NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2854 8.2493 123.5871 51.0960 19.8518 175.0921 2 S 4.4236 7.2007 115.1070 58.2058 65.0034 174.8198 3 A 4.6254 8.5655 122.5968 50.1160 22.4040 177.7089 4 G 4.3667 8.9565 111.8020 45.0697 0.0000 173.4308 5 V 4.0580 8.0707 120.0465 61.0534 33.2909 174.6544 6 A 4.9476 8.2690 122.5975 50.0849 22.2480 175.5301 7 V 4.3618 8.5445 121.4118 61.1662 34.3863 174.6086 8 T 4.9961 8.5117 117.3239 60.3774 71.6304 173.2140 9 N 4.3999 8.8856 117.1595 54.3914 36.0069 175.8295 10 L 3.9305 8.0104 122.5320 56.7149 42.6887 176.7651 11 N 4.1417 8.0719 113.6955 54.0106 35.9835 174.4236 12 L 4.1763 8.2644 120.4187 54.8025 43.3286 175.7045 13 K 4.7367 8.3801 124.8213 53.6455 34.5540 173.9137 14 P 3.6563 0.0000 0.0000 64.4266 31.5254 177.0571 15 G 3.7921 9.2871 110.2901 45.5165 0.0000 172.0327 16 H 5.3220 7.9508 115.9615 53.8475 33.1860 171.9466 17 C 5.4711 8.6667 112.3191 57.0139 33.6923 173.4228 18 V 4.8883 8.7576 112.4917 59.5898 35.0471 174.2006 19 E 5.0499 9.1641 126.2350 54.4762 32.1924 174.4165 20 I 4.8969 9.0152 127.9868 59.4956 40.2276 174.5676 21 K 4.8655 8.8813 126.9658 54.8533 35.2020 175.2928 22 G 4.6597 8.8464 113.8819 45.4284 0.0000 170.8448 23 S 5.1348 8.9786 113.9939 56.4121 66.3027 173.3720 24 I 4.4078 8.4819 124.8972 59.5148 38.4307 173.8206 25 P 4.6119 0.0000 0.0000 61.4918 32.6992 175.0193 26 P 4.7781 0.0000 0.0000 63.0115 31.3228 176.2956 27 D 4.4011 7.4998 113.5977 54.6909 40.4225 174.8267 28 C 4.2984 7.9499 120.9812 59.9005 31.8960 173.8583 29 K 4.2424 8.9861 126.9685 58.8186 32.1979 176.6874 30 G 4.5489 7.4377 103.4740 45.9741 0.0000 172.3700 31 F 5.4991 8.2121 114.6051 55.1461 42.1038 173.3831 32 A 5.2887 9.0726 119.9029 50.4133 23.1110 175.2629 33 V 4.6758 9.0251 120.0486 61.2034 34.7330 173.9728 34 N 5.0751 8.9563 125.7974 51.2315 41.3236 173.5465 35 L 4.9381 8.4369 124.0491 52.3319 44.4761 174.1648 36 G 4.3019 8.9229 115.4050 47.2512 0.0000 175.6954 37 E 4.5922 9.5276 122.4346 57.1671 31.9504 174.9249 38 D 3.3700 7.1364 115.4000 52.3928 41.4723 176.0372 39 A 4.4999 7.9200 118.1789 52.9682 17.6176 178.0556 40 S 4.1824 8.0366 112.2249 59.0232 66.5125 173.5867 41 N 4.9625 7.9492 117.8020 51.6919 42.1738 173.2456 42 F 5.5271 8.6347 123.1625 55.6979 41.7910 176.5077 43 L 4.2473 9.3448 126.3563 57.4483 43.0591 176.9841 44 L 4.7208 7.8395 120.6714 53.7844 45.8218 174.0717 45 H 5.0919 9.8056 127.1223 54.5537 32.1621 172.4832 46 F 4.8584 9.0769 130.4027 56.6694 41.0346 173.9026 47 N 4.9546 8.3790 125.7517 51.6081 41.4482 172.9462 48 A 4.5018 7.9872 129.5339 50.5243 20.5535 175.6609 49 R 4.4423 8.5881 122.5924 55.6007 31.6797 177.5922 50 F 3.8715 9.3268 124.1952 59.8705 39.9552 176.1357 51 D 4.7514 7.9842 121.9589 53.3682 41.9444 173.1092 52 L 4.2608 9.3673 125.8344 55.1495 45.5281 174.7584 53 H 4.0506 9.7381 121.5153 56.9880 26.2208 175.7647 54 G 3.9074 8.5205 104.9066 45.6007 0.0000 173.5142 55 D 4.8338 7.8325 119.7410 52.0865 42.8641 175.5845 56 V 4.5308 7.7791 122.0183 62.0523 34.0951 175.2290 57 N 3.1400 8.3885 126.8912 53.6108 36.4757 174.1482 58 K 4.5432 7.4674 117.8110 54.6360 36.7431 175.5404 59 I 4.4797 8.1608 127.6714 60.1477 38.9394 174.7209 60 V 4.5900 8.6274 127.8601 61.3512 33.7266 174.1970 61 C 5.5882 8.4089 125.4587 57.7186 31.3143 172.2843 62 N 4.9622 7.5049 118.0918 53.6811 42.2602 172.6470 63 S 5.4912 8.6857 115.4370 56.4503 67.0807 172.5959 64 K 4.9212 9.1211 120.7759 54.6846 35.8328 174.5270 65 E 4.5255 8.5917 126.8233 54.3948 32.7289 175.2310 66 A 3.7575 9.1787 131.4113 53.5773 16.0035 176.7716 67 D 4.0770 8.1584 115.8054 54.9539 39.5592 174.2531 68 A 4.5464 7.4141 122.9593 49.6128 20.7203 176.4329 69 W 4.8558 8.7119 123.6054 57.3625 29.7333 177.3625 70 G 4.2319 8.8483 113.3525 46.2441 0.0000 172.4683 71 S 4.8251 8.7188 117.6717 57.7097 63.9096 174.5512 72 E 4.5692 8.8972 124.0867 56.4157 30.5982 176.1522 73 Q 4.6044 9.0737 123.6803 54.6209 31.6031 174.4764 74 R 4.8777 8.6372 125.5755 55.2206 31.9514 175.8680 75 E 4.4856 8.8167 121.4456 54.6715 32.5948 177.1584 76 E 3.8716 8.9225 124.0339 59.0805 29.9491 178.3193 77 V 3.6409 7.5843 117.9971 62.0576 32.0784 176.3305 78 F 4.2673 8.2113 126.2050 55.5558 39.0761 173.0170 79 P 4.0763 0.0000 0.0000 62.7195 30.9444 176.8528 80 F 5.2143 6.7112 117.0868 56.3998 41.9218 174.8265 81 Q 5.0620 8.5926 118.3955 54.7201 31.2297 174.1962 82 Q 3.6947 8.2843 119.6738 57.6714 29.1021 177.6673 83 G 3.8359 8.4339 108.7878 45.4297 0.0000 173.4622 84 A 4.4904 7.5682 121.3539 51.2778 21.1550 175.4160 85 E 4.9152 8.5885 116.7693 54.8901 31.6740 176.6244 86 V 4.2519 8.4754 124.4285 62.5019 34.0751 175.0707 87 M 5.3194 8.6309 124.6593 53.9053 34.6211 173.2839 88 V 4.4303 8.7005 123.2797 60.8776 35.0279 173.7932 89 C 5.1040 7.9699 123.3338 57.8523 31.9538 172.8347 90 F 5.0546 9.4632 122.8355 55.7198 41.2057 173.9186 91 E 5.0319 9.0956 126.2710 54.6899 31.6795 173.9271 92 Y 5.1100 9.1621 129.4463 57.0249 39.7816 174.0660 93 Q 4.8732 9.2289 125.9593 53.8911 32.0900 177.1677 94 T 3.6428 8.5343 112.3062 64.6021 69.2591 175.3877 95 Q 4.4113 8.1796 120.3137 58.3163 30.3572 175.7794 96 K 5.1371 7.9106 117.0061 55.7090 37.0745 174.6640 97 I 5.0157 8.8475 120.7808 59.6894 39.8889 175.0849 98 I 4.5152 8.7047 128.5805 60.2132 38.8875 174.7142 99 I 4.1691 8.5837 128.4828 59.1992 39.3285 174.8590 100 K 4.6796 7.9274 125.8322 54.4490 35.6857 175.5159 101 F 5.3888 8.7448 122.8933 55.4255 41.8201 176.8737 102 S 4.3581 8.4790 114.4106 60.9501 62.6530 175.8841 103 S 4.1503 8.3357 114.6568 59.8843 62.9044 175.1508 104 G 4.0226 8.2805 109.4349 44.8943 0.0000 173.3285 105 D 4.8162 7.9423 119.9044 54.2464 42.1653 175.3476 106 Q 5.1334 8.4383 122.0720 55.0444 32.5559 173.2773 107 F 5.0496 8.5711 117.7022 56.3786 41.5741 172.5918 108 S 5.3484 9.1010 113.7917 56.5987 66.2717 172.6770 109 F 5.3552 9.1630 122.4183 55.7875 42.5307 172.2795 110 P 4.8606 0.0000 0.0000 62.1959 32.6085 175.6310 111 V 3.9904 8.5762 123.3056 63.0206 31.3835 176.1016 112 R 4.3007 8.8883 126.3783 56.6007 31.0051 176.3267 113 K 4.3765 7.7444 117.8967 54.2852 33.9204 175.5631 114 V 3.9067 8.4931 127.0203 62.7790 32.1111 175.0332 115 L 4.9273 8.5000 127.0990 52.0508 44.0597 175.2273 116 P 4.4771 0.0000 0.0000 65.6188 31.5864 176.4075 117 S 4.8486 7.7080 110.2606 57.3847 65.4377 173.5022 118 I 4.3927 9.3556 124.5109 59.4540 37.9780 174.8314 119 P 4.4676 0.0000 0.0000 64.2970 32.9200 175.7303 120 F 5.4610 8.4874 122.0665 56.3047 42.8190 174.0268 121 L 5.3484 7.5947 125.3424 53.6242 45.7227 174.5883 122 S 4.8230 8.0942 118.8064 56.7028 66.9658 172.4777 123 L 5.3998 8.5489 119.8801 53.2634 45.8741 175.4462 124 E 4.8023 8.7661 119.5360 55.8054 33.9368 176.4492 125 G 3.8985 9.2036 110.4307 45.8515 0.0000 172.6264 126 L 4.2917 7.6820 120.7333 52.5688 43.5835 175.7210 127 A 4.2474 8.6004 129.2772 51.4468 18.7348 176.1639 128 F 4.4128 8.8797 124.2560 59.6580 39.8171 174.3098 129 K 4.0932 8.6622 124.9653 57.4267 33.4340 176.6451 130 S 4.9193 7.5840 112.4170 57.2958 66.3445 172.6547 131 I 5.1951 8.5076 121.3046 60.1058 40.3619 174.8781 132 T 4.8522 9.0842 122.1312 62.1374 72.9428 172.9979 133 T 5.1821 8.4170 118.9377 62.1409 72.7873 173.9232 134 E 4.3361 9.1386 123.0208 56.8910 31.0300 175.1208 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 A 8.25 4.29 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 2 S 7.20 4.42 0.00 4.08 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 8.57 4.63 1.25 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 4 G 8.96 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 0.00 0.00 0.00 0.00 5 V 8.07 4.06 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 0.34 0.00 0.00 0.66 0.00 0.00 6 A 8.27 4.95 1.24 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 0.00 0.00 0.00 0.00 0.00 7 V 8.54 4.36 1.86 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 0.89 0.00 0.00 0.70 0.00 0.00 8 T 8.51 5.00 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 1.44 0.00 0.00 9 N 8.89 4.40 0.00 2.91 2.97 0.00 0.00 6.90 7.85 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 10 L 8.01 3.93 0.00 1.55 1.90 0.88 0.96 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 11 N 8.07 4.14 0.00 2.85 2.84 0.00 0.00 6.85 7.85 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 12 L 8.26 4.18 0.00 1.71 1.57 1.03 0.54 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 13 K 8.38 4.74 0.00 1.83 1.72 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.48 1.58 7.81 14 P 0.00 3.66 0.00 1.83 1.58 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.42 0.00 15 G 9.29 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 16 H 7.95 5.32 0.00 3.22 3.24 0.00 5.56 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 C 8.67 5.47 0.00 3.08 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 18 V 8.76 4.89 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 0.74 0.00 0.00 0.96 0.00 0.00 19 E 9.16 5.05 0.00 1.99 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 2.18 2.20 0.00 20 I 9.02 4.90 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.41 0.96 0.00 0.00 21 K 8.88 4.87 0.00 1.77 1.61 0.00 1.60 0.00 0.00 1.61 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.31 1.48 7.81 22 G 8.85 4.66 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 0.00 0.00 0.00 23 S 8.98 5.13 0.00 3.75 3.86 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 24 I 8.48 4.41 1.88 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.72 1.02 0.00 0.00 25 P 0.00 4.61 0.00 2.07 1.97 0.00 3.65 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 26 P 0.00 4.78 0.00 2.13 2.09 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 27 D 7.50 4.40 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 28 C 7.95 4.30 0.00 3.12 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 29 K 8.99 4.24 0.00 1.92 1.99 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.47 7.81 30 G 7.44 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 31 F 8.21 5.50 0.00 3.30 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 32 A 9.07 5.29 1.24 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 0.00 0.00 0.00 0.00 0.00 33 V 9.03 4.68 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 0.69 0.00 0.00 1.21 0.00 0.00 34 N 8.96 5.08 0.00 2.21 1.42 0.00 0.00 6.36 6.66 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 35 L 8.44 4.94 0.00 1.31 1.36 0.54 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.92 4.30 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 0.00 37 E 9.53 4.59 0.00 1.87 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 2.23 2.21 0.00 38 D 7.14 3.37 0.00 2.46 2.43 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 39 A 7.92 4.50 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 40 S 8.04 4.18 0.00 3.64 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 41 N 7.95 4.96 0.00 2.57 2.58 0.00 0.00 6.68 7.72 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 42 F 8.63 5.53 0.00 2.96 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 43 L 9.34 4.25 0.00 1.60 1.74 1.07 0.77 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 44 L 7.84 4.72 0.00 1.83 1.37 0.66 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 45 H 9.81 5.09 0.00 3.65 3.67 0.00 5.81 0.00 0.00 0.00 0.00 6.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 9.08 4.86 0.00 3.24 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 47 N 8.38 4.95 0.00 2.42 2.47 0.00 0.00 6.60 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 48 A 7.99 4.50 0.05 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 0.00 0.00 49 R 8.59 4.44 0.00 1.72 1.74 0.00 3.01 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.42 0.00 50 F 9.33 3.87 0.00 3.25 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 51 D 7.98 4.75 0.00 2.59 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 9.37 4.26 0.00 1.77 1.34 0.79 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 53 H 9.74 4.05 0.00 3.26 3.28 0.00 5.81 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.52 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 0.00 0.00 0.00 55 D 7.83 4.83 0.00 2.76 2.43 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 56 V 7.78 4.53 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 0.75 0.00 0.00 0.91 0.00 0.00 57 N 8.39 3.14 0.00 2.43 2.05 0.00 0.00 6.76 7.29 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 58 K 7.47 4.54 0.00 1.58 1.41 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.22 1.44 7.81 59 I 8.16 4.48 1.78 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.72 0.68 0.00 0.00 60 V 8.63 4.59 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 0.90 0.00 0.00 0.81 0.00 0.00 61 C 8.41 5.59 0.00 2.79 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 0.00 0.00 0.00 62 N 7.50 4.96 0.00 2.84 2.81 0.00 0.00 6.49 7.63 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 63 S 8.69 5.49 0.00 4.21 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 0.00 64 K 9.12 4.92 0.00 0.93 1.00 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.75 0.38 7.81 65 E 8.59 4.53 0.00 2.00 1.67 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 2.13 2.19 0.00 66 A 9.18 3.76 1.24 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 0.00 0.00 0.00 0.00 0.00 67 D 8.16 4.08 0.00 2.70 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 68 A 7.41 4.55 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 69 W 8.71 4.86 0.00 3.21 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 70 G 8.85 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 71 S 8.72 4.83 0.00 3.84 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.90 4.57 0.00 1.87 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 2.30 0.00 73 Q 9.07 4.60 0.00 2.40 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 74 R 8.64 4.88 0.00 1.68 1.77 0.00 3.23 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 75 E 8.82 4.49 0.00 1.51 1.38 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 1.81 1.47 0.00 76 E 8.92 3.87 0.00 1.90 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 2.27 2.24 0.00 77 V 7.58 3.64 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 0.67 0.00 0.00 0.90 0.00 0.00 78 F 8.21 4.27 0.00 3.00 2.79 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 79 P 0.00 4.08 0.00 1.73 1.77 0.00 2.67 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.11 0.00 80 F 6.71 5.21 0.00 2.75 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 81 Q 8.59 5.06 0.00 2.30 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.01 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 82 Q 8.28 3.69 0.00 1.83 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.76 0.00 0.00 0.00 0.00 0.00 1.50 1.30 0.00 83 G 8.43 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 84 A 7.57 4.49 1.38 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 85 E 8.59 4.92 0.00 1.84 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 2.17 2.24 0.00 86 V 8.48 4.25 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 0.96 0.00 0.00 0.50 0.00 0.00 87 M 8.63 5.32 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.48 0.00 88 V 8.70 4.43 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 -0.47 0.00 0.00 1.22 0.00 0.00 89 C 7.97 5.10 0.00 2.62 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 90 F 9.46 5.05 0.00 2.78 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 91 E 9.10 5.03 0.00 2.01 1.79 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 2.25 2.37 0.00 92 Y 9.16 5.11 0.00 3.06 2.82 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 93 Q 9.23 4.87 0.00 2.24 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.56 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 94 T 8.53 3.64 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 1.09 0.00 0.00 95 Q 8.18 4.41 0.00 2.17 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 96 K 7.91 5.14 0.00 2.06 1.97 0.00 1.31 0.00 0.00 1.85 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.63 7.81 97 I 8.85 5.02 2.07 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 1.40 0.92 1.13 0.00 0.00 98 I 8.70 4.52 1.83 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.79 0.82 0.00 0.00 99 I 8.58 4.17 0.70 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 0.85 0.24 -0.43 0.00 0.00 100 K 7.93 4.68 0.00 1.40 1.48 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.17 1.15 7.81 101 F 8.74 5.39 0.00 2.96 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 0.00 102 S 8.48 4.36 0.00 3.97 4.03 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 0.00 103 S 8.34 4.15 0.00 3.98 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 0.00 104 G 8.28 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 0.00 0.00 0.00 0.00 105 D 7.94 4.82 0.00 2.83 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 0.00 106 Q 8.44 5.13 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 107 F 8.57 5.05 0.00 3.24 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 0.00 108 S 9.10 5.35 0.00 4.00 3.90 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 0.00 109 F 9.16 5.36 0.00 3.30 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 0.00 110 P 0.00 4.86 0.00 1.96 1.90 0.00 2.39 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.67 0.00 111 V 8.58 3.99 2.41 0.00 0.00 0.00 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 1.24 0.00 0.00 112 R 8.89 4.30 0.00 1.91 2.00 0.00 3.34 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 113 K 7.74 4.38 0.00 1.68 1.69 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.44 7.81 114 V 8.49 3.91 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 0.95 0.00 0.00 0.99 0.00 0.00 115 L 8.50 4.93 0.00 1.73 1.79 0.92 0.85 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 0.00 116 P 0.00 4.48 0.00 2.21 2.22 0.00 3.86 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 117 S 7.71 4.85 0.00 4.10 3.89 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 0.00 118 I 9.36 4.39 1.80 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.42 0.92 0.00 0.00 119 P 0.00 4.47 0.00 2.18 2.33 0.00 3.80 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 2.30 1.99 0.00 120 F 8.49 5.46 0.00 3.22 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 0.00 121 L 7.59 5.35 0.00 1.50 1.12 0.73 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 122 S 8.09 4.82 0.00 3.81 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 0.00 123 L 8.55 5.40 0.00 1.59 1.58 0.94 0.79 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 0.00 124 E 8.77 4.80 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 125 G 9.20 3.90 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 0.00 0.00 0.00 126 L 7.68 4.29 0.00 1.42 1.55 0.51 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 127 A 8.60 4.25 1.28 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 0.00 0.00 128 F 8.88 4.41 0.00 3.06 2.95 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 0.00 129 K 8.66 4.09 0.00 1.64 1.67 0.00 1.61 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.27 1.22 7.81 130 S 7.58 4.92 0.00 3.88 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.51 5.20 1.87 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.89 0.87 0.00 0.00 132 T 9.08 4.85 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 1.22 0.00 0.00 133 T 8.42 5.18 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 1.31 0.00 0.00 134 E 9.14 4.34 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 2.24 2.27 0.00