NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3681 8.2931 120.3261 55.0598 33.3315 174.3212 2 G 3.7692 8.1730 109.8245 41.9186 0.0000 170.9979 3 P 4.4905 0.0000 0.0000 62.6835 32.7248 174.6973 4 K 4.4993 8.4344 117.0401 56.5187 34.0607 176.9661 5 R 4.5336 7.6037 116.6764 54.2590 33.7656 174.1845 6 R 4.2695 8.5793 123.0446 55.2905 30.7376 175.3175 7 Q 4.4528 8.4606 124.5202 54.5516 30.5503 175.0501 8 L 4.8172 7.9641 121.2508 53.0333 44.6109 176.2227 9 T 4.3265 9.2648 112.8212 61.0225 71.2654 176.0700 10 F 4.1636 8.4980 120.7761 60.6604 38.8521 178.1214 11 R 4.2297 8.1273 119.8857 58.9104 29.8951 178.5032 12 E 3.9762 8.1614 118.4850 59.4199 29.5086 179.5285 13 K 3.9365 8.2346 118.6046 59.1921 31.9467 179.4658 14 S 4.1044 8.3157 113.8656 61.2412 62.2272 176.1901 15 R 3.8672 8.0192 121.4545 59.4089 29.9799 178.4573 16 I 2.8204 7.4404 119.5203 64.1189 37.1395 178.3986 17 I 3.6345 7.6523 120.4286 64.5538 37.0649 178.2521 18 Q 3.9966 8.2969 120.5157 59.1073 28.2615 177.9987 19 E 4.0104 8.4097 120.7400 59.3679 29.5102 179.0593 20 V 3.6766 7.4954 116.7333 65.9921 31.6666 177.5847 21 E 4.1535 8.0404 116.9290 58.4483 29.4508 178.0061 22 E 4.4701 7.8622 115.9794 56.2927 31.3172 175.6582 23 N 5.1276 7.8173 115.8870 51.2755 39.2929 173.9534 24 P 4.3507 0.0000 0.0000 65.3852 31.9191 177.0576 25 D 4.8508 7.9876 117.8078 54.0759 40.9651 175.6827 26 L 4.8506 7.2783 118.2604 52.5071 44.5548 176.9071 27 R 4.1257 8.2829 120.5775 55.9691 30.9506 178.0496 28 K 4.0565 8.9288 121.7451 59.7452 32.1262 179.8604 29 G 3.7025 8.1081 105.2977 47.4945 0.0000 175.2987 30 E 3.9551 8.2620 121.7265 59.3498 29.5867 178.9229 31 I 3.8218 7.7859 119.2127 64.3018 37.1998 178.0154 32 A 4.1143 8.5039 122.1431 55.1728 18.1140 179.6891 33 R 3.8237 7.9296 117.0288 59.7548 29.9969 178.8683 34 R 3.7608 7.8376 116.5258 58.6012 30.0779 177.9728 35 F 4.4587 7.7499 114.4472 55.7629 40.5765 174.8474 36 N 4.2028 8.2580 116.8099 54.5272 37.3791 173.3758 37 I 4.7626 7.9644 109.9199 57.4954 41.5348 174.5494 38 P 4.4055 0.0000 0.0000 61.9981 33.1219 176.0295 39 P 4.3031 0.0000 0.0000 65.9817 31.1710 178.7413 40 S 4.0708 8.0607 112.4870 61.7748 62.3298 176.1931 41 T 3.8914 7.7501 117.8251 66.4435 68.1387 176.3111 42 L 3.9347 7.9251 122.3543 58.0899 42.0629 179.1786 43 S 4.0881 8.1875 115.1220 62.0429 62.9445 176.6920 44 T 3.9229 7.8049 115.2207 65.0100 66.7585 176.2743 45 I 3.6953 7.5289 121.2354 64.3741 37.5124 177.9910 46 L 4.1163 8.1424 120.0745 57.7361 41.2063 179.5882 47 K 4.0616 8.3892 119.0473 58.8174 32.2862 177.6017 48 N 4.8014 7.9127 115.0987 53.1175 38.6240 176.9070 49 K 4.1157 7.7242 123.5178 59.8915 32.4622 178.5326 50 R 3.9540 8.0225 117.5985 58.9994 30.0269 178.8798 51 A 3.9742 7.9174 120.1831 55.1375 18.4618 179.4427 52 I 3.8228 8.1247 118.7309 64.8260 37.2920 178.7863 53 L 3.9952 8.1015 119.3029 57.4688 41.2590 179.5303 54 A 3.9473 7.8471 120.9671 55.0898 18.3067 179.8533 55 S 3.6955 8.2267 114.0977 61.5404 62.7181 176.2940 56 E 4.1974 7.9693 123.3859 58.7926 29.1355 179.2562 57 R 3.9696 7.7508 117.3533 59.0109 29.9206 178.8218 58 K 3.7074 7.7631 118.4803 59.6506 32.0288 177.8264 59 Y 4.3514 8.3417 115.3917 57.4146 38.3732 177.2020 60 G 3.9733 8.3011 110.4865 46.3377 0.0000 177.7158 61 V 3.6150 8.4606 117.4668 63.3954 31.5962 176.8757 62 A 4.2737 8.3246 121.1121 52.8285 18.5020 178.9380 63 S 4.5767 8.3262 114.6852 60.9677 62.6900 176.0575 64 T 4.1975 7.3695 117.2594 65.3864 68.2972 174.9036 65 C 4.6245 7.6238 115.4798 60.4326 31.4018 174.8501 66 R 3.9169 8.5805 120.3568 56.2822 30.1111 176.8905 67 K 3.8939 8.2723 121.7055 55.3639 34.7781 176.4903 68 T 4.6380 7.4966 113.7991 61.7418 70.8778 173.3352 69 N 5.2535 8.7681 123.2141 52.7814 39.5077 175.2016 70 K 4.1532 8.1664 117.8302 56.3345 33.1073 175.4500 71 L 4.8512 8.2367 124.5440 52.9568 44.4583 175.8708 72 S 4.6204 8.3054 114.8742 56.6237 63.3353 173.3442 73 P 4.2305 0.0000 0.0000 64.9513 31.3090 176.3460 74 Y 4.7284 7.6935 117.0824 58.0408 38.3050 176.7353 75 D 4.4514 8.2966 123.3336 57.7405 40.8615 178.6007 76 K 3.8988 7.9868 119.3360 59.3104 32.1936 178.3637 77 L 3.7852 7.7358 120.0772 58.2482 42.0507 178.5867 78 E 3.9389 8.3544 118.5737 59.1527 29.2909 179.7604 79 G 3.5700 7.9530 105.7754 47.8413 0.0000 175.7734 80 L 3.9922 7.5877 122.3222 57.1569 41.6227 179.3680 81 L 4.0862 8.1580 120.4374 58.2486 41.9786 179.0341 82 I 2.4462 7.9159 119.3372 64.0745 36.8614 177.9991 83 A 3.8797 7.5532 120.0195 55.1656 18.4686 179.1283 84 W 4.2388 8.3039 126.7571 60.7612 30.8730 178.2238 85 F 3.4864 8.4774 114.3281 59.1679 37.4806 176.9955 86 Q 4.1289 7.9937 120.5109 58.4554 28.5591 177.2626 87 Q 4.1268 7.4188 119.1757 58.4330 29.5069 177.3443 88 I 3.8250 7.1961 120.6728 64.1158 37.3582 178.1554 89 R 4.4137 8.4643 119.6345 58.0324 29.6574 178.7087 90 A 4.0924 7.4162 118.4034 54.0828 18.2889 177.7176 91 A 4.3848 7.4869 119.1066 51.6552 18.8752 177.1667 92 G 3.9412 8.0011 105.0223 47.8219 0.0000 174.2745 93 L 4.7896 7.6026 117.8853 51.6990 44.8297 174.5103 94 P 4.5679 0.0000 0.0000 61.7669 32.6711 175.8454 95 V 4.2193 7.8045 119.1614 59.3767 32.4772 175.8176 96 K 3.9950 8.7018 125.2526 56.2536 32.6813 178.1110 97 G 3.8953 9.0775 110.5366 48.4664 0.0000 175.6756 98 I 3.8419 7.7781 121.1634 64.3025 37.1044 178.4360 99 I 3.8887 8.1086 120.9321 63.9505 36.9451 178.1919 100 L 4.2633 8.0284 120.9448 58.3286 41.9815 178.9227 101 K 4.2309 8.2809 119.4767 59.2218 31.9396 178.5190 102 E 3.8960 8.0205 120.1416 59.1018 29.6529 178.6471 103 K 3.6142 8.1573 119.6675 59.2421 32.0773 178.6372 104 A 3.8795 8.0288 121.1499 55.1159 18.1845 179.6614 105 L 4.0715 7.7986 117.3672 57.7841 41.6136 179.9967 106 R 3.8915 7.6181 118.1649 59.1500 29.9581 179.0211 107 I 3.5769 7.6890 119.4345 64.2036 36.9450 178.3292 108 A 3.7238 7.8622 121.6169 54.9743 18.0771 179.6067 109 E 3.8509 7.7827 117.1844 59.6436 29.3328 179.4029 110 E 3.9532 7.8028 117.4007 59.2986 29.6210 178.9802 111 L 4.2050 7.9707 117.3727 55.1712 41.7933 177.7900 112 G 3.8181 7.5237 106.3118 46.5482 0.0000 174.6654 113 M 4.3482 7.9414 122.1971 53.6451 30.3463 176.8210 114 D 4.4459 8.2122 122.2994 56.4238 41.4603 177.1426 115 D 4.6420 7.8898 116.7659 54.2206 41.5439 176.3729 116 F 3.9120 7.7327 122.3633 58.2587 39.6546 174.8361 117 T 4.0434 6.6522 121.0376 61.7793 70.2014 173.5793 118 A 2.5800 5.8000 122.5414 51.8741 16.2915 178.0210 119 S 4.2403 7.5993 113.3371 60.3334 64.6586 174.0408 120 N 4.4741 8.8694 120.3344 56.5509 38.2884 177.7897 121 G 3.7016 8.1592 106.4514 47.6047 0.0000 175.2241 122 W 4.2311 8.4461 131.3528 60.0206 30.7074 177.7245 123 L 3.1062 8.5643 120.6197 57.8384 41.5626 178.3466 124 D 4.2429 8.3362 118.1807 57.5313 41.1474 178.3255 125 R 3.9189 8.0877 118.6326 59.1778 29.9180 178.7925 126 F 4.3045 8.2053 120.6297 61.5003 39.2143 177.1932 127 R 3.5707 8.0351 117.8991 59.2953 29.6134 178.9710 128 R 4.0977 7.7414 116.1821 58.7139 30.6910 177.7641 129 R 4.0590 9.0095 120.9802 58.1307 29.6217 177.4811 130 R 3.8597 7.6752 121.4623 58.8976 30.0265 177.0041 131 S 4.5296 7.3569 118.4852 58.7342 65.0468 171.8325 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 8.29 4.37 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 2 G 8.17 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 3 P 0.00 4.49 0.00 2.18 2.06 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 4 K 8.43 4.50 0.00 1.73 1.86 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.41 7.81 5 R 7.60 4.53 0.00 1.71 1.75 0.00 3.18 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 6 R 8.58 4.27 0.00 1.74 1.82 0.00 3.26 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 7 Q 8.46 4.45 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.57 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 8 L 7.96 4.82 0.00 1.55 1.45 0.86 0.65 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 9 T 9.26 4.33 4.46 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 0.00 0.00 0.00 1.27 0.00 0.00 10 F 8.50 4.16 0.00 3.24 3.16 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 11 R 8.13 4.23 0.00 2.09 1.96 0.00 3.22 0.00 0.00 3.49 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 12 E 8.16 3.98 0.00 2.19 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 2.35 2.35 0.00 13 K 8.23 3.94 0.00 1.80 1.85 0.00 1.62 0.00 0.00 1.46 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.34 7.81 14 S 8.32 4.10 0.00 4.03 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 15 R 8.02 3.87 0.00 1.96 2.05 0.00 3.26 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.76 0.00 16 I 7.44 2.82 1.71 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.32 0.60 0.00 0.00 17 I 7.65 3.63 2.02 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 1.38 1.13 0.91 0.00 0.00 18 Q 8.30 4.00 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.39 0.00 19 E 8.41 4.01 0.00 2.44 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 2.76 2.53 0.00 20 V 7.50 3.68 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 0.90 0.00 0.00 0.94 0.00 0.00 21 E 8.04 4.15 0.00 2.03 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 2.35 2.58 0.00 22 E 7.86 4.47 0.00 1.98 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 2.30 2.58 0.00 23 N 7.82 5.13 0.00 2.87 2.72 0.00 0.00 6.63 7.91 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 24 P 0.00 4.35 0.00 2.18 2.20 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 25 D 7.99 4.85 0.00 2.69 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 26 L 7.28 4.85 0.00 1.69 1.56 1.01 1.33 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 27 R 8.28 4.13 0.00 1.88 1.86 0.00 3.14 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 28 K 8.93 4.06 0.00 1.77 1.88 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.47 7.81 29 G 8.11 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 30 E 8.26 3.96 0.00 2.11 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 0.00 2.31 2.40 0.00 31 I 7.79 3.82 2.07 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 1.66 1.03 1.14 0.00 0.00 32 A 8.50 4.11 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 33 R 7.93 3.82 0.00 2.03 2.12 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 34 R 7.84 3.76 0.00 1.77 1.53 0.00 3.16 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.96 0.00 35 F 7.75 4.46 0.00 2.98 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 36 N 8.26 4.20 0.00 2.83 2.86 0.00 0.00 6.87 7.80 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 37 I 7.96 4.76 1.89 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 1.53 0.89 0.99 0.00 0.00 38 P 0.00 4.41 0.00 2.18 2.02 0.00 3.61 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 39 P 0.00 4.30 0.00 2.27 2.33 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 40 S 8.06 4.07 0.00 3.91 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 41 T 7.75 3.89 4.39 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 1.19 0.00 0.00 42 L 7.93 3.93 0.00 1.78 1.84 0.89 1.03 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 43 S 8.19 4.09 0.00 4.07 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 44 T 7.80 3.92 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 1.30 0.00 0.00 45 I 7.53 3.70 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.83 0.87 0.00 0.00 46 L 8.14 4.12 0.00 1.84 1.72 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.39 4.06 0.00 1.72 1.84 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.48 7.81 48 N 7.91 4.80 0.00 2.83 2.84 0.00 0.00 6.51 7.50 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 49 K 7.72 4.12 0.00 2.14 1.81 0.00 1.64 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.45 1.54 7.81 50 R 8.02 3.95 0.00 1.90 1.96 0.00 3.18 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 51 A 7.92 3.97 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 52 I 8.12 3.82 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.79 1.07 0.00 0.00 53 L 8.10 4.00 0.00 1.70 1.71 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.85 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 55 S 8.23 3.70 0.00 3.13 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 0.00 0.00 0.00 0.00 56 E 7.97 4.20 0.00 2.10 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 0.00 2.34 2.30 0.00 57 R 7.75 3.97 0.00 2.01 1.90 0.00 3.15 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 58 K 7.76 3.71 0.00 1.52 1.54 0.00 1.48 0.00 0.00 0.90 0.00 0.00 2.51 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.67 1.16 7.81 59 Y 8.34 4.35 0.00 3.08 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 0.00 60 G 8.30 3.97 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 0.00 0.00 0.00 61 V 8.46 3.61 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 0.81 0.00 0.00 0.94 0.00 0.00 62 A 8.32 4.27 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 63 S 8.33 4.58 0.00 4.02 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 64 T 7.37 4.20 4.39 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 1.22 0.00 0.00 65 C 7.62 4.62 0.00 2.88 2.88 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 66 R 8.58 3.92 0.00 1.68 1.78 0.00 2.81 0.00 0.00 2.66 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.39 0.00 67 K 8.27 3.89 0.00 1.54 1.62 0.00 1.70 0.00 0.00 2.25 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.24 1.42 7.81 68 T 7.50 4.64 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 1.31 0.00 0.00 69 N 8.77 5.25 0.00 2.99 2.99 0.00 0.00 7.29 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 70 K 8.17 4.15 0.00 1.81 1.77 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.52 7.81 71 L 8.24 4.85 0.00 1.69 1.60 0.95 0.98 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 72 S 8.31 4.62 0.00 4.06 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 73 P 0.00 4.23 0.00 1.84 1.98 0.00 3.64 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.65 0.00 74 Y 7.69 4.73 0.00 3.05 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 75 D 8.30 4.45 0.00 2.92 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 76 K 7.99 3.90 0.00 1.84 1.75 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.47 7.81 77 L 7.74 3.79 0.00 1.41 1.57 -0.47 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.35 3.94 0.00 2.31 2.15 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 1.96 2.45 0.00 79 G 7.95 3.57 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 0.00 0.00 0.00 80 L 7.59 3.99 0.00 1.71 1.69 0.86 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.16 4.09 0.00 1.88 1.91 1.01 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.92 2.45 2.01 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 1.61 0.98 0.76 0.00 0.00 83 A 7.55 3.88 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 84 W 8.30 4.24 0.00 3.46 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 85 F 8.48 3.49 0.00 2.93 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 86 Q 7.99 4.13 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 87 Q 7.42 4.13 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 88 I 7.20 3.83 1.74 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.50 0.77 0.00 0.00 89 R 8.46 4.41 0.00 1.89 1.98 0.00 3.03 0.00 0.00 3.38 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 90 A 7.42 4.09 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 91 A 7.49 4.38 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 92 G 8.00 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 0.00 0.00 0.00 93 L 7.60 4.79 0.00 1.76 1.50 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.57 0.00 2.14 2.00 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 95 V 7.80 4.22 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 0.54 0.00 0.00 1.05 0.00 0.00 96 K 8.70 3.99 0.00 1.90 1.83 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.47 7.81 97 G 9.08 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 0.00 0.00 0.00 98 I 7.78 3.84 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.99 0.96 0.00 0.00 99 I 8.11 3.89 2.23 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.01 1.28 0.00 0.00 100 L 8.03 4.26 0.00 2.00 2.06 1.46 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.28 4.23 0.00 2.03 1.88 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.56 7.81 102 E 8.02 3.90 0.00 2.19 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 0.00 2.27 2.30 0.00 103 K 8.16 3.61 0.00 1.12 1.26 0.00 1.06 0.00 0.00 0.81 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.30 0.69 7.81 104 A 8.03 3.88 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 0.00 105 L 7.80 4.07 0.00 1.77 1.69 0.87 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.62 3.89 0.00 1.83 1.86 0.00 3.00 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 107 I 7.69 3.58 1.76 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 1.28 0.61 0.74 0.00 0.00 108 A 7.86 3.72 1.22 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 0.00 0.00 0.00 109 E 7.78 3.85 0.00 2.12 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 2.29 2.48 0.00 110 E 7.80 3.95 0.00 2.04 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 2.29 2.43 0.00 111 L 7.97 4.21 0.00 1.59 1.64 0.85 0.91 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 0.00 112 G 7.52 3.82 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 0.00 0.00 0.00 113 M 7.94 4.35 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 114 D 8.21 4.45 0.00 2.66 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 0.00 115 D 7.89 4.64 0.00 2.73 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 0.00 116 F 7.73 3.91 0.00 2.40 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 0.00 117 T 6.65 4.04 3.97 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 1.08 0.00 0.00 118 A 5.80 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 7.60 4.24 0.00 4.08 4.01 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 0.00 0.00 0.00 120 N 8.87 4.47 0.00 2.79 2.95 0.00 0.00 6.76 7.59 0.00 0.00 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 G 8.16 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 0.00 122 W 8.45 4.23 0.00 3.66 3.53 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 0.00 123 L 8.56 3.11 0.00 2.07 1.86 0.96 1.14 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 0.00 124 D 8.34 4.24 0.00 2.83 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 0.00 125 R 8.09 3.92 0.00 2.14 2.01 0.00 3.28 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 126 F 8.21 4.30 0.00 2.20 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.04 3.57 0.00 1.95 1.85 0.00 3.11 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.81 0.00 128 R 7.74 4.10 0.00 1.77 1.96 0.00 3.15 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 129 R 9.01 4.06 0.00 1.98 2.01 0.00 3.46 0.00 0.00 3.43 8.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.88 0.00 130 R 7.68 3.86 0.00 1.92 2.06 0.00 3.05 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 0.50 1.11 0.00 131 S 7.36 4.53 0.00 4.07 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00