205 55.4025 18.2277 179.2305 63 H 4.4196 8.5817 116.9492 59.2336 29.8672 177.7674 64 G 3.6535 8.4284 107.7786 47.4802 0.0000 175.9048 65 K 4.0255 7.8776 120.8314 59.1651 32.0122 179.1501 66 K 4.1348 8.0261 119.3747 58.8800 32.0985 179.0176 67 V 3.7228 7.5352 119.1002 65.8996 31.5123 177.8287 68 L 4.4589 8.5529 120.5384 58.0104 41.9073 179.1386 69 G 3.7706 8.1710 105.4678 47.5205 0.0000 175.6981 70 A 4.1220 8.0331 122.7329 55.0830 18.3830 179.7551 71 F 4.1646 8.3720 116.3859 60.6645 38.7879 178.2374 72 S 4.2268 8.2565 114.4308 61.6004 62.5347 175.8745 73 D 4.5607 8.4640 120.9637 56.9919 40.9808 178.5290 74 G 3.7933 8.0373 106.2912 47.5398 0.0000 175.5451 75 L 4.1026 7.7615 119.6341 56.6684 41.7032 178.6510 76 A 4.1672 7.3483 119.7150 53.2796 19.9366 177.3198 77 H 4.8674 7.5116 112.6288 54.6285 28.5531 174.4790 78 L 4.2057 7.6399 116.7718 55.4426 42.6388 177.8715 79 D 4.4567 8.0174 118.4382 55.7904 40.3965 175.9365 80 N 4.9083 7.4976 119.4782 51.5960 39.1530 173.9124 81 L 4.5358 8.1588 123.4375 56.2437 42.7718 179.4314 82 K 4.0649 8.2586 116.6500 59.0454 32.5234 177.6612 83 G 3.8720 7.9378 106.7194 46.9429 0.0000 175.6150 84 T 3.8393 7.2139 114.7882 65.7458 68.5108 175.9327 85 F 4.6491 7.8613 117.4825 57.3308 39.2382 177.6500 86 A 3.9827 7.6975 123.9496 55.4198 18.0550 180.0887 87 T 3.9898 7.7573 110.7354 64.5469 67.6165 176.5861 88 L 4.1104 7.7355 120.6448 57.1754 41.7574 179.0782 89 S 4.0962 8.4463 113.7663 61.5389 62.4798 175.7495 90 E 4.0116 7.8581 120.8833 59.4812 29.1280 179.4204 91 L 3.8613 7.5635 119.8367 58.7053 42.3172 178.8264 92 H 4.3355 8.2965 115.9570 58.3800 28.6122 177.2503 93 C 3.9979 8.4996 120.1825 61.3634 28.1682 175.6411 94 D 4.4392 7.6533 118.3832 55.5271 40.9769 177.3983 95 K 4.4451 7.9833 118.1962 56.7715 34.2059 176.4415 96 L 4.4359 8.1798 116.9284 54.5335 42.6649 175.9422 97 H 4.3800 8.1391 113.8875 55.3363 26.3297 175.0177 98 V 3.8840 7.9508 117.8781 61.8884 32.5920 174.9379 99 D 4.2040 8.6585 127.1362 53.4992 41.5051 175.0244 100 P 3.1997 0.0000 0.0000 64.8488 31.5729 177.8858 101 E 3.8792 7.6675 119.5499 59.1699 29.4552 178.1909 102 N 4.3305 7.8232 116.1466 55.9043 38.5336 177.2522 103 F 4.6290 7.4687 119.4189 60.4514 39.0196 177.9693 104 R 4.0829 7.8833 117.4887 59.1269 29.8596 178.8423 105 L 4.0124 7.9678 118.9813 57.4850 41.3710 179.2048 106 L 4.2384 8.1746 120.5670 57.8259 41.9447 179.1333 107 G 3.7993 8.1635 105.4138 47.9658 0.0000 175.3888 108 N 4.5096 8.4730 118.4920 55.3907 38.1617 177.2471 109 V 3.8070 7.6095 118.9187 64.4786 31.5991 177.7291 110 L 3.8635 7.5132 120.5067 58.2576 42.1098 178.7427 111 V 3.4027 7.4678 118.2193 66.0981 30.9267 177.5428 112 C 4.2145 7.7605 116.0491 61.7520 27.9410 175.7995 113 V 3.4957 7.1284 119.3452 65.2383 31.1807 177.9949 114 L 3.8338 7.7767 118.8377 57.4878 41.3739 179.2807 115 A 3.8061 7.2163 120.2586 54.9453 17.9914 179.3212 116 H 4.1680 7.3229 116.0174 59.8753 30.0980 176.9981 117 H 4.0630 8.3455 116.9431 58.3338 28.8592 177.0843 118 F 4.4577 8.9169 118.7646 55.2089 39.7618 177.9910 119 G 3.8508 8.6582 106.6267 46.1339 0.0000 177.0579 120 K 4.0014 9.1476 125.4211 58.9506 32.0097 176.7803 121 E 4.1907 8.2672 118.2594 57.7726 29.9923 176.8771 122 F 4.7484 7.9377 122.4489 57.2980 38.1863 175.4265 123 T 4.2022 7.3891 115.5685 60.2470 71.4872 173.4622 124 P 4.1689 0.0000 0.0000 65.5648 31.4974 177.1208 125 P 4.3186 0.0000 0.0000 64.7794 31.2739 178.6076 126 V 3.6955 7.4437 117.1688 65.3099 31.3810 177.8683 127 Q 3.4988 7.4133 118.7877 58.9946 28.8211 177.6869 128 A 4.0974 7.5643 119.8362 55.0611 18.4396 179.2816 129 A 4.0208 7.5638 118.1533 55.6136 18.5271 179.5750 130 Y 3.9487 7.9952 115.1314 61.1122 37.7653 178.7256 131 Q 4.1238 8.7605 119.6773 58.6895 28.6457 178.7069 132 K 4.0551 7.9160 119.9729 59.0523 32.0845 179.6948 133 V 3.5427 7.5467 118.1629 66.2200 31.7419 178.4834 134 V 4.0197 8.2681 111.6595 63.8020 31.2851 178.5572 135 A 4.1502 7.9557 121.2883 55.0751 18.4641 179.9266 136 G 3.5161 7.9378 103.9122 47.5352 0.0000 176.0117 137 V 3.1427 7.6888 120.1468 65.0993 30.9731 177.6719 138 A 4.1216 7.6605 119.6978 54.2530 18.2275 179.0498 139 N 4.1902 8.0480 114.4135 55.7952 38.8276 176.9440 140 A 4.2883 7.5633 120.9272 54.2769 18.9383 178.7400 141 L 3.9505 7.5824 116.9892 56.0335 42.2458 176.8596 142 A 5.1411 7.3164 121.2054 52.5464 19.8761 177.0972 143 H 4.0536 8.3054 122.0650 60.2600 30.4246 175.8355 144 K 4.2647 7.7669 118.3956 56.9170 31.8645 177.1270 145 Y 5.1074 7.7455 114.6778 57.4811 40.9523 175.5974 146 H 4.5697 8.1212 119.9808 55.6118 28.7606 173.0585 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 V 8.05 3.99 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 0.90 0.00 0.00 0.94 0.00 0.00 2 H 8.65 4.44 0.00 3.21 3.31 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.12 4.80 0.00 1.63 1.57 0.88 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.12 4.02 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 1.23 0.00 0.00 5 P 0.00 4.18 0.00 2.17 2.10 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 6 V 7.70 3.62 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 0.81 0.00 0.00 0.92 0.00 0.00 7 E 8.01 4.00 0.00 2.17 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 0.00 2.34 2.32 0.00 8 K 8.16 3.90 0.00 1.87 1.86 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.56 7.81 9 S 8.32 4.26 0.00 4.03 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 10 A 7.98 4.04 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 11 V 7.75 3.56 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 0.21 0.00 0.00 0.80 0.00 0.00 12 T 7.63 3.98 4.27 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 1.25 0.00 0.00 13 A 7.91 4.10 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 14 L 7.93 4.05 0.00 2.01 2.07 -0.03 1.09 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 15 W 8.94 4.43 0.00 3.77 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 16 G 8.25 3.78 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 0.00 0.00 0.00 17 K 7.58 4.48 0.00 2.32 2.08 0.00 1.81 0.00 0.00 2.12 0.00 0.00 3.15 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.78 7.81 18 V 6.82 3.88 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 -0.13 0.00 0.00 0.62 0.00 0.00 19 N 8.22 4.50 0.00 2.65 2.67 0.00 0.00 7.02 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 8.05 4.04 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 0.65 0.00 0.00 0.90 0.00 0.00 21 D 8.41 4.69 0.00 2.79 2.58 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 22 E 7.99 5.10 0.00 1.90 1.92 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 2.23 2.31 0.00 23 V 7.43 3.95 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 0.89 0.00 0.00 0.66 0.00 0.00 24 G 7.90 3.70 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 0.00 25 G 7.58 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 7.94 4.02 0.00 2.22 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 2.32 2.35 0.00 27 A 8.15 3.88 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 8.26 4.09 0.00 1.82 1.63 0.81 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.73 3.58 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 0.00 30 R 7.98 4.11 0.00 1.83 1.88 0.00 3.05 0.00 0.00 2.99 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 31 L 7.48 4.05 0.00 1.97 1.85 1.05 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.50 4.00 0.00 1.81 1.68 0.75 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.04 3.64 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 0.72 0.00 0.00 0.96 0.00 0.00 34 V 7.39 3.62 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 0.20 0.00 0.00 0.68 0.00 0.00 35 Y 7.08 3.71 0.00 2.61 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 4.54 0.00 2.26 2.14 0.00 3.81 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 2.14 1.93 0.00 37 W 8.05 4.55 0.00 3.48 3.43 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 38 T 7.68 4.69 4.40 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 1.15 0.00 0.00 39 Q 8.24 4.29 0.00 2.32 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 40 R 8.15 3.93 0.00 1.79 1.95 0.00 3.16 0.00 0.00 2.99 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.55 0.00 41 F 8.02 4.17 0.00 2.85 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 42 F 7.49 4.60 0.00 2.88 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 0.00 0.00 0.00 43 E 7.91 4.25 0.00 2.05 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 2.41 2.43 0.00 44 S 8.26 4.76 0.00 4.16 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 8.31 4.46 0.00 3.31 3.20 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 46 G 8.43 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 0.00 0.00 0.00 47 D 8.89 4.26 0.00 2.78 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 48 L 7.98 4.97 0.00 1.64 1.62 1.01 1.06 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 49 S 8.34 4.31 0.00 3.95 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 50 T 7.48 4.73 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 4.20 0.00 2.25 2.32 0.00 3.68 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 2.05 2.04 0.00 52 D 8.17 4.37 0.00 2.78 2.75 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 0.00 0.00 0.00 0.00 53 A 7.92 4.39 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 54 V 7.52 3.72 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 0.92 0.00 0.00 1.02 0.00 0.00 55 M 8.00 4.30 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.93 0.00 56 G 7.36 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 57 N 7.50 4.82 0.00 3.03 2.73 0.00 0.00 6.79 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 58 P 0.00 4.29 0.00 2.25 2.27 0.00 3.73 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 2.02 2.03 0.00 59 K 7.78 3.72 0.00 1.82 1.02 0.00 0.61 0.00 0.00 0.97 0.00 0.00 2.70 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.19 1.28 7.81 60 V 7.69 3.78 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 1.09 0.00 0.00 1.09 0.00 0.00 61 K 7.82 3.88 0.00 1.94 1.86 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.73 7.81 62 A 8.09 4.15 1.34 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 0.00 0.00 0.00 63 H 8.58 4.42 0.00 3.61 3.59 0.00 5.79 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 8.43 3.65 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 0.00 0.00 0.00 65 K 7.88 4.03 0.00 2.01 1.90 0.00 1.67 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.72 7.81 66 K 8.03 4.13 0.00 1.89 1.84 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.54 7.81 67 V 7.54 3.72 2.34 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 1.15 0.00 0.00 1.03 0.00 0.00 68 L 8.55 4.46 0.00 2.03 1.90 0.98 1.16 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 69 G 8.17 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.03 4.12 1.55 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 0.00 0.00 71 F 8.37 4.16 0.00 3.43 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 72 S 8.26 4.23 0.00 4.24 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 0.00 73 D 8.46 4.56 0.00 2.97 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 74 G 8.04 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 4.10 0.00 1.52 1.51 -0.32 0.50 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 76 A 7.35 4.17 1.16 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 0.00 0.00 77 H 7.51 4.87 0.00 3.23 3.29 0.00 5.81 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.64 4.21 0.00 1.56 1.83 0.81 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.02 4.46 0.00 2.59 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 N 7.50 4.91 0.00 2.75 2.61 0.00 0.00 7.25 6.54 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 81 L 8.16 4.54 0.00 1.81 1.81 1.02 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.26 4.06 0.00 1.82 2.04 0.00 1.63 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.61 1.43 7.81 83 G 7.94 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 84 T 7.21 3.84 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 0.65 0.00 0.00 85 F 7.86 4.65 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 86 A 7.70 3.98 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 87 T 7.76 3.99 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 1.15 0.00 0.00 88 L 7.74 4.11 0.00 1.94 1.79 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.45 4.10 0.00 4.12 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 90 E 7.86 4.01 0.00 2.20 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 0.00 2.29 2.43 0.00 91 L 7.56 3.86 0.00 1.75 1.77 0.88 1.38 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 92 H 8.30 4.34 0.00 3.25 3.58 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.50 4.00 0.00 2.55 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 0.00 0.00 0.00 94 D 7.65 4.44 0.00 2.74 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 7.98 4.45 0.00 1.64 1.92 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.49 7.81 96 L 8.18 4.44 0.00 1.97 1.84 0.86 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.14 4.38 0.00 3.34 3.47 0.00 5.94 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.95 3.88 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 0.31 0.00 0.00 0.76 0.00 0.00 99 D 8.66 4.20 0.00 2.73 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 0.00 100 P 0.00 3.20 0.00 2.12 2.22 0.00 3.36 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.41 0.00 101 E 7.67 3.88 0.00 2.13 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 2.24 2.32 0.00 102 N 7.82 4.33 0.00 2.69 2.82 0.00 0.00 6.95 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 0.00 103 F 7.47 4.63 0.00 3.08 2.97 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 0.00 104 R 7.88 4.08 0.00 2.13 1.99 0.00 3.26 0.00 0.00 3.53 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 105 L 7.97 4.01 0.00 1.65 1.25 0.19 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.17 4.24 0.00 1.94 1.80 1.15 1.13 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 0.00 107 G 8.16 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 0.00 0.00 0.00 108 N 8.47 4.51 0.00 2.93 2.96 0.00 0.00 6.66 6.96 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 0.00 109 V 7.61 3.81 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 1.03 0.00 0.00 1.11 0.00 0.00 110 L 7.51 3.86 0.00 1.63 1.65 0.80 0.17 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 0.00 111 V 7.47 3.40 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 1.27 0.00 0.00 1.16 0.00 0.00 112 C 7.76 4.21 0.00 3.10 2.89 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 0.00 113 V 7.13 3.50 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 1.05 0.00 0.00 0.92 0.00 0.00 114 L 7.78 3.83 0.00 0.75 0.71 0.20 0.83 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 0.00 115 A 7.22 3.81 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 0.00 116 H 7.32 4.17 0.00 3.18 3.49 0.00 5.78 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 0.00 117 H 8.35 4.06 0.00 3.19 2.91 0.00 5.71 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 8.92 4.46 0.00 3.19 3.23 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 0.00 119 G 8.66 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 0.00 120 K 9.15 4.00 0.00 1.77 1.91 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.47 7.81 121 E 8.27 4.19 0.00 2.25 2.34 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 2.48 2.37 0.00 122 F 7.94 4.75 0.00 3.01 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 0.00 123 T 7.39 4.20 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 1.30 0.00 0.00 124 P 0.00 4.17 0.00 2.15 2.13 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 2.18 0.00 125 P 0.00 4.32 0.00 2.11 2.05 0.00 3.53 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 2.08 2.10 0.00 126 V 7.44 3.70 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 1.07 0.00 0.00 0.88 0.00 0.00 127 Q 7.41 3.50 0.00 1.68 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 128 A 7.56 4.10 1.38 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 0.00 129 A 7.56 4.02 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 0.00 130 Y 8.00 3.95 0.00 3.44 3.20 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 0.00 131 Q 8.76 4.12 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.67 2.60 0.00 132 K 7.92 4.06 0.00 1.94 1.83 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.66 7.81 133 V 7.55 3.54 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 1.08 0.00 0.00 0.80 0.00 0.00 134 V 8.27 4.02 2.30 0.00 0.00 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 1.14 0.00 0.00 135 A 7.96 4.15 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 0.00 136 G 7.94 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 0.00 137 V 7.69 3.14 1.73 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 -0.33 0.00 0.00 0.62 0.00 0.00 138 A 7.66 4.12 1.47 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 0.00 139 N 8.05 4.19 0.00 2.85 2.92 0.00 0.00 6.95 6.90 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 0.00 140 A 7.56 4.29 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 0.00 141 L 7.58 3.95 0.00 1.44 0.88 -0.27 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.32 5.14 1.61 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 0.00 143 H 8.31 4.05 0.00 3.35 3.23 0.00 5.67 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 0.00 144 K 7.77 4.26 0.00 1.56 1.80 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.46 7.81 145 Y 7.75 5.11 0.00 3.21 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.57 0.00 3.18 3.25 0.00 5.78 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