NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4290 8.3044 120.3555 55.1256 33.5045 174.5410 2 L 4.3296 8.4587 128.5722 54.0640 43.8263 169.8924 3 V 5.0494 9.2642 127.8770 61.2963 34.2045 173.5319 4 A 5.3364 9.2668 130.4011 50.7891 21.3107 175.1100 5 Y 5.7618 8.2212 118.0306 55.7729 42.0436 173.2137 6 D 5.0104 8.6554 118.3136 53.0292 44.9812 174.6218 7 S 4.5231 8.5579 116.9112 57.5669 65.4677 173.3582 8 M 4.1148 7.8720 127.7245 57.5597 32.4645 176.6451 9 T 4.3436 7.6607 104.5097 61.1712 69.4288 174.7209 10 G 4.0388 7.9697 111.7552 45.9062 0.0000 176.0567 11 N 4.3336 8.2390 117.2897 56.4492 38.5761 177.2028 12 V 3.7958 7.8048 119.1660 65.9356 31.7261 177.6981 13 K 3.6567 8.1002 118.9137 59.3573 31.8487 178.5408 14 R 3.8188 8.0584 118.2395 59.3029 30.4565 177.8009 15 F 4.1060 8.3109 120.6707 61.4183 39.3406 177.2316 16 I 3.5022 7.9577 112.6711 64.0961 37.4119 177.8702 17 H 4.0856 8.0614 117.8710 58.3631 28.2321 177.7218 18 K 4.0284 7.4335 119.1637 58.8240 30.9316 178.9903 19 L 3.8773 7.3222 119.3289 55.3552 41.2200 177.4080 20 N 4.3361 7.3518 112.8545 54.4365 36.6636 173.9053 21 M 4.5982 7.0155 116.4082 52.6622 34.4321 174.3791 22 P 4.4507 0.0000 0.0000 63.4416 32.3418 175.3899 23 A 5.4106 8.4652 124.8400 50.5425 22.6688 175.5721 24 V 4.4495 9.0228 120.2043 59.7352 34.9384 174.5549 25 Q 3.4604 8.5286 126.2901 55.2990 29.4261 175.6503 26 I 3.4688 7.6647 128.1985 61.9035 37.8493 175.0320 27 D 4.5169 8.0109 122.9637 52.8551 41.7260 175.2683 28 E 4.1835 8.6852 117.2969 57.5077 29.6966 176.9866 29 D 4.8399 7.5025 116.7916 52.4305 40.8160 176.3450 30 L 3.9451 7.9612 123.0091 55.3791 42.4178 176.0353 31 V 4.4427 8.2982 124.9746 61.0564 33.5765 174.2779 32 I 4.3247 8.7222 129.0083 59.9697 38.2228 175.2614 33 D 4.9530 8.6701 123.6039 52.6460 39.6619 175.3486 34 E 4.7702 7.7641 115.5955 54.8285 32.4373 174.2373 35 D 4.9077 8.6682 119.7506 55.5091 41.4267 176.0361 36 F 5.2727 8.8996 116.1999 55.6917 42.1628 172.9279 37 I 4.8275 8.8664 120.7357 59.6870 39.5246 174.4796 38 L 5.1757 8.7255 128.9278 54.0674 44.1859 175.0077 39 I 5.0291 9.0192 127.2578 60.0082 39.4959 174.6389 40 T 5.0196 8.7135 121.6353 60.3494 71.0157 172.4386 41 Y 5.2101 7.9622 123.1505 55.2763 40.6907 174.3359 42 T 4.6018 8.3108 115.3492 61.9662 70.8290 174.1192 43 T 4.5235 8.3705 119.4390 60.3515 71.6290 174.9972 44 G 3.5375 7.9660 113.4672 47.1989 0.0000 177.1228 45 F 4.3288 8.5307 115.5984 55.8792 37.3389 175.4050 46 G 3.7561 7.5693 107.8526 45.7386 0.0000 170.7163 47 N 4.7805 7.8364 117.0144 50.9946 40.3863 174.6586 48 V 3.8211 7.9449 120.5065 61.7506 32.4181 174.9714 49 P 4.2691 0.0000 0.0000 62.2713 33.0408 177.0274 50 E 3.8879 8.7331 121.7153 59.5998 29.6033 179.3157 51 R 3.8858 7.9288 118.1675 59.3719 30.0888 178.5589 52 V 3.6560 7.6492 117.6224 65.9209 31.6069 177.7582 53 L 4.0502 8.1589 118.9347 57.9708 40.9352 179.3218 54 D 4.3608 8.5005 119.0815 57.2571 40.7764 178.5264 55 F 4.1409 8.3485 121.0934 61.4810 39.1933 177.2563 56 L 3.8253 8.1312 117.3601 57.5806 41.4140 178.7603 57 E 4.1280 8.1733 118.0873 59.5239 29.4721 179.0922 58 R 4.2581 7.3058 115.5569 57.1462 30.4772 176.8149 59 N 4.8840 7.3095 115.3046 52.7493 39.7776 175.0431 60 N 4.3325 7.9866 116.4733 53.9835 38.1991 176.3779 61 E 3.8659 8.2807 119.8470 58.9674 29.8501 177.3746 62 K 4.4161 7.9112 115.1388 55.7641 32.6050 175.1592 63 L 3.2990 7.4094 122.3853 55.0763 41.8086 176.8489 64 K 4.4031 8.7855 125.0240 55.3853 33.8193 176.1525 65 G 4.2205 7.0166 109.0153 46.1578 0.0000 172.1039 66 V 5.2431 8.0453 119.0923 59.9088 35.1097 174.3249 67 S 5.9629 9.5414 117.3994 55.7817 65.7217 172.3201 68 A 5.0911 8.1422 125.9172 49.9606 22.0425 175.1508 69 S 3.4576 8.4091 117.3778 57.8982 63.7017 173.2680 70 G 4.1992 8.5115 113.2277 46.2076 0.0000 171.5689 71 N 5.3321 9.0243 119.9161 52.4303 42.0409 176.3421 72 R 3.7547 9.3758 125.8174 58.3154 30.2161 177.9844 73 N 4.4821 8.7549 114.9785 54.1238 37.5546 175.6018 74 W 4.4217 8.8242 119.5275 56.1130 30.6996 177.4787 75 G 3.7821 7.9075 110.6283 47.0582 0.0000 175.8188 76 D 4.7002 9.0218 123.8819 54.3032 39.6639 176.2950 77 M 4.3736 8.4735 119.9139 55.2270 32.3557 175.4103 78 F 4.4192 8.3584 122.6677 59.6073 39.7063 174.7175 79 G 3.4267 8.6585 115.5977 46.4976 0.0000 174.8904 80 A 4.4360 7.9351 124.9188 53.5156 18.1567 180.3677 81 S 3.9732 7.9542 112.8664 61.6487 62.7738 176.5152 82 A 3.9547 7.8665 124.2730 54.8180 17.9649 179.2613 83 D 4.2956 7.8990 116.9164 57.4541 40.9649 179.0721 84 K 3.9518 8.0351 118.8153 59.5477 32.0829 179.5869 85 I 3.8566 7.7551 120.0562 64.3509 37.0854 178.3415 86 S 4.3582 8.3238 115.7282 61.2435 61.9900 176.4747 87 T 3.8495 7.7421 116.9998 66.3470 68.2493 176.5217 88 K 3.8803 7.8243 120.3834 59.3440 32.4031 177.8053 89 Y 4.4429 7.7129 113.1304 56.6771 39.2763 175.0229 90 E 3.8661 8.0650 118.7021 57.8576 27.3592 174.3391 91 V 4.5611 7.0752 110.7984 58.4804 36.1964 174.1408 92 P 4.4034 0.0000 0.0000 62.8136 32.9151 175.7627 93 I 4.4123 8.2186 122.4537 60.9874 36.6397 175.9780 94 V 3.8227 8.8255 128.9439 65.2707 31.7541 175.9950 95 S 4.9499 7.7168 111.9104 57.8218 65.8731 173.8764 96 K 5.1302 8.8982 119.5393 54.6674 35.1113 175.6095 97 F 5.2510 8.4141 117.5534 55.4893 42.0935 172.9877 98 E 5.0462 9.1268 119.1102 55.4492 31.0140 175.9906 99 L 3.5103 8.7079 124.0838 56.5943 40.8666 176.1349 100 S 4.7497 9.0560 122.2036 58.9884 63.2785 174.6449 101 G 4.2090 8.5204 107.5969 46.7854 0.0000 174.0543 102 T 4.4784 8.8090 111.7670 60.1832 71.9699 175.8036 103 N 4.3355 8.5383 117.9586 56.5458 38.3614 177.3591 104 N 4.4280 8.1855 117.4513 56.4264 38.6900 176.9473 105 D 4.5408 8.1571 120.3488 57.2719 41.0120 179.0062 106 V 3.3802 7.8507 118.6861 66.1440 31.5197 178.0470 107 E 4.0409 8.2594 118.3527 59.4267 29.1828 178.7136 108 Y 4.3837 8.4506 121.2757 60.0706 38.8188 177.6467 109 F 4.0419 8.5788 121.5924 61.5529 39.4744 177.3209 110 K 3.9753 8.1808 117.5209 59.4897 31.4304 179.2524 111 E 3.9144 8.3497 118.9660 59.4287 29.3529 179.6808 112 R 3.6928 7.8865 118.3995 59.0756 30.0247 179.2076 113 V 3.3651 7.5307 118.1895 66.0511 31.2114 178.3217 114 R 3.9796 7.6396 116.8025 59.0417 29.8789 178.3350 115 E 4.0450 7.5961 118.4657 59.0004 29.6900 178.4253 116 I 3.9101 7.3934 118.8063 63.6043 37.4880 175.7856 117 A 4.1274 8.1400 126.5248 52.5774 18.1949 176.9111 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 4.43 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.61 0.00 2 L 8.46 4.33 0.00 1.98 1.65 0.97 0.55 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 3 V 9.26 5.05 2.21 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 1.17 0.00 0.00 1.18 0.00 0.00 4 A 9.27 5.34 1.13 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 0.00 0.00 5 Y 8.22 5.76 0.00 3.14 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 6 D 8.66 5.01 0.00 2.54 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 7 S 8.56 4.52 0.00 4.04 3.82 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 8 M 7.87 4.11 0.00 1.49 1.91 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 9 T 7.66 4.34 4.18 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 1.12 0.00 0.00 10 G 7.97 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 11 N 8.24 4.33 0.00 2.76 3.09 0.00 0.00 6.77 7.68 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 12 V 7.80 3.80 2.33 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 1.35 0.00 0.00 1.07 0.00 0.00 13 K 8.10 3.66 0.00 1.99 1.97 0.00 1.94 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.53 1.60 7.81 14 R 8.06 3.82 0.00 1.94 2.18 0.00 3.34 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 15 F 8.31 4.11 0.00 3.15 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 16 I 7.96 3.50 1.52 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.08 0.04 0.77 0.00 0.00 17 H 8.06 4.09 0.00 3.30 3.34 0.00 5.81 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 18 K 7.43 4.03 0.00 1.51 1.62 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.54 7.81 19 L 7.32 3.88 0.00 1.62 1.59 0.49 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.35 4.34 0.00 2.90 2.85 0.00 0.00 6.94 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 21 M 7.02 4.60 0.00 2.23 2.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.52 0.00 22 P 0.00 4.45 0.00 2.11 2.02 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 23 A 8.47 5.41 1.23 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 0.00 0.00 24 V 9.02 4.45 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 0.63 0.00 0.00 0.85 0.00 0.00 25 Q 8.53 3.46 0.00 1.54 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.97 0.00 0.00 0.00 0.00 0.00 2.18 2.20 0.00 26 I 7.66 3.47 1.55 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.29 0.63 0.00 0.00 27 D 8.01 4.52 0.00 2.81 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 28 E 8.69 4.18 0.00 1.97 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 2.31 2.37 0.00 29 D 7.50 4.84 0.00 2.72 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 30 L 7.96 3.95 0.00 1.80 1.91 0.90 0.72 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 31 V 8.30 4.44 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 0.86 0.00 0.00 0.96 0.00 0.00 32 I 8.72 4.32 1.51 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.67 0.90 0.00 0.00 33 D 8.67 4.95 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 7.76 4.77 0.00 2.10 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 0.00 2.21 2.39 0.00 35 D 8.67 4.91 0.00 2.62 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 36 F 8.90 5.27 0.00 3.32 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 37 I 8.87 4.83 2.11 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.95 1.17 0.00 0.00 38 L 8.73 5.18 0.00 2.08 1.63 1.11 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 39 I 9.02 5.03 2.04 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.27 1.07 0.00 0.00 40 T 8.71 5.02 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 1.18 0.00 0.00 41 Y 7.96 5.21 0.00 2.94 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 42 T 8.31 4.60 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 1.00 0.00 0.00 43 T 8.37 4.52 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 1.16 0.00 0.00 44 G 7.97 3.54 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 45 F 8.53 4.33 0.00 3.11 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 46 G 7.57 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 47 N 7.84 4.78 0.00 2.83 2.67 0.00 0.00 6.68 8.52 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 48 V 7.94 3.82 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 0.75 0.00 0.00 0.93 0.00 0.00 49 P 0.00 4.27 0.00 1.93 1.73 0.00 3.34 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.19 0.00 50 E 8.73 3.89 0.00 2.07 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 2.39 2.60 0.00 51 R 7.93 3.89 0.00 1.93 2.03 0.00 3.23 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 52 V 7.65 3.66 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 1.12 0.00 0.00 0.82 0.00 0.00 53 L 8.16 4.05 0.00 1.93 1.74 0.96 1.15 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 54 D 8.50 4.36 0.00 2.88 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 55 F 8.35 4.14 0.00 3.14 3.19 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 56 L 8.13 3.83 0.00 1.85 1.55 1.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.17 4.13 0.00 2.13 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 2.57 0.00 58 R 7.31 4.26 0.00 1.72 1.84 0.00 3.06 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 59 N 7.31 4.88 0.00 1.51 2.35 0.00 0.00 7.02 8.08 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 60 N 7.99 4.33 0.00 2.16 2.62 0.00 0.00 5.75 7.66 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 61 E 8.28 3.87 0.00 1.93 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 2.30 2.35 0.00 62 K 7.91 4.42 0.00 2.04 2.07 0.00 1.86 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.41 7.81 63 L 7.41 3.30 0.00 1.23 1.41 0.57 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.79 4.40 0.00 1.60 1.70 0.00 1.83 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.44 7.81 65 G 7.02 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 0.00 0.00 0.00 0.00 66 V 8.05 5.24 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 0.90 0.00 0.00 1.02 0.00 0.00 67 S 9.54 5.96 0.00 4.32 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 68 A 8.14 5.09 0.95 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 69 S 8.41 3.46 0.00 3.29 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.51 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 0.00 0.00 0.00 71 N 9.02 5.33 0.00 2.86 2.98 0.00 0.00 6.95 7.65 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 72 R 9.38 3.75 0.00 1.77 1.72 0.00 2.93 0.00 0.00 2.92 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.88 0.00 73 N 8.75 4.48 0.00 2.68 2.90 0.00 0.00 6.94 8.44 0.00 0.00 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 W 8.82 4.42 0.00 3.72 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 75 G 7.91 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 76 D 9.02 4.70 0.00 2.87 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 77 M 8.47 4.37 0.00 2.24 2.67 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.61 0.00 78 F 8.36 4.42 0.00 3.04 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 79 G 8.66 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 0.00 0.00 0.00 80 A 7.94 4.44 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 81 S 7.95 3.97 0.00 3.92 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 82 A 7.87 3.95 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 83 D 7.90 4.30 0.00 2.81 2.71 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 0.00 0.00 0.00 0.00 84 K 8.04 3.95 0.00 1.92 1.82 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.59 7.81 85 I 7.76 3.86 1.92 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 1.56 0.86 1.06 0.00 0.00 86 S 8.32 4.36 0.00 3.89 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 87 T 7.74 3.85 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 1.17 0.00 0.00 88 K 7.82 3.88 0.00 1.56 1.39 0.00 1.51 0.00 0.00 1.14 0.00 0.00 2.69 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 1.07 7.81 89 Y 7.71 4.44 0.00 3.13 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 90 E 8.06 3.87 0.00 2.15 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 0.00 2.24 2.25 0.00 91 V 7.08 4.56 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 0.93 0.00 0.00 0.95 0.00 0.00 92 P 0.00 4.40 0.00 2.09 2.15 0.00 3.79 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 1.96 0.00 93 I 8.22 4.41 1.89 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 1.23 0.55 0.98 0.00 0.00 94 V 8.83 3.82 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 0.39 0.00 0.00 0.86 0.00 0.00 95 S 7.72 4.95 0.00 4.34 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 0.00 96 K 8.90 5.13 0.00 1.58 1.09 0.00 1.56 0.00 0.00 1.19 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.04 1.30 7.81 97 F 8.41 5.25 0.00 3.25 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 98 E 9.13 5.05 0.00 2.05 1.99 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 2.36 2.31 0.00 99 L 8.71 3.51 0.00 1.89 1.15 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 100 S 9.06 4.75 0.00 4.06 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 0.00 101 G 8.52 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 0.00 0.00 0.00 102 T 8.81 4.48 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 0.00 103 N 8.54 4.34 0.00 2.76 2.91 0.00 0.00 6.81 6.92 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 0.00 104 N 8.19 4.43 0.00 2.77 2.91 0.00 0.00 7.16 8.08 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 0.00 105 D 8.16 4.54 0.00 3.04 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 0.00 106 V 7.85 3.38 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 0.80 0.00 0.00 0.57 0.00 0.00 107 E 8.26 4.04 0.00 2.18 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 2.35 2.38 0.00 108 Y 8.45 4.38 0.00 3.17 3.28 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 0.00 109 F 8.58 4.04 0.00 3.52 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 0.00 110 K 8.18 3.98 0.00 2.04 1.86 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.81 7.81 111 E 8.35 3.91 0.00 2.05 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 0.00 2.33 2.49 0.00 112 R 7.89 3.69 0.00 1.49 1.66 0.00 3.06 0.00 0.00 2.78 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.67 0.00 113 V 7.53 3.37 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 0.96 0.00 0.00 0.14 0.00 0.00 114 R 7.64 3.98 0.00 1.98 1.94 0.00 3.19 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 115 E 7.60 4.05 0.00 1.86 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 0.00 2.27 2.31 0.00 116 I 7.39 3.91 1.76 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.61 0.84 0.00 0.00 117 A 8.14 4.13 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