NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2963 8.3001 120.3491 54.8055 34.1787 175.4993 2 A 4.3889 7.6082 120.1337 49.9487 21.2199 175.0473 3 A 4.6351 8.0697 122.0614 50.7617 20.3751 174.4751 4 T 4.7405 7.8909 112.5368 61.3383 69.6265 174.5631 5 V 4.3909 7.4048 116.7716 62.1336 33.9319 171.2424 6 C 4.8758 8.8467 122.8166 58.2559 30.7928 173.4391 7 T 4.9615 8.5976 120.4668 62.5044 70.0887 174.1886 8 I 4.6554 7.9613 116.6835 58.8970 40.6647 174.4169 9 A 4.1432 8.7359 122.0564 56.0427 18.1438 178.8192 10 D 4.8219 7.6892 113.0451 52.3586 42.3369 173.5593 11 M 4.7791 7.3503 118.4352 55.5011 36.7771 174.2175 12 T 4.7719 8.5705 117.5384 61.7725 72.0323 173.5238 13 V 4.4823 8.9405 127.9517 61.8580 33.6922 174.1940 14 D 5.2484 8.8645 127.2461 52.7674 42.7935 176.4018 15 M 4.3005 8.9643 123.3743 56.5936 32.1013 177.2329 16 V 4.1537 7.7296 111.5970 62.0608 33.1366 176.6494 17 R 4.3261 7.9574 115.8377 55.2063 31.6759 175.8358 18 R 3.9412 7.9235 116.5867 57.2126 27.8974 174.3683 19 T 4.9260 7.1837 107.0533 60.3157 74.0423 174.8636 20 V 4.8666 8.2193 113.6410 59.9625 35.6579 174.7711 21 I 4.4729 8.8401 127.8965 59.7683 38.9639 175.0419 22 R 4.5752 9.2027 129.8284 54.9026 31.2490 176.0438 23 S 3.7395 9.0829 118.5621 59.2590 61.4188 172.7964 24 G 3.8817 8.8023 103.2693 44.7852 0.0000 173.9363 25 K 4.4697 8.1831 119.3028 53.7352 34.3573 175.5087 26 K 4.6943 8.6350 126.2872 56.4297 32.6960 176.5381 27 I 4.1625 8.3107 128.5045 61.4383 37.9641 174.7618 28 H 5.0597 8.6308 125.1283 54.6655 32.0973 173.1432 29 L 4.3845 7.6418 122.7131 54.1909 43.3272 174.4243 30 T 4.4349 8.0203 112.8565 60.4537 70.3984 174.7134 31 G 3.6293 8.3672 107.1236 47.9236 0.0000 175.6561 32 K 3.7885 7.8845 121.0221 59.2007 32.2403 179.1384 33 E 3.9769 8.1532 118.1146 59.6308 29.2721 178.7440 34 Y 4.3060 8.3615 120.0612 60.5308 38.9112 178.2493 35 V 3.3331 7.6748 119.3785 65.7400 31.7110 177.9657 36 L 3.9200 7.7168 118.6331 57.9763 41.5089 179.6086 37 L 4.0757 7.8623 118.5623 57.2906 41.5830 179.1711 38 E 3.7194 8.0992 119.1490 59.4782 29.3812 179.4920 39 L 3.9686 7.6687 118.3351 57.4874 41.5548 179.2692 40 L 3.9886 7.5426 117.9928 57.8785 42.0014 179.3844 41 L 4.1411 8.3794 119.9151 58.8673 40.2369 178.9709 42 Q 4.0159 7.9136 119.5186 58.1158 29.2433 177.5835 43 R 4.5574 8.1907 117.8784 54.9325 31.0187 175.6173 44 T 4.0124 7.0213 113.5551 64.1125 67.5847 173.8943 45 G 4.1577 9.5762 116.3002 45.1469 0.0000 173.2059 46 E 4.7058 7.6653 115.8513 54.1246 32.6269 175.1849 47 V 4.2027 8.3257 121.2010 62.6668 32.4648 174.9758 48 L 5.0527 8.5036 127.3521 52.9254 43.9436 174.0612 49 P 4.6631 0.0000 0.0000 63.1139 32.1120 176.3306 50 R 4.3438 8.5490 118.3511 58.1188 30.5338 177.7527 51 S 4.3150 8.1106 114.2455 60.7208 62.9194 176.1086 52 L 4.0773 7.8331 123.0173 57.9601 41.9568 178.5792 53 I 3.6443 7.7929 119.4558 64.6405 36.9897 178.2763 54 S 4.1520 8.3420 115.0229 61.7569 62.0290 176.5180 55 S 4.1719 8.0694 116.5020 60.8689 61.9358 175.5716 56 L 3.9214 7.9458 120.2784 56.9641 41.4113 176.7002 57 V 4.0624 7.1609 109.0147 62.0101 34.2126 177.1131 58 W 4.5498 7.2700 123.7252 56.4002 30.0752 177.3569 59 N 4.2774 8.1772 117.3220 53.3538 40.0752 173.7281 60 M 4.5856 8.1943 115.5880 54.0346 33.0594 174.6376 61 N 4.4573 7.8582 115.5932 53.0333 41.6902 175.2421 62 F 4.4471 9.0644 124.6744 60.7660 39.8449 174.8102 63 D 4.5331 7.1218 116.6067 52.7677 42.8599 174.5919 64 S 4.7096 8.1121 113.6309 57.0642 64.5129 175.5466 65 D 4.5230 8.4846 127.9828 55.6808 38.3468 175.9295 66 T 3.5272 8.6889 117.5558 63.3800 66.6790 171.2247 67 N 4.2267 7.8688 112.0491 53.5062 37.1944 177.3036 68 V 3.7431 8.2292 119.6448 64.6911 31.7003 177.3493 69 I 3.6338 7.6368 120.2960 64.3215 37.1150 177.4681 70 D 3.8684 7.8652 118.2017 57.4262 41.0713 178.4739 71 V 3.6223 7.7834 118.2232 65.7519 31.5704 177.8917 72 A 4.0451 8.0327 120.8803 54.9367 18.1779 179.7648 73 V 3.5735 7.6519 116.7379 65.9997 31.6689 178.5937 74 R 4.0202 8.0364 118.2554 58.9515 29.7172 179.1594 75 R 3.9583 8.2359 115.9957 59.1544 29.9694 178.6189 76 L 4.1095 7.8897 120.4610 58.2803 40.5532 179.2456 77 R 3.8793 8.0370 119.6758 59.1561 29.9109 177.7205 78 S 4.4239 7.7260 109.3359 59.1665 62.5598 175.2554 79 K 4.1996 7.6430 119.9752 59.4818 32.1990 176.7462 80 I 4.4502 7.2693 115.5574 62.4100 43.7648 176.0948 81 D 4.6127 8.0026 117.9658 56.2919 40.9208 176.6036 82 D 4.5173 7.8322 118.8575 56.6146 41.2125 176.6266 83 D 4.8205 7.9588 115.1814 54.7249 42.8098 175.7839 84 F 3.9857 7.7331 116.8169 59.1344 39.3935 174.9014 85 E 4.7387 8.0711 121.3593 53.6700 32.4104 174.4498 86 P 4.5408 0.0000 0.0000 61.8852 32.3221 177.1224 87 K 4.1805 8.3016 117.2800 57.6460 30.4676 176.2868 88 L 5.0585 8.0068 124.7672 54.8473 43.2437 175.7582 89 I 4.4899 7.5239 121.0612 61.0518 37.9958 175.0895 90 H 5.0721 9.0962 123.5322 54.3734 33.1489 172.6095 91 T 4.5894 8.4171 117.9359 61.5922 71.9315 173.4514 92 V 3.9554 7.9878 124.9636 60.7249 32.5426 174.2687 93 R 3.9665 8.4190 127.9019 60.6802 29.0249 175.6753 94 G 4.1948 9.2938 116.3952 45.4330 0.0000 172.6879 95 A 4.6409 7.3312 121.2002 49.8548 24.9982 180.8136 96 G 4.4249 7.8952 109.6912 45.8213 0.0000 173.7774 97 Y 4.7977 5.3700 117.2331 56.7097 43.7414 175.1103 98 V 4.9635 8.8583 121.9805 60.1666 35.6096 173.3449 99 L 5.2053 7.9781 121.5773 54.1891 42.6502 174.9985 100 E 4.9026 9.1537 122.2643 56.0782 33.6958 174.6436 101 I 4.6362 7.8345 116.1929 59.2500 39.5124 176.9143 102 R 4.2445 8.4322 118.3230 58.5376 30.0529 177.3625 103 E 3.9876 8.2800 118.8264 58.8892 29.8319 175.9367 104 E 4.1104 7.5300 123.5999 56.4636 29.5742 176.0835 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 8.30 4.30 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 2 A 7.61 4.39 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 3 A 8.07 4.64 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 4 T 7.89 4.74 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 5 V 7.40 4.39 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 0.64 0.00 0.00 0.98 0.00 0.00 6 C 8.85 4.88 0.00 2.87 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 7 T 8.60 4.96 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 1.25 0.00 0.00 8 I 7.96 4.66 1.89 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 1.38 0.96 0.93 0.00 0.00 9 A 8.74 4.14 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 10 D 7.69 4.82 0.00 2.74 2.54 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 11 M 7.35 4.78 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 12 T 8.57 4.77 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 1.22 0.00 0.00 13 V 8.94 4.48 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 1.09 0.00 0.00 0.95 0.00 0.00 14 D 8.86 5.25 0.00 2.76 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 M 8.96 4.30 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.45 0.00 16 V 7.73 4.15 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 0.75 0.00 0.00 1.04 0.00 0.00 17 R 7.96 4.33 0.00 1.97 1.99 0.00 3.37 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 18 R 7.92 3.94 0.00 2.08 1.96 0.00 3.28 0.00 0.00 3.34 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 19 T 7.18 4.93 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 1.27 0.00 0.00 20 V 8.22 4.87 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 0.93 0.00 0.00 0.98 0.00 0.00 21 I 8.84 4.47 1.89 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 1.13 0.57 0.95 0.00 0.00 22 R 9.20 4.58 0.00 1.97 1.91 0.00 3.12 0.00 0.00 2.74 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.65 0.00 23 S 9.08 3.74 0.00 3.95 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 24 G 8.80 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 25 K 8.18 4.47 0.00 2.03 1.80 0.00 1.71 0.00 0.00 1.51 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.40 7.81 26 K 8.63 4.69 0.00 1.79 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.62 7.81 27 I 8.31 4.16 1.90 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.01 0.86 0.00 0.00 28 H 8.63 5.06 0.00 3.05 3.13 0.00 5.93 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 29 L 7.64 4.38 0.00 1.69 1.57 0.84 0.74 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 30 T 8.02 4.43 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 1.25 0.00 0.00 31 G 8.37 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 32 K 7.88 3.79 0.00 1.76 1.79 0.00 1.67 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.25 1.41 7.81 33 E 8.15 3.98 0.00 2.12 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 2.38 2.42 0.00 34 Y 8.36 4.31 0.00 3.06 3.10 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 0.00 0.00 0.00 0.00 35 V 7.67 3.33 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 0.97 0.00 0.00 0.91 0.00 0.00 36 L 7.72 3.92 0.00 1.81 1.65 0.85 0.65 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 37 L 7.86 4.08 0.00 1.81 1.72 0.94 1.01 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 38 E 8.10 3.72 0.00 1.75 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 0.00 1.47 1.47 0.00 39 L 7.67 3.97 0.00 1.64 1.68 0.89 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 40 L 7.54 3.99 0.00 1.80 1.75 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.38 4.14 0.00 1.87 1.95 0.97 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 7.91 4.02 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.36 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 43 R 8.19 4.56 0.00 1.88 1.89 0.00 3.37 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 44 T 7.02 4.01 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 1.23 0.00 0.00 45 G 9.58 4.16 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 0.00 46 E 7.67 4.71 0.00 2.06 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 2.23 2.34 0.00 47 V 8.33 4.20 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 0.80 0.00 0.00 0.92 0.00 0.00 48 L 8.50 5.05 0.00 1.78 1.73 0.99 0.83 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 49 P 0.00 4.66 0.00 2.13 2.15 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 50 R 8.55 4.34 0.00 1.95 1.98 0.00 3.19 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 51 S 8.11 4.31 0.00 4.10 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 52 L 7.83 4.08 0.00 1.79 1.71 0.92 1.07 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 53 I 7.79 3.64 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.54 0.86 0.00 0.00 54 S 8.34 4.15 0.00 4.25 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 0.00 55 S 8.07 4.17 0.00 4.12 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 56 L 7.95 3.92 0.00 1.82 1.64 0.86 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.16 4.06 1.66 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 0.60 0.00 0.00 0.96 0.00 0.00 58 W 7.27 4.55 0.00 3.41 3.01 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 59 N 8.18 4.28 0.00 2.87 2.88 0.00 0.00 7.13 7.23 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 60 M 8.19 4.59 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 61 N 7.86 4.46 0.00 2.79 2.65 0.00 0.00 6.62 7.74 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 62 F 9.06 4.45 0.00 2.93 3.11 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 0.00 0.00 0.00 0.00 63 D 7.12 4.53 0.00 2.73 2.54 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 64 S 8.11 4.71 0.00 3.74 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 65 D 8.48 4.52 0.00 2.74 2.49 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 0.00 0.00 0.00 0.00 66 T 8.69 3.53 4.17 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 1.14 0.00 0.00 67 N 7.87 4.23 0.00 2.92 2.82 0.00 0.00 6.81 7.10 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 68 V 8.23 3.74 2.18 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 0.96 0.00 0.00 1.11 0.00 0.00 69 I 7.64 3.63 1.79 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.27 0.77 0.00 0.00 70 D 7.87 3.87 0.00 2.68 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 71 V 7.78 3.62 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 0.99 0.00 0.00 0.95 0.00 0.00 72 A 8.03 4.05 1.40 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 0.00 0.00 0.00 73 V 7.65 3.57 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 1.09 0.00 0.00 0.78 0.00 0.00 74 R 8.04 4.02 0.00 1.89 1.97 0.00 3.38 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.91 0.00 75 R 8.24 3.96 0.00 1.92 2.15 0.00 3.13 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.62 0.00 76 L 7.89 4.11 0.00 1.96 2.10 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.04 3.88 0.00 2.07 2.10 0.00 3.26 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 78 S 7.73 4.42 0.00 4.03 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 79 K 7.64 4.20 0.00 1.95 1.79 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.48 7.81 80 I 7.27 4.45 1.60 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.08 0.79 0.00 0.00 81 D 8.00 4.61 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 82 D 7.83 4.52 0.00 2.71 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 83 D 7.96 4.82 0.00 2.68 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 84 F 7.73 3.99 0.00 3.17 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 85 E 8.07 4.74 0.00 2.38 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 2.26 2.27 0.00 86 P 0.00 4.54 0.00 2.19 2.11 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 87 K 8.30 4.18 0.00 1.85 1.91 0.00 1.58 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.46 7.81 88 L 8.01 5.06 0.00 1.68 1.74 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.52 4.49 1.90 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 1.40 0.50 1.08 0.00 0.00 90 H 9.10 5.07 0.00 3.05 3.06 0.00 5.55 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.42 4.59 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 0.79 0.00 0.00 92 V 7.99 3.96 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 0.90 0.00 0.00 0.89 0.00 0.00 93 R 8.42 3.97 0.00 1.75 1.86 0.00 3.29 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 94 G 9.29 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 95 A 7.33 4.64 1.21 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 0.00 0.00 96 G 7.90 4.42 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 0.00 97 Y 5.37 4.80 0.00 2.96 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 98 V 8.86 4.96 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 0.73 0.00 0.00 0.95 0.00 0.00 99 L 7.98 5.21 0.00 1.67 1.71 0.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 100 E 9.15 4.90 0.00 2.04 1.83 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 2.11 2.20 0.00 101 I 7.83 4.64 1.89 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 1.49 0.74 0.96 0.00 0.00 102 R 8.43 4.24 0.00 1.96 2.19 0.00 3.11 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 103 E 8.28 3.99 0.00 1.96 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 0.00 2.30 2.31 0.00 104 E 7.53 4.11 0.00 2.12 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 2.33 2.31 0.00