NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7140 8.3049 120.2838 55.3986 33.4453 174.4255 2 R 4.4671 9.0957 121.5155 53.5419 35.2104 172.2963 3 R 4.7799 8.9328 123.2329 55.7030 32.1567 174.4571 4 Y 5.4017 9.3043 122.9641 56.3810 43.2896 173.8360 5 E 4.8183 9.5162 120.4509 54.7193 32.5455 175.4565 6 V 4.4103 8.6632 125.9542 61.5156 33.3046 174.1501 7 N 5.5264 9.2703 127.0718 51.8708 40.6107 174.1751 8 I 4.9353 8.9308 125.0345 59.3384 40.9883 174.6349 9 V 4.3888 8.5868 126.7975 60.9909 33.6613 174.5658 10 L 5.1609 8.9317 127.4700 52.3451 45.5700 175.2815 11 N 4.6366 8.7574 119.8835 53.8281 39.3021 173.8758 12 P 4.6624 0.0000 0.0000 64.4835 31.8163 176.3363 13 N 4.7923 8.6172 116.4469 53.0787 38.7377 175.0829 14 L 4.3566 7.2056 118.0261 54.3621 42.5100 177.0790 15 D 4.7188 8.6681 122.4925 52.3424 42.2633 177.5595 16 Q 3.8837 8.6293 119.0372 59.6701 28.0224 179.4677 17 S 4.0216 7.9590 114.4405 61.5461 62.7122 175.9881 18 Q 4.0131 9.2238 121.4370 58.5452 28.3605 178.4257 19 L 3.7938 8.2061 121.7682 58.0874 42.0766 178.8936 20 A 4.0047 7.8747 120.5766 54.9046 18.1858 179.3244 21 L 3.8673 7.7350 118.4346 58.4607 42.1648 179.0109 22 E 3.9486 8.0450 118.3033 59.5139 29.3027 179.6391 23 K 4.0726 8.1462 118.4725 59.4039 32.0984 179.0888 24 E 3.9527 8.3889 119.8204 59.3115 29.5618 178.9759 25 I 3.7618 8.0767 120.1690 64.2669 37.0334 178.5115 26 I 3.6462 8.0021 120.9106 64.4058 36.9146 178.4598 27 Q 3.9004 8.3363 119.2067 58.9464 28.4898 178.9331 28 R 3.8743 8.2066 119.5340 59.1754 30.0691 178.4105 29 A 4.1314 8.1238 120.6171 55.1909 18.3606 179.4057 30 L 3.8725 8.0230 117.7298 58.1030 41.8469 179.5489 31 E 3.9414 8.1496 119.0063 59.4161 29.3806 178.6187 32 N 4.3570 8.5113 115.8781 55.6934 38.5101 175.9028 33 Y 4.4011 8.0091 116.5170 57.3694 38.3254 176.3228 34 G 3.8491 7.8260 106.4182 45.7123 0.0000 173.9987 35 A 4.5978 8.1915 121.1878 51.3295 19.9320 178.0239 36 R 4.4781 9.0413 120.2123 54.3727 32.4780 175.6741 37 V 4.1766 8.4313 125.2485 62.6113 31.4427 175.2579 38 E 4.4647 9.0851 128.5332 58.1343 30.7635 176.8017 39 K 4.6360 7.6363 118.2841 55.2118 35.7465 174.6745 40 V 4.8111 8.4453 125.1256 61.0261 34.8110 174.3785 41 A 4.6154 9.0822 128.0218 50.3957 22.5505 175.0977 42 I 4.4354 8.3693 123.6575 59.9390 37.0405 175.5149 43 L 3.8353 8.4689 128.3510 55.6995 42.4068 178.4838 44 G 2.9978 7.5329 105.6350 43.7119 0.0000 171.5535 45 L 4.7594 7.9673 119.7515 55.0247 42.4682 177.0764 46 R 4.5866 8.8680 121.1841 54.3644 35.0556 174.1753 47 R 4.6168 8.4016 122.6143 55.8689 30.6950 176.4130 48 L 4.2771 8.9928 126.7880 54.1701 42.4030 177.0948 49 A 4.1923 8.3836 124.2300 55.3279 18.5525 177.7926 50 Y 4.9224 6.8922 110.8901 54.7111 40.6404 172.7519 51 P 4.5809 0.0000 0.0000 63.2322 32.1293 175.6012 52 I 4.5031 8.2365 120.9492 60.6199 39.9436 175.6609 53 A 3.8405 9.5211 127.3755 53.3790 15.8891 177.8000 54 K 3.9572 8.4517 115.4991 58.1753 30.1258 175.5422 55 D 4.9654 7.8791 120.4051 51.8885 42.5778 175.5055 56 P 4.4817 0.0000 0.0000 64.2045 32.0502 175.4355 57 Q 5.1994 7.8554 116.8833 54.3494 32.3067 174.6775 58 G 4.3163 9.0419 106.3189 45.2857 0.0000 171.1005 59 Y 5.1599 9.1228 123.3271 56.0751 40.5492 174.3721 60 F 5.1378 9.3803 126.5660 56.3648 41.0864 175.0392 61 L 5.2936 9.2607 122.6705 52.7592 45.6945 175.3582 62 W 5.6003 8.9596 131.2839 56.0519 34.6079 173.4685 63 Y 4.7166 8.1306 122.7041 56.0878 42.2241 173.7179 64 Q 4.5789 8.4011 124.7165 54.4267 31.3057 174.7985 65 V 5.0815 8.9027 118.9192 59.6941 37.1730 173.7676 66 E 5.2861 8.9342 122.5529 54.7906 32.2149 174.5606 67 M 5.0831 9.1575 122.9868 53.4667 35.6691 172.3662 68 P 4.6548 0.0000 0.0000 62.2937 31.7754 177.8569 69 E 4.1203 9.0135 121.3599 59.2348 29.7000 178.0322 70 D 4.6534 8.1183 116.3251 54.2077 39.7806 177.0297 71 R 4.5989 7.9549 118.4428 55.9254 31.4658 177.6915 72 V 3.3109 7.2944 118.7179 65.8819 31.3951 177.2005 73 N 4.1577 7.9765 116.0639 56.8901 38.7710 176.2176 74 D 4.2761 7.9964 119.6566 57.1708 40.9225 178.4222 75 L 2.6084 7.7128 120.5820 57.6606 42.0705 178.7816 76 A 3.8254 7.9080 120.9206 55.2804 17.8938 179.7915 77 R 3.7977 8.0407 116.6821 59.3461 29.8978 178.8819 78 E 3.8965 7.8066 118.1364 59.2942 29.7381 178.6201 79 L 4.0817 7.9211 119.0559 57.7129 41.4952 179.5383 80 R 4.0023 7.8826 116.7286 58.6284 30.0351 178.7124 81 I 3.8455 7.2165 118.5441 62.6964 37.6131 176.7557 82 R 4.0777 7.3375 120.4116 55.7521 30.4763 177.3118 83 D 4.3333 8.7077 122.0697 57.1908 41.5844 176.5598 84 N 4.5555 8.0534 114.2109 53.5561 39.0803 173.9913 85 V 4.2335 7.2587 119.5177 62.0677 31.5172 175.8620 86 R 4.3124 9.1022 128.1102 58.3872 31.1041 177.0379 87 R 4.5793 7.4131 116.4890 55.1779 33.6200 173.9104 88 V 4.7712 8.2798 124.3260 61.3873 34.6030 174.0929 89 M 4.6989 9.3042 127.5656 53.9082 35.2675 173.6557 90 V 4.8782 8.5086 126.1472 61.3230 33.5969 175.0728 91 V 4.7681 8.6984 120.1170 59.1833 35.9480 175.1840 92 K 4.3781 8.7746 122.6780 56.1979 32.7350 176.9946 93 S 4.2349 8.6464 120.2023 58.9423 62.2689 173.6891 94 Q 4.5472 8.9467 124.9119 56.8673 30.6493 175.8335 95 E 4.6042 7.6992 115.9744 53.1881 30.2331 172.7911 96 P 4.7197 0.0000 0.0000 62.5020 32.4094 177.1955 97 F 4.3611 9.5777 120.2430 57.1283 39.7973 175.9849 98 L 4.2900 8.5451 122.9967 55.1592 41.5720 176.8209 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.71 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 2 R 9.10 4.47 0.00 1.53 1.37 0.00 3.28 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.86 0.00 3 R 8.93 4.78 0.00 1.83 1.68 0.00 3.13 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 4 Y 9.30 5.40 0.00 2.80 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 5 E 9.52 4.82 0.00 2.00 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 2.38 2.40 0.00 6 V 8.66 4.41 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 0.85 0.00 0.00 0.82 0.00 0.00 7 N 9.27 5.53 0.00 2.86 2.86 0.00 0.00 6.36 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.93 4.94 1.99 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 1.09 0.74 0.91 0.00 0.00 9 V 8.59 4.39 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 0.47 0.00 0.00 -0.21 0.00 0.00 10 L 8.93 5.16 0.00 1.66 1.53 0.96 0.55 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 11 N 8.76 4.64 0.00 2.84 2.71 0.00 0.00 7.32 7.41 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 12 P 0.00 4.66 0.00 2.29 2.26 0.00 3.83 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 2.02 2.20 0.00 13 N 8.62 4.79 0.00 2.78 2.87 0.00 0.00 6.98 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 14 L 7.21 4.36 0.00 1.55 1.50 0.84 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.67 4.72 0.00 2.89 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 16 Q 8.63 3.88 0.00 2.27 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 17 S 7.96 4.02 0.00 3.89 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 18 Q 9.22 4.01 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 19 L 8.21 3.79 0.00 1.78 1.63 0.30 0.32 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 20 A 7.87 4.00 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 21 L 7.73 3.87 0.00 1.74 1.86 0.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.04 3.95 0.00 2.20 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 2.54 2.48 0.00 23 K 8.15 4.07 0.00 2.01 1.96 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.74 7.81 24 E 8.39 3.95 0.00 2.19 2.09 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 2.31 2.36 0.00 25 I 8.08 3.76 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.77 0.90 0.00 0.00 26 I 8.00 3.65 2.03 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 1.45 0.82 0.52 0.00 0.00 27 Q 8.34 3.90 0.00 2.25 2.16 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 2.64 2.58 0.00 28 R 8.21 3.87 0.00 1.88 2.07 0.00 3.09 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 1.79 1.64 0.00 29 A 8.12 4.13 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 30 L 8.02 3.87 0.00 1.76 1.65 0.36 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.15 3.94 0.00 2.09 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 2.30 2.38 0.00 32 N 8.51 4.36 0.00 2.89 2.60 0.00 0.00 7.03 7.04 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 33 Y 8.01 4.40 0.00 2.97 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 34 G 7.83 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 0.00 0.00 0.00 35 A 8.19 4.60 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 36 R 9.04 4.48 0.00 1.84 1.87 0.00 3.14 0.00 0.00 3.11 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 37 V 8.43 4.18 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 0.90 0.00 0.00 0.93 0.00 0.00 38 E 9.09 4.46 0.00 2.01 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 2.32 2.41 0.00 39 K 7.64 4.64 0.00 1.89 1.72 0.00 1.58 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.55 1.44 7.81 40 V 8.45 4.81 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 0.48 0.00 0.00 1.01 0.00 0.00 41 A 9.08 4.62 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 42 I 8.37 4.44 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.65 1.02 0.00 0.00 43 L 8.47 3.84 0.00 1.63 1.59 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.53 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 0.00 0.00 0.00 45 L 7.97 4.76 0.00 1.55 1.65 1.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.87 4.59 0.00 1.00 1.31 0.00 2.39 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 1.14 1.20 0.00 47 R 8.40 4.62 0.00 1.81 1.80 0.00 3.23 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 48 L 8.99 4.28 0.00 1.63 1.49 0.97 0.99 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 49 A 8.38 4.19 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 50 Y 6.89 4.92 0.00 3.04 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 51 P 0.00 4.58 0.00 2.26 2.16 0.00 3.89 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 52 I 8.24 4.50 1.86 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.10 1.00 0.00 0.00 53 A 9.52 3.84 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 54 K 8.45 3.96 0.00 1.95 1.99 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.40 7.81 55 D 7.88 4.97 0.00 2.86 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 56 P 0.00 4.48 0.00 2.24 2.32 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 57 Q 7.86 5.20 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 58 G 9.04 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 0.00 0.00 0.00 59 Y 9.12 5.16 0.00 3.13 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 60 F 9.38 5.14 0.00 2.95 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 61 L 9.26 5.29 0.00 1.69 1.60 1.11 0.81 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 62 W 8.96 5.60 0.00 3.36 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 63 Y 8.13 4.72 0.00 2.65 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 64 Q 8.40 4.58 0.00 1.78 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.63 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 65 V 8.90 5.08 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 0.54 0.00 0.00 1.01 0.00 0.00 66 E 8.93 5.29 0.00 2.03 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 0.00 2.21 2.30 0.00 67 M 9.16 5.08 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 68 P 0.00 4.65 0.00 2.29 2.07 0.00 3.77 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 2.14 2.10 0.00 69 E 9.01 4.12 0.00 2.29 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 2.43 2.36 0.00 70 D 8.12 4.65 0.00 2.82 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 71 R 7.95 4.60 0.00 1.99 2.14 0.00 3.35 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 1.57 1.78 0.00 72 V 7.29 3.31 1.82 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 0.67 0.00 0.00 0.37 0.00 0.00 73 N 7.98 4.16 0.00 2.77 2.75 0.00 0.00 7.13 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 74 D 8.00 4.28 0.00 2.99 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.71 2.61 0.00 1.30 1.58 0.61 1.01 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 76 A 7.91 3.83 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 77 R 8.04 3.80 0.00 1.93 1.94 0.00 3.25 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 78 E 7.81 3.90 0.00 1.84 1.83 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 2.42 2.38 0.00 79 L 7.92 4.08 0.00 1.76 1.61 0.75 0.68 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 80 R 7.88 4.00 0.00 1.87 1.96 0.00 3.12 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 81 I 7.22 3.85 2.10 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 0.33 0.90 0.00 0.00 82 R 7.34 4.08 0.00 1.85 1.83 0.00 3.28 0.00 0.00 3.08 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 83 D 8.71 4.33 0.00 2.62 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.05 4.56 0.00 2.92 2.80 0.00 0.00 6.75 7.68 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 85 V 7.26 4.23 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 0.73 0.00 0.00 0.95 0.00 0.00 86 R 9.10 4.31 0.00 1.71 1.91 0.00 3.42 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 87 R 7.41 4.58 0.00 1.76 1.56 0.00 3.11 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 88 V 8.28 4.77 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 0.76 0.00 0.00 0.87 0.00 0.00 89 M 9.30 4.70 0.00 2.11 1.87 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 2.51 2.51 0.00 90 V 8.51 4.88 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 0.66 0.00 0.00 0.80 0.00 0.00 91 V 8.70 4.77 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 0.73 0.00 0.00 1.07 0.00 0.00 92 K 8.77 4.38 0.00 1.67 1.66 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.59 7.81 93 S 8.65 4.23 0.00 3.92 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 94 Q 8.95 4.55 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.01 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 95 E 7.70 4.60 0.00 1.80 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 96 P 0.00 4.72 0.00 2.25 2.12 0.00 3.74 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 1.99 2.00 0.00 97 F 9.58 4.36 0.00 3.15 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 98 L 8.55 4.29 0.00 1.69 1.62 0.95 0.84 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