NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4216 8.3049 118.1942 54.2480 32.6039 174.4979 2 I 3.4060 8.1238 118.5967 60.6408 37.1475 174.6802 3 S 4.6071 9.9155 118.7554 57.4387 65.3022 174.4985 4 G 3.7619 7.2519 106.7091 45.5003 0.0000 170.5774 5 L 4.2228 7.9551 122.5602 54.4875 42.8754 177.2773 6 S 4.4054 8.6067 121.5991 59.9632 62.8222 172.9992 7 H 4.7059 7.0006 111.5764 55.0457 30.8493 172.1440 8 I 4.4276 8.1133 119.4150 59.7023 39.9909 174.9303 9 T 5.0546 8.4167 122.6411 61.7450 70.7903 173.5792 10 L 4.8746 9.3991 125.6461 52.9470 45.7740 175.3252 11 I 4.9627 8.4546 122.6873 59.9158 38.9998 175.5177 12 V 4.8769 9.1377 119.8026 59.4696 35.5023 177.0296 13 K 4.0826 9.5697 122.9628 58.3613 33.0172 177.0493 14 D 4.6213 7.8074 117.4546 51.2280 43.0370 175.0573 15 L 4.0796 8.5401 127.6147 57.9606 41.7750 179.1119 16 N 4.3668 8.1992 115.5563 56.1824 38.5879 176.9841 17 K 3.7560 9.2348 121.7908 59.9987 32.1780 178.8582 18 T 4.1733 8.3127 116.0396 67.0186 68.4154 176.6179 19 T 3.9524 8.7948 117.8286 66.7203 68.4914 176.2432 20 A 4.0784 8.1310 122.3724 55.2101 18.5761 179.0719 21 F 4.1730 8.2893 118.6803 61.9375 39.4543 177.4541 22 L 4.1400 8.3685 118.3034 57.7623 41.3136 179.7467 23 Q 4.1159 8.2988 118.0248 59.2147 28.5962 178.4405 24 N 4.3564 8.4258 116.3120 55.3714 38.5097 176.6765 25 I 3.8246 7.0611 119.3170 62.5929 38.2501 176.7355 26 F 4.3828 7.5687 113.9864 56.5164 39.1638 175.3617 27 N 4.8419 8.4178 115.7056 52.6592 36.0237 174.1593 28 A 4.3528 7.8700 118.5147 52.6737 19.5763 177.7725 29 E 4.5759 9.1250 122.4332 54.2615 31.6089 174.6786 30 E 4.0892 8.8909 129.5214 56.0084 29.8640 176.0609 31 I 4.5443 8.2626 119.2337 60.7332 39.2167 174.8109 32 Y 4.7738 7.3691 122.4011 56.9487 41.8950 172.7653 33 S 4.6642 7.3561 119.1703 56.9591 66.0057 172.4288 34 S 4.2497 8.2039 117.6087 57.6983 66.1601 173.5934 35 G 4.4681 8.1146 109.0431 43.6746 0.0000 173.3512 36 D 4.3640 8.6179 116.6296 53.1972 43.1773 176.5154 37 K 4.0358 8.3600 127.6784 59.6454 32.9087 179.4799 38 T 4.0965 7.7638 108.3743 63.2811 68.9147 174.8006 39 F 4.9206 8.1041 122.8469 57.1816 39.9397 174.7983 40 S 3.6867 7.7122 112.5720 59.6298 60.8369 172.9642 41 L 4.8741 8.1673 119.6247 52.5283 44.6172 177.7927 42 S 4.8504 9.0021 121.6941 59.0649 63.8305 175.1379 43 K 4.5171 9.9620 126.4515 55.6199 32.8201 175.1178 44 E 5.2957 9.5826 123.9215 54.4891 33.8691 174.1793 45 K 5.0402 9.1967 122.5535 55.3263 37.4372 174.7917 46 F 6.0230 9.2040 123.2051 56.2593 41.5746 174.8884 47 F 5.5343 10.0365 120.9640 55.7840 43.8189 173.6006 48 L 5.4217 9.0209 120.3094 53.2070 44.7265 175.7592 49 I 4.7306 8.8690 124.0873 59.4367 40.5809 175.6888 50 A 3.8499 9.8529 131.9983 53.2593 16.0024 177.5813 51 G 3.9840 8.3995 106.0570 46.5859 0.0000 173.7805 52 L 4.5033 8.4863 121.6499 53.0302 43.0432 175.4510 53 W 5.0849 8.8427 133.9231 57.0778 31.8609 174.3261 54 I 5.0124 9.4273 128.8515 59.4215 40.2969 173.6688 55 C 5.7068 9.3963 127.5535 57.9785 30.8310 172.7790 56 I 5.1787 9.1926 117.1963 59.4676 40.2871 174.4465 57 M 5.5346 9.1063 124.3843 53.2212 36.2330 174.6051 58 E 5.2123 8.4390 120.8051 55.6149 30.4535 176.8819 59 G 4.0062 8.0837 106.8138 46.7516 0.0000 171.4933 60 D 4.5791 8.6261 119.3171 54.3553 41.3903 176.7565 61 S 4.4768 8.2744 117.8850 57.5986 63.8371 174.3427 62 L 4.1011 7.9309 122.7295 55.1890 41.7957 178.2480 63 Q 4.1500 8.5888 121.4174 58.3628 29.0584 175.9781 64 E 4.7352 7.6687 114.5228 54.6693 33.7517 174.3711 65 R 4.5788 8.3000 119.4282 55.2336 31.5330 176.1096 66 T 4.7730 8.0064 110.5975 60.1484 71.9787 173.0639 67 Y 4.3755 8.5408 120.9066 58.2250 39.0319 175.1979 68 N 4.3297 7.7719 117.3748 54.2951 39.0104 173.8640 69 H 4.1700 7.5571 116.6445 55.1265 30.5160 172.8923 70 I 4.3454 7.2295 112.6292 58.9151 40.3213 174.1624 71 A 5.0768 8.0244 124.8589 50.3412 21.4285 175.5941 72 F 4.6401 9.3591 121.4337 56.2536 41.5732 174.7846 73 Q 5.1317 8.6871 122.2386 55.1988 30.6464 174.4252 74 I 4.8061 8.3718 117.4893 59.4551 42.0265 174.1312 75 Q 4.5135 8.5961 120.9371 55.1621 29.4942 177.9160 76 S 4.2086 8.3621 116.9307 61.5749 62.6914 176.6251 77 E 4.1653 8.2760 120.7778 57.8404 29.4670 177.5085 78 E 4.9725 7.9307 117.6575 55.0283 30.2729 177.5216 79 V 3.6490 7.6768 120.7781 66.7156 31.4177 177.6893 80 D 4.3192 8.0158 117.8422 57.3075 40.6958 178.0944 81 E 3.8647 8.1602 118.5667 59.9417 29.4644 179.0952 82 Y 3.9435 8.1040 116.5020 61.0732 37.9605 178.7365 83 T 3.8271 7.8688 116.7857 66.8287 68.6238 176.3705 84 E 3.9646 8.2961 121.0781 58.9973 29.3877 178.6930 85 R 3.8107 7.8332 118.3979 59.4503 30.0203 178.3197 86 I 3.6698 7.8404 119.6381 63.7480 36.9984 178.3666 87 K 3.9363 7.8251 120.2449 59.4244 31.8580 178.8063 88 A 4.0253 8.1748 120.2592 54.8263 18.3312 178.9132 89 L 4.2379 7.3658 115.3978 55.3704 41.9376 178.1678 90 G 3.9584 7.9686 107.0279 45.2885 0.0000 173.6730 91 V 3.9189 7.4805 119.3196 61.9705 32.3038 175.2539 92 E 4.2969 8.9299 128.2262 56.7807 30.6096 175.2286 93 M 5.3330 8.8188 124.9373 53.6246 35.7615 174.8360 94 K 4.9410 8.8440 120.1224 53.7509 34.9382 174.8607 95 P 4.5129 0.0000 0.0000 62.2801 32.0151 175.7687 96 E 4.2822 8.4976 119.8819 56.3381 30.1392 176.7834 97 R 4.2670 8.3040 123.3359 54.4390 31.2734 174.6541 98 P 4.3321 0.0000 0.0000 63.0597 31.6432 176.1167 99 R 4.7459 8.2114 117.3866 54.6422 33.1477 173.8927 100 V 4.4738 8.1767 116.0649 60.3012 34.4501 174.3973 101 Q 4.1490 8.5562 125.1070 57.8230 29.2034 176.1145 102 G 4.1441 8.9958 112.5389 45.8493 0.0000 173.7630 103 E 4.3681 7.8286 119.3727 55.1703 30.7088 178.7575 104 G 4.5775 8.5359 112.3313 44.9077 0.0000 172.2233 105 R 5.0546 8.4268 119.2100 54.6658 33.7102 175.3671 106 S 5.1428 9.0737 116.4529 56.8852 67.2330 173.5741 107 I 4.5849 8.4870 123.0115 59.7891 40.1743 174.0571 108 Y 5.3085 8.6961 124.4367 56.2498 40.8672 174.7099 109 F 5.5529 8.3193 117.0553 56.9818 41.7516 172.5320 110 Y 5.7682 9.2418 116.8990 55.8629 40.6599 175.9968 111 D 3.5245 8.5207 121.7398 52.8739 40.9029 177.1100 112 F 4.8139 8.0190 121.4093 57.9749 39.4076 175.3638 113 D 4.8589 8.8597 120.7504 54.1229 41.7555 176.3449 114 N 4.1747 8.4994 113.1037 54.4302 36.1144 173.4891 115 H 4.5777 8.2290 116.0928 55.0883 30.1710 174.0682 116 L 4.0420 8.1672 125.3441 53.9485 43.1850 175.5309 117 F 4.9608 8.6700 123.8717 55.5465 43.2278 173.5696 118 E 4.8948 8.8185 121.0881 54.4047 33.3266 174.2231 119 L 5.1090 8.9687 126.7724 53.4849 44.1282 174.6597 120 H 5.3041 9.2543 124.7826 54.1801 32.6574 172.5518 121 A 5.4197 8.3616 127.9310 50.4168 20.5786 175.7162 122 G 4.2286 8.6866 110.6264 44.5474 0.0000 173.9784 123 T 4.4663 8.6062 113.3396 59.7191 72.0769 176.0124 124 L 3.9277 8.2196 121.6922 58.4021 41.8756 178.2760 125 E 3.9793 8.2218 116.7406 59.8296 29.4585 178.9306 126 E 4.1278 7.7763 117.4447 59.1558 29.5657 179.0014 127 R 4.2817 7.7066 118.1460 58.3631 30.3317 176.6091 128 L 4.2707 7.9830 120.4570 54.9147 40.8342 177.5572 129 K 4.6027 8.2470 125.6262 55.1286 33.5134 176.7783 130 R 4.1031 8.4526 123.4986 56.9720 29.9689 176.6654 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 4.42 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 2 I 8.12 3.41 1.86 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 1.46 0.63 0.89 0.00 0.00 3 S 9.92 4.61 0.00 3.96 3.96 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 4 G 7.25 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 5 L 7.96 4.22 0.00 1.57 1.58 0.83 0.79 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 6 S 8.61 4.41 0.00 3.88 3.75 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 7 H 7.00 4.71 0.00 2.36 2.10 0.00 5.52 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.11 4.43 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 1.11 0.78 0.84 0.00 0.00 9 T 8.42 5.05 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 1.22 0.00 0.00 10 L 9.40 4.87 0.00 1.53 1.44 1.04 0.62 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 11 I 8.45 4.96 1.93 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 1.38 0.86 1.07 0.00 0.00 12 V 9.14 4.88 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 0.95 0.00 0.00 1.09 0.00 0.00 13 K 9.57 4.08 0.00 1.85 1.97 0.00 1.56 0.00 0.00 1.51 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.76 1.36 7.81 14 D 7.81 4.62 0.00 2.66 2.53 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 15 L 8.54 4.08 0.00 1.76 1.82 1.07 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.20 4.37 0.00 2.90 2.89 0.00 0.00 6.72 6.99 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 17 K 9.23 3.76 0.00 1.78 1.90 0.00 1.12 0.00 0.00 1.30 0.00 0.00 2.21 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.71 0.39 7.81 18 T 8.31 4.17 4.49 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 1.30 0.00 0.00 19 T 8.79 3.95 4.57 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 1.61 0.00 0.00 20 A 8.13 4.08 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 F 8.29 4.17 0.00 3.60 3.52 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 0.00 0.00 0.00 0.00 22 L 8.37 4.14 0.00 1.62 1.49 0.23 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.30 4.12 0.00 2.31 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.78 2.84 0.00 24 N 8.43 4.36 0.00 2.58 2.80 0.00 0.00 7.04 7.00 0.00 0.00 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 7.06 3.82 0.91 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.03 -0.34 0.00 0.00 26 F 7.57 4.38 0.00 2.84 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 27 N 8.42 4.84 0.00 2.86 2.92 0.00 0.00 7.23 7.35 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 28 A 7.87 4.35 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 29 E 9.12 4.58 0.00 2.12 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 2.24 2.25 0.00 30 E 8.89 4.09 0.00 1.67 1.71 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 2.02 1.61 0.00 31 I 8.26 4.54 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.01 1.00 0.00 0.00 32 Y 7.37 4.77 0.00 2.89 2.57 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 33 S 7.36 4.66 0.00 3.76 3.39 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 34 S 8.20 4.25 0.00 3.22 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 35 G 8.11 4.47 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 36 D 8.62 4.36 0.00 2.66 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 37 K 8.36 4.04 0.00 2.00 2.08 0.00 1.57 0.00 0.00 1.88 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.46 7.81 38 T 7.76 4.10 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 1.23 0.00 0.00 39 F 8.10 4.92 0.00 3.01 3.16 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 40 S 7.71 3.69 0.00 3.93 3.83 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 41 L 8.17 4.87 0.00 1.85 1.62 1.22 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 42 S 9.00 4.85 0.00 3.91 3.91 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 43 K 9.96 4.52 0.00 1.43 1.73 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.26 7.81 44 E 9.58 5.30 0.00 2.02 1.75 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 2.40 2.54 0.00 45 K 9.20 5.04 0.00 2.02 1.78 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.45 7.81 46 F 9.20 6.02 0.00 3.11 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 47 F 10.04 5.53 0.00 3.01 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 48 L 9.02 5.42 0.00 1.66 1.62 0.93 0.85 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 49 I 8.87 4.73 1.92 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.09 0.59 0.00 0.00 50 A 9.85 3.85 1.42 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 51 G 8.40 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 52 L 8.49 4.50 0.00 1.97 1.73 1.17 0.39 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 53 W 8.84 5.08 0.00 3.34 3.20 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 54 I 9.43 5.01 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.48 1.18 0.00 0.00 55 C 9.40 5.71 0.00 2.76 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 9.19 5.18 2.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.11 0.98 0.00 0.00 57 M 9.11 5.53 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.59 0.00 58 E 8.44 5.21 0.00 2.03 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 2.65 2.15 0.00 59 G 8.08 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 0.00 0.00 0.00 60 D 8.63 4.58 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.27 4.48 0.00 3.86 3.83 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 62 L 7.93 4.10 0.00 1.70 1.70 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.59 4.15 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 64 E 7.67 4.74 0.00 1.87 1.77 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 2.19 2.25 0.00 65 R 8.30 4.58 0.00 1.75 1.95 0.00 2.75 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 66 T 8.01 4.77 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 1.22 0.00 0.00 67 Y 8.54 4.38 0.00 2.85 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 68 N 7.77 4.33 0.00 2.69 2.66 0.00 0.00 6.80 7.88 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 69 H 7.56 4.17 0.00 3.10 2.90 0.00 5.49 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 70 I 7.23 4.35 1.45 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 1.06 0.63 0.68 0.00 0.00 71 A 8.02 5.08 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 72 F 9.36 4.64 0.00 3.17 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 73 Q 8.69 5.13 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 74 I 8.37 4.81 1.89 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.49 0.56 0.00 0.00 75 Q 8.60 4.51 0.00 2.40 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.83 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 76 S 8.36 4.21 0.00 4.01 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 77 E 8.28 4.17 0.00 1.95 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 0.00 2.32 2.43 0.00 78 E 7.93 4.97 0.00 2.19 2.24 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 2.37 2.37 0.00 79 V 7.68 3.65 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 1.05 0.00 0.00 0.99 0.00 0.00 80 D 8.02 4.32 0.00 2.80 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 81 E 8.16 3.86 0.00 1.94 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 2.31 2.35 0.00 82 Y 8.10 3.94 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 83 T 7.87 3.83 4.43 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 1.23 0.00 0.00 84 E 8.30 3.96 0.00 2.01 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 2.29 0.00 85 R 7.83 3.81 0.00 1.76 2.00 0.00 3.02 0.00 0.00 2.90 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 86 I 7.84 3.67 1.78 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.58 0.52 0.00 0.00 87 K 7.83 3.94 0.00 1.98 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 88 A 8.17 4.03 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 L 7.37 4.24 0.00 1.77 1.77 0.74 0.83 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 90 G 7.97 3.96 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 0.00 0.00 0.00 91 V 7.48 3.92 2.19 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 1.13 0.00 0.00 1.09 0.00 0.00 92 E 8.93 4.30 0.00 2.20 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 2.56 2.45 0.00 93 M 8.82 5.33 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.66 0.00 94 K 8.84 4.94 0.00 1.77 1.74 0.00 1.80 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.65 1.72 7.81 95 P 0.00 4.51 0.00 2.21 2.10 0.00 3.82 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 96 E 8.50 4.28 0.00 2.06 1.97 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 2.43 2.58 0.00 97 R 8.30 4.27 0.00 1.84 1.74 0.00 2.76 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.20 0.00 98 P 0.00 4.33 0.00 2.01 1.98 0.00 3.54 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 99 R 8.21 4.75 0.00 2.01 1.91 0.00 3.02 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 100 V 8.18 4.47 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 0.97 0.00 0.00 0.94 0.00 0.00 101 Q 8.56 4.15 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.77 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 102 G 9.00 4.14 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 0.00 0.00 0.00 103 E 7.83 4.37 0.00 2.06 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 2.36 2.50 0.00 104 G 8.54 4.58 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 0.00 105 R 8.43 5.05 0.00 1.75 1.83 0.00 3.10 0.00 0.00 3.36 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 106 S 9.07 5.14 0.00 3.70 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 0.00 107 I 8.49 4.58 1.93 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 1.26 0.80 1.04 0.00 0.00 108 Y 8.70 5.31 0.00 2.99 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 0.00 109 F 8.32 5.55 0.00 3.41 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 0.00 110 Y 9.24 5.77 0.00 2.87 2.92 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 0.00 0.00 0.00 0.00 111 D 8.52 3.52 0.00 1.80 2.34 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 0.00 112 F 8.02 4.81 0.00 3.02 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 0.00 113 D 8.86 4.86 0.00 2.65 2.57 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 0.00 114 N 8.50 4.17 0.00 2.95 2.91 0.00 0.00 7.13 8.16 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 0.00 115 H 8.23 4.58 0.00 3.41 2.64 0.00 5.80 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.17 4.04 0.00 1.25 1.26 0.39 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 117 F 8.67 4.96 0.00 2.21 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 0.00 118 E 8.82 4.89 0.00 1.89 1.68 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 1.92 1.47 0.00 119 L 8.97 5.11 0.00 1.58 1.43 0.50 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 120 H 9.25 5.30 0.00 3.33 3.13 0.00 5.76 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 0.00 121 A 8.36 5.42 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 0.00 122 G 8.69 4.23 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 0.00 123 T 8.61 4.47 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 1.25 0.00 0.00 124 L 8.22 3.93 0.00 1.78 1.71 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.22 3.98 0.00 1.96 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 2.33 2.49 0.00 126 E 7.78 4.13 0.00 2.07 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 2.35 2.32 0.00 127 R 7.71 4.28 0.00 1.93 2.13 0.00 3.34 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 128 L 7.98 4.27 0.00 1.65 1.64 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.25 4.60 0.00 1.70 1.75 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.41 7.81 130 R 8.45 4.10 0.00 1.80 1.88 0.00 3.24 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 1.65 1.66 0.00