NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 V 3.8409 8.0549 120.3808 62.7274 32.0556 174.7171 4 I 4.1964 8.2740 129.6386 58.1006 37.7392 173.9500 5 N 5.1615 8.5374 122.8800 50.8257 39.1932 173.8104 6 T 4.6499 7.6854 108.8456 60.6208 72.3983 174.5886 7 F 4.2745 8.3857 120.6502 61.3347 39.0313 177.7812 8 D 4.6692 8.3571 117.5558 56.7038 40.8922 179.0942 9 G 3.6139 7.8795 106.2156 47.8775 0.0000 176.1043 10 V 3.6876 8.1023 121.0611 65.2783 31.5401 177.9202 11 A 4.0530 8.1805 120.5821 55.4939 18.3136 179.3884 12 D 4.3052 8.3326 117.4154 57.6078 40.7676 178.4652 13 Y 4.0320 8.0425 119.6479 60.6672 38.8179 178.0242 14 L 4.2430 8.3940 121.7227 57.4714 41.4971 179.6065 15 Q 3.7088 7.7454 116.9230 59.0311 28.6887 178.4389 16 T 3.6427 7.4682 115.7994 65.1111 68.5663 175.1394 17 Y 4.4618 7.1878 114.9089 56.8467 39.1046 174.9510 18 H 3.0871 7.4643 116.2165 55.6183 27.0799 174.1600 19 K 4.5189 7.3151 114.0329 56.3492 34.7483 174.2756 20 L 4.2465 8.3576 119.6501 53.3112 42.0043 175.2092 21 P 3.6400 0.0000 0.0000 62.1997 31.8799 177.4706 22 D 4.4510 8.3275 118.8027 56.9028 41.1097 177.8632 23 N 4.6682 7.6500 116.6281 53.0459 36.8423 173.4099 24 Y 5.3438 7.7024 117.4500 56.5674 40.9494 174.8236 25 I 4.9392 8.5757 116.3221 59.1324 41.7209 175.0246 26 T 4.4920 9.7170 115.3995 61.3205 70.1018 175.6384 27 K 4.1407 9.3273 121.6043 59.6542 31.9056 179.9718 28 S 4.2852 8.1227 114.1821 61.4258 62.8784 176.2915 29 E 3.9744 7.9748 120.8088 59.0939 29.5122 178.7539 30 A 4.1346 8.1922 120.8829 55.1734 18.3917 179.4612 31 Q 4.2402 8.5064 117.8922 59.4409 29.0111 178.3183 32 A 4.2920 8.1657 120.2913 54.3300 18.4294 178.4437 33 L 4.4881 7.5672 115.7019 54.4561 42.1754 177.3277 34 G 4.0868 8.3836 107.9265 44.5862 0.0000 174.1208 35 W 4.4823 8.0816 129.8960 57.4692 31.0231 175.6526 36 V 3.7425 8.7784 124.8456 60.4715 32.1622 175.6868 37 A 3.9912 6.9752 130.4273 54.9493 18.2907 179.8619 38 S 4.4083 7.8443 107.7331 60.3430 63.1838 175.0589 39 K 4.2754 9.0823 121.0001 56.1283 32.5291 176.6725 40 G 3.4171 7.9553 107.1888 47.0107 0.0000 174.1938 41 N 5.1488 8.1112 115.9109 51.5439 37.8484 174.7097 42 L 3.8535 8.3111 124.3189 59.0501 42.0737 178.9764 43 A 4.2485 8.1177 119.5704 54.9921 18.3465 179.2312 44 D 4.4096 7.9140 117.3255 57.5631 40.9065 178.9914 45 V 4.0648 8.0525 111.5812 62.7041 33.1465 176.8739 46 A 4.6217 8.5618 121.6384 49.0929 19.6717 172.2218 47 P 4.4500 0.0000 0.0000 63.0223 32.0794 177.4173 48 G 3.8393 8.7205 109.4009 45.6817 0.0000 173.4370 49 K 4.6176 7.6656 118.6719 55.5795 33.8304 176.3770 50 S 4.5581 8.3168 117.0358 56.5623 67.6929 173.7590 51 I 4.2610 8.0654 123.5016 60.9454 38.0092 175.4830 52 G 4.3311 8.7857 114.6236 47.3285 0.0000 173.1488 53 G 4.5420 9.6164 110.0358 44.7389 0.0000 174.3005 54 D 4.7127 8.0162 119.3692 53.8120 42.3514 175.9066 55 I 4.2208 8.3901 122.2333 61.7858 37.9052 175.1273 56 F 4.8373 9.4563 130.4972 56.7484 40.0476 175.8456 57 S 4.0122 8.3467 121.7379 58.6899 63.9507 173.3739 58 N 3.4775 5.8509 118.7377 54.4105 36.7228 175.0613 59 R 3.8431 7.0977 116.5784 58.7122 29.9203 178.0766 60 E 4.2797 8.0948 115.5782 55.3902 30.0576 176.5757 61 G 3.7834 7.5749 106.2744 46.4534 0.0000 175.5612 62 K 4.0756 7.4486 118.8674 58.1498 32.3911 177.9384 63 L 3.6994 7.3160 117.8596 51.9354 42.5101 174.5589 64 P 4.2421 0.0000 0.0000 63.3194 31.1290 175.9365 65 G 4.2096 8.4775 112.5409 44.0581 0.0000 172.1748 66 K 4.5426 8.1390 121.8306 54.2913 35.3276 175.3866 67 S 4.1886 8.6053 121.5620 60.6020 62.9622 174.9683 68 G 3.8515 9.0659 114.0343 44.8856 0.0000 172.7083 69 R 4.1349 7.7370 120.6455 54.8978 31.1995 175.0164 70 T 4.6047 8.0614 119.7462 60.0608 70.3858 172.7158 71 W 5.1445 8.5995 125.9525 55.1836 32.5745 174.9171 72 R 5.2448 8.8246 120.8127 54.5308 34.5272 173.7897 73 E 5.4603 9.0520 117.5641 55.1085 33.7361 174.2236 74 A 4.9851 8.6023 119.9258 50.6948 23.0234 175.6059 75 D 4.9784 9.3143 122.0022 54.4759 40.3949 176.1186 76 I 4.3703 8.2032 122.6248 60.1635 40.7165 175.7967 77 N 4.2672 8.8573 121.8294 54.2062 36.6302 173.4491 78 Y 4.4587 7.2898 119.8657 56.7781 39.8567 174.5128 79 T 4.0646 7.0700 114.6345 62.0742 70.6406 173.8240 80 S 4.2893 6.3415 113.4907 57.8439 66.1849 175.2308 81 G 3.7908 8.5642 106.5872 46.1094 0.0000 173.3993 82 F 4.6907 8.3037 121.2911 56.8680 39.9616 175.6833 83 R 4.3499 8.7481 122.5600 56.4398 30.7272 176.9248 84 N 4.9512 8.5530 118.4650 52.2920 40.1677 175.4540 85 S 4.7492 8.5890 115.4446 58.7450 64.8588 172.6208 86 D 5.5485 8.5785 120.9644 53.3630 43.0347 175.7339 87 R 5.1675 9.0692 120.8436 54.7414 35.4612 173.6235 88 I 5.1676 8.9181 122.6468 59.3744 40.8550 174.0784 89 L 5.5170 9.6105 129.4729 53.1223 44.4771 175.0521 90 Y 5.7723 9.0843 121.6157 55.4001 41.7952 174.9107 91 S 4.4044 8.2082 116.0384 56.0327 65.5010 175.2426 92 S 3.3621 7.7540 115.0977 60.5530 62.5993 174.8757 93 D 4.4025 7.2247 118.1347 52.2171 39.3083 175.8544 94 W 3.7837 6.5320 116.9575 58.3750 27.1737 174.4229 95 L 4.5657 8.1015 118.1756 54.2375 42.3677 176.1118 96 I 5.4890 8.3496 122.8783 60.0251 40.3412 174.3310 97 Y 5.4626 9.8153 123.8083 56.1930 42.7018 174.2312 98 K 5.3370 9.2041 118.9252 55.9150 36.8202 175.0425 99 T 4.8438 8.9263 114.7896 60.7980 70.8688 174.0607 100 T 5.3503 8.8115 114.4115 60.0874 70.2160 173.4397 101 D 4.7981 7.4290 122.0599 54.1098 40.2313 174.9428 102 H 3.8455 8.6345 113.6145 58.8169 28.6675 174.0223 103 Y 3.1594 7.3591 111.7795 58.7424 36.6185 171.7224 104 Q 4.1273 7.9650 120.4585 58.5837 28.8720 176.5759 105 T 4.7115 7.7460 104.8568 59.6721 71.8987 172.7177 106 F 5.2374 8.5281 119.3997 56.1566 43.2754 174.4044 107 T 4.7176 8.9218 117.2790 61.5731 72.0681 173.1667 108 K 3.7488 8.6378 128.0979 55.8285 32.4141 176.3786 109 I 4.3840 8.4921 119.9144 60.7694 38.9912 175.8268 110 R 4.1697 7.5151 125.7055 56.8250 31.0113 174.5495 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 3 V 8.05 3.84 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 0.87 0.00 0.00 0.88 0.00 0.00 4 I 8.27 4.20 1.77 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 1.35 0.81 0.93 0.00 0.00 5 N 8.54 5.16 0.00 2.75 2.79 0.00 0.00 6.38 7.22 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 6 T 7.69 4.65 4.27 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 1.20 0.00 0.00 7 F 8.39 4.27 0.00 3.16 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.36 4.67 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 9 G 7.88 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.10 3.69 2.17 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 0.89 0.00 0.00 1.14 0.00 0.00 11 A 8.18 4.05 1.53 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 0.00 0.00 12 D 8.33 4.31 0.00 2.81 2.73 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 0.00 0.00 0.00 13 Y 8.04 4.03 0.00 3.33 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 14 L 8.39 4.24 0.00 1.91 1.78 0.60 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 7.75 3.71 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.63 0.00 16 T 7.47 3.64 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 -0.03 0.00 0.00 17 Y 7.19 4.46 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 18 H 7.46 3.09 0.00 3.11 3.33 0.00 5.71 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.32 4.52 0.00 2.02 2.01 0.00 1.62 0.00 0.00 1.92 0.00 0.00 3.14 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.64 1.67 7.81 20 L 8.36 4.25 0.00 1.64 1.46 0.79 0.35 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 21 P 0.00 3.64 0.00 2.25 1.45 0.00 3.56 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.14 0.00 22 D 8.33 4.45 0.00 2.66 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 23 N 7.65 4.67 0.00 2.97 2.86 0.00 0.00 6.61 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 24 Y 7.70 5.34 0.00 2.97 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 25 I 8.58 4.94 1.95 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.96 0.89 0.00 0.00 26 T 9.72 4.49 4.59 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 1.37 0.00 0.00 27 K 9.33 4.14 0.00 1.98 2.20 0.00 1.79 0.00 0.00 1.87 0.00 0.00 3.16 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.74 1.71 7.81 28 S 8.12 4.29 0.00 4.10 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 0.00 29 E 7.97 3.97 0.00 2.12 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 0.00 2.38 2.37 0.00 30 A 8.19 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 31 Q 8.51 4.24 0.00 2.54 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 32 A 8.17 4.29 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 33 L 7.57 4.49 0.00 1.89 1.75 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.38 4.09 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 0.00 0.00 0.00 35 W 8.08 4.48 0.00 3.21 3.21 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 36 V 8.78 3.74 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 0.81 0.00 0.00 0.93 0.00 0.00 37 A 6.98 3.99 0.91 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 38 S 7.84 4.41 0.00 4.01 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 39 K 9.08 4.28 0.00 1.77 1.91 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.36 7.81 40 G 7.96 3.42 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 41 N 8.11 5.15 0.00 2.98 3.06 0.00 0.00 6.34 6.67 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 42 L 8.31 3.85 0.00 1.31 1.73 0.33 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.12 4.25 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 44 D 7.91 4.41 0.00 2.89 2.73 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 0.00 0.00 0.00 45 V 8.05 4.06 2.31 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 0.81 0.00 0.00 1.16 0.00 0.00 46 A 8.56 4.62 1.15 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 47 P 0.00 4.45 0.00 2.02 2.01 0.00 3.81 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.22 0.00 48 G 8.72 3.84 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 0.00 0.00 0.00 49 K 7.67 4.62 0.00 1.67 1.60 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.64 1.49 7.81 50 S 8.32 4.56 0.00 3.15 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.07 4.26 1.70 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.16 0.87 0.00 0.00 52 G 8.79 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 0.00 0.00 0.00 0.00 53 G 9.62 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 54 D 8.02 4.71 0.00 2.72 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 55 I 8.39 4.22 1.88 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 1.22 0.33 0.95 0.00 0.00 56 F 9.46 4.84 0.00 2.91 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 57 S 8.35 4.01 0.00 3.59 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 58 N 5.85 3.48 0.00 2.60 2.53 0.00 0.00 7.20 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 59 R 7.10 3.84 0.00 1.64 1.85 0.00 3.02 0.00 0.00 3.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.34 0.00 60 E 8.09 4.28 0.00 2.04 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 2.33 2.29 0.00 61 G 7.57 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 62 K 7.45 4.08 0.00 1.70 1.97 0.00 2.15 0.00 0.00 2.16 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.48 7.81 63 L 7.32 3.70 0.00 0.51 0.13 -0.67 -0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.24 0.00 2.35 2.23 0.00 3.10 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.30 0.00 65 G 8.48 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 66 K 8.14 4.54 0.00 1.75 1.55 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.44 7.81 67 S 8.61 4.19 0.00 3.87 3.80 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 0.00 0.00 0.00 68 G 9.07 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 69 R 7.74 4.13 0.00 1.54 1.88 0.00 3.18 0.00 0.00 2.38 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.90 0.00 70 T 8.06 4.60 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 1.07 0.00 0.00 71 W 8.60 5.14 0.00 3.60 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 72 R 8.82 5.24 0.00 0.67 1.48 0.00 2.97 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.31 0.00 73 E 9.05 5.46 0.00 2.09 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 2.40 0.00 74 A 8.60 4.99 1.01 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 0.00 0.00 75 D 9.31 4.98 0.00 2.71 2.66 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 76 I 8.20 4.37 1.40 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 -0.16 0.00 0.00 77 N 8.86 4.27 0.00 2.81 2.89 0.00 0.00 6.88 7.04 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 78 Y 7.29 4.46 0.00 3.14 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 79 T 7.07 4.06 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 1.06 0.00 0.00 80 S 6.34 4.29 0.00 3.84 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 81 G 8.56 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 0.00 0.00 0.00 82 F 8.30 4.69 0.00 3.20 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 83 R 8.75 4.35 0.00 1.96 1.95 0.00 3.30 0.00 0.00 3.55 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.67 0.00 84 N 8.55 4.95 0.00 2.86 2.96 0.00 0.00 5.97 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 85 S 8.59 4.75 0.00 3.97 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 86 D 8.58 5.55 0.00 2.82 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 87 R 9.07 5.17 0.00 1.63 1.81 0.00 3.51 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.27 0.00 88 I 8.92 5.17 2.08 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.93 1.03 0.00 0.00 89 L 9.61 5.52 0.00 1.53 1.39 0.12 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 9.08 5.77 0.00 3.20 3.18 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 91 S 8.21 4.40 0.00 2.72 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 92 S 7.75 3.36 0.00 3.67 3.69 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 93 D 7.22 4.40 0.00 2.70 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 94 W 6.53 3.78 0.00 3.53 3.40 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 95 L 8.10 4.57 0.00 1.81 2.01 1.09 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.35 5.49 1.99 0.00 0.00 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 1.43 1.27 1.16 0.00 0.00 97 Y 9.82 5.46 0.00 2.73 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 98 K 9.20 5.34 0.00 1.34 1.71 0.00 0.61 0.00 0.00 0.76 0.00 0.00 2.54 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.23 1.05 7.81 99 T 8.93 4.84 3.73 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 0.00 0.00 0.99 0.00 0.00 100 T 8.81 5.35 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 1.35 0.00 0.00 101 D 7.43 4.80 0.00 2.83 2.80 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 0.00 0.00 0.00 102 H 8.63 3.85 0.00 3.24 3.38 0.00 5.88 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.36 3.16 0.00 3.21 3.27 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 0.00 104 Q 7.97 4.13 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 105 T 7.75 4.71 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 0.00 106 F 8.53 5.24 0.00 2.94 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 0.00 107 T 8.92 4.72 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 1.15 0.00 0.00 108 K 8.64 3.75 0.00 1.01 1.43 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.15 0.79 7.81 109 I 8.49 4.38 1.86 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.88 0.80 0.00 0.00 110 R 7.52 4.17 0.00 1.88 1.83 0.00 3.43 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00