NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 P 4.3532 0.0000 0.0000 62.4044 32.2799 175.9122 5 T 4.0444 7.9150 109.5394 59.1903 70.7350 173.9155 6 I 3.7002 8.3384 115.2092 64.2456 37.8437 178.8086 7 N 4.2571 8.1588 118.5569 56.5389 38.6810 176.4942 8 Q 3.9941 8.7132 119.5778 58.9446 28.1957 179.1611 9 L 4.0628 7.5277 118.9836 57.8396 41.5248 179.5129 10 V 3.6615 7.8418 117.2520 64.3107 31.7169 177.3417 11 R 4.5941 8.8876 119.9714 55.6373 29.0234 178.1063 12 K 4.1353 8.7230 128.1915 60.2129 32.6458 176.6380 13 G 3.9590 7.5874 101.7873 45.0623 0.0000 172.5463 14 R 4.2602 8.0919 117.6912 54.7234 30.6371 176.5021 15 E 4.0768 8.6032 124.7065 55.5617 30.3474 176.1429 16 K 4.2166 8.4122 127.2603 55.9218 33.2412 176.7282 17 V 3.6133 8.6921 119.2996 64.3430 31.4918 176.4188 18 R 3.5364 7.8494 118.0178 56.8840 27.2375 175.2376 19 K 4.4238 7.9023 121.5245 55.4251 34.5463 176.5332 20 K 4.5890 7.9037 116.5079 54.5857 35.8878 176.1156 21 S 4.4078 8.3941 115.6769 58.4409 63.0182 173.7973 22 K 4.4896 8.0620 117.5845 55.5008 33.6567 177.4616 23 V 4.0300 7.8285 117.7908 61.7361 33.1247 172.3098 24 P 4.5776 0.0000 0.0000 62.2604 30.3827 178.0421 25 A 4.0076 8.0252 117.6839 53.1345 18.8264 176.0840 26 L 3.3622 7.8773 123.5566 55.0777 43.0454 174.1233 27 K 3.6464 9.3672 118.5872 56.2115 29.9991 175.0083 28 G 3.9908 8.1410 103.9987 45.8716 0.0000 173.6727 29 A 4.1679 7.5597 121.2770 51.2511 18.9146 177.1220 30 P 4.0168 0.0000 0.0000 64.9483 31.7240 176.7728 31 F 5.1168 7.3285 113.5509 56.6375 43.0591 173.6437 32 R 4.7206 8.5524 119.9490 54.7993 33.5182 174.6231 33 R 4.7902 8.7184 125.7741 56.3165 32.1666 174.6185 34 G 3.9457 8.1083 108.1646 46.0426 0.0000 172.1484 35 V 4.9689 7.7647 119.3892 60.7846 34.2799 174.6202 36 C 4.4463 8.9501 125.6412 60.5116 27.9089 173.4483 37 T 4.2376 9.2975 119.7623 64.0147 68.3375 175.4784 38 V 4.3509 7.4126 120.5200 61.7830 35.1136 172.7456 39 V 4.4184 8.4548 128.5128 61.9029 32.5311 174.6383 40 R 4.7756 9.0484 127.3953 55.3945 34.6015 172.9999 41 T 5.7637 8.2970 114.6741 59.3878 70.0824 173.1594 42 V 4.7292 8.3234 120.9348 59.3458 35.8806 175.0833 43 T 4.2801 8.5028 114.3355 61.4775 69.6003 172.8885 44 P 4.6456 0.0000 0.0000 62.1825 32.9245 175.4477 45 K 4.4594 8.0311 121.3031 56.0560 32.8988 177.2124 46 K 3.6903 8.8603 121.8698 60.0053 31.9780 176.7567 47 P 4.6151 0.0000 0.0000 63.0463 32.4687 174.3649 48 N 5.2272 6.8291 116.3879 53.7560 41.1866 173.3670 49 S 4.4336 7.9444 110.1448 58.1976 64.7191 175.7346 50 A 4.2701 8.9365 134.2141 50.8905 19.4838 176.3119 51 L 4.2050 8.1824 124.2351 57.4542 40.7166 177.6505 52 R 4.4209 9.2981 123.7866 55.7144 32.0567 176.2015 53 K 4.7292 8.8661 121.1177 55.5594 33.3643 175.9336 54 V 5.1427 8.8706 124.2150 61.5469 36.0330 173.5478 55 A 5.1083 8.9245 124.0228 50.4941 23.1298 175.3215 56 K 4.8037 9.0031 121.0339 55.3115 33.9547 175.8994 57 V 4.7827 9.4103 126.5106 60.9935 34.4789 174.2490 58 R 4.6545 8.8352 128.6951 55.6114 31.1887 175.9342 59 L 4.7153 8.0707 125.5531 53.9929 42.7625 177.3443 60 T 4.0030 8.2881 111.1375 65.0241 68.9319 176.8989 61 S 4.5105 8.0316 115.9144 58.0170 62.5275 176.0445 62 G 4.0559 8.2816 108.4036 47.4482 0.0000 175.6760 63 Y 4.1959 7.9316 117.7248 59.4909 38.7173 174.2955 64 E 5.1329 8.3086 115.3314 56.7878 30.9835 176.2717 65 V 4.5674 8.4850 126.2919 60.8955 34.7206 173.9688 66 T 4.9341 8.4166 114.4896 60.6965 70.4128 173.8715 67 A 5.0924 9.1704 125.5902 50.4813 23.2924 174.5864 68 Y 4.8166 9.0281 122.5384 57.5570 40.4933 174.6562 69 I 4.4507 8.0528 127.5773 58.9957 37.8799 174.0571 70 P 3.9177 0.0000 0.0000 62.7282 32.0159 177.2631 71 G 3.9101 8.7942 107.1579 45.1165 0.0000 172.2396 72 E 4.2992 8.3618 118.0450 55.6111 30.3572 173.8037 73 G 4.0447 9.2475 118.7856 45.3471 0.0000 172.0365 74 H 4.8565 8.1422 116.0945 54.7219 31.2494 172.7728 75 N 5.0079 8.5413 113.5148 52.3846 37.9136 174.2137 76 L 4.3100 8.2051 118.1715 55.2959 42.5164 175.9211 77 Q 4.6214 8.4176 119.5830 54.4393 33.0820 175.7806 78 E 4.3728 8.5897 116.8781 56.6294 28.6938 177.0268 79 H 4.7250 8.8522 110.5272 56.1334 33.9219 174.1276 80 S 4.9330 8.3943 117.0246 58.0789 63.4151 174.3561 81 V 4.3085 8.7246 125.2263 62.1179 32.9510 175.3071 82 V 4.5295 8.6827 120.2642 61.2808 35.2941 171.1771 83 L 5.0040 8.4632 123.5027 53.8033 43.5676 174.7367 84 I 4.7484 8.8379 126.7516 59.9285 39.4170 175.6756 85 R 4.6722 9.4744 127.8507 55.0761 32.6495 172.0570 86 G 3.8521 8.6584 115.9698 43.7160 0.0000 172.8598 87 G 4.6890 7.3447 124.4491 45.2552 0.0000 172.9321 88 R 4.7760 7.8618 122.8739 55.3779 31.2725 175.8090 89 V 4.1371 7.9523 117.9347 61.8762 33.0294 175.5633 90 K 3.8203 8.8708 128.2064 59.7049 32.3885 177.9948 91 D 4.4365 8.0086 117.4517 55.6123 41.5816 175.4902 92 L 4.9220 7.3477 118.3333 51.6846 44.0704 174.4401 93 P 4.1592 0.0000 0.0000 63.5896 31.5209 176.2776 94 G 3.9347 8.7380 109.4566 46.2615 0.0000 171.9429 95 V 4.4477 7.3405 122.3042 62.3879 32.6575 173.6741 96 R 4.5917 8.3520 123.1212 55.3376 31.6303 174.7236 97 Y 5.1159 7.7567 115.4420 57.2791 42.6943 173.4174 98 H 5.2254 8.9956 119.9754 54.3614 31.2007 174.6872 99 I 4.3748 8.8903 122.9309 61.0138 39.1205 175.1086 100 V 4.2863 8.0238 125.7936 60.8396 32.8363 175.6710 101 R 4.0008 8.3846 128.0817 57.5396 30.4996 177.3512 102 G 4.1466 9.3221 111.2614 45.0683 0.0000 173.1912 103 V 4.1476 7.0687 118.0866 61.8874 35.1815 175.2963 104 Y 3.6939 8.1474 123.1270 59.5146 36.6448 171.3509 105 D 4.4337 8.6055 122.8467 56.4630 41.2091 175.2554 106 A 4.7882 7.9245 122.8596 50.3067 19.9712 177.2987 107 A 4.3141 9.5390 125.0909 52.5627 19.6808 176.6211 108 G 4.5442 8.2803 105.8702 44.3410 0.0000 174.0497 109 V 3.8632 8.3452 120.7051 62.2431 32.4393 175.4217 110 K 3.8173 8.6085 129.9465 57.8542 32.3713 176.0981 111 D 4.5984 8.9326 124.5211 54.5791 38.1467 173.9043 112 R 4.0451 7.4303 119.1023 56.2131 30.5038 176.2788 113 K 4.3587 8.5802 123.4480 56.8236 33.8900 176.6624 114 K 4.3196 7.8692 117.8713 55.9803 33.4457 176.6283 115 S 3.8000 8.6471 119.5378 60.0976 60.0772 173.8996 116 R 4.1242 7.6817 119.4297 58.8206 30.0877 178.6177 117 S 4.1457 8.0863 112.3338 60.7594 62.5374 175.1025 118 K 4.2625 7.6089 118.0612 56.7132 32.3532 176.5688 119 Y 4.5206 7.6777 116.8634 56.8266 40.0396 175.5823 120 G 4.4964 8.0420 105.7825 45.7883 0.0000 173.2962 121 T 4.7526 7.2838 112.0840 61.3070 72.2949 174.8213 122 K 4.1170 8.5145 127.0710 55.6604 33.0087 175.8867 123 K 4.1268 8.3557 124.0046 55.0259 32.4319 174.9055 124 P 4.3388 0.0000 0.0000 62.4070 31.9024 176.1423 125 K 4.0996 8.5534 120.9387 56.8408 32.0896 176.3728 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 4 P 0.00 4.35 0.00 2.19 2.15 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 1.88 1.96 0.00 5 T 7.92 4.04 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 6 I 8.34 3.70 1.87 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 1.52 1.04 0.91 0.00 0.00 7 N 8.16 4.26 0.00 2.77 2.86 0.00 0.00 7.17 7.12 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 8 Q 8.71 3.99 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 9 L 7.53 4.06 0.00 1.95 1.71 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.84 3.66 2.22 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 0.83 0.00 0.00 0.96 0.00 0.00 11 R 8.89 4.59 0.00 1.94 1.05 0.00 3.25 0.00 0.00 3.15 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 12 K 8.72 4.14 0.00 1.72 1.82 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.50 7.81 13 G 7.59 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.09 4.26 0.00 1.81 1.88 0.00 3.37 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 15 E 8.60 4.08 0.00 1.92 1.85 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 2.29 2.29 0.00 16 K 8.41 4.22 0.00 1.75 1.68 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.40 7.81 17 V 8.69 3.61 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 0.72 0.00 0.00 0.93 0.00 0.00 18 R 7.85 3.54 0.00 1.87 1.89 0.00 3.23 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 19 K 7.90 4.42 0.00 1.89 1.82 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.39 7.81 20 K 7.90 4.59 0.00 1.70 1.69 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.34 1.41 7.81 21 S 8.39 4.41 0.00 3.82 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 22 K 8.06 4.49 0.00 1.66 1.66 0.00 1.80 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.35 7.81 23 V 7.83 4.03 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 0.75 0.00 0.00 0.54 0.00 0.00 24 P 0.00 4.58 0.00 2.40 2.37 0.00 3.84 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 2.36 2.15 0.00 25 A 8.03 4.01 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 26 L 7.88 3.36 0.00 1.50 1.44 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 27 K 9.37 3.65 0.00 1.86 1.82 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.40 7.81 28 G 8.14 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 0.00 0.00 0.00 29 A 7.56 4.17 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 30 P 0.00 4.02 0.00 1.64 1.73 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 31 F 7.33 5.12 0.00 2.92 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 32 R 8.55 4.72 0.00 1.90 1.68 0.00 3.26 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 33 R 8.72 4.79 0.00 1.99 1.77 0.00 2.98 0.00 0.00 2.78 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 34 G 8.11 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 0.00 0.00 0.00 35 V 7.76 4.97 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 1.11 0.00 0.00 0.90 0.00 0.00 36 C 8.95 4.45 0.00 3.00 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 37 T 9.30 4.24 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 1.23 0.00 0.00 38 V 7.41 4.35 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 0.93 0.00 0.00 39 V 8.45 4.42 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 0.90 0.00 0.00 1.02 0.00 0.00 40 R 9.05 4.78 0.00 1.86 1.74 0.00 3.28 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 41 T 8.30 5.76 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 1.24 0.00 0.00 42 V 8.32 4.73 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 0.72 0.00 0.00 0.97 0.00 0.00 43 T 8.50 4.28 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 44 P 0.00 4.65 0.00 1.95 2.31 0.00 3.66 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 1.97 2.24 0.00 45 K 8.03 4.46 0.00 1.96 1.66 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.44 7.81 46 K 8.86 3.69 0.00 1.70 1.86 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.46 7.81 47 P 0.00 4.62 0.00 2.19 2.14 0.00 3.50 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 1.92 2.08 0.00 48 N 6.83 5.23 0.00 2.73 2.79 0.00 0.00 6.77 7.45 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 49 S 7.94 4.43 0.00 3.78 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 50 A 8.94 4.27 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 51 L 8.18 4.21 0.00 1.67 1.78 0.95 0.72 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 52 R 9.30 4.42 0.00 1.95 2.03 0.00 3.41 0.00 0.00 3.11 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.75 0.00 53 K 8.87 4.73 0.00 1.78 1.73 0.00 1.59 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.58 7.81 54 V 8.87 5.14 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 1.16 0.00 0.00 1.11 0.00 0.00 55 A 8.92 5.11 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 56 K 9.00 4.80 0.00 1.72 1.75 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.39 7.81 57 V 9.41 4.78 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 0.92 0.00 0.00 0.93 0.00 0.00 58 R 8.84 4.65 0.00 1.91 1.77 0.00 3.14 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 59 L 8.07 4.72 0.00 1.75 1.61 0.81 0.87 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 60 T 8.29 4.00 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 1.24 0.00 0.00 61 S 8.03 4.51 0.00 3.90 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 62 G 8.28 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 0.00 0.00 0.00 0.00 63 Y 7.93 4.20 0.00 2.96 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 8.31 5.13 0.00 1.92 1.80 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 2.11 2.21 0.00 65 V 8.48 4.57 1.80 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 0.94 0.00 0.00 0.74 0.00 0.00 66 T 8.42 4.93 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 1.25 0.00 0.00 67 A 9.17 5.09 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 9.03 4.82 0.00 3.00 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 69 I 8.05 4.45 1.79 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 1.00 0.49 0.72 0.00 0.00 70 P 0.00 3.92 0.00 1.96 1.93 0.00 3.55 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 1.87 2.00 0.00 71 G 8.79 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 0.00 0.00 0.00 72 E 8.36 4.30 0.00 1.93 1.89 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 2.23 2.21 0.00 73 G 9.25 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 0.00 0.00 0.00 74 H 8.14 4.86 0.00 3.22 3.26 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.54 5.01 0.00 2.80 2.87 0.00 0.00 5.99 7.79 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 76 L 8.21 4.31 0.00 1.74 1.68 0.96 0.90 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 77 Q 8.42 4.62 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.13 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 78 E 8.59 4.37 0.00 1.92 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 2.32 2.31 0.00 79 H 8.85 4.73 0.00 2.99 3.22 0.00 5.72 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 80 S 8.39 4.93 0.00 3.89 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 81 V 8.72 4.31 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 0.84 0.00 0.00 0.58 0.00 0.00 82 V 8.68 4.53 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 0.64 0.00 0.00 0.99 0.00 0.00 83 L 8.46 5.00 0.00 1.64 1.48 0.85 1.05 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 84 I 8.84 4.75 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.21 1.03 0.00 0.00 85 R 9.47 4.67 0.00 1.96 2.17 0.00 3.51 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 1.68 1.96 0.00 86 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 87 G 7.34 4.69 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 88 R 7.86 4.78 0.00 1.86 1.90 0.00 2.57 0.00 0.00 3.76 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 89 V 7.95 4.14 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 0.79 0.00 0.00 0.68 0.00 0.00 90 K 8.87 3.82 0.00 1.75 1.87 0.00 1.80 0.00 0.00 1.61 0.00 0.00 2.72 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.39 7.81 91 D 8.01 4.44 0.00 2.67 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 92 L 7.35 4.92 0.00 1.57 1.48 0.67 1.01 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 93 P 0.00 4.16 0.00 2.04 2.00 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 94 G 8.74 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 95 V 7.34 4.45 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 1.06 0.00 0.00 1.01 0.00 0.00 96 R 8.35 4.59 0.00 1.54 1.32 0.00 3.36 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 97 Y 7.76 5.12 0.00 2.91 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 98 H 9.00 5.23 0.00 3.23 3.25 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 8.89 4.37 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.64 0.88 0.00 0.00 100 V 8.02 4.29 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 0.67 0.00 0.00 0.90 0.00 0.00 101 R 8.38 4.00 0.00 1.84 1.94 0.00 3.28 0.00 0.00 3.41 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 102 G 9.32 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 0.00 103 V 7.07 4.15 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 -0.02 0.00 0.00 0.65 0.00 0.00 104 Y 8.15 3.69 0.00 3.14 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 0.00 105 D 8.61 4.43 0.00 2.90 2.74 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 0.00 106 A 7.92 4.79 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 0.00 107 A 9.54 4.31 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 0.00 108 G 8.28 4.54 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 0.00 0.00 0.00 109 V 8.35 3.86 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 0.87 0.00 0.00 1.14 0.00 0.00 110 K 8.61 3.82 0.00 1.75 1.71 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.46 7.81 111 D 8.93 4.60 0.00 2.87 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 0.00 112 R 7.43 4.05 0.00 1.76 1.80 0.00 3.13 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.48 0.00 113 K 8.58 4.36 0.00 1.75 1.81 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.36 7.81 114 K 7.87 4.32 0.00 1.71 1.73 0.00 1.89 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.43 7.81 115 S 8.65 3.80 0.00 4.14 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 0.00 116 R 7.68 4.12 0.00 1.88 2.15 0.00 3.24 0.00 0.00 3.28 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.80 0.00 117 S 8.09 4.15 0.00 3.86 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 0.00 118 K 7.61 4.26 0.00 1.65 1.47 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.44 7.81 119 Y 7.68 4.52 0.00 3.05 2.88 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 0.00 120 G 8.04 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 T 7.28 4.75 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 1.26 0.00 0.00 122 K 8.51 4.12 0.00 1.69 1.71 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.48 7.81 123 K 8.36 4.13 0.00 1.73 1.71 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.42 1.48 7.81 124 P 0.00 4.34 0.00 2.21 2.04 0.00 3.82 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 1.98 1.95 0.00 125 K 8.55 4.10 0.00 1.71 1.73 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.49 7.81