NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2031 8.1727 122.0547 56.3004 34.1071 173.8713 2 V 4.6599 8.2145 126.9672 61.0241 32.4141 174.6987 3 F 4.5515 9.5464 127.8791 57.1954 40.6019 174.8804 4 G 4.0001 8.6835 107.3195 44.9258 0.0000 174.7562 5 R 3.4533 8.7347 120.1756 59.8839 30.0296 179.6173 6 C 4.3447 8.0587 115.4158 59.7081 34.4245 175.6232 7 E 3.9180 8.0657 120.6414 59.2774 29.2496 178.5555 8 L 3.4712 8.2231 120.5549 57.7274 41.9687 178.6007 9 A 3.8981 7.9701 120.5795 55.2113 18.3377 179.5243 10 A 3.9025 8.1065 118.9841 55.1473 18.2885 179.7558 11 A 3.9640 7.8409 118.8977 55.6148 18.4421 179.8475 12 M 3.8563 8.2439 117.5843 57.9580 31.9755 178.9031 13 K 3.8447 8.2793 120.3043 59.6134 32.2467 178.9620 14 R 4.1652 7.8689 117.1426 58.9804 29.9965 177.0683 15 H 4.5797 7.5826 114.0035 54.8854 29.1372 174.9615 16 G 3.7430 8.3356 109.0432 46.7628 0.0000 175.0258 17 L 3.7919 7.6995 121.0135 55.2811 42.5121 176.3442 18 D 4.5376 7.9843 117.6170 55.5459 41.0751 174.9787 19 N 4.3547 9.4067 123.3121 54.1915 37.0752 173.3808 20 Y 4.2136 8.4066 121.1702 58.7357 38.9325 176.1928 21 R 3.6176 9.0040 124.9887 57.1037 27.4752 177.3148 22 G 3.7224 8.4958 106.1746 45.3023 0.0000 173.6433 23 Y 4.3687 7.8657 118.5463 55.9505 38.3191 175.7406 24 S 4.7364 8.5161 119.9316 57.7981 64.2152 174.8782 25 L 4.2991 8.6693 122.8519 58.7263 41.6088 179.5322 26 G 3.9310 8.3532 104.8890 47.8515 0.0000 175.2313 27 N 4.4777 8.2979 118.6213 56.1859 38.5954 177.4765 28 W 3.9218 7.7850 119.7478 59.7239 29.2022 178.6684 29 V 3.6214 7.8403 117.9454 65.8071 30.9488 177.3307 30 C 2.4500 7.9602 118.1147 58.7918 44.4087 175.2450 31 A 3.8637 8.0581 122.4830 55.1875 17.8547 179.2769 32 A 3.9987 7.7174 119.0831 55.1897 18.5507 179.4869 33 K 2.5398 7.4771 117.8134 59.4234 31.8743 178.5840 34 F 4.6719 7.1248 114.6178 58.8382 39.1228 177.0694 35 E 4.4492 8.0345 118.3908 57.7035 30.1103 176.9486 36 S 4.5553 8.0319 110.2116 56.5472 64.4526 173.7147 37 N 3.7483 8.2431 118.0393 54.9036 37.3920 174.2228 38 F 4.1530 8.0551 111.2452 57.6902 36.5991 173.6655 39 N 5.2851 7.8522 120.6026 52.0342 39.5283 176.0821 40 T 4.0179 9.1359 117.4221 64.3847 69.0571 175.6814 41 Q 4.4101 8.3330 119.0136 55.7279 29.3387 175.6529 42 A 4.3354 7.7774 122.4894 52.3628 19.3539 176.9608 43 T 4.9575 8.3713 111.3452 60.0192 72.3265 173.2551 44 N 4.8874 8.7522 120.5292 51.8395 42.9715 173.3523 45 R 4.6159 8.6243 124.6817 55.5379 31.3622 175.7218 46 N 4.8711 9.1857 124.2650 51.8759 40.2910 176.3796 47 T 3.8891 8.3785 110.2447 64.8478 68.8622 175.2922 48 D 4.4034 7.9493 119.2639 54.1802 39.6162 176.8451 49 G 3.9485 8.1333 109.3438 45.0944 0.0000 173.9114 50 S 4.5774 8.0026 114.5905 58.3901 65.0401 173.2206 51 T 5.0077 8.9651 115.8549 61.9209 72.8048 172.8309 52 D 5.4849 9.1528 124.8373 53.0700 43.3594 175.0835 53 Y 4.9224 9.2959 120.8858 57.4570 41.6787 177.0432 54 G 4.1113 9.0787 111.7094 44.4577 0.0000 173.4480 55 I 3.7895 8.3665 116.8697 62.8841 37.7947 176.8888 56 L 4.5985 7.9459 116.4536 53.5783 42.4387 176.4974 57 Q 3.4512 8.0034 116.4208 57.0981 26.7282 174.4119 58 I 4.1135 8.0581 119.1773 61.1334 39.1938 176.8774 59 N 5.4131 9.0365 125.7827 53.3615 39.7077 175.8700 60 S 4.5799 8.9742 120.6520 60.5821 63.4351 175.5761 61 R 3.6928 8.9745 122.0217 58.1191 30.4112 178.2105 62 W 4.1826 8.0555 117.2809 56.9285 31.4923 176.8153 63 W 4.7404 8.3463 116.9701 57.1612 30.8402 173.7508 64 C 5.3837 8.1545 112.7486 53.7413 46.5134 172.2878 65 N 4.9982 9.0905 119.1542 51.8206 40.1897 174.5328 66 D 4.8065 8.7498 124.5549 52.5348 39.8791 176.8442 67 G 3.9493 8.6050 106.5241 46.4974 0.0000 174.7699 68 R 4.4814 8.3224 111.8644 55.5098 31.1270 175.0444 69 T 4.3562 7.6985 116.5993 61.1950 68.9372 171.9101 70 P 4.2355 0.0000 0.0000 63.6355 31.7932 177.0848 71 G 3.6979 8.7867 110.6016 45.8605 0.0000 173.0303 72 S 4.0942 7.2784 113.3377 57.8430 62.6072 174.6773 73 R 3.8968 8.5150 127.6542 56.9672 30.8319 175.9933 74 N 4.1368 8.0955 115.7523 54.1269 37.2319 175.1678 75 L 4.0412 8.4705 118.8123 58.0255 42.1968 178.3411 76 C 4.6186 8.5481 113.3963 56.3318 40.6931 173.3644 77 N 4.6029 8.0264 114.9260 52.1294 36.9173 172.4731 78 I 4.2517 6.9429 117.5560 58.9217 41.4288 171.2971 79 P 4.8375 0.0000 0.0000 62.3650 32.2706 178.0285 80 C 3.8989 8.6312 119.9695 60.0162 37.2653 176.6761 81 S 3.9286 7.8386 114.9161 60.9451 62.8217 176.1171 82 A 4.0599 8.2002 124.8665 54.7654 17.8567 178.7158 83 L 4.3552 7.6256 115.2523 55.8699 41.8757 177.4387 84 L 5.4514 7.3197 117.7618 53.7304 40.6056 176.6720 85 S 4.4175 7.5053 113.5574 57.9163 62.8932 175.4404 86 S 4.3467 8.5879 121.0160 60.8350 62.8630 174.0424 87 D 4.7192 7.3693 119.3228 53.1153 41.2234 176.3069 88 I 4.1189 8.3168 119.9126 61.5887 37.7387 177.3315 89 T 3.6520 8.0036 119.2924 67.1174 68.3376 176.0247 90 A 3.9531 7.8930 121.8149 55.1766 18.4698 179.5967 91 S 4.0351 7.9296 113.0782 61.8140 63.0581 176.7704 92 V 3.3101 7.8807 121.0991 66.2176 31.2716 177.8437 93 N 4.1990 8.2963 116.3348 56.3506 38.3028 176.6409 94 C 4.3127 8.3566 119.7525 59.3746 39.4963 175.3885 95 A 3.9798 8.4153 122.9158 55.0893 18.0412 179.7239 96 K 3.7382 7.8986 117.0566 59.3648 31.7721 179.4898 97 K 4.0383 7.2529 118.2651 59.4027 32.4284 178.7930 98 I 3.0323 7.4488 120.4257 64.0437 36.7070 178.8870 99 V 3.8548 8.5576 120.1855 64.6166 31.2735 177.7424 100 S 4.5858 8.1590 113.8775 59.2935 62.7085 175.0977 101 D 4.6182 7.8201 121.4259 55.7580 40.9977 176.4603 102 G 4.0560 7.8796 105.2714 45.6852 0.0000 173.7871 103 N 4.6740 8.1839 116.0751 52.2794 40.5513 175.6681 104 G 4.3445 7.8900 106.0579 45.7539 0.0000 174.4798 105 M 4.2804 7.3319 119.4892 56.2573 31.7454 177.8602 106 N 4.8244 7.7358 116.0090 55.5502 38.8558 176.2975 107 A 3.9325 7.6714 120.9107 53.7899 18.6703 177.7721 108 W 4.6696 8.3550 117.0237 55.1342 30.2006 176.9922 109 V 3.6598 8.6089 124.4335 66.2260 31.0236 177.7083 110 A 4.0140 8.4457 120.2259 54.6340 18.1958 179.5183 111 W 3.9619 8.2066 126.6178 60.5315 30.6964 177.9363 112 R 3.5481 8.2112 117.4023 59.5775 29.6842 177.8200 113 N 4.5173 8.2079 113.9168 54.5727 38.8546 176.0022 114 R 4.4304 7.8731 116.0594 55.3689 32.3716 175.2525 115 C 4.7197 7.6293 114.2358 57.7438 42.2883 174.2651 116 K 3.1773 6.9698 120.5137 57.5915 31.7057 176.3293 117 G 3.8097 8.7876 114.3154 46.7580 0.0000 172.5690 118 T 4.6912 7.3165 108.0230 58.7664 72.1791 174.9238 119 D 4.6827 8.2340 121.0029 53.4031 38.4422 176.4846 120 V 4.2029 7.9897 117.4690 63.6555 32.1904 177.4131 121 Q 4.1074 8.2990 116.8395 58.8277 28.5112 178.1359 122 A 4.0211 8.1230 122.8419 54.4907 18.0684 179.3287 123 W 4.3768 8.3256 117.3003 58.4799 29.2826 176.8896 124 I 4.5464 7.6544 110.2735 60.1700 37.8461 175.4075 125 R 3.9781 7.5128 120.1951 57.8389 30.2047 176.9954 126 G 3.9567 9.1129 110.5092 45.3871 0.0000 173.4321 127 C 4.6340 7.5167 117.2177 55.2213 41.5701 173.8794 128 R 4.2810 8.3732 124.7085 55.1698 28.9298 176.0625 129 L 4.2672 8.2590 124.0582 54.7663 41.8184 177.0173 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 K 8.17 4.20 0.00 1.74 1.62 0.00 1.28 0.00 0.00 0.81 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 1.17 7.81 2 V 8.21 4.66 2.12 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 0.96 0.00 0.00 0.98 0.00 0.00 3 F 9.55 4.55 0.00 2.80 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 4 G 8.68 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 5 R 8.73 3.45 0.00 2.02 1.99 0.00 3.57 0.00 0.00 3.64 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.03 0.00 6 C 8.06 4.34 0.00 3.01 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 7 E 8.07 3.92 0.00 2.07 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 2.80 2.47 0.00 8 L 8.22 3.47 0.00 1.25 1.31 -0.07 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.97 3.90 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 10 A 8.11 3.90 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 11 A 7.84 3.96 1.35 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 0.00 0.00 12 M 8.24 3.86 0.00 1.80 1.99 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.27 0.00 13 K 8.28 3.84 0.00 1.90 1.90 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.44 7.81 14 R 7.87 4.17 0.00 1.81 2.13 0.00 3.25 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 15 H 7.58 4.58 0.00 3.00 3.14 0.00 5.96 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.34 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.70 3.79 0.00 1.40 0.56 -0.04 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.98 4.54 0.00 2.65 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 9.41 4.35 0.00 3.04 2.94 0.00 0.00 6.25 6.75 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 20 Y 8.41 4.21 0.00 3.18 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 21 R 9.00 3.62 0.00 2.22 2.14 0.00 3.39 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.57 0.00 22 G 8.50 3.72 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 0.00 0.00 0.00 23 Y 7.87 4.37 0.00 3.07 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.52 4.74 0.00 4.10 4.08 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 25 L 8.67 4.30 0.00 2.03 1.83 1.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.35 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 27 N 8.30 4.48 0.00 2.54 2.45 0.00 0.00 6.93 7.83 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 28 W 7.79 3.92 0.00 3.43 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 29 V 7.84 3.62 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 1.09 0.00 0.00 1.01 0.00 0.00 30 C 7.96 2.45 0.00 2.25 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 31 A 8.06 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.72 4.00 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.48 2.54 0.00 0.91 0.74 0.00 0.61 0.00 0.00 0.87 0.00 0.00 3.01 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.40 0.21 7.81 34 F 7.12 4.67 0.00 3.06 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 35 E 8.03 4.45 0.00 2.01 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 2.53 2.56 0.00 36 S 8.03 4.56 0.00 4.15 4.31 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 37 N 8.24 3.75 0.00 2.87 2.93 0.00 0.00 7.19 6.32 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 38 F 8.06 4.15 0.00 3.35 3.20 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 39 N 7.85 5.29 0.00 2.90 2.92 0.00 0.00 6.97 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 40 T 9.14 4.02 4.49 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 1.60 0.00 0.00 41 Q 8.33 4.41 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 42 A 7.78 4.34 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 43 T 8.37 4.96 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 1.24 0.00 0.00 44 N 8.75 4.89 0.00 2.72 2.68 0.00 0.00 6.59 7.18 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 45 R 8.62 4.62 0.00 1.77 1.80 0.00 3.21 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.81 0.00 46 N 9.19 4.87 0.00 3.06 2.72 0.00 0.00 6.44 7.09 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 47 T 8.38 3.89 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 1.21 0.00 0.00 48 D 7.95 4.40 0.00 2.79 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 49 G 8.13 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 50 S 8.00 4.58 0.00 3.96 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 51 T 8.97 5.01 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 0.71 0.00 0.00 52 D 9.15 5.48 0.00 2.64 2.74 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 0.00 0.00 0.00 53 Y 9.30 4.92 0.00 2.98 2.90 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 54 G 9.08 4.11 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 0.00 0.00 0.00 55 I 8.37 3.79 1.92 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 1.31 1.56 0.89 0.00 0.00 56 L 7.95 4.60 0.00 1.75 1.95 0.81 0.89 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 57 Q 8.00 3.45 0.00 2.42 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.77 0.00 58 I 8.06 4.11 2.02 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.84 1.05 0.00 0.00 59 N 9.04 5.41 0.00 3.02 3.04 0.00 0.00 6.98 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 60 S 8.97 4.58 0.00 4.03 4.36 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 61 R 8.97 3.69 0.00 1.66 1.65 0.00 2.74 0.00 0.00 2.78 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.07 0.00 62 W 8.06 4.18 0.00 2.53 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 0.00 0.00 0.00 63 W 8.35 4.74 0.00 3.39 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 64 C 8.15 5.38 0.00 3.04 3.20 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 65 N 9.09 5.00 0.00 2.80 2.67 0.00 0.00 7.17 8.62 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 66 D 8.75 4.81 0.00 2.79 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 G 8.61 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 68 R 8.32 4.48 0.00 1.89 1.97 0.00 3.06 0.00 0.00 3.27 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 69 T 7.70 4.36 4.19 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 1.12 0.00 0.00 70 P 0.00 4.24 0.00 1.98 1.94 0.00 3.66 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 1.99 2.04 0.00 71 G 8.79 3.70 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 0.00 0.00 0.00 72 S 7.28 4.09 0.00 3.89 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 73 R 8.52 3.90 0.00 1.95 1.94 0.00 3.55 0.00 0.00 3.08 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.96 0.00 74 N 8.10 4.14 0.00 2.83 2.75 0.00 0.00 7.24 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 75 L 8.47 4.04 0.00 1.59 1.92 0.88 0.26 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 76 C 8.55 4.62 0.00 3.33 3.21 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 77 N 8.03 4.60 0.00 2.78 2.78 0.00 0.00 6.91 8.80 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 78 I 6.94 4.25 2.05 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 1.46 1.21 0.94 0.00 0.00 79 P 0.00 4.84 0.00 2.20 2.12 0.00 3.75 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 2.03 1.96 0.00 80 C 8.63 3.90 0.00 1.94 1.43 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 81 S 7.84 3.93 0.00 4.04 4.08 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 82 A 8.20 4.06 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 83 L 7.63 4.36 0.00 1.86 1.81 1.01 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.32 5.45 0.00 1.71 1.76 1.11 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.51 4.42 0.00 4.04 3.88 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 0.00 0.00 0.00 0.00 86 S 8.59 4.35 0.00 3.90 3.88 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 0.00 0.00 0.00 0.00 87 D 7.37 4.72 0.00 2.64 2.60 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 0.00 0.00 0.00 0.00 88 I 8.32 4.12 1.71 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.70 0.84 0.00 0.00 89 T 8.00 3.65 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 1.21 0.00 0.00 90 A 7.89 3.95 1.31 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 0.00 0.00 91 S 7.93 4.04 0.00 3.97 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 92 V 7.88 3.31 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 0.69 0.00 0.00 0.63 0.00 0.00 93 N 8.30 4.20 0.00 2.89 2.79 0.00 0.00 6.71 8.03 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 94 C 8.36 4.31 0.00 3.07 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 95 A 8.42 3.98 1.43 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 0.00 0.00 96 K 7.90 3.74 0.00 1.73 1.52 0.00 1.29 0.00 0.00 0.92 0.00 0.00 2.34 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.30 0.98 7.81 97 K 7.25 4.04 0.00 1.87 1.88 0.00 2.02 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.68 1.58 7.81 98 I 7.45 3.03 1.57 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.10 0.00 0.00 99 V 8.56 3.85 2.63 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 1.42 0.00 0.00 0.87 0.00 0.00 100 S 8.16 4.59 0.00 4.04 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 0.00 101 D 7.82 4.62 0.00 2.82 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 0.00 102 G 7.88 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 0.00 0.00 0.00 103 N 8.18 4.67 0.00 2.71 2.77 0.00 0.00 7.12 8.21 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 0.00 104 G 7.89 4.34 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 0.00 105 M 7.33 4.28 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.85 0.00 106 N 7.74 4.82 0.00 3.19 3.03 0.00 0.00 6.88 7.23 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 0.00 107 A 7.67 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 W 8.36 4.67 0.00 3.57 3.21 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 0.00 109 V 8.61 3.66 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 1.17 0.00 0.00 0.98 0.00 0.00 110 A 8.45 4.01 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 0.00 111 W 8.21 3.96 0.00 3.26 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 0.00 112 R 8.21 3.55 0.00 2.07 2.19 0.00 3.36 0.00 0.00 3.52 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 113 N 8.21 4.52 0.00 2.66 2.77 0.00 0.00 6.89 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 0.00 114 R 7.87 4.43 0.00 1.48 1.33 0.00 2.88 0.00 0.00 2.78 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.47 0.00 115 C 7.63 4.72 0.00 2.42 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 0.00 116 K 6.97 3.18 0.00 0.79 1.26 0.00 1.62 0.00 0.00 1.55 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.19 0.97 7.81 117 G 8.79 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.32 4.69 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 1.21 0.00 0.00 119 D 8.23 4.68 0.00 2.82 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 0.00 120 V 7.99 4.20 2.38 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 1.03 0.00 0.00 1.09 0.00 0.00 121 Q 8.30 4.11 0.00 2.29 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.63 2.40 0.00 122 A 8.12 4.02 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 0.00 123 W 8.33 4.38 0.00 3.53 3.38 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 0.00 124 I 7.65 4.55 1.94 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 1.50 1.32 1.04 0.00 0.00 125 R 7.51 3.98 0.00 1.87 1.90 0.00 3.14 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 126 G 9.11 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 0.00 127 C 7.52 4.63 0.00 3.02 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 0.00 128 R 8.37 4.28 0.00 1.77 1.88 0.00 3.22 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 129 L 8.26 4.27 0.00 1.68 1.56 0.95 0.91 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