NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 S 4.5172 8.1933 115.5034 57.6057 65.7877 172.7041 6 Q 4.7144 7.2974 119.1512 53.5672 31.8735 174.1638 7 F 4.8371 9.5111 122.3112 55.4772 43.8628 173.7335 8 W 4.9262 9.0253 123.5339 56.8465 29.8255 175.9678 9 V 4.9728 9.5154 116.7886 60.3402 36.6732 174.0371 10 T 5.4004 8.8205 118.5557 61.7280 71.3147 174.4252 11 V 4.2596 9.1301 126.9161 61.9794 32.3237 175.7500 12 Q 4.6523 8.4922 122.1198 54.0941 31.0604 175.4691 13 R 4.0205 8.3776 122.3107 56.3455 30.7251 176.3364 14 T 4.6151 7.8812 114.3907 58.8471 73.4012 174.3521 15 E 3.7848 8.4678 120.8452 59.4318 29.6434 178.6366 16 A 3.8388 7.5491 119.9873 54.9332 18.4169 179.2894 17 A 4.0591 7.3408 118.9624 55.2656 18.4413 179.4617 18 E 3.9000 8.3501 118.0836 59.4584 29.4860 179.0067 19 R 3.9578 7.9867 117.7985 59.2506 30.2321 177.3493 20 C 4.5962 8.0642 113.7253 59.0253 28.4488 173.9836 21 G 3.9972 7.8459 108.5771 46.3213 0.0000 173.8885 22 L 4.5709 8.0600 119.7399 54.3574 42.3614 176.3839 23 H 4.9519 9.4815 117.3957 55.6342 32.3202 175.5655 24 G 3.8736 8.8718 108.3838 45.9940 0.0000 171.9884 25 S 5.4380 8.2096 117.6059 57.5974 65.0573 173.2897 26 Y 5.0276 9.3262 119.8250 56.7984 43.1991 173.7844 27 V 4.2881 8.5610 120.8976 61.3149 33.7043 174.1278 28 L 4.8739 8.8081 130.4692 53.5273 43.9089 174.6733 29 R 4.9172 9.0233 127.5245 54.5379 32.4314 174.6274 30 V 4.3278 8.9715 127.6517 62.0906 32.0964 175.0630 31 E 4.6250 8.8177 128.3459 54.2038 32.0281 176.8606 32 A 4.1436 8.5320 121.6107 55.0437 18.6063 177.9928 33 E 4.9405 7.6465 109.4322 55.9110 32.0429 175.9205 34 R 3.9682 7.0428 114.9066 54.7648 33.0146 173.2853 35 L 4.8901 8.2144 122.0990 54.1151 44.2646 175.2665 36 T 5.0409 8.7796 121.3015 61.6668 72.7004 172.3685 37 L 5.1426 9.1193 128.0347 53.4856 44.2191 175.0643 38 L 5.3430 9.0352 125.7379 53.2635 45.7092 175.3365 39 T 5.1231 8.6965 115.6222 59.9467 71.5760 172.8147 40 V 4.2862 8.5141 125.1398 62.8038 32.3229 175.5829 41 G 3.8957 9.3941 115.2871 44.4950 0.0000 173.7347 42 A 4.2112 8.8336 125.6541 54.2385 19.1976 179.4211 43 Q 3.8402 8.0996 117.5733 58.6523 29.4414 178.6620 44 S 4.3382 7.6254 110.8308 58.5850 63.7384 174.4829 45 Q 3.5890 8.7569 117.8738 56.4223 26.7670 172.8068 46 I 4.8140 7.2883 109.7543 58.4930 41.4916 174.4857 47 L 4.6246 8.5718 122.8258 55.2925 41.9841 176.6024 48 E 4.8449 9.5183 122.6725 53.5858 33.3443 173.5442 49 P 4.5267 0.0000 0.0000 63.3321 31.7283 175.2987 50 L 4.6213 9.0484 122.2355 55.9602 43.8374 176.8503 51 L 4.4749 7.3457 116.4208 53.1037 46.1695 175.3963 52 S 4.6912 7.6784 116.1152 56.4908 67.3747 173.6563 53 W 4.7139 9.0266 122.3658 54.0629 32.1850 173.5139 54 P 4.4559 0.0000 0.0000 62.5638 31.6994 177.3341 55 Y 4.3504 8.2385 120.6094 61.4519 37.9641 178.9492 56 T 4.1169 8.0024 108.1792 63.5692 69.2828 174.8066 57 L 4.6381 8.0819 121.5956 54.3244 42.1398 175.5869 58 L 4.8338 7.6761 120.2133 54.3615 42.3451 177.3143 59 R 4.3550 9.1932 123.9536 59.1616 30.6945 176.8993 60 R 4.6493 7.9525 112.3051 56.1154 32.0916 173.1100 61 Y 5.2310 7.7376 117.0459 56.4565 41.2746 173.4092 62 G 4.1867 8.7988 106.8959 46.9047 0.0000 172.2416 63 R 5.1165 8.1350 114.7564 55.4204 32.2463 173.7265 64 D 4.7498 8.5636 117.1187 52.1765 42.0133 175.8791 65 K 4.3193 8.7096 116.9448 58.6284 32.2116 177.6160 66 V 4.6668 8.7016 111.5898 60.9928 34.2660 174.8952 67 M 5.3697 8.1312 116.1030 54.1039 35.0601 173.3857 68 F 5.4999 9.5300 121.9683 56.7145 42.9751 173.7486 69 S 5.0191 8.0531 118.8390 56.7888 66.2541 172.4998 70 F 5.4193 8.6899 120.0621 55.4103 42.0984 172.4592 71 E 5.1687 9.4243 120.3741 54.4304 32.1569 174.5105 72 A 5.0011 9.4447 129.6290 51.1411 21.1086 177.2623 73 G 4.1153 9.0748 109.5183 45.3454 0.0000 175.0574 74 R 4.1535 8.7356 118.3387 59.0238 30.0601 178.3118 75 R 4.3518 7.8860 113.9988 56.4950 30.7005 176.3723 76 C 4.4377 7.9563 117.1078 58.7726 28.7640 173.1976 77 P 4.2215 0.0000 0.0000 65.3813 31.0710 178.1408 78 S 4.1433 7.8554 111.6845 59.0899 63.1102 175.1354 79 G 4.0541 8.1456 109.2672 44.1584 0.0000 171.1429 80 P 4.8655 0.0000 0.0000 62.2052 32.4957 175.5401 81 G 3.9679 7.6868 105.3249 43.8120 0.0000 172.2184 82 T 4.6888 7.6060 116.6339 62.2982 69.8735 174.8603 83 F 4.3009 8.5672 124.3135 55.6925 42.3092 174.4242 84 T 4.8946 7.5773 118.6895 61.7192 72.8694 172.7741 85 F 5.3842 9.2011 123.7904 55.7091 43.2583 174.2917 86 Q 4.7519 9.7273 123.3334 56.2996 29.7818 175.1734 87 T 4.5422 8.4571 114.7100 61.7265 70.8573 172.7366 88 A 4.6294 9.1083 129.7979 52.9363 19.1783 177.5970 89 Q 4.6900 8.5361 116.1162 55.6135 29.5833 178.1025 90 G 3.7564 8.3197 107.9461 48.2121 0.0000 175.5796 91 N 4.4681 8.1251 118.8920 56.3547 39.0126 176.5553 92 D 4.3667 8.0097 119.9151 57.3614 40.9100 178.5877 93 I 2.8094 7.2579 120.2450 63.9378 36.8771 178.1319 94 F 4.3034 8.3718 121.7150 61.6902 39.1819 177.2120 95 Q 3.9900 8.6731 117.7317 58.7907 28.4977 178.5952 96 A 3.9343 8.1043 121.9524 55.0771 18.3454 179.9174 97 V 3.1159 7.7320 116.9607 65.8735 31.4687 177.7271 98 E 3.7367 8.0189 119.4100 59.6268 29.4095 178.9700 99 T 3.7708 8.0566 115.6550 66.4642 68.4852 176.5143 100 A 3.9405 7.8413 122.5873 55.2644 18.3363 179.8145 101 I 3.4751 7.5362 118.5988 64.5130 36.7097 178.0487 102 H 4.0335 8.3401 119.3230 59.5237 29.4589 177.5634 103 R 3.9395 7.8660 118.4727 59.1472 29.9026 178.5891 104 Q 4.1082 7.7791 118.7576 59.1505 29.1969 178.1070 105 K 4.0763 8.1431 118.3576 59.0028 32.0802 177.4087 106 A 4.2505 7.4604 124.5387 52.3388 18.4442 176.9177 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 5 S 8.19 4.52 0.00 4.03 4.12 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 6 Q 7.30 4.71 0.00 1.68 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.68 0.00 0.00 0.00 0.00 0.00 2.06 2.27 0.00 7 F 9.51 4.84 0.00 2.83 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 8 W 9.03 4.93 0.00 3.27 3.17 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 0.00 0.00 0.00 0.00 9 V 9.52 4.97 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 0.83 0.00 0.00 1.03 0.00 0.00 10 T 8.82 5.40 4.39 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 1.38 0.00 0.00 11 V 9.13 4.26 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 0.98 0.00 0.00 0.70 0.00 0.00 12 Q 8.49 4.65 0.00 1.90 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.88 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 13 R 8.38 4.02 0.00 1.75 1.80 0.00 3.29 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 14 T 7.88 4.62 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 0.97 0.00 0.00 15 E 8.47 3.78 0.00 1.98 1.87 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 2.31 2.33 0.00 16 A 7.55 3.84 0.56 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 0.00 0.00 17 A 7.34 4.06 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 18 E 8.35 3.90 0.00 2.14 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 0.00 2.32 2.33 0.00 19 R 7.99 3.96 0.00 1.86 2.13 0.00 3.34 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 20 C 8.06 4.60 0.00 3.24 3.09 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 21 G 7.85 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.06 4.57 0.00 1.80 1.76 1.24 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 23 H 9.48 4.95 0.00 3.28 3.35 0.00 5.80 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 24 G 8.87 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 25 S 8.21 5.44 0.00 3.74 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 26 Y 9.33 5.03 0.00 2.98 2.96 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 27 V 8.56 4.29 1.69 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 0.65 0.00 0.00 -0.74 0.00 0.00 28 L 8.81 4.87 0.00 1.56 1.46 0.82 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 29 R 9.02 4.92 0.00 1.76 1.68 0.00 3.05 0.00 0.00 2.99 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.44 0.00 30 V 8.97 4.33 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 0.85 0.00 0.00 0.95 0.00 0.00 31 E 8.82 4.62 0.00 2.05 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 2.18 2.15 0.00 32 A 8.53 4.14 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 33 E 7.65 4.94 0.00 1.86 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 2.22 2.19 0.00 34 R 7.04 3.97 0.00 1.61 1.69 0.00 2.92 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.41 0.00 35 L 8.21 4.89 0.00 1.62 1.61 0.88 0.14 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 36 T 8.78 5.04 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 1.18 0.00 0.00 37 L 9.12 5.14 0.00 2.05 1.54 0.81 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 38 L 9.04 5.34 0.00 1.54 1.48 0.88 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.70 5.12 4.64 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 1.33 0.00 0.00 40 V 8.51 4.29 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 0.87 0.00 0.00 1.12 0.00 0.00 41 G 9.39 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 0.00 0.00 0.00 42 A 8.83 4.21 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 43 Q 8.10 3.84 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 44 S 7.63 4.34 0.00 3.85 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 45 Q 8.76 3.59 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 46 I 7.29 4.81 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 1.24 1.33 0.97 0.00 0.00 47 L 8.57 4.62 0.00 1.52 1.61 0.75 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 48 E 9.52 4.84 0.00 1.84 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 2.22 2.45 0.00 49 P 0.00 4.53 0.00 1.99 1.98 0.00 3.70 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 1.94 1.95 0.00 50 L 9.05 4.62 0.00 1.60 1.66 1.07 0.98 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 51 L 7.35 4.47 0.00 0.78 0.13 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 52 S 7.68 4.69 0.00 3.43 3.57 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 53 W 9.03 4.71 0.00 2.94 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 54 P 0.00 4.46 0.00 2.17 1.91 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 55 Y 8.24 4.35 0.00 3.19 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 56 T 8.00 4.12 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 1.27 0.00 0.00 57 L 8.08 4.64 0.00 1.93 1.80 0.95 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 58 L 7.68 4.83 0.00 1.96 1.80 0.85 0.92 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 59 R 9.19 4.36 0.00 1.75 2.04 0.00 3.31 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 60 R 7.95 4.65 0.00 1.79 1.97 0.00 3.05 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 61 Y 7.74 5.23 0.00 3.00 3.03 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 0.00 0.00 0.00 62 G 8.80 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 63 R 8.14 5.12 0.00 2.27 2.26 0.00 2.49 0.00 0.00 2.91 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.76 0.00 64 D 8.56 4.75 0.00 2.85 2.76 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 65 K 8.71 4.32 0.00 1.78 1.92 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.46 7.81 66 V 8.70 4.67 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 0.79 0.00 0.00 0.95 0.00 0.00 67 M 8.13 5.37 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.53 0.00 68 F 9.53 5.50 0.00 3.17 3.08 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 69 S 8.05 5.02 0.00 3.73 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 70 F 8.69 5.42 0.00 3.26 3.02 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 71 E 9.42 5.17 0.00 2.04 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 2.25 2.33 0.00 72 A 9.44 5.00 1.76 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 73 G 9.07 4.12 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 0.00 0.00 0.00 74 R 8.74 4.15 0.00 1.86 2.06 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 75 R 7.89 4.35 0.00 1.84 1.99 0.00 3.23 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 76 C 7.96 4.44 0.00 3.35 2.96 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 77 P 0.00 4.22 0.00 1.85 2.02 0.00 3.55 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 1.84 1.97 0.00 78 S 7.86 4.14 0.00 4.47 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.15 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 0.00 0.00 0.00 80 P 0.00 4.87 0.00 2.25 2.22 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 81 G 7.69 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 82 T 7.61 4.69 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 83 F 8.57 4.30 0.00 1.51 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 0.00 0.00 0.00 0.00 84 T 7.58 4.89 4.00 0.00 0.00 0.00 0.00 0.00 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 85 F 9.20 5.38 0.00 3.12 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 86 Q 9.73 4.75 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.85 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 87 T 8.46 4.54 4.39 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 1.41 0.00 0.00 88 A 9.11 4.63 1.33 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 0.00 0.00 0.00 89 Q 8.54 4.69 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 90 G 8.32 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 91 N 8.13 4.47 0.00 2.86 2.85 0.00 0.00 7.20 8.49 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 92 D 8.01 4.37 0.00 2.81 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 93 I 7.26 2.81 1.14 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.61 0.00 0.00 94 F 8.37 4.30 0.00 3.49 3.34 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 95 Q 8.67 3.99 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.79 2.62 0.00 96 A 8.10 3.93 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 97 V 7.73 3.12 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 -0.03 0.00 0.00 0.72 0.00 0.00 98 E 8.02 3.74 0.00 1.71 1.87 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 2.23 2.27 0.00 99 T 8.06 3.77 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 1.18 0.00 0.00 100 A 7.84 3.94 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 0.00 101 I 7.54 3.48 1.65 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 -0.34 0.87 0.00 0.00 102 H 8.34 4.03 0.00 3.25 3.41 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 R 7.87 3.94 0.00 1.97 1.98 0.00 3.21 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 104 Q 7.78 4.11 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.00 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 105 K 8.14 4.08 0.00 1.84 1.83 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.58 7.81 106 A 7.46 4.25 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