NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5332 8.3044 120.2867 55.2964 33.8643 173.9224 3 V 4.2239 8.0609 121.5102 59.8785 33.7885 172.8759 4 W 4.5889 9.1545 135.0000 57.4865 31.5964 174.8719 5 T 4.1805 8.0554 123.8087 61.4710 67.0308 172.6000 6 P 4.5379 0.0000 0.0000 63.2085 32.2736 175.6204 7 V 4.0409 7.4377 119.6557 62.6979 32.7085 175.3261 8 N 4.1932 8.7022 125.3120 54.8936 36.0566 173.3922 9 N 5.0452 7.5792 108.5959 52.9710 40.0853 174.1775 10 K 4.1274 8.5107 116.6713 56.5016 32.8145 176.8319 11 M 4.8879 8.3615 121.2405 53.9654 34.9052 175.2663 12 F 4.6403 8.0034 116.6501 57.4131 41.1093 176.7122 13 E 3.4988 8.4016 121.7376 57.1482 27.8135 175.3580 14 T 3.8601 8.3569 122.0026 66.4689 68.9384 174.2668 15 F 4.5289 9.0111 123.9347 57.5944 36.6557 176.5400 16 S 4.4355 8.2557 115.1126 60.5914 62.9626 174.5745 17 Y 4.3994 8.2757 116.9904 58.1341 38.2468 175.1214 18 L 4.6710 7.5361 119.8218 52.1612 43.5925 174.4872 19 P 4.4247 0.0000 0.0000 61.8711 31.7592 175.0205 20 P 4.2688 0.0000 0.0000 62.8122 31.7326 176.4655 21 L 3.9482 8.3758 123.0071 54.8674 42.1154 177.9628 22 T 4.2330 8.2048 114.1163 61.1585 71.1249 175.2471 23 D 4.3647 8.5528 120.9798 57.5593 40.7554 178.8123 24 E 3.9204 8.0634 119.3312 59.3678 29.8521 178.7567 25 Q 3.9367 8.0752 118.1902 58.7724 28.6501 178.7628 26 I 3.6980 8.1476 121.0940 64.3398 37.1426 178.0827 27 A 4.0117 8.2145 121.4877 55.3602 18.2628 179.5230 28 A 3.9567 8.0727 119.0185 55.4582 18.4223 179.9505 29 Q 4.0976 8.0310 116.1313 59.0544 28.8034 179.0390 30 V 3.7341 8.2289 119.4724 66.1928 31.5969 177.6672 31 D 4.4255 8.4403 118.7875 57.6634 40.6692 178.3122 32 Y 4.1552 8.0282 119.5607 60.6269 38.8483 177.9648 33 I 3.8896 7.9785 120.7917 64.5796 37.3147 178.5578 34 V 3.5126 7.9352 118.5904 66.0275 31.1774 177.8634 35 A 3.9143 8.1486 119.5338 54.6627 18.2385 178.3852 36 N 4.0587 7.1306 111.8952 52.2504 38.7113 175.8211 37 G 3.7537 7.3139 108.3327 46.0117 0.0000 173.9979 38 W 4.9533 7.4849 118.9853 56.0955 30.6959 176.2067 39 I 4.5150 8.9020 123.1061 59.2567 37.9405 174.0185 40 P 4.9336 0.0000 0.0000 63.1487 33.0182 174.8256 41 C 5.0112 8.9585 120.3737 58.4477 35.5978 172.3390 42 L 5.3070 8.7373 123.8270 53.1991 44.3580 175.2104 43 E 5.5986 9.2925 121.4419 54.8498 34.0147 174.6615 44 F 5.6537 9.1259 116.2244 55.8725 42.1285 173.0500 45 A 4.4844 8.4144 120.2163 50.2380 22.6053 176.2673 46 E 4.2892 8.6079 118.6900 55.6746 30.7372 177.6557 47 A 4.2809 8.8684 122.8583 55.8827 18.3752 179.7970 48 D 4.5109 8.1388 113.1254 56.3373 41.0556 177.1802 49 K 4.5748 7.9443 117.2252 56.0280 32.6358 176.8565 50 A 3.7918 7.6208 124.3056 54.0146 18.8057 178.2357 51 Y 4.6455 7.4196 111.2526 55.5640 40.2169 175.7690 52 V 3.8350 8.3237 122.2555 63.9102 31.9559 175.2483 53 S 4.7470 8.7739 119.3593 56.7501 66.2340 173.6887 54 N 5.0994 8.5728 114.5763 52.6301 39.2751 176.0740 55 E 3.9172 8.2646 120.5806 59.9298 29.3844 179.2591 56 S 4.0495 8.7363 115.2578 60.6157 62.8546 176.0539 57 A 2.5800 7.7568 123.3599 53.4919 17.7330 179.0184 58 I 3.5701 7.0127 116.5382 63.6452 38.0260 177.0828 59 R 4.2965 7.5128 116.3861 55.6367 30.5206 176.2477 60 F 5.0565 7.1307 118.0421 55.9671 41.2544 177.1366 61 G 3.9909 8.2102 115.6427 46.2362 0.0000 175.3976 62 S 4.5968 8.4179 113.8070 58.1921 61.7619 174.3452 63 V 4.4649 7.1770 107.3900 61.1465 33.3471 177.6288 64 S 4.4745 8.2211 114.9835 59.4827 63.5999 173.4260 65 C 3.9910 8.0877 118.9858 61.6093 27.9575 173.1953 66 L 3.6154 8.4675 122.9240 55.5950 38.9695 173.1375 67 Y 4.4340 7.8152 119.6954 55.9755 40.0186 174.6142 68 Y 4.8438 7.2135 123.1497 56.3397 42.4004 174.6798 69 D 4.4946 8.9199 123.3015 55.0680 41.8141 177.0462 70 N 4.4694 8.8671 115.7994 54.1429 36.0736 176.0200 71 R 3.9560 7.9300 118.7495 59.2645 30.3668 177.0986 72 Y 4.4150 7.7142 114.9142 57.7960 38.4214 175.0576 73 W 5.0346 8.6835 124.4234 55.5038 32.5245 174.6533 74 T 4.3404 8.0823 117.0316 62.5763 69.5451 174.5924 75 M 4.6344 8.5268 126.5548 55.2738 33.1863 175.2338 76 W 4.7833 9.4748 135.0000 56.2968 31.2632 176.7897 77 K 3.4296 8.5526 128.8322 57.6034 30.5368 177.9694 78 L 4.9244 8.2374 125.0457 52.6986 45.1067 174.0744 79 P 4.3569 0.0000 0.0000 63.4355 32.3209 177.4659 80 M 4.2866 8.5532 123.0803 53.6390 30.4396 175.7639 81 F 4.4638 7.2615 118.6305 58.8596 40.0369 176.4434 82 G 3.9569 9.1270 112.2207 45.6058 0.0000 173.0043 83 C 4.2478 7.9081 120.3651 59.7333 31.6278 173.2647 84 R 4.5812 8.6306 124.7863 55.5744 30.9694 174.7382 85 D 4.6699 7.8053 117.6232 51.1480 43.2614 174.1795 86 P 4.3349 0.0000 0.0000 65.8812 31.2153 178.5759 87 M 4.1590 8.3471 117.7058 58.2588 31.7725 178.6972 88 Q 4.0107 7.9261 118.5470 58.8765 28.8751 179.0288 89 V 3.6093 7.7456 118.7213 66.0356 31.7055 177.8961 90 L 4.0298 7.8586 118.4368 57.9523 41.4189 179.7572 91 R 3.9718 8.3397 118.2269 59.3267 29.9345 179.0150 92 E 4.1203 8.3371 118.4790 59.1672 29.4188 179.3422 93 I 3.5161 7.7731 120.0544 64.3012 37.2125 178.4294 94 V 3.4776 7.6626 118.6747 65.9939 31.3202 177.8683 95 A 3.9465 8.0335 120.3971 55.2151 18.2690 179.2289 96 C 2.0000 7.7122 117.6738 62.0853 30.9913 175.9828 97 T 3.7600 7.5740 111.2342 64.2994 68.0102 176.4915 98 K 3.8264 7.6500 121.8729 59.3349 32.3208 178.4438 99 A 3.9573 7.5552 119.9605 53.5669 19.9270 177.6649 100 F 4.7551 7.7147 115.3418 55.1469 39.1451 174.0067 101 P 4.4477 0.0000 0.0000 64.2135 31.8687 177.8107 102 D 4.6539 8.0584 116.7578 53.9431 41.3208 175.5818 103 A 4.7525 7.4079 120.9246 50.5845 20.9555 177.1230 104 Y 4.1892 8.6020 117.9366 57.9201 39.4642 175.2910 105 V 5.1985 8.9318 122.9975 61.1867 35.1962 174.2874 106 R 4.9836 9.5558 123.8841 54.2627 33.0658 173.7940 107 L 4.7389 8.1760 123.4304 53.9549 43.7574 175.7178 108 V 4.8404 8.7796 118.3455 59.4921 36.3653 174.1971 109 A 4.8932 8.0356 121.6286 50.4568 22.8062 175.1683 110 F 5.2602 9.0435 119.7954 55.7064 42.6778 174.1279 111 D 5.3411 8.8222 122.7599 52.7172 42.3585 176.5547 112 N 4.7477 9.1623 123.0868 54.1661 38.3829 176.3075 113 Q 4.2075 8.7129 118.8183 58.8504 29.0783 177.6024 114 K 4.0137 8.2864 115.0073 57.0849 32.9691 176.5544 115 Q 3.4867 7.7056 118.7402 56.0099 27.5007 172.7664 116 V 4.5305 6.8393 117.2578 59.9904 34.7383 174.1653 117 Q 4.3505 8.6944 123.1179 56.4696 29.3482 175.5186 118 I 4.2910 8.1936 124.3607 60.9741 39.9693 174.5469 119 M 4.7268 6.9735 117.5193 54.5005 34.6644 173.8152 120 G 4.1991 8.3421 103.7391 45.9549 0.0000 172.5739 121 F 5.0565 7.7709 117.2362 55.3411 41.6903 173.0070 122 L 4.5041 8.8057 122.8587 55.4936 42.0643 176.7617 123 V 4.5272 8.9668 118.1028 61.4231 34.0937 175.6434 124 Q 4.6241 7.8149 121.2336 54.4031 32.4419 173.2742 125 R 4.3677 8.1291 121.5185 52.9192 32.7387 173.5511 126 P 4.2186 0.0000 0.0000 62.7466 31.7439 177.6452 127 K 4.0813 8.4388 119.5808 59.3410 32.1424 178.2414 128 T 4.1266 7.7896 106.7280 62.2533 69.3534 174.7182 129 A 4.2565 7.8299 126.7506 52.9059 18.6006 177.3577 130 R 4.5988 8.8584 120.3716 55.9240 31.6412 175.5075 131 D 4.9326 8.4523 116.9016 52.7328 39.6715 175.3397 132 F 5.3540 7.7677 113.1102 55.5827 41.1681 173.5492 133 Q 4.4332 8.3608 119.2776 52.9808 31.6153 174.2338 134 P 4.5152 0.0000 0.0000 62.2296 32.5992 176.9624 135 A 3.9476 8.8541 122.7798 55.6477 18.1512 179.2223 136 N 4.6967 8.0810 109.0098 53.7934 37.5560 175.3768 137 K 4.4542 7.8780 117.0681 56.3315 33.3393 177.3110 138 R 3.5907 7.7506 119.6550 57.7097 30.1631 176.5967 139 S 4.9965 7.4808 110.6791 56.2964 66.0064 174.2520 140 V 3.9830 8.5309 115.0900 61.6999 31.9958 175.5674 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 2 M 8.30 4.53 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.06 4.22 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 1.08 0.00 0.00 0.97 0.00 0.00 4 W 9.15 4.59 0.00 3.49 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 5 T 8.06 4.18 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 1.05 0.00 0.00 6 P 0.00 4.54 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 7 V 7.44 4.04 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.70 4.19 0.00 2.88 2.88 0.00 0.00 6.81 8.00 0.00 0.00 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 N 7.58 5.05 0.00 2.65 2.68 0.00 0.00 7.30 6.68 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 10 K 8.51 4.13 0.00 1.93 1.55 0.00 0.61 0.00 0.00 0.67 0.00 0.00 2.56 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.28 1.38 7.81 11 M 8.36 4.89 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.66 0.00 12 F 8.00 4.64 0.00 3.09 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 13 E 8.40 3.50 0.00 2.15 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 2.22 2.15 0.00 14 T 8.36 3.86 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 0.10 0.00 0.00 15 F 9.01 4.53 0.00 3.29 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 16 S 8.26 4.44 0.00 4.12 4.24 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 17 Y 8.28 4.40 0.00 3.02 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 18 L 7.54 4.67 0.00 1.82 1.62 0.89 1.13 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 19 P 0.00 4.42 0.00 2.03 2.00 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 20 P 0.00 4.27 0.00 2.04 2.02 0.00 3.70 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 2.07 2.17 0.00 21 L 8.38 3.95 0.00 1.58 1.49 0.28 0.53 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 22 T 8.20 4.23 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 23 D 8.55 4.36 0.00 2.70 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 24 E 8.06 3.92 0.00 2.01 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 2.35 2.38 0.00 25 Q 8.08 3.94 0.00 2.27 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 26 I 8.15 3.70 2.05 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 1.63 0.70 1.09 0.00 0.00 27 A 8.21 4.01 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.07 3.96 1.37 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 29 Q 8.03 4.10 0.00 2.47 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.39 1.94 0.00 30 V 8.23 3.73 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 1.15 0.00 0.00 1.07 0.00 0.00 31 D 8.44 4.43 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 32 Y 8.03 4.16 0.00 3.24 3.31 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 33 I 7.98 3.89 2.18 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.16 1.07 0.00 0.00 34 V 7.94 3.51 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 0.99 0.00 0.00 0.96 0.00 0.00 35 A 8.15 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.13 4.06 0.00 1.44 1.42 0.00 0.00 7.04 8.27 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 37 G 7.31 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 0.00 0.00 0.00 38 W 7.48 4.95 0.00 3.37 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 39 I 8.90 4.52 2.13 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 1.53 1.00 0.76 0.00 0.00 40 P 0.00 4.93 0.00 2.13 2.20 0.00 3.92 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 41 C 8.96 5.01 0.00 3.11 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 42 L 8.74 5.31 0.00 1.86 1.63 0.85 0.83 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 43 E 9.29 5.60 0.00 2.02 2.05 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 2.36 2.32 0.00 44 F 9.13 5.65 0.00 3.09 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 45 A 8.41 4.48 -0.17 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 46 E 8.61 4.29 0.00 2.18 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 0.00 2.29 2.27 0.00 47 A 8.87 4.28 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 48 D 8.14 4.51 0.00 2.70 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 49 K 7.94 4.57 0.00 1.58 1.65 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.41 7.81 50 A 7.62 3.79 0.48 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 51 Y 7.42 4.65 0.00 2.90 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 52 V 8.32 3.83 1.95 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 0.64 0.00 0.00 0.77 0.00 0.00 53 S 8.77 4.75 0.00 4.08 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 54 N 8.57 5.10 0.00 2.75 2.86 0.00 0.00 6.56 7.66 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 55 E 8.26 3.92 0.00 2.15 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 2.39 2.38 0.00 56 S 8.74 4.05 0.00 4.06 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 57 A 7.76 2.58 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 58 I 7.01 3.57 1.78 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 1.47 0.81 0.86 0.00 0.00 59 R 7.51 4.30 0.00 1.88 2.00 0.00 3.19 0.00 0.00 3.22 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 60 F 7.13 5.06 0.00 3.01 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 61 G 8.21 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 62 S 8.42 4.60 0.00 3.86 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 63 V 7.18 4.46 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 0.66 0.00 0.00 0.48 0.00 0.00 64 S 8.22 4.47 0.00 4.11 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 0.00 65 C 8.09 3.99 0.00 2.96 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 66 L 8.47 3.62 0.00 1.78 1.76 0.94 0.99 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 67 Y 7.82 4.43 0.00 2.88 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.21 4.84 0.00 2.80 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 69 D 8.92 4.49 0.00 2.77 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 70 N 8.87 4.47 0.00 3.05 3.23 0.00 0.00 6.97 7.66 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 71 R 7.93 3.96 0.00 1.52 1.69 0.00 3.08 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 72 Y 7.71 4.42 0.00 3.06 2.85 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 73 W 8.68 5.03 0.00 3.08 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 74 T 8.08 4.34 2.99 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 0.93 0.00 0.00 75 M 8.53 4.63 0.00 2.09 2.03 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 2.71 2.77 0.00 76 W 9.47 4.78 0.00 3.70 3.32 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 0.00 77 K 8.55 3.43 0.00 1.69 0.83 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.72 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.81 0.21 7.81 78 L 8.24 4.92 0.00 1.59 1.56 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.36 0.00 0.76 1.85 0.00 3.63 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 2.16 0.00 80 M 8.55 4.29 0.00 2.04 2.01 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 2.60 2.53 0.00 81 F 7.26 4.46 0.00 3.11 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 82 G 9.13 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 83 C 7.91 4.25 0.00 3.07 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 84 R 8.63 4.58 0.00 1.80 1.86 0.00 3.22 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 85 D 7.81 4.67 0.00 2.70 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 4.33 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.35 4.16 0.00 2.07 2.24 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 2.63 2.74 0.00 88 Q 7.93 4.01 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 89 V 7.75 3.61 2.26 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 1.10 0.00 0.00 0.97 0.00 0.00 90 L 7.86 4.03 0.00 1.92 1.72 0.94 0.83 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 91 R 8.34 3.97 0.00 2.03 2.01 0.00 3.15 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 92 E 8.34 4.12 0.00 2.24 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 0.00 2.62 2.66 0.00 93 I 7.77 3.52 2.00 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 1.35 0.84 0.85 0.00 0.00 94 V 7.66 3.48 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 95 A 8.03 3.95 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 0.00 0.00 96 C 7.71 2.00 0.00 1.23 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 0.00 0.00 0.00 97 T 7.57 3.76 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 1.13 0.00 0.00 98 K 7.65 3.83 0.00 1.83 1.93 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.39 7.81 99 A 7.56 3.96 1.14 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 0.00 100 F 7.71 4.76 0.00 2.82 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 0.00 101 P 0.00 4.45 0.00 2.12 2.11 0.00 3.26 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.88 0.00 102 D 8.06 4.65 0.00 2.70 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 0.00 103 A 7.41 4.75 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 0.00 104 Y 8.60 4.19 0.00 2.57 2.76 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 0.00 105 V 8.93 5.20 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 0.94 0.00 0.00 0.89 0.00 0.00 106 R 9.56 4.98 0.00 1.79 1.87 0.00 2.30 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.32 0.00 107 L 8.18 4.74 0.00 1.48 0.72 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.78 4.84 1.60 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 0.48 0.00 0.00 0.58 0.00 0.00 109 A 8.04 4.89 1.20 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 0.00 0.00 110 F 9.04 5.26 0.00 3.00 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 0.00 111 D 8.82 5.34 0.00 2.32 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 0.00 112 N 9.16 4.75 0.00 2.93 3.04 0.00 0.00 6.32 7.39 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 0.00 113 Q 8.71 4.21 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.06 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 114 K 8.29 4.01 0.00 1.75 1.87 0.00 2.13 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.46 7.81 115 Q 7.71 3.49 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.62 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 116 V 6.84 4.53 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 0.56 0.00 0.00 0.91 0.00 0.00 117 Q 8.69 4.35 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.86 0.00 0.00 0.00 0.00 0.00 2.17 1.93 0.00 118 I 8.19 4.29 1.24 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.61 -0.48 0.00 0.00 119 M 6.97 4.73 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.64 0.00 120 G 8.34 4.20 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 0.00 0.00 0.00 121 F 7.77 5.06 0.00 3.21 3.29 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 0.00 122 L 8.81 4.50 0.00 1.56 1.61 0.58 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.97 4.53 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 0.74 0.00 0.00 0.92 0.00 0.00 124 Q 7.81 4.62 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 8.13 4.37 0.00 1.13 1.49 0.00 2.21 0.00 0.00 2.69 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.26 0.00 126 P 0.00 4.22 0.00 2.13 2.20 0.00 2.20 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 127 K 8.44 4.08 0.00 1.75 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.39 7.81 128 T 7.79 4.13 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 1.22 0.00 0.00 129 A 7.83 4.26 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 0.00 130 R 8.86 4.60 0.00 1.80 1.89 0.00 3.20 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.76 0.00 131 D 8.45 4.93 0.00 2.88 2.94 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 0.00 0.00 0.00 132 F 7.77 5.35 0.00 3.22 3.17 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 0.00 133 Q 8.36 4.43 0.00 1.87 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.07 0.00 0.00 0.00 0.00 0.00 2.27 2.03 0.00 134 P 0.00 4.52 0.00 2.21 2.19 0.00 3.55 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 135 A 8.85 3.95 1.36 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 0.00 0.00 0.00 136 N 8.08 4.70 0.00 2.83 2.94 0.00 0.00 5.81 7.13 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 0.00 137 K 7.88 4.45 0.00 1.74 1.70 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.29 7.81 138 R 7.75 3.59 0.00 1.37 0.66 0.00 3.03 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.55 0.00 139 S 7.48 5.00 0.00 4.00 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 0.00 140 V 8.53 3.98 2.05 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 0.61 0.00 0.00 0.95 0.00 0.00