NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5700 8.3049 120.3309 54.9883 32.7691 174.7010 2 R 4.2415 9.2351 125.3927 55.5262 31.3552 174.3777 3 R 5.1866 10.4128 125.2395 54.5955 32.8708 175.4897 4 G 4.5487 9.5094 111.2243 44.2766 0.0000 171.6277 5 L 5.0030 8.6931 123.5009 52.7743 45.2214 175.1425 6 V 4.6435 8.7783 126.6682 61.1985 33.9233 174.1801 7 I 4.4891 8.8752 129.8710 60.1406 38.7446 174.8369 8 V 4.4806 8.7727 128.7704 61.2420 33.2863 175.1412 9 G 4.3760 8.1199 114.7363 44.9248 0.0000 171.4844 10 H 4.7054 7.6451 115.0437 55.4119 33.3028 174.1973 11 G 4.4833 7.3131 127.0700 46.4769 0.0000 172.9381 12 S 4.1313 7.3614 114.6921 58.8814 62.8493 174.7067 13 Q 4.1073 7.6402 117.6437 58.3831 29.1311 176.5183 14 L 4.0103 7.3673 118.7736 54.1150 42.1451 176.0711 15 N 4.1657 8.6804 120.9524 55.8576 39.3026 174.0085 16 H 4.1816 8.8905 119.5533 57.1444 26.8967 176.1145 17 Y 4.0224 7.9966 121.9482 60.9550 38.5417 177.9286 18 R 3.9477 8.1323 119.2085 59.3705 30.3425 177.8072 19 E 3.9080 8.1711 118.7116 59.2557 29.8037 178.8743 20 V 3.5035 7.7849 118.2789 66.1810 31.6138 177.7498 21 M 3.9100 7.7486 118.4880 58.5600 31.6834 178.4444 22 E 3.9502 8.5055 119.5746 58.7895 29.6605 178.5845 23 L 3.8734 7.6688 120.5066 58.4115 42.1039 178.7102 24 H 4.1458 7.9228 115.8541 58.6473 28.5773 177.7613 25 R 3.8054 7.8945 120.5316 59.2138 29.8991 178.4202 26 K 3.8702 8.2473 119.6235 59.6030 32.0822 178.7879 27 R 3.8988 8.1673 118.4902 59.5339 29.8074 179.2356 28 I 3.7828 7.7058 118.1680 64.0850 37.5002 177.7587 29 E 4.1176 8.6177 120.6579 59.5888 29.3196 178.9035 30 E 4.0597 8.1708 117.1445 59.1433 29.5284 179.0956 31 S 4.3230 7.8027 113.3534 59.0797 63.3203 175.4873 32 G 3.8785 7.8828 109.1628 45.5327 0.0000 174.3332 33 A 3.9255 7.7786 123.3973 54.0429 18.5409 178.2808 34 F 4.9287 7.7088 111.7626 55.4658 42.6807 174.8282 35 D 4.6469 8.9438 123.0662 57.2164 41.3326 176.7889 36 E 4.7739 8.1286 117.9756 54.6093 33.4477 174.1076 37 V 4.8209 8.4207 125.2913 61.1194 34.3270 174.5279 38 K 4.8377 9.1798 126.7318 54.5029 36.2915 175.0244 39 I 4.7723 8.1796 115.0888 59.5912 40.0134 174.2243 40 A 4.6341 8.3423 124.9369 50.8615 23.2782 174.6687 41 F 5.4077 8.9167 116.1166 55.8000 43.2148 175.5712 42 A 4.1782 8.9537 125.0379 52.1824 19.5647 177.7088 43 A 3.6214 8.2566 120.5487 52.0773 17.1392 176.5272 44 R 4.1422 8.5371 113.4800 57.0240 31.5046 176.8381 45 K 3.7003 8.6247 122.7688 57.3056 30.2381 174.1761 46 R 4.3515 7.4315 116.7760 54.5816 32.9341 173.9682 47 R 4.8548 8.3796 124.3390 54.2338 32.2382 174.4661 48 P 4.8465 0.0000 0.0000 62.4865 33.5202 175.4516 49 M 4.8860 8.4358 120.1568 54.0527 33.1248 175.6485 50 P 4.1645 0.0000 0.0000 65.7542 31.3504 178.7951 51 D 3.8337 7.8454 117.5457 56.1790 39.4091 178.0147 52 E 3.9183 8.1810 120.2328 58.8744 29.4939 178.2212 53 A 3.9866 7.6512 119.2517 55.5271 18.7929 179.4370 54 I 3.8163 7.8097 118.0454 64.5222 36.9298 178.8000 55 R 4.0714 8.0623 118.0032 59.4720 30.0413 178.5892 56 E 4.1773 8.1427 116.3740 57.4010 29.9168 176.9809 57 M 4.4330 7.3090 119.2863 54.7695 33.3773 176.8208 58 N 4.8097 8.6166 124.2031 52.7858 37.8145 173.5295 59 C 5.0461 7.3798 116.0765 58.0152 32.5722 174.4864 60 D 4.6314 8.8734 121.7226 56.4099 42.0431 176.5871 61 I 4.8155 7.7039 117.9543 59.0682 41.4484 174.1125 62 I 4.9736 8.5996 129.7199 59.7339 40.3529 173.8927 63 Y 4.8474 9.1223 124.8418 56.4064 40.2598 174.7585 64 V 4.5407 9.0103 124.9369 61.3070 33.6466 174.5320 65 V 4.5227 8.3648 129.4978 60.4600 33.5761 173.0485 66 P 4.7979 0.0000 0.0000 61.8801 32.0178 176.8977 67 L 4.5858 8.8064 132.1094 54.1070 39.5864 176.0558 68 F 4.8312 7.8738 119.8989 55.6208 42.9584 177.2249 69 I 3.7413 8.4431 125.4529 64.3185 37.2930 176.9489 70 S 4.9069 7.8830 112.6429 58.2196 64.3271 172.7618 71 Y 4.7600 8.1692 118.5730 56.5376 38.8937 173.6513 72 G 4.2559 7.5618 112.3553 44.9434 0.0000 173.5683 73 L 3.9666 8.4916 117.8612 57.9251 41.5630 178.6863 74 H 4.4508 8.2138 117.4286 57.9981 28.3587 177.3985 75 V 3.4942 7.2705 118.0719 65.5553 32.0425 177.6754 76 T 4.4491 8.0579 110.2767 62.8515 68.7447 174.8752 77 E 4.3583 7.8188 118.4125 57.6981 32.1262 177.1990 78 D 4.3527 8.5889 118.6680 57.5414 40.8257 178.8784 79 L 3.8537 7.9433 120.1559 57.8143 42.1511 177.2272 80 P 4.2401 0.0000 0.0000 65.6495 31.4477 178.1384 81 D 4.3878 8.3435 117.8795 57.4967 40.5774 178.5886 82 L 4.0046 7.9036 119.3566 57.8281 42.1348 178.1318 83 L 4.4872 7.5894 115.2676 53.5326 42.1303 176.4829 84 G 3.9806 7.9911 106.6178 46.9279 0.0000 173.9480 85 F 4.7342 8.6085 117.3437 54.3323 41.2471 174.4847 86 P 4.3540 0.0000 0.0000 62.9994 31.5708 177.0169 87 R 4.2730 8.2268 120.9282 55.7549 31.1586 174.7770 88 G 3.7225 8.5636 104.9522 44.4771 0.0000 173.6140 89 R 4.2262 8.0038 117.6536 56.0172 30.7497 176.5174 90 G 4.0014 9.2170 106.2124 44.3119 0.0000 173.3657 91 I 4.2331 8.0130 119.5411 61.2796 37.8055 176.2461 92 K 4.7444 9.2183 125.7051 54.7886 35.4102 175.2060 93 E 5.0921 9.1248 124.2680 54.6387 31.9115 176.6998 94 G 3.5821 7.2229 107.4008 46.0635 0.0000 171.2808 95 E 5.1898 8.3042 117.8277 54.3928 33.1117 175.0878 96 F 4.7653 9.3352 124.4532 57.3054 41.5970 175.0974 97 E 3.4261 9.4623 129.9537 57.3362 26.5969 175.8320 98 G 3.9895 8.0319 104.9423 45.0980 0.0000 172.6533 99 K 4.6291 7.6058 119.4168 54.3693 34.5994 175.9311 100 K 4.6366 8.3421 125.8917 56.6006 33.5579 175.8698 101 V 4.8095 9.2225 126.7292 61.2235 35.6033 173.7796 102 V 4.8714 8.5759 127.4677 61.1767 34.2174 174.1951 103 I 4.4452 8.7534 130.0636 60.8888 38.1221 175.8580 104 C 4.9523 8.9499 125.8704 58.4775 29.8179 173.3695 105 E 4.3397 8.5637 119.5395 55.1432 29.8925 175.6494 106 P 4.8532 0.0000 0.0000 62.2946 31.9236 176.6960 107 I 3.9114 8.3039 112.2686 62.4573 38.2767 178.0428 108 G 4.2483 7.5977 110.0323 48.2646 0.0000 174.3822 109 E 4.2512 7.9709 116.1604 55.7489 30.0736 176.3540 110 D 4.3157 8.0142 120.6198 54.0316 41.9520 176.7335 111 Y 4.2784 8.2798 123.3356 61.3224 37.7681 179.0617 112 F 4.5147 8.9512 119.2884 60.4467 38.9470 177.8180 113 V 3.6736 8.1214 118.1748 66.2042 31.3714 177.9930 114 T 3.8369 8.0212 115.0290 67.2215 68.2903 175.9915 115 Y 3.9785 8.4315 118.1628 60.7242 37.8562 178.1762 116 A 4.1243 8.6759 122.4780 55.0758 18.1273 179.7792 117 I 3.5959 7.8793 118.2842 64.5588 37.1943 178.5421 118 L 3.4656 7.7553 119.7441 57.7538 41.4319 179.1826 119 N 4.5915 8.6294 116.8784 56.1847 38.6342 176.8389 120 S 4.2430 7.6466 113.7813 60.9670 62.4307 175.9501 121 V 3.8200 6.8801 120.0212 65.8759 31.5853 177.8440 122 F 4.6769 8.2717 116.4956 58.6562 39.2280 175.8083 123 R 3.7917 8.4333 116.0728 57.0618 28.0570 177.3777 124 I 4.0409 8.2974 118.9523 63.1288 36.8189 177.0219 125 G 3.4670 8.7815 113.7427 45.2610 0.0000 171.5953 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 4.57 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 2 R 9.24 4.24 0.00 1.77 1.91 0.00 3.29 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 3 R 10.41 5.19 0.00 1.84 2.23 0.00 3.14 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.69 0.00 4 G 9.51 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.69 5.00 0.00 0.27 0.88 0.62 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.78 4.64 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 0.86 0.00 0.00 0.83 0.00 0.00 7 I 8.88 4.49 1.71 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.45 0.77 0.00 0.00 8 V 8.77 4.48 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 1.01 0.00 0.00 0.83 0.00 0.00 9 G 8.12 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 H 7.65 4.71 0.00 3.20 3.04 0.00 6.11 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 11 G 7.31 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 7.36 4.13 0.00 3.91 3.81 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 13 Q 7.64 4.11 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 14 L 7.37 4.01 0.00 1.62 1.57 0.82 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.68 4.17 0.00 2.64 2.75 0.00 0.00 7.13 7.89 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 16 H 8.89 4.18 0.00 3.43 3.38 0.00 5.67 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.00 4.02 0.00 3.12 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 18 R 8.13 3.95 0.00 2.04 1.98 0.00 3.31 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.17 0.00 19 E 8.17 3.91 0.00 2.10 2.14 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 2.37 2.37 0.00 20 V 7.78 3.50 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 0.93 0.00 0.00 0.99 0.00 0.00 21 M 7.75 3.91 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.25 0.00 22 E 8.51 3.95 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 2.30 2.33 0.00 23 L 7.67 3.87 0.00 1.88 1.73 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 24 H 7.92 4.15 0.00 3.32 3.25 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.89 3.81 0.00 1.97 2.04 0.00 3.23 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 26 K 8.25 3.87 0.00 1.90 2.01 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.47 7.81 27 R 8.17 3.90 0.00 2.01 1.95 0.00 3.13 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 28 I 7.71 3.78 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.59 1.07 0.00 0.00 29 E 8.62 4.12 0.00 2.05 2.14 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 2.32 2.38 0.00 30 E 8.17 4.06 0.00 2.11 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 2.34 2.50 0.00 31 S 7.80 4.32 0.00 3.96 4.13 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 32 G 7.88 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 33 A 7.78 3.93 1.17 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 0.00 0.00 34 F 7.71 4.93 0.00 3.01 3.13 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 35 D 8.94 4.65 0.00 2.76 2.78 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 36 E 8.13 4.77 0.00 2.03 1.74 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 2.29 2.33 0.00 37 V 8.42 4.82 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 0.77 0.00 0.00 0.96 0.00 0.00 38 K 9.18 4.84 0.00 1.60 1.56 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.31 1.32 7.81 39 I 8.18 4.77 1.54 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 1.21 0.50 0.81 0.00 0.00 40 A 8.34 4.63 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 41 F 8.92 5.41 0.00 3.15 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 42 A 8.95 4.18 1.43 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 43 A 8.26 3.62 1.26 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 0.00 0.00 44 R 8.54 4.14 0.00 1.82 1.87 0.00 3.36 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 45 K 8.62 3.70 0.00 1.77 1.74 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.45 7.81 46 R 7.43 4.35 0.00 1.59 1.43 0.00 2.21 0.00 0.00 2.51 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.13 0.00 47 R 8.38 4.85 0.00 1.75 1.88 0.00 3.27 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 48 P 0.00 4.85 0.00 2.14 2.21 0.00 3.94 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.02 0.00 49 M 8.44 4.89 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.47 0.00 50 P 0.00 4.16 0.00 1.98 1.96 0.00 3.56 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 51 D 7.85 3.83 0.00 3.03 2.70 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 0.00 0.00 0.00 0.00 52 E 8.18 3.92 0.00 2.09 2.16 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 2.41 2.42 0.00 53 A 7.65 3.99 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 54 I 7.81 3.82 1.69 0.00 0.00 0.50 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 1.00 1.06 0.00 0.00 55 R 8.06 4.07 0.00 2.03 2.08 0.00 3.26 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.29 0.00 56 E 8.14 4.18 0.00 2.12 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 2.56 2.51 0.00 57 M 7.31 4.43 0.00 2.06 2.15 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 2.78 2.64 0.00 58 N 8.62 4.81 0.00 2.69 2.76 0.00 0.00 7.00 7.67 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 59 C 7.38 5.05 0.00 2.98 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 60 D 8.87 4.63 0.00 2.64 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 61 I 7.70 4.82 1.84 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 0.71 1.00 1.00 0.00 0.00 62 I 8.60 4.97 1.82 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 1.23 0.70 0.85 0.00 0.00 63 Y 9.12 4.85 0.00 2.75 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 64 V 9.01 4.54 1.91 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 0.67 0.00 0.00 0.73 0.00 0.00 65 V 8.36 4.52 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 0.95 0.00 0.00 0.88 0.00 0.00 66 P 0.00 4.80 0.00 2.07 1.89 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 67 L 8.81 4.59 0.00 1.50 1.60 0.81 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.87 4.83 0.00 2.91 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 69 I 8.44 3.74 1.90 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 1.48 1.35 0.93 0.00 0.00 70 S 7.88 4.91 0.00 4.09 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 71 Y 8.17 4.76 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 72 G 7.56 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 0.00 0.00 0.00 0.00 73 L 8.49 3.97 0.00 1.66 1.70 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 74 H 8.21 4.45 0.00 2.92 3.19 0.00 6.08 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.27 3.49 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 0.65 0.00 0.00 0.08 0.00 0.00 76 T 8.06 4.45 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 1.28 0.00 0.00 77 E 7.82 4.36 0.00 2.09 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 2.28 2.28 0.00 78 D 8.59 4.35 0.00 2.82 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 79 L 7.94 3.85 0.00 1.78 1.61 0.80 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 4.24 0.00 2.25 2.34 0.00 3.61 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 2.24 2.19 0.00 81 D 8.34 4.39 0.00 3.03 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 L 7.90 4.00 0.00 1.74 1.77 0.94 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.59 4.49 0.00 1.42 1.48 0.44 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 84 G 7.99 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 0.00 0.00 0.00 85 F 8.61 4.73 0.00 2.86 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 86 P 0.00 4.35 0.00 2.09 2.01 0.00 3.78 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 2.03 2.08 0.00 87 R 8.23 4.27 0.00 1.82 2.04 0.00 3.19 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 88 G 8.56 3.72 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 0.00 0.00 0.00 89 R 8.00 4.23 0.00 1.63 1.52 0.00 2.21 0.00 0.00 2.79 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.33 0.00 90 G 9.22 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 91 I 8.01 4.23 1.94 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 1.41 0.91 1.00 0.00 0.00 92 K 9.22 4.74 0.00 1.91 1.98 0.00 1.74 0.00 0.00 1.96 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.45 1.62 7.81 93 E 9.12 5.09 0.00 1.88 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 94 G 7.22 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 0.00 0.00 0.00 95 E 8.30 5.19 0.00 1.90 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 2.20 2.22 0.00 96 F 9.34 4.77 0.00 3.19 2.98 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 97 E 9.46 3.43 0.00 1.66 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 0.00 1.79 1.47 0.00 98 G 8.03 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 99 K 7.61 4.63 0.00 2.04 1.78 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.40 7.81 100 K 8.34 4.64 0.00 1.88 1.78 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.41 7.81 101 V 9.22 4.81 2.37 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 0.60 0.00 0.00 1.02 0.00 0.00 102 V 8.58 4.87 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 0.95 0.00 0.00 0.82 0.00 0.00 103 I 8.75 4.45 1.79 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.33 0.79 0.00 0.00 104 C 8.95 4.95 0.00 2.91 2.90 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 0.00 105 E 8.56 4.34 0.00 1.87 1.85 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 2.46 2.38 0.00 106 P 0.00 4.85 0.00 2.06 1.76 0.00 2.67 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 0.96 0.44 0.00 107 I 8.30 3.91 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.77 0.94 0.00 0.00 108 G 7.60 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 0.00 0.00 0.00 0.00 109 E 7.97 4.25 0.00 1.95 1.91 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 2.30 2.33 0.00 110 D 8.01 4.32 0.00 2.86 2.65 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 0.00 0.00 0.00 0.00 111 Y 8.28 4.28 0.00 2.93 2.97 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 0.00 112 F 8.95 4.51 0.00 3.28 3.06 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 0.00 113 V 8.12 3.67 2.32 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 1.05 0.00 0.00 1.06 0.00 0.00 114 T 8.02 3.84 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 115 Y 8.43 3.98 0.00 3.29 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 0.00 116 A 8.68 4.12 1.43 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 0.00 117 I 7.88 3.60 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.90 0.83 0.00 0.00 118 L 7.76 3.47 0.00 1.70 1.12 0.50 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 119 N 8.63 4.59 0.00 3.05 2.88 0.00 0.00 6.86 7.18 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 0.00 120 S 7.65 4.24 0.00 3.88 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 0.00 121 V 6.88 3.82 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 0.98 0.00 0.00 0.83 0.00 0.00 122 F 8.27 4.68 0.00 3.05 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 0.00 123 R 8.43 3.79 0.00 1.93 2.02 0.00 3.18 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 124 I 8.30 4.04 2.10 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 1.25 0.73 0.95 0.00 0.00 125 G 8.78 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00