NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.4114 8.3349 115.4123 58.4415 64.7145 174.2440 7 I 3.9405 7.7962 122.4744 59.2327 35.3716 174.3591 8 A 4.1206 8.3665 125.3498 51.6627 20.3383 177.7889 9 I 3.8401 8.2569 123.6620 61.7235 37.9814 175.1047 10 D 4.7187 8.7733 123.6439 55.4726 42.2638 176.3796 11 S 4.7393 7.5627 109.9787 57.0822 65.8587 172.5383 12 Y 4.7426 8.3177 121.8416 56.1118 41.3165 173.8156 13 Q 4.2736 8.0339 127.8308 54.2404 31.1921 174.6391 14 E 3.9318 8.3950 124.8672 58.8165 30.2059 177.1123 15 D 4.3554 7.7620 116.9165 53.5148 41.3428 174.5296 16 P 4.1728 0.0000 0.0000 63.5146 31.1693 174.6870 17 S 4.4373 8.1515 117.1342 58.0836 65.1782 173.8478 18 V 4.2418 7.3801 122.1528 58.8214 33.4478 176.0053 19 V 4.1155 7.8005 120.3627 60.8449 32.6934 174.8842 20 V 3.6837 8.2329 127.4905 62.4114 32.0402 175.0910 21 S 4.3824 8.3208 121.2606 56.2072 64.2422 172.8953 22 N 4.5812 8.1040 125.5214 51.9194 38.1604 173.4846 23 F 4.5468 7.6266 124.2193 57.3315 39.8643 176.8294 24 F 4.8542 7.1117 116.6896 55.9245 40.6499 174.0758 25 K 4.0133 8.7947 121.3404 57.6300 32.4338 177.5706 26 G 3.6319 8.7300 113.2475 46.0462 0.0000 173.4497 27 V 3.2467 7.0603 116.5101 62.4315 32.5818 175.7726 28 R 4.2754 8.1333 124.3424 54.2158 30.1585 174.6608 29 V 4.0701 7.7657 121.5312 60.0576 32.0300 173.7474 30 P 4.6303 0.0000 0.0000 61.7022 32.0913 176.7917 31 K 4.1893 8.5157 117.3718 59.8804 32.9283 178.7890 32 D 4.3106 8.0440 117.6991 56.4928 41.3033 175.6226 33 T 3.9238 7.2601 114.0506 61.7975 66.8520 173.2640 34 E 4.5178 8.5847 129.5588 55.3142 30.3466 176.0943 35 F 4.7571 8.8795 122.7010 56.0421 40.8316 175.3305 36 Q 4.4015 8.4992 121.7144 54.0714 31.5855 174.9562 37 L 4.4778 8.0792 124.3237 54.0423 43.6319 175.9662 38 Y 4.5516 7.9787 120.2145 56.0846 39.6126 174.4126 39 K 4.1173 8.4321 126.1479 55.6424 33.0177 176.6055 40 K 4.2099 8.4790 127.6302 56.0132 32.9312 176.3128 41 R 4.1606 8.4236 125.0983 55.8193 30.7600 176.2901 42 K 4.1403 8.2528 121.3939 55.7686 34.5150 174.1486 43 Q 4.3497 8.6709 128.5930 54.6795 29.4526 175.0589 44 D 4.4610 8.4511 125.2086 54.3331 41.5528 176.0004 45 Q 4.3822 7.9291 119.5928 55.5191 29.8877 175.0772 46 F 5.0840 8.9059 117.7978 56.1073 43.3861 174.5323 47 V 4.7494 8.4346 118.7984 61.3816 34.7538 173.9613 48 L 4.8874 9.2677 128.7328 53.5452 45.6399 174.7186 49 H 4.8912 8.9087 124.4694 54.5905 32.4280 172.2092 50 G 4.1867 9.4412 115.0290 45.0640 0.0000 171.3216 51 E 5.3979 8.6275 124.5615 55.2526 33.1518 174.0008 52 N 4.8223 8.0121 120.3021 52.7050 39.8349 174.3717 53 E 4.4035 8.7548 118.6916 57.2270 29.5914 176.8033 54 R 4.4462 8.2073 117.7227 57.2572 32.5434 174.9155 55 L 4.9134 8.9425 116.1690 52.7976 46.5334 174.9182 56 E 4.7839 9.4255 122.9816 54.7455 32.4853 174.5107 57 Y 5.3560 9.2012 123.8456 55.3750 40.5192 173.6051 58 D 5.4921 8.4000 123.9552 52.6741 43.9873 175.7070 59 G 4.4599 8.5982 107.4470 46.2463 0.0000 171.3635 60 E 5.1317 8.6418 121.0165 54.4657 33.9802 173.8386 61 T 4.7675 8.2578 116.7145 61.3284 71.3832 174.9402 62 D 4.4194 8.7890 124.7965 53.8193 41.2000 176.0389 63 E 3.8999 8.7799 127.9470 59.6211 29.3804 178.1058 64 L 4.1138 7.9566 119.3434 58.4559 42.2029 178.9452 65 T 4.0729 8.2178 115.8200 66.7687 68.1479 176.4183 66 T 4.3193 7.6892 113.9523 63.9257 67.9660 175.3574 67 K 4.5750 7.8373 120.1103 56.5414 34.8825 177.4332 68 T 4.3069 7.6469 113.7445 64.7507 69.2307 174.4607 69 N 4.9421 8.0213 116.9783 51.2328 41.7955 174.3742 70 Q 4.5064 8.4550 120.6901 55.3994 30.7052 174.2926 71 Y 4.7581 8.4195 116.9265 56.6054 40.7199 174.3206 72 M 5.1017 8.6704 121.9428 53.8088 35.8914 174.1821 73 V 4.5673 8.9011 124.5322 61.3488 34.5139 174.5723 74 G 4.8889 8.5693 112.1036 44.6467 0.0000 171.6176 75 L 4.9496 8.7117 122.1252 52.8357 44.3598 174.6570 76 Y 5.5088 8.5467 124.3152 54.8058 41.4725 174.1701 77 D 4.3593 8.3322 126.7716 52.8924 41.6188 176.7409 78 K 3.4195 8.1754 127.0950 59.5577 32.2383 179.1274 79 Q 4.0948 7.7079 117.0127 57.6785 28.5712 177.7539 80 S 4.5453 7.9350 113.4264 59.2242 65.0488 175.5758 81 G 3.9897 8.8628 108.8525 45.6667 0.0000 172.7494 82 K 4.8400 7.7829 116.0418 54.1976 37.1628 176.3579 83 I 4.8094 8.2900 121.4878 59.7035 40.5317 175.2262 84 N 4.7389 9.2150 129.2265 52.2763 37.8258 174.0349 85 L 4.7564 7.9980 122.2828 54.6022 43.2964 175.9489 86 Y 4.6554 9.1760 120.2330 56.2036 42.0809 174.5688 87 R 4.4074 8.9189 125.6218 56.3798 30.7991 175.4601 88 A 4.8463 8.5592 127.3618 49.5253 22.1016 173.8712 89 P 4.4150 0.0000 0.0000 61.8264 32.7599 175.9574 90 V 3.8084 7.9321 119.6647 61.4615 31.4869 175.1635 91 V 4.4198 8.0171 128.3987 61.2922 32.7958 175.5054 92 T 4.2448 8.1916 119.1225 61.4997 68.3730 174.2825 93 S 5.1076 8.5260 122.8776 56.8989 66.3953 173.2004 94 K 4.6697 9.2362 120.5744 54.7891 36.3041 174.8814 95 I 4.6072 8.1476 121.0482 59.9188 39.5325 175.6479 96 V 4.4683 8.6332 118.4220 60.6282 36.7581 173.2235 97 S 4.4169 8.0628 114.4887 57.1600 65.2405 174.8895 98 K 4.0454 8.6053 123.8494 56.7332 28.8502 176.9480 99 F 3.9016 8.1082 116.1310 58.0325 37.4152 177.5259 100 S 4.4043 7.9064 117.6431 61.1309 62.6864 175.5631 101 K 4.4120 7.8303 116.7959 57.2824 33.8506 177.3938 102 N 4.4632 8.2570 116.4555 56.6677 39.0469 176.1759 103 L 4.1576 7.3818 116.5039 56.8236 42.0767 177.4575 104 G 3.7575 7.9979 111.5369 45.6281 0.0000 173.3818 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 6 S 8.33 4.41 0.00 3.99 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 7 I 7.80 3.94 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 1.34 0.20 0.91 0.00 0.00 8 A 8.37 4.12 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 9 I 8.26 3.84 1.87 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 1.29 0.57 0.94 0.00 0.00 10 D 8.77 4.72 0.00 2.63 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 11 S 7.56 4.74 0.00 3.97 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 12 Y 8.32 4.74 0.00 2.83 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 13 Q 8.03 4.27 0.00 1.84 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.78 0.00 0.00 0.00 0.00 0.00 2.12 2.34 0.00 14 E 8.40 3.93 0.00 1.87 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 0.00 2.36 2.44 0.00 15 D 7.76 4.36 0.00 2.60 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.17 0.00 2.00 2.00 0.00 3.59 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 2.01 2.08 0.00 17 S 8.15 4.44 0.00 3.86 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 18 V 7.38 4.24 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 0.71 0.00 0.00 0.89 0.00 0.00 19 V 7.80 4.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.89 0.00 0.00 20 V 8.23 3.68 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 0.76 0.00 0.00 0.89 0.00 0.00 21 S 8.32 4.38 0.00 3.56 3.16 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 22 N 8.10 4.58 0.00 2.57 2.61 0.00 0.00 7.06 7.02 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 23 F 7.63 4.55 0.00 2.72 2.82 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 24 F 7.11 4.85 0.00 3.11 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 25 K 8.79 4.01 0.00 1.88 1.89 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.49 7.81 26 G 8.73 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 27 V 7.06 3.25 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 -0.18 0.00 0.00 0.69 0.00 0.00 28 R 8.13 4.28 0.00 1.81 1.83 0.00 3.24 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 29 V 7.77 4.07 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 0.94 0.00 0.00 0.63 0.00 0.00 30 P 0.00 4.63 0.00 2.09 2.01 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 31 K 8.52 4.19 0.00 1.92 2.07 0.00 1.53 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.37 7.81 32 D 8.04 4.31 0.00 2.65 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 33 T 7.26 3.92 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 1.38 0.00 0.00 34 E 8.58 4.52 0.00 2.00 1.90 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 2.30 2.37 0.00 35 F 8.88 4.76 0.00 2.95 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 36 Q 8.50 4.40 0.00 2.05 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 37 L 8.08 4.48 0.00 1.53 1.44 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.98 4.55 0.00 2.95 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 39 K 8.43 4.12 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.44 7.81 40 K 8.48 4.21 0.00 1.78 1.71 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.47 7.81 41 R 8.42 4.16 0.00 1.86 1.87 0.00 3.32 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 42 K 8.25 4.14 0.00 1.67 1.65 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.33 7.81 43 Q 8.67 4.35 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 44 D 8.45 4.46 0.00 2.40 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 0.00 0.00 0.00 45 Q 7.93 4.38 0.00 1.94 1.98 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 2.34 2.34 0.00 46 F 8.91 5.08 0.00 2.81 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 47 V 8.43 4.75 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 0.81 0.00 0.00 0.96 0.00 0.00 48 L 9.27 4.89 0.00 1.75 1.46 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.91 4.89 0.00 3.14 3.18 0.00 5.96 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 50 G 9.44 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 0.00 0.00 0.00 0.00 51 E 8.63 5.40 0.00 1.97 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 2.34 0.00 52 N 8.01 4.82 0.00 2.98 2.82 0.00 0.00 6.98 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 53 E 8.75 4.40 0.00 2.00 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 2.31 0.00 54 R 8.21 4.45 0.00 1.72 1.89 0.00 3.19 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 55 L 8.94 4.91 0.00 1.45 0.95 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 56 E 9.43 4.78 0.00 1.83 1.64 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 2.10 2.22 0.00 57 Y 9.20 5.36 0.00 2.84 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 58 D 8.40 5.49 0.00 2.58 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.60 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.64 5.13 0.00 2.03 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 2.28 2.33 0.00 61 T 8.26 4.77 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 1.37 0.00 0.00 62 D 8.79 4.42 0.00 2.80 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 63 E 8.78 3.90 0.00 2.01 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 2.32 2.56 0.00 64 L 7.96 4.11 0.00 1.81 1.83 0.93 0.84 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 65 T 8.22 4.07 4.45 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 1.45 0.00 0.00 66 T 7.69 4.32 4.31 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 1.45 0.00 0.00 67 K 7.84 4.58 0.00 1.85 1.79 0.00 1.91 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.45 7.81 68 T 7.65 4.31 4.26 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 1.21 0.00 0.00 69 N 8.02 4.94 0.00 2.58 2.44 0.00 0.00 7.15 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 70 Q 8.45 4.51 0.00 2.31 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.71 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 71 Y 8.42 4.76 0.00 3.03 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 72 M 8.67 5.10 0.00 1.97 1.89 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00 73 V 8.90 4.57 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 0.98 0.00 0.00 0.95 0.00 0.00 74 G 8.57 4.89 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 0.00 0.00 0.00 75 L 8.71 4.95 0.00 1.68 1.63 0.98 0.68 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 76 Y 8.55 5.51 0.00 2.87 2.83 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 77 D 8.33 4.36 0.00 2.59 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 78 K 8.18 3.42 0.00 1.66 1.82 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.45 7.81 79 Q 7.71 4.09 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 80 S 7.94 4.55 0.00 3.96 4.05 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 0.00 0.00 0.00 81 G 8.86 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 82 K 7.78 4.84 0.00 1.65 1.69 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.34 7.81 83 I 8.29 4.81 1.97 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.82 0.94 0.00 0.00 84 N 9.22 4.74 0.00 2.86 2.88 0.00 0.00 6.64 7.47 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 85 L 8.00 4.76 0.00 1.47 1.58 0.91 0.86 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 86 Y 9.18 4.66 0.00 2.76 2.77 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 87 R 8.92 4.41 0.00 1.87 1.90 0.00 3.24 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 88 A 8.56 4.85 1.18 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 0.00 0.00 0.00 89 P 0.00 4.41 0.00 1.91 1.77 0.00 3.48 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.44 0.00 90 V 7.93 3.81 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.21 0.00 0.00 91 V 8.02 4.42 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 0.94 0.00 0.00 0.90 0.00 0.00 92 T 8.19 4.24 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 1.18 0.00 0.00 93 S 8.53 5.11 0.00 3.81 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 94 K 9.24 4.67 0.00 1.60 1.66 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.38 7.81 95 I 8.15 4.61 1.78 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 0.65 0.55 0.00 0.00 96 V 8.63 4.47 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 0.64 0.00 0.00 0.88 0.00 0.00 97 S 8.06 4.42 0.00 3.74 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 98 K 8.61 4.05 0.00 1.88 1.82 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.42 7.81 99 F 8.11 3.90 0.00 3.18 3.05 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 0.00 0.00 0.00 100 S 7.91 4.40 0.00 3.87 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 0.00 101 K 7.83 4.41 0.00 1.71 1.83 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.32 7.81 102 N 8.26 4.46 0.00 2.67 2.87 0.00 0.00 7.01 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 0.00 103 L 7.38 4.16 0.00 2.03 1.73 1.23 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 104 G 8.00 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