NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 N 4.5631 8.4249 118.0647 53.3552 39.3865 173.3749 21 Y 4.8598 7.9942 120.9144 54.0207 40.6413 174.8801 22 S 4.4396 9.1197 118.5133 57.7966 66.2035 174.7531 23 E 3.9065 8.7042 121.9655 59.7556 29.2141 178.6909 24 I 3.7201 7.6921 117.8898 63.9668 38.0803 177.3917 25 E 3.8560 8.0856 119.2049 59.4627 29.2647 179.4992 26 S 4.0964 8.2179 115.0819 61.5040 62.9186 176.8978 27 K 3.9007 7.9155 120.9865 59.4710 31.5888 179.5422 28 V 3.4933 7.4388 117.1509 65.9772 31.7656 177.9087 29 R 3.9856 7.9506 119.2029 58.5058 29.7538 178.4604 30 E 3.8076 8.5533 119.2128 59.3782 29.4636 178.7548 31 A 4.1391 8.2627 119.0642 53.8902 18.2195 177.8224 32 T 4.3830 7.4204 107.6231 61.0482 69.3148 174.3164 33 N 4.6609 7.3902 120.6303 52.7519 39.0340 174.1514 34 D 4.2553 8.1807 116.1713 55.4989 41.5595 176.8564 35 D 3.6303 7.5408 120.1728 54.1323 40.8903 176.2358 36 P 4.4096 0.0000 0.0000 62.0572 30.7933 175.7603 37 W 5.1590 6.8944 114.4013 55.8261 31.3384 175.7340 38 G 3.9509 8.7882 108.2029 43.9519 0.0000 171.5182 39 P 4.4201 0.0000 0.0000 62.1720 32.1584 176.8998 40 S 4.4596 8.4134 115.3558 58.0105 65.2443 175.3269 41 G 3.5814 8.6477 109.7188 48.2490 0.0000 175.9354 42 Q 3.9535 7.9161 119.4801 58.7889 28.8677 178.5361 43 L 3.9094 7.7156 120.9948 58.3035 42.1352 178.8696 44 M 3.8882 8.0650 119.0350 58.0562 31.7477 178.8574 45 G 3.7717 8.2070 106.2042 47.8224 0.0000 174.9424 46 E 3.9448 8.2106 122.1681 59.2877 29.3540 179.1634 47 I 3.6930 7.6268 117.7797 64.2269 37.5737 177.8006 48 A 4.2377 8.6571 121.9793 55.3189 18.0977 179.6443 49 K 4.1181 8.7740 117.0018 59.9198 32.3041 179.4005 50 A 4.1615 7.9931 120.3948 54.9066 18.0334 179.5387 51 T 4.1662 7.6187 107.1461 64.4226 68.8645 176.1469 52 F 4.6295 7.8392 119.8529 58.4614 39.4688 175.4574 53 M 4.3888 7.8226 119.0020 54.5567 31.1094 176.5518 54 Y 4.3376 8.6691 124.4234 60.2432 37.9023 177.9578 55 E 3.8128 7.8263 118.4518 58.3162 29.9643 178.0336 56 Q 4.3690 8.0969 117.7088 57.1067 29.3313 177.5050 57 F 4.0823 7.7863 121.8299 60.9373 39.3035 175.2819 58 P 4.1346 0.0000 0.0000 65.7106 31.1925 178.4551 59 E 3.9090 8.0861 116.7722 59.1083 29.4366 178.6950 60 L 3.7939 7.6724 120.3267 58.7454 42.0572 179.1738 61 M 3.7074 7.7541 118.5044 58.2490 31.8437 178.6309 62 N 4.5189 8.3821 117.0641 56.2939 38.5635 177.2315 63 M 3.8833 8.0803 119.8340 58.3011 32.3467 177.7702 64 L 3.6804 7.6710 120.4861 58.1350 42.1734 179.1212 65 W 4.3438 8.1363 118.9909 59.7017 28.9379 178.5088 66 S 4.1368 8.2629 113.0743 61.5746 61.6714 176.4093 67 R 3.8731 7.8995 119.6060 59.4923 29.8310 178.4788 68 M 4.1676 8.0087 117.0647 57.8105 32.3426 176.7680 69 L 4.8383 7.9888 116.5950 54.9022 44.2912 176.9498 70 K 4.1826 8.2329 118.3665 57.1736 33.1963 176.9989 71 D 4.3808 8.4750 123.3739 55.8249 37.9739 173.4340 72 N 5.0340 7.6776 113.0333 52.5812 38.4155 177.4170 73 K 4.2618 8.2693 119.3243 58.7726 32.4106 177.7752 74 K 4.8577 8.2114 115.8669 56.5878 33.9025 176.4689 75 N 4.7974 7.4888 118.5372 50.9774 37.6801 175.1780 76 W 4.2716 7.4361 120.8286 58.9082 28.4816 178.7053 77 R 2.8995 6.2892 118.2730 58.5007 29.4096 178.6917 78 R 3.8207 7.5016 117.9542 59.3619 30.1045 178.5370 79 V 3.4889 7.3511 118.0109 66.0288 31.4513 177.2749 80 Y 4.0894 8.1466 119.3322 60.9080 38.6646 178.3836 81 K 3.7987 8.3675 119.8689 59.1065 31.9671 179.5580 82 S 3.9569 8.0012 114.8620 61.2728 62.8408 176.6976 83 L 3.8437 7.7503 122.5673 57.3339 41.3642 179.1846 84 L 3.7912 7.6000 119.0334 57.7209 41.4818 179.3855 85 L 3.8216 7.9900 120.3150 58.0456 41.9662 178.7017 86 L 3.7667 8.0751 120.3533 57.9790 41.9567 178.5541 87 A 4.0419 8.3722 121.0948 55.5427 18.3233 179.0152 88 Y 4.0097 8.0097 117.8013 60.8898 38.8057 178.2283 89 L 4.1167 8.4736 120.3505 57.8975 41.4798 179.5671 90 I 3.7000 8.0611 119.3517 64.0577 37.0197 178.1415 91 R 4.3031 7.5022 116.6596 57.9816 30.4156 177.5830 92 N 4.9667 8.0721 113.2072 53.8720 40.7398 174.8403 93 G 3.9074 8.0479 109.1695 43.8139 0.0000 173.2086 94 S 3.5371 7.5110 113.5689 58.1642 62.7572 175.8553 95 E 3.9467 8.7971 125.0849 59.8182 29.0841 180.0310 96 R 3.7772 7.9998 118.2131 58.6646 29.7544 179.1085 97 V 3.8253 7.6760 118.4611 65.9994 31.5506 178.0240 98 V 3.5606 7.7750 117.3556 66.5242 31.2677 177.8866 99 T 3.8858 7.6842 115.0489 66.6201 68.3078 176.5651 100 S 4.2737 8.4344 114.7694 61.4296 62.3066 175.8677 101 A 4.4481 8.2312 122.2966 55.6362 18.4943 179.5860 102 R 3.9830 8.1857 116.3564 59.4599 29.9578 179.2038 103 E 4.0772 8.4754 117.4107 58.4831 29.6581 177.4853 104 H 4.6000 7.6232 115.5918 55.1562 29.5278 176.0225 105 I 3.6002 7.4553 122.5430 64.4784 37.7047 177.0827 106 Y 4.2626 7.6187 116.6649 60.4187 37.6536 177.4051 107 D 4.4088 8.0235 119.1266 57.2733 41.2208 178.2110 108 L 4.2810 7.8550 119.2395 58.0354 41.7182 179.8640 109 R 4.2560 8.1422 117.8559 58.7139 29.7462 178.8828 110 S 4.3781 7.8462 112.8995 60.3912 63.3450 175.3499 111 L 4.6027 7.9378 121.8966 55.0624 41.5793 177.9635 112 E 4.2129 8.1233 119.0514 58.5458 29.5454 177.3387 113 N 5.0600 7.9441 115.2887 52.7111 39.3427 173.7166 114 Y 4.0844 8.1350 120.4967 58.0582 39.2791 173.8788 115 H 5.0101 8.0233 126.8974 54.3214 32.0141 173.3436 116 F 4.3394 8.2993 127.2823 57.2177 42.6649 172.4901 117 V 4.8374 7.7321 126.4973 60.8497 33.3285 174.9212 118 D 4.8386 9.2859 128.2999 52.4338 41.3265 175.6040 119 E 3.9569 8.6598 118.7599 58.1250 29.9493 176.9254 120 H 3.9486 9.3322 118.0851 56.7664 26.2079 175.6838 121 G 4.0151 7.9473 108.4126 46.4282 0.0000 174.4441 122 K 3.9706 7.8722 120.2065 56.0341 32.4626 175.9933 123 D 4.9563 8.3669 123.8135 53.5918 40.1323 175.9787 124 Q 3.6413 8.2665 126.6580 57.6925 28.8463 178.0456 125 G 3.9316 8.4245 107.4496 47.9073 0.0000 175.3853 126 I 3.7333 7.9760 120.6737 64.0668 37.8631 177.7180 127 N 4.3169 7.7995 117.2305 56.1646 38.1957 177.4720 128 I 3.8465 7.6661 120.6426 64.5840 37.3996 178.5473 129 R 4.0057 8.1607 118.8561 59.3217 30.0020 179.2616 130 Q 4.0045 8.2989 117.8301 58.9003 28.8045 178.7188 131 K 4.0257 8.1685 120.9323 59.5046 32.1841 179.2570 132 V 3.7211 8.1595 119.6913 64.6635 31.3366 178.5384 133 K 3.9977 8.0136 118.7163 59.3280 31.8928 179.1233 134 E 4.0139 8.1557 118.5755 59.3528 29.3431 179.1793 135 L 4.0962 8.1164 120.4054 58.1165 42.1349 179.2801 136 V 3.6196 8.2381 118.5984 65.9452 31.2808 177.8124 137 E 3.9946 8.0962 117.2429 59.3828 29.6671 178.9299 138 F 4.5822 8.4950 120.3194 61.5020 39.3430 177.1159 139 A 3.8114 8.2462 119.2886 54.8449 18.2339 178.8268 140 Q 4.3363 7.9393 114.2819 56.1710 30.0207 176.7040 141 D 4.6622 7.5328 120.8573 52.5153 40.3826 175.5949 142 D 4.2172 8.1991 124.9572 56.7641 41.4003 176.8904 143 D 4.2867 7.9778 118.0916 57.3534 41.2578 178.1318 144 R 3.9308 8.1395 118.8473 59.2226 30.1555 177.9418 145 L 3.5647 8.0599 120.5584 58.1416 42.0064 178.7965 146 R 3.8497 7.9723 118.4100 59.6303 29.9106 178.0917 147 E 3.9926 8.0251 118.8242 59.1416 29.6275 178.4311 148 E 4.0184 8.6259 119.0712 59.6545 29.6163 179.6433 149 R 4.1098 8.2291 118.0640 58.8607 29.8379 179.0095 150 K 3.8813 7.9603 118.6894 59.5641 32.6292 178.5266 151 K 4.0397 8.3810 118.8102 59.5728 31.8093 179.1643 152 A 4.0022 8.2152 120.8979 55.1464 18.1062 179.8603 153 K 3.9603 7.8595 115.6768 59.2330 32.0908 179.3537 154 K 4.1562 7.6007 117.9190 58.9462 32.0674 176.7159 155 N 4.5311 7.7619 120.4924 53.4686 38.5168 174.7379 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 20 N 8.42 4.56 0.00 2.61 2.77 0.00 0.00 6.81 6.57 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 21 Y 7.99 4.86 0.00 3.04 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 22 S 9.12 4.44 0.00 4.08 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 0.00 23 E 8.70 3.91 0.00 2.06 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 0.00 2.38 2.39 0.00 24 I 7.69 3.72 2.05 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 1.61 1.00 0.90 0.00 0.00 25 E 8.09 3.86 0.00 2.26 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 2.24 2.34 0.00 26 S 8.22 4.10 0.00 4.05 3.92 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 27 K 7.92 3.90 0.00 1.92 1.81 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.63 7.81 28 V 7.44 3.49 1.93 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 0.68 0.00 0.00 0.84 0.00 0.00 29 R 7.95 3.99 0.00 1.93 1.87 0.00 2.60 0.00 0.00 2.84 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.23 0.00 30 E 8.55 3.81 0.00 1.99 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 2.26 2.29 0.00 31 A 8.26 4.14 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 32 T 7.42 4.38 4.10 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 1.09 0.00 0.00 33 N 7.39 4.66 0.00 2.64 2.93 0.00 0.00 6.85 9.00 0.00 0.00 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 D 8.18 4.26 0.00 2.53 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 35 D 7.54 3.63 0.00 1.86 1.54 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 36 P 0.00 4.41 0.00 2.21 2.09 0.00 2.94 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 37 W 6.89 5.16 0.00 3.35 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 38 G 8.79 3.95 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 0.00 39 P 0.00 4.42 0.00 2.06 2.09 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.81 0.00 40 S 8.41 4.46 0.00 4.20 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 41 G 8.65 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 42 Q 7.92 3.95 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 43 L 7.72 3.91 0.00 1.75 1.73 0.87 0.85 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 44 M 8.06 3.89 0.00 0.67 1.08 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.28 0.00 45 G 8.21 3.77 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 0.00 0.00 0.00 46 E 8.21 3.94 0.00 2.18 2.18 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 2.30 2.42 0.00 47 I 7.63 3.69 1.94 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.75 0.85 0.00 0.00 48 A 8.66 4.24 1.65 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 0.00 0.00 49 K 8.77 4.12 0.00 2.04 1.98 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.69 7.81 50 A 7.99 4.16 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 51 T 7.62 4.17 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 1.31 0.00 0.00 52 F 7.84 4.63 0.00 3.18 3.15 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 53 M 7.82 4.39 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.54 0.00 54 Y 8.67 4.34 0.00 3.12 3.25 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 55 E 7.83 3.81 0.00 1.80 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 2.07 1.65 0.00 56 Q 8.10 4.37 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 57 F 7.79 4.08 0.00 3.14 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 58 P 0.00 4.13 0.00 2.25 2.16 0.00 3.74 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 59 E 8.09 3.91 0.00 2.00 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 2.42 2.38 0.00 60 L 7.67 3.79 0.00 1.78 1.68 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 61 M 7.75 3.71 0.00 1.88 1.54 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 62 N 8.38 4.52 0.00 2.77 2.89 0.00 0.00 6.64 8.09 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 63 M 8.08 3.88 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 64 L 7.67 3.68 0.00 1.53 1.37 0.55 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 65 W 8.14 4.34 0.00 3.33 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 66 S 8.26 4.14 0.00 3.99 3.95 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 67 R 7.90 3.87 0.00 1.90 1.87 0.00 3.25 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 68 M 8.01 4.17 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 69 L 7.99 4.84 0.00 1.84 1.75 1.03 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.23 4.18 0.00 1.86 1.78 0.00 1.89 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.59 7.81 71 D 8.47 4.38 0.00 2.77 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 72 N 7.68 5.03 0.00 2.99 3.09 0.00 0.00 6.13 7.20 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 73 K 8.27 4.26 0.00 1.85 1.96 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.52 7.81 74 K 8.21 4.86 0.00 1.84 2.00 0.00 1.85 0.00 0.00 1.83 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.45 7.81 75 N 7.49 4.80 0.00 2.79 2.66 0.00 0.00 6.57 7.55 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 76 W 7.44 4.27 0.00 3.45 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 77 R 6.29 2.90 0.00 1.06 1.42 0.00 2.66 0.00 0.00 2.81 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 78 R 7.50 3.82 0.00 1.72 1.98 0.00 3.13 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 79 V 7.35 3.49 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 0.65 0.00 0.00 0.99 0.00 0.00 80 Y 8.15 4.09 0.00 3.39 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 81 K 8.37 3.80 0.00 1.73 1.88 0.00 1.51 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.46 7.81 82 S 8.00 3.96 0.00 3.89 4.10 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 83 L 7.75 3.84 0.00 1.70 1.65 0.93 0.67 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 84 L 7.60 3.79 0.00 1.62 1.57 0.72 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.99 3.82 0.00 1.64 1.66 0.82 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.08 3.77 0.00 1.53 1.64 0.72 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 87 A 8.37 4.04 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 88 Y 8.01 4.01 0.00 3.09 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 89 L 8.47 4.12 0.00 1.83 1.71 0.82 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.06 3.70 2.04 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 1.53 0.64 0.89 0.00 0.00 91 R 7.50 4.30 0.00 1.83 1.92 0.00 3.03 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.96 0.00 92 N 8.07 4.97 0.00 2.29 2.68 0.00 0.00 6.99 7.08 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 93 G 8.05 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 94 S 7.51 3.54 0.00 3.13 3.35 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 0.00 0.00 0.00 0.00 95 E 8.80 3.95 0.00 1.95 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 2.41 2.35 0.00 96 R 8.00 3.78 0.00 0.67 0.82 0.00 2.83 0.00 0.00 2.40 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.28 0.00 97 V 7.68 3.83 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 1.11 0.00 0.00 1.13 0.00 0.00 98 V 7.78 3.56 2.29 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 0.94 0.00 0.00 0.91 0.00 0.00 99 T 7.68 3.89 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 1.26 0.00 0.00 100 S 8.43 4.27 0.00 4.38 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 0.00 101 A 8.23 4.45 1.48 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 0.00 102 R 8.19 3.98 0.00 2.02 1.96 0.00 3.10 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 103 E 8.48 4.08 0.00 2.02 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 2.32 2.55 0.00 104 H 7.62 4.60 0.00 2.27 2.22 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.46 3.60 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.93 0.20 0.00 0.00 106 Y 7.62 4.26 0.00 3.13 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 0.00 107 D 8.02 4.41 0.00 2.57 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 0.00 108 L 7.85 4.28 0.00 2.01 1.79 1.07 1.10 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 0.00 109 R 8.14 4.26 0.00 2.11 2.07 0.00 3.07 0.00 0.00 3.28 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 110 S 7.85 4.38 0.00 4.13 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 0.00 111 L 7.94 4.60 0.00 1.95 1.81 0.99 1.04 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 0.00 112 E 8.12 4.21 0.00 2.15 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 2.41 2.42 0.00 113 N 7.94 5.06 0.00 2.73 2.82 0.00 0.00 6.87 7.46 0.00 0.00 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 Y 8.13 4.08 0.00 3.31 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 0.00 115 H 8.02 5.01 0.00 3.08 3.02 0.00 6.00 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 F 8.30 4.34 0.00 3.29 2.87 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 0.00 117 V 7.73 4.84 1.93 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 0.88 0.00 0.00 0.76 0.00 0.00 118 D 9.29 4.84 0.00 2.93 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 0.00 119 E 8.66 3.96 0.00 2.01 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 2.34 2.29 0.00 120 H 9.33 3.95 0.00 3.43 3.51 0.00 5.54 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 0.00 121 G 7.95 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 0.00 122 K 7.87 3.97 0.00 2.07 1.65 0.00 1.66 0.00 0.00 1.57 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.34 7.81 123 D 8.37 4.96 0.00 2.57 2.54 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 0.00 124 Q 8.27 3.64 0.00 1.16 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.63 0.00 0.00 0.00 0.00 0.00 2.30 1.80 0.00 125 G 8.42 3.93 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 0.00 0.00 0.00 126 I 7.98 3.73 2.01 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 1.51 1.33 0.89 0.00 0.00 127 N 7.80 4.32 0.00 2.45 2.34 0.00 0.00 6.95 8.76 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 0.00 128 I 7.67 3.85 2.06 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.50 0.73 0.00 0.00 129 R 8.16 4.01 0.00 1.93 2.05 0.00 3.41 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.06 0.00 130 Q 8.30 4.00 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 131 K 8.17 4.03 0.00 2.09 1.98 0.00 1.52 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.47 7.81 132 V 8.16 3.72 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 0.98 0.00 0.00 1.09 0.00 0.00 133 K 8.01 4.00 0.00 2.00 1.94 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.51 1.65 7.81 134 E 8.16 4.01 0.00 2.17 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 2.62 2.48 0.00 135 L 8.12 4.10 0.00 1.98 1.89 1.05 0.70 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 0.00 136 V 8.24 3.62 2.30 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 1.00 0.00 0.00 1.00 0.00 0.00 137 E 8.10 3.99 0.00 2.24 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 2.38 2.45 0.00 138 F 8.50 4.58 0.00 3.13 3.24 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 0.00 139 A 8.25 3.81 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 0.00 140 Q 7.94 4.34 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 141 D 7.53 4.66 0.00 2.91 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 0.00 142 D 8.20 4.22 0.00 2.72 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 0.00 143 D 7.98 4.29 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 0.00 144 R 8.14 3.93 0.00 2.26 2.17 0.00 3.26 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.75 0.00 145 L 8.06 3.56 0.00 1.73 1.47 0.74 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.97 3.85 0.00 2.06 2.08 0.00 3.14 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 147 E 8.03 3.99 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 2.32 2.41 0.00 148 E 8.63 4.02 0.00 2.35 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 2.65 2.62 0.00 149 R 8.23 4.11 0.00 2.06 1.99 0.00 3.22 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 150 K 7.96 3.88 0.00 1.95 2.05 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.49 7.81 151 K 8.38 4.04 0.00 1.98 1.86 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.64 7.81 152 A 8.22 4.00 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 0.00 153 K 7.86 3.96 0.00 1.92 1.89 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.52 7.81 154 K 7.60 4.16 0.00 1.93 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.68 7.81 155 N 7.76 4.53 0.00 2.82 2.73 0.00 0.00 6.87 7.42 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