NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4547 8.1633 120.3526 54.9175 33.3590 174.7344 2 K 3.9680 8.6340 126.2081 57.2196 32.8992 175.3495 3 N 4.5650 9.2288 117.6776 53.6991 37.5223 175.6079 4 I 3.6207 7.4701 119.1777 64.2147 37.6415 177.5846 5 E 4.1632 8.3045 119.0130 59.4946 29.2106 179.3300 6 K 4.0436 8.2150 118.4590 58.9552 32.0650 179.2563 7 L 3.6721 7.5612 120.9269 57.9918 41.9051 178.7268 8 E 4.2017 7.9025 119.3719 58.9620 29.1977 179.2437 9 Q 3.9849 7.8994 116.9116 59.1721 28.8844 178.6186 10 S 4.2629 7.8135 114.8917 61.6239 62.9257 176.4022 11 L 4.2059 7.9290 120.5849 55.0920 41.5777 177.3740 12 T 3.4344 8.0250 107.3011 62.3945 67.2613 170.8886 13 Y 4.5076 7.7172 121.4474 56.5281 41.6904 172.9681 14 E 4.7585 7.5325 127.3047 53.9337 31.4446 175.3000 15 F 4.3147 8.8075 125.8359 57.2151 39.7193 176.0472 16 K 3.9674 9.8304 125.2771 58.5628 32.2744 176.6352 17 D 4.8165 8.3770 120.3228 52.0154 41.3473 176.5791 18 K 4.0321 8.5250 128.0805 59.9469 32.5898 178.5490 19 N 4.4396 8.3773 117.4873 55.6286 38.3363 177.0858 20 L 4.0135 7.9015 122.4255 57.8846 42.3071 178.6634 21 L 3.2860 7.2689 119.7877 57.9286 41.7712 178.7321 22 I 3.6579 7.4128 118.6324 64.5335 37.2999 177.4753 23 H 4.2508 8.3195 118.7996 59.4103 29.4936 177.2204 24 A 4.0157 7.7271 120.9919 54.5558 18.4362 178.5520 25 L 4.6021 7.5964 115.3195 54.2318 41.9124 176.3772 26 T 4.5032 7.5236 118.0802 61.9341 68.3473 173.9920 27 H 4.5763 8.7346 127.5151 55.3666 30.5222 176.5328 28 K 4.0069 8.2308 124.0863 59.7457 32.3370 178.2970 29 S 4.3213 7.9264 112.8452 60.4108 63.5569 175.3736 30 F 4.4190 8.2918 123.5974 60.4533 38.9977 174.9411 31 K 4.5025 7.7960 120.3240 54.0642 35.1834 174.9044 32 K 4.1937 8.6059 126.9860 57.7349 32.5645 176.4253 33 S 3.7983 9.0715 120.6397 59.2275 60.2060 171.3883 34 Y 4.4336 7.7794 121.3846 57.0239 39.7429 173.2108 35 N 4.9087 7.9067 123.5961 50.9866 40.1491 174.4290 36 N 4.6228 8.9173 114.6156 53.2914 37.5121 176.5979 37 E 3.9559 8.4070 123.0619 60.1036 29.5535 179.4629 38 R 4.0367 7.8542 117.4501 59.1520 30.1890 178.9196 39 L 4.0524 7.8025 118.4383 57.5489 41.5441 178.9712 40 E 3.9533 8.5743 119.9008 59.0817 29.1217 178.5891 41 F 4.1612 8.1269 120.5354 61.2223 39.5080 176.9302 42 L 3.8481 8.1296 120.0697 57.9882 41.8722 178.9568 43 G 3.6463 8.3730 106.1398 47.8998 0.0000 174.8160 44 D 4.5918 8.6173 121.9752 56.5495 41.1674 178.4806 45 A 3.9157 7.4804 119.8693 54.7629 18.2713 179.7188 46 V 3.5594 7.7843 116.8336 66.3958 31.5934 178.3698 47 L 4.1416 8.1895 118.7543 57.8060 41.3740 179.1797 48 D 4.3899 8.2958 119.0036 57.3567 40.6740 178.7192 49 L 3.9635 7.9313 120.7854 57.9358 42.1172 178.9188 50 V 3.7501 8.3968 118.7615 66.2785 31.4277 178.2774 51 V 3.8312 8.3550 118.3132 65.8443 31.3495 178.1408 52 G 3.6854 8.3497 105.6659 47.8221 0.0000 175.2634 53 E 3.9515 8.6573 122.2642 59.1933 29.7538 178.1449 54 Y 4.2694 8.2567 119.6124 60.9472 38.8540 178.2337 55 L 4.1379 8.4898 119.9768 57.4286 41.5014 179.0547 56 F 4.0998 8.3323 120.1524 61.7678 39.2819 176.7222 57 H 4.4188 8.3678 115.6940 58.8284 28.3737 177.8260 58 K 3.8521 7.9514 120.1693 58.4193 31.9911 177.8932 59 F 4.5301 8.1147 116.1975 56.7756 39.1681 177.2112 60 A 3.7821 7.3226 123.4793 55.3444 18.1215 180.4500 61 K 4.3238 7.6200 112.7211 56.4939 32.5052 177.5654 62 D 4.4472 7.6505 119.5795 52.4249 42.1526 174.1546 63 A 4.1003 8.5558 129.8792 54.6086 18.7542 177.9108 64 E 4.2621 7.9724 114.2890 56.2301 30.4439 174.9467 65 G 3.6149 8.1732 107.5189 44.0957 0.0000 173.7048 66 D 4.6251 8.3565 123.9465 52.4908 42.0481 176.8635 67 L 3.8276 8.1389 128.4074 57.3621 41.7409 179.2826 68 S 4.0202 7.9367 113.3873 61.0977 62.3413 176.1568 69 K 3.8933 8.0063 121.8625 59.4753 32.0198 178.5844 70 L 3.9037 7.7717 119.3103 57.7207 41.4046 179.6370 71 R 3.9176 8.2712 118.6735 59.3634 29.9883 178.2664 72 A 3.8572 8.0330 120.3720 55.2847 18.0819 179.5110 73 A 3.7893 7.7194 118.0668 54.7456 18.4419 179.1991 74 L 3.9505 7.1319 115.1208 56.1336 42.0874 178.6470 75 V 3.2032 7.2127 110.0710 59.7386 32.3954 176.1143 76 N 4.4178 6.7451 118.0120 51.9811 39.4338 175.3100 77 E 3.9183 8.5428 120.8155 59.4840 29.5709 178.7806 78 K 4.0031 7.9854 119.0112 59.5440 32.2900 178.9484 79 S 4.4726 8.7305 115.8214 61.8693 62.7428 176.7067 80 F 4.5671 8.3754 120.2764 60.6265 38.5035 177.6374 81 A 4.1109 8.4686 120.6699 54.7065 18.2197 179.7053 82 K 3.9154 8.0308 117.9266 59.7079 32.2277 179.0663 83 I 3.8168 8.1894 120.0850 64.4644 37.0960 178.1870 84 A 4.0151 8.3778 121.8099 55.4492 18.2802 179.5139 85 N 4.4146 8.6079 115.3027 56.2164 38.3116 177.8043 86 S 4.1696 7.8056 114.3791 60.7498 63.2837 174.9586 87 L 4.3843 7.6122 118.6213 53.8763 41.7634 175.9377 88 N 4.3006 8.1285 115.7401 53.7733 36.9265 176.5202 89 L 4.2390 8.1648 119.9263 57.9706 42.0944 180.1485 90 G 3.7552 8.2911 106.4251 48.7777 0.0000 174.2601 91 D 4.2646 8.0730 118.5018 55.9843 40.8721 177.0509 92 F 4.6821 7.8604 116.0601 57.5451 40.2789 176.0332 93 I 4.0806 7.6643 122.1359 61.1568 37.7142 175.5118 94 L 4.2027 8.9046 128.5414 54.0837 42.4714 175.9395 95 M 5.4083 8.3041 120.3325 53.5199 34.7425 174.7181 96 S 4.4606 8.8126 114.1116 58.0643 64.0850 175.6583 97 V 3.5843 8.5905 120.2111 66.2305 31.1056 177.9667 98 A 3.9918 7.9889 119.8952 55.2600 18.2384 179.0528 99 E 3.8848 8.4329 117.8448 59.3242 29.5903 178.8679 100 E 3.9440 8.3679 118.6849 59.6387 29.3700 179.0783 101 N 4.3512 8.3171 115.4019 56.1111 38.5716 176.1726 102 N 4.8068 8.0829 115.9261 52.7419 38.7582 175.2334 103 G 3.8645 8.4622 109.2752 46.4108 0.0000 176.7702 104 G 3.6262 8.2986 111.8363 48.1068 0.0000 177.0907 105 K 3.9990 8.1034 118.5067 58.3826 32.1493 177.3022 106 E 4.5541 7.6673 114.3481 55.5955 30.1421 176.6162 107 K 4.1026 7.7896 121.1699 56.0708 33.0259 176.1166 108 P 4.3745 0.0000 0.0000 65.8274 31.2852 178.8396 109 S 4.2937 8.0417 113.8405 61.3446 63.0526 176.4509 110 I 3.7978 7.7000 122.9769 63.9733 36.9608 178.2250 111 L 3.9767 8.0085 119.8355 57.8487 41.5350 179.3989 112 S 4.2266 8.4939 113.4158 61.6208 62.2703 175.8411 113 D 4.4104 8.3399 121.2585 57.4404 40.5740 178.7326 114 A 3.9729 8.0592 121.1703 54.9541 18.3917 179.3289 115 L 3.8156 7.9265 118.8131 58.4167 42.1598 179.0259 116 E 3.8571 8.1615 118.1670 59.4708 29.4331 179.3031 117 A 4.1974 8.2695 120.9987 55.1100 18.3890 179.8096 118 I 3.7169 7.9208 118.4841 64.6085 37.2011 178.7419 119 I 3.7532 7.8575 120.8273 64.2433 36.8840 178.7244 120 G 3.6195 8.3520 106.5694 47.7681 0.0000 175.6008 121 A 4.0954 8.2057 123.1602 54.9824 18.3306 179.8536 122 I 3.1818 7.9245 118.4101 64.3984 37.0768 178.0212 123 H 4.1939 8.2130 119.0781 59.3132 29.4797 177.2019 124 L 3.9652 7.8289 119.3512 57.8874 41.5662 178.8302 125 E 4.1433 8.1598 117.5219 58.0503 29.8108 176.8703 126 A 4.4656 8.6983 119.4004 51.1474 21.1473 176.8884 127 G 3.9955 7.9626 102.0900 44.8772 0.0000 174.4770 128 F 4.1775 9.0103 120.7392 61.5064 39.3759 177.1324 129 E 3.7874 8.3582 117.4281 59.3341 29.2997 179.1135 130 F 3.8819 8.0857 119.6737 61.3077 39.5204 176.6809 131 A 3.8196 7.9677 120.4027 55.0108 17.9816 179.4180 132 K 3.5755 7.9511 118.2773 59.9926 32.2867 179.1662 133 T 3.8189 7.6464 115.6569 66.5680 68.4318 176.8082 134 I 3.7014 7.7540 121.4419 64.3135 37.1382 178.3992 135 A 3.9267 8.1594 121.8823 55.1625 18.1765 179.7220 136 L 3.8333 8.2078 117.9400 57.7609 41.5848 179.7412 137 R 3.8984 7.8499 118.3044 59.4258 29.6477 178.6495 138 L 3.9997 7.8299 118.4323 57.5979 41.5576 179.6526 139 I 3.9454 7.9335 119.8915 64.4036 36.8929 177.9311 140 E 4.0008 8.2186 118.4484 59.8047 29.5023 179.7662 141 K 4.0935 8.1268 116.2061 58.6158 32.1082 178.1493 142 N 4.5992 7.4855 113.5292 52.7161 40.9181 175.3461 143 F 4.8910 7.9057 117.8992 54.8943 39.9984 172.8391 144 P 4.5591 0.0000 0.0000 62.7454 31.0748 176.6897 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 8.16 4.45 0.00 2.09 2.04 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 2.64 2.71 0.00 2 K 8.63 3.97 0.00 1.89 1.75 0.00 1.94 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.54 7.81 3 N 9.23 4.57 0.00 3.10 3.11 0.00 0.00 7.24 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 I 7.47 3.62 2.03 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.11 0.95 0.00 0.00 5 E 8.30 4.16 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 6 K 8.21 4.04 0.00 2.15 1.97 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.52 7.81 7 L 7.56 3.67 0.00 0.34 1.27 0.75 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.90 4.20 0.00 2.18 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 2.64 2.39 0.00 9 Q 7.90 3.98 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.94 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 10 S 7.81 4.26 0.00 4.00 3.94 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 11 L 7.93 4.21 0.00 1.83 1.77 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.02 3.43 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 1.29 0.00 0.00 13 Y 7.72 4.51 0.00 2.86 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 7.53 4.76 0.00 1.76 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 2.03 2.20 0.00 15 F 8.81 4.31 0.00 3.01 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 16 K 9.83 3.97 0.00 1.85 1.88 0.00 1.49 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.36 7.81 17 D 8.38 4.82 0.00 2.82 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 18 K 8.53 4.03 0.00 2.04 2.06 0.00 1.45 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.60 7.81 19 N 8.38 4.44 0.00 2.99 2.96 0.00 0.00 6.51 6.74 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 20 L 7.90 4.01 0.00 1.85 1.88 0.96 0.74 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 21 L 7.27 3.29 0.00 0.27 1.33 0.60 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.41 3.66 2.03 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 1.38 0.74 0.96 0.00 0.00 23 H 8.32 4.25 0.00 3.47 3.37 0.00 5.61 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.73 4.02 1.32 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 0.00 0.00 25 L 7.60 4.60 0.00 1.82 1.67 0.87 0.51 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 26 T 7.52 4.50 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 1.52 0.00 0.00 27 H 8.73 4.58 0.00 3.16 3.35 0.00 5.60 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.23 4.01 0.00 1.84 1.89 0.00 1.46 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.08 7.81 29 S 7.93 4.32 0.00 4.11 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 0.00 30 F 8.29 4.42 0.00 3.15 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 K 7.80 4.50 0.00 1.86 1.79 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.31 7.81 32 K 8.61 4.19 0.00 1.73 1.71 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.54 7.81 33 S 9.07 3.80 0.00 4.12 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 7.78 4.43 0.00 2.91 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 35 N 7.91 4.91 0.00 2.90 2.78 0.00 0.00 6.29 8.04 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 36 N 8.92 4.62 0.00 2.97 3.23 0.00 0.00 7.43 8.49 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 37 E 8.41 3.96 0.00 2.04 2.04 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 2.36 2.54 0.00 38 R 7.85 4.04 0.00 1.78 1.98 0.00 3.20 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 39 L 7.80 4.05 0.00 1.77 1.84 0.72 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.57 3.95 0.00 2.12 2.25 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 2.46 2.62 0.00 41 F 8.13 4.16 0.00 3.20 3.28 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 42 L 8.13 3.85 0.00 1.89 1.83 0.88 1.16 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 43 G 8.37 3.65 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 0.00 44 D 8.62 4.59 0.00 2.95 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 45 A 7.48 3.92 1.10 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 0.00 0.00 46 V 7.78 3.56 2.22 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 1.13 0.00 0.00 0.86 0.00 0.00 47 L 8.19 4.14 0.00 1.87 1.92 0.81 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.30 4.39 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.93 3.96 0.00 1.73 1.89 0.83 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.40 3.75 2.25 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 0.92 0.00 0.00 0.91 0.00 0.00 51 V 8.36 3.83 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 1.02 0.00 0.00 1.03 0.00 0.00 52 G 8.35 3.69 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 0.00 0.00 0.00 53 E 8.66 3.95 0.00 2.20 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 0.00 2.50 2.35 0.00 54 Y 8.26 4.27 0.00 3.21 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.49 4.14 0.00 1.97 1.68 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.33 4.10 0.00 3.06 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 57 H 8.37 4.42 0.00 3.28 3.33 0.00 5.67 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 58 K 7.95 3.85 0.00 1.29 1.69 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.90 1.15 7.81 59 F 8.11 4.53 0.00 3.15 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 60 A 7.32 3.78 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 61 K 7.62 4.32 0.00 1.69 1.79 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.35 7.81 62 D 7.65 4.45 0.00 2.52 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 63 A 8.56 4.10 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 64 E 7.97 4.26 0.00 2.18 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 65 G 8.17 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.36 4.63 0.00 2.73 2.50 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 67 L 8.14 3.83 0.00 1.68 1.63 0.95 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.94 4.02 0.00 3.81 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 69 K 8.01 3.89 0.00 1.99 1.84 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.48 7.81 70 L 7.77 3.90 0.00 1.67 1.57 -0.04 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.27 3.92 0.00 1.90 2.02 0.00 3.25 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 72 A 8.03 3.86 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 73 A 7.72 3.79 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 74 L 7.13 3.95 0.00 1.72 1.64 0.96 0.59 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 75 V 7.21 3.20 1.78 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 0.87 0.00 0.00 0.77 0.00 0.00 76 N 6.75 4.42 0.00 2.99 2.95 0.00 0.00 6.61 7.54 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 77 E 8.54 3.92 0.00 2.04 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 2.41 2.42 0.00 78 K 7.99 4.00 0.00 1.87 1.94 0.00 1.79 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.57 1.57 7.81 79 S 8.73 4.47 0.00 3.85 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 80 F 8.38 4.57 0.00 3.13 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 81 A 8.47 4.11 1.49 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 0.00 0.00 0.00 82 K 8.03 3.92 0.00 1.95 2.16 0.00 1.64 0.00 0.00 1.34 0.00 0.00 2.61 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.45 7.81 83 I 8.19 3.82 2.06 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.88 0.00 0.00 84 A 8.38 4.02 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 85 N 8.61 4.41 0.00 2.75 2.90 0.00 0.00 6.81 7.96 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 86 S 7.81 4.17 0.00 3.99 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 87 L 7.61 4.38 0.00 1.78 1.75 0.90 1.45 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 88 N 8.13 4.30 0.00 3.15 3.09 0.00 0.00 6.97 6.72 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 89 L 8.16 4.24 0.00 1.78 1.80 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.29 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 91 D 8.07 4.26 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 F 7.86 4.68 0.00 3.00 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 93 I 7.66 4.08 1.86 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 1.36 0.63 0.96 0.00 0.00 94 L 8.90 4.20 0.00 0.86 0.13 0.71 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 95 M 8.30 5.41 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 96 S 8.81 4.46 0.00 4.11 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 97 V 8.59 3.58 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.96 0.00 0.00 98 A 7.99 3.99 1.34 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 0.00 0.00 99 E 8.43 3.88 0.00 2.15 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 2.19 2.34 0.00 100 E 8.37 3.94 0.00 2.24 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 2.33 2.54 0.00 101 N 8.32 4.35 0.00 2.83 2.90 0.00 0.00 7.13 7.60 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 0.00 102 N 8.08 4.81 0.00 2.83 2.84 0.00 0.00 7.05 8.34 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 0.00 103 G 8.46 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 0.00 0.00 0.00 104 G 8.30 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.10 4.00 0.00 1.74 1.87 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.67 1.41 7.81 106 E 7.67 4.55 0.00 2.01 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 2.21 2.39 0.00 107 K 7.79 4.10 0.00 1.93 1.81 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.66 7.81 108 P 0.00 4.37 0.00 2.45 2.35 0.00 3.71 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 2.09 2.05 0.00 109 S 8.04 4.29 0.00 4.11 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 0.00 110 I 7.70 3.80 2.01 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.57 0.90 0.00 0.00 111 L 8.01 3.98 0.00 1.89 1.76 1.02 0.69 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 0.00 112 S 8.49 4.23 0.00 4.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.34 4.41 0.00 2.98 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 0.00 114 A 8.06 3.97 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 0.00 115 L 7.93 3.82 0.00 1.72 1.73 0.81 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.16 3.86 0.00 2.28 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 2.45 2.66 0.00 117 A 8.27 4.20 1.39 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 0.00 0.00 118 I 7.92 3.72 2.01 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 1.49 0.98 1.00 0.00 0.00 119 I 7.86 3.75 1.90 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.94 0.83 0.00 0.00 120 G 8.35 3.62 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 0.00 0.00 0.00 121 A 8.21 4.10 1.53 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 0.00 0.00 122 I 7.92 3.18 1.68 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 0.36 0.89 -0.11 0.00 0.00 123 H 8.21 4.19 0.00 3.27 3.50 0.00 5.79 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 0.00 124 L 7.83 3.97 0.00 1.89 1.75 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.16 4.14 0.00 2.06 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 2.35 2.36 0.00 126 A 8.70 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 7.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 9.01 4.18 0.00 3.28 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 0.00 129 E 8.36 3.79 0.00 2.11 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 2.46 2.56 0.00 130 F 8.09 3.88 0.00 3.02 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 0.00 131 A 7.97 3.82 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 0.00 132 K 7.95 3.58 0.00 0.96 1.67 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.34 1.39 7.81 133 T 7.65 3.82 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 134 I 7.75 3.70 1.92 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.19 0.91 0.00 0.00 135 A 8.16 3.93 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 L 8.21 3.83 0.00 1.66 1.65 0.96 0.51 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 0.00 137 R 7.85 3.90 0.00 1.88 2.09 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 138 L 7.83 4.00 0.00 1.86 1.67 0.85 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 139 I 7.93 3.95 1.94 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 1.66 0.95 0.92 0.00 0.00 140 E 8.22 4.00 0.00 2.16 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 2.39 2.47 0.00 141 K 8.13 4.09 0.00 1.75 1.84 0.00 1.67 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.56 7.81 142 N 7.49 4.60 0.00 2.64 2.02 0.00 0.00 6.74 7.33 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 0.00 143 F 7.91 4.89 0.00 3.03 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 0.00 144 P 0.00 4.56 0.00 2.07 2.00 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00