NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2178 8.3344 116.7726 57.8481 65.3828 173.0397 5 V 3.7244 7.4345 126.6593 61.1141 31.5975 170.6927 6 V 4.1749 8.9499 128.6261 61.6679 33.8480 174.6188 7 K 4.7509 8.1161 123.9208 54.3482 35.6512 177.2850 8 S 4.1605 8.8684 118.0843 62.1104 62.7897 176.6150 9 E 4.4777 8.2394 112.8714 57.3520 29.2107 176.4134 10 D 4.7460 7.9605 118.2950 54.5033 40.9889 177.9839 11 Y 4.1780 7.4608 118.5854 59.5741 37.8667 177.1210 12 A 4.1973 6.9697 121.1585 52.6881 19.2842 176.8659 13 L 4.5943 7.2078 115.7506 52.0068 43.3608 174.8871 14 P 4.2928 0.0000 0.0000 63.2035 31.6940 175.8058 15 S 4.8509 8.3577 115.4450 56.4539 66.1513 172.2888 16 Y 4.5284 8.3664 121.1824 56.4847 39.7513 174.9416 17 V 4.2910 6.9220 117.8403 59.9357 35.6885 174.5259 18 D 4.6567 8.4691 123.6313 52.7689 41.0913 176.0374 19 R 4.5679 7.8088 122.4765 53.9606 34.1347 176.9863 20 R 3.5977 8.6333 121.4083 59.0140 30.1815 177.2626 21 D 4.7909 7.9723 113.9733 53.5584 39.0740 175.9849 22 Y 4.7870 7.7990 120.6520 55.4248 38.7850 173.5456 23 P 4.5958 0.0000 0.0000 65.0440 31.8508 176.9043 24 L 4.6800 6.7143 117.3958 51.6479 41.3839 174.3288 25 P 4.6580 0.0000 0.0000 62.1884 32.0143 176.8549 26 D 4.5719 8.7831 119.2963 56.8564 40.9436 177.1274 27 V 4.5553 7.4480 109.4420 58.9693 35.6227 174.8411 28 A 4.2023 8.2875 123.9977 51.9137 19.1551 177.3660 29 H 3.5940 8.6922 122.0505 58.3013 29.9223 175.9245 30 V 4.1348 7.6545 119.1418 60.7701 32.7710 174.8159 31 K 4.2110 8.5492 126.3414 58.0760 33.7340 176.6628 32 N 4.6695 7.8972 116.7432 51.9251 39.4328 174.1233 33 L 4.6881 8.2028 122.9007 52.7662 44.3506 177.1999 34 S 4.5012 8.2497 117.3789 57.1854 65.9136 175.0692 35 A 3.9784 8.4051 122.6600 55.5493 18.0584 179.9196 36 S 4.1334 7.9926 112.1884 61.5954 63.2217 176.5440 37 Q 4.0047 8.1561 121.7832 58.6407 28.5217 178.6483 38 K 3.9702 8.5201 119.8255 59.4421 32.0086 179.2742 39 A 4.0434 8.0041 120.9923 54.8974 18.1804 179.4923 40 L 3.9079 7.9649 119.0345 58.3016 41.9767 179.3838 41 K 3.9937 7.9654 117.3729 59.2625 32.1988 179.0308 42 E 4.1309 7.9933 118.6518 59.3320 29.5078 179.1543 43 K 3.9986 8.3149 119.7708 59.4166 31.9796 178.2817 44 E 4.2765 8.3469 118.8435 58.7630 29.5981 178.3154 45 K 4.2410 8.0744 116.8042 57.9020 32.4968 176.4484 46 A 4.4958 7.6494 122.1981 49.9587 21.1553 176.2584 47 S 3.9526 8.3823 111.9334 58.8372 62.7416 175.4655 48 W 4.7283 8.4384 126.3767 58.9989 29.2718 178.5124 49 S 4.2852 7.8866 114.0984 61.4289 62.2983 175.5957 50 S 4.3932 7.8079 114.3636 59.6666 62.9587 174.3768 51 L 4.5079 7.5684 121.5365 54.0402 42.2950 177.5579 52 S 4.5288 8.7178 118.1878 57.5685 65.3901 175.5741 53 I 3.6720 8.2427 123.3443 64.9698 36.8761 178.3540 54 D 4.3618 8.0979 118.9233 57.5074 40.6687 178.6629 55 E 4.0389 8.2219 119.1153 59.2112 29.4579 179.5132 56 K 3.9772 8.4278 119.0823 59.3428 32.0256 179.6167 57 V 3.6509 8.0902 118.8708 65.9306 31.4608 177.7711 58 E 3.9732 8.2881 119.2321 59.1464 29.3244 178.7935 59 L 3.9884 8.1114 119.2575 57.7093 41.6936 178.8304 60 Y 4.0327 8.2159 119.5318 60.8918 38.6504 178.3527 61 R 4.3767 8.1390 118.5889 58.2012 30.2857 178.6310 62 L 4.0918 7.6024 118.9842 57.1642 41.6539 179.1159 63 K 3.5351 7.5476 119.6458 57.5289 32.2111 176.5674 64 F 5.3223 7.3581 116.8811 55.4460 41.8946 175.8316 65 K 3.7607 9.2930 125.0435 58.3244 32.4018 176.6908 66 E 5.3039 8.4858 117.3011 53.2934 32.3681 176.9138 67 S 5.2712 8.5666 118.3765 57.3130 65.5919 175.4481 68 F 3.9728 9.0035 120.1997 60.5902 38.3963 177.5889 69 A 4.0613 8.1299 118.8744 55.3351 17.9592 179.1420 70 E 4.0987 8.1074 116.6601 59.8159 29.4200 179.5315 71 M 4.2001 8.1364 115.4491 57.5033 31.3510 177.2050 72 N 4.7819 7.8156 116.1321 51.8987 39.3935 175.2080 73 R 4.0794 7.0982 117.4289 56.0930 30.1202 176.6695 74 S 4.6006 8.3703 115.3036 57.7007 64.5387 172.5546 75 T 4.7508 8.0363 110.1664 60.4382 71.8970 173.1921 76 N 4.7955 8.4618 115.6214 53.2934 38.8574 176.7439 77 E 3.9244 8.2457 122.5709 59.1804 29.4013 178.9012 78 W 4.2949 8.3438 116.2483 59.4506 27.9331 178.3831 79 K 3.0012 6.6510 119.0042 59.2199 31.3280 179.4086 80 T 3.7526 7.4850 115.4095 66.4727 68.3753 176.6799 81 V 3.5925 7.9301 120.2021 66.1300 31.6486 178.2394 82 V 3.7743 8.2713 118.3476 65.9529 31.4386 178.2237 83 G 3.6074 8.3484 105.4070 47.7925 0.0000 175.5906 84 A 4.1795 8.3564 123.3460 54.7301 18.3864 179.5021 85 A 4.1545 8.3993 119.4855 55.8676 18.4331 179.8374 86 M 4.0870 8.3556 117.1388 58.4135 31.8917 178.8171 87 F 4.0430 8.3336 120.9736 61.3332 39.5616 177.2873 88 F 3.9148 8.5310 117.3754 60.3080 38.4727 177.8814 89 I 3.9668 8.0383 119.3076 64.0627 37.0229 178.3786 90 G 3.6153 8.1936 107.0439 47.6948 0.0000 175.5087 91 F 3.8863 8.0038 123.5792 61.1969 39.2234 177.2607 92 T 3.6580 7.8352 115.1629 66.5589 68.1891 176.3420 93 A 4.0050 7.7036 122.5730 55.0126 18.2908 179.7079 94 L 3.8618 7.4893 117.7444 57.8308 41.6179 179.6355 95 L 3.9051 7.2597 118.5498 57.6277 41.5296 179.3587 96 L 4.0825 7.8383 119.1101 57.6394 41.5322 179.5804 97 I 3.6985 8.0027 120.0107 64.1239 37.0283 178.1491 98 W 4.2038 8.3774 129.2253 60.4330 30.4154 177.5575 99 E 3.9200 8.4889 119.1673 59.3003 28.9340 178.6456 100 K 4.0354 7.9736 118.3050 59.7283 32.2524 177.9912 101 H 3.9783 7.9225 117.5211 59.0959 29.9746 176.1951 102 Y 4.1942 7.4279 115.7927 57.8986 38.3235 176.4627 103 V 4.0146 7.2708 118.0715 64.3848 32.9371 175.7418 104 Y 4.5429 7.5845 116.3290 57.8840 38.3713 176.0373 105 G 4.0568 8.3611 113.8659 43.4434 0.0000 171.3213 106 P 4.3634 0.0000 0.0000 62.3029 31.9727 176.0311 107 I 4.0265 7.7656 113.5041 59.0376 38.9901 173.7176 108 P 4.3225 0.0000 0.0000 62.9877 31.7533 177.5149 109 H 4.2944 8.5442 116.1502 58.1333 28.5618 177.0345 110 T 2.5777 7.0330 108.9041 62.6194 68.4944 174.6358 111 F 4.5082 7.5279 119.8620 57.6683 39.7887 176.6439 112 E 4.2103 8.0125 121.8274 56.1235 31.1996 177.2767 113 E 3.9854 8.8610 122.5445 59.5972 29.7379 179.0614 114 E 3.9376 8.2060 118.7359 58.9204 29.8617 178.2348 115 W 3.8947 8.3050 127.9628 60.6071 30.7603 177.7983 116 V 3.7632 8.3094 118.0043 66.0960 30.9761 177.8461 117 A 4.0359 8.1143 120.4959 54.9480 18.1216 179.8918 118 K 3.7666 7.9922 117.0454 59.6320 32.0947 179.3152 119 Q 3.8382 8.2863 120.1587 59.5382 28.8853 178.6631 120 T 3.9879 8.1601 116.8513 66.4102 68.4524 176.6319 121 K 3.6498 7.7958 121.4342 59.4008 32.1635 178.7162 122 R 3.8297 8.1864 119.3458 59.8171 29.8419 178.3595 123 M 4.0105 8.3378 118.6908 58.4245 31.9750 178.7870 124 L 4.1466 7.9884 119.1299 57.7291 41.4643 179.2474 125 D 4.4881 8.2564 119.1242 56.8515 40.8363 177.5515 126 M 4.2951 8.1067 115.0294 53.9973 32.4231 176.0546 127 K 4.1910 7.7503 116.9746 56.3880 30.4183 176.1696 128 V 3.4882 8.2426 118.4219 64.4924 32.8166 174.9921 129 A 3.9631 8.7145 128.1369 52.9616 15.4929 175.3204 130 P 4.5160 0.0000 0.0000 64.1102 32.7394 178.9261 131 I 4.1038 7.8497 119.4948 63.9441 37.5784 176.0815 132 Q 4.6581 8.0191 114.2281 57.3675 35.0327 176.2446 133 G 3.8476 8.4093 105.5794 48.2078 0.0000 173.0095 134 F 4.8024 8.3637 121.5216 59.1201 42.7001 176.4799 135 S 4.3745 9.4233 116.8469 61.5535 63.0876 176.8653 136 A 4.2586 8.2508 121.7418 54.4179 18.4264 177.8826 137 K 4.4991 8.6133 115.0113 55.9533 32.5061 175.6035 138 W 4.6086 8.0886 129.6813 55.2567 32.4470 174.8408 139 D 4.4723 7.6714 125.7697 52.8877 39.9703 176.5400 140 Y 4.2205 8.4642 125.3846 60.7034 38.4146 177.7933 141 D 4.4864 8.2857 119.0281 57.2768 41.1604 177.6429 142 K 4.0052 8.0047 114.9797 56.1290 32.6313 176.3192 143 N 3.9857 7.3981 116.9850 53.4645 37.7797 171.8820 144 E 3.5328 5.9000 113.9061 54.3417 33.6088 175.4450 145 W 4.2929 7.8258 120.2898 56.1832 29.7184 176.7434 146 K 3.8769 8.6581 124.4107 56.5013 32.2274 177.3571 147 K 4.1423 8.5385 122.6606 56.7972 32.0121 176.8656 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 4 S 8.33 4.22 0.00 3.78 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 5 V 7.43 3.72 2.07 0.00 0.00 0.00 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 0.92 0.00 0.00 6 V 8.95 4.17 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 0.90 0.00 0.00 0.97 0.00 0.00 7 K 8.12 4.75 0.00 1.82 1.76 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.87 4.16 0.00 3.92 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 9 E 8.24 4.48 0.00 2.11 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 0.00 2.27 2.28 0.00 10 D 7.96 4.75 0.00 2.95 2.68 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 0.00 0.00 0.00 0.00 11 Y 7.46 4.18 0.00 3.10 3.11 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 12 A 6.97 4.20 0.96 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 13 L 7.21 4.59 0.00 1.74 1.57 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.29 0.00 2.06 2.04 0.00 3.61 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 2.04 2.10 0.00 15 S 8.36 4.85 0.00 3.98 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 16 Y 8.37 4.53 0.00 3.02 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 17 V 6.92 4.29 1.97 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 0.68 0.00 0.00 0.84 0.00 0.00 18 D 8.47 4.66 0.00 2.67 2.57 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 19 R 7.81 4.57 0.00 1.82 1.94 0.00 3.09 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 20 R 8.63 3.60 0.00 1.80 2.08 0.00 3.28 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 21 D 7.97 4.79 0.00 2.84 2.81 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 22 Y 7.80 4.79 0.00 2.97 2.81 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 23 P 0.00 4.60 0.00 2.26 2.43 0.00 3.74 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 1.95 2.03 0.00 24 L 6.71 4.68 0.00 1.51 1.67 0.95 1.24 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 25 P 0.00 4.66 0.00 2.20 1.74 0.00 3.93 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.09 0.00 26 D 8.78 4.57 0.00 2.90 2.80 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 0.00 0.00 0.00 0.00 27 V 7.45 4.56 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 0.77 0.00 0.00 1.09 0.00 0.00 28 A 8.29 4.20 1.13 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 0.00 0.00 29 H 8.69 3.59 0.00 2.26 3.28 0.00 5.90 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.65 4.13 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 0.80 0.00 0.00 0.64 0.00 0.00 31 K 8.55 4.21 0.00 1.86 1.87 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.40 7.81 32 N 7.90 4.67 0.00 2.69 2.76 0.00 0.00 6.74 7.85 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 33 L 8.20 4.69 0.00 1.58 1.53 0.90 0.89 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 34 S 8.25 4.50 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 35 A 8.41 3.98 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 36 S 7.99 4.13 0.00 4.06 4.13 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 37 Q 8.16 4.00 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 38 K 8.52 3.97 0.00 1.94 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.67 7.81 39 A 8.00 4.04 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 40 L 7.96 3.91 0.00 1.90 1.90 0.93 0.57 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 41 K 7.97 3.99 0.00 1.96 1.87 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.70 1.61 7.81 42 E 7.99 4.13 0.00 2.24 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 2.49 2.46 0.00 43 K 8.31 4.00 0.00 1.95 2.00 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.35 4.28 0.00 2.16 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 0.00 2.64 2.50 0.00 45 K 8.07 4.24 0.00 1.89 1.87 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.33 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.73 7.81 46 A 7.65 4.50 1.29 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 0.00 0.00 47 S 8.38 3.95 0.00 3.81 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 48 W 8.44 4.73 0.00 3.50 3.11 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 49 S 7.89 4.29 0.00 3.92 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 50 S 7.81 4.39 0.00 4.04 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 51 L 7.57 4.51 0.00 2.02 1.64 1.01 0.98 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 52 S 8.72 4.53 0.00 4.08 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 53 I 8.24 3.67 1.87 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 1.64 0.86 0.90 0.00 0.00 54 D 8.10 4.36 0.00 2.72 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.22 4.04 0.00 2.28 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 2.34 2.36 0.00 56 K 8.43 3.98 0.00 1.92 1.81 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.39 1.58 7.81 57 V 8.09 3.65 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 1.10 0.00 0.00 0.91 0.00 0.00 58 E 8.29 3.97 0.00 2.11 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 2.30 2.36 0.00 59 L 8.11 3.99 0.00 1.89 1.63 0.85 0.51 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 60 Y 8.22 4.03 0.00 3.17 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 61 R 8.14 4.38 0.00 1.88 2.05 0.00 3.46 0.00 0.00 3.35 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.76 0.00 62 L 7.60 4.09 0.00 1.75 1.60 0.88 1.16 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 63 K 7.55 3.54 0.00 1.35 1.06 0.00 1.05 0.00 0.00 1.27 0.00 0.00 2.78 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.30 0.21 7.81 64 F 7.36 5.32 0.00 2.56 2.83 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 65 K 9.29 3.76 0.00 1.04 2.10 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.17 7.81 66 E 8.49 5.30 0.00 2.06 1.87 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 2.27 2.21 0.00 67 S 8.57 5.27 0.00 4.07 4.04 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 0.00 0.00 0.00 68 F 9.00 3.97 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 69 A 8.13 4.06 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 70 E 8.11 4.10 0.00 2.33 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 2.35 0.00 71 M 8.14 4.20 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 72 N 7.82 4.78 0.00 2.81 2.88 0.00 0.00 7.01 7.27 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 73 R 7.10 4.08 0.00 1.96 1.95 0.00 3.07 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.59 0.00 74 S 8.37 4.60 0.00 4.05 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 75 T 8.04 4.75 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 1.24 0.00 0.00 76 N 8.46 4.80 0.00 2.71 2.69 0.00 0.00 6.45 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 77 E 8.25 3.92 0.00 2.08 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 0.00 2.34 2.34 0.00 78 W 8.34 4.29 0.00 3.71 3.37 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 79 K 6.65 3.00 0.00 1.45 1.38 0.00 1.32 0.00 0.00 1.30 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.48 3.75 4.33 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 1.18 0.00 0.00 81 V 7.93 3.59 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 1.13 0.00 0.00 1.01 0.00 0.00 82 V 8.27 3.77 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 1.10 0.00 0.00 1.22 0.00 0.00 83 G 8.35 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 84 A 8.36 4.18 1.57 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 85 A 8.40 4.15 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 86 M 8.36 4.09 0.00 2.15 2.35 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.61 0.00 87 F 8.33 4.04 0.00 3.13 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 88 F 8.53 3.91 0.00 3.41 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 89 I 8.04 3.97 2.04 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 1.51 0.67 0.93 0.00 0.00 90 G 8.19 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 91 F 8.00 3.89 0.00 2.42 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 92 T 7.84 3.66 4.41 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 1.20 0.00 0.00 93 A 7.70 4.00 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 94 L 7.49 3.86 0.00 1.43 1.54 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.26 3.91 0.00 1.69 1.59 0.87 0.34 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 96 L 7.84 4.08 0.00 1.86 1.74 0.92 0.90 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 97 I 8.00 3.70 2.05 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 1.40 0.87 0.91 0.00 0.00 98 W 8.38 4.20 0.00 3.52 3.39 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 99 E 8.49 3.92 0.00 2.30 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 1.56 2.05 0.00 100 K 7.97 4.04 0.00 1.86 1.99 0.00 1.88 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.49 7.81 101 H 7.92 3.98 0.00 3.00 2.93 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.43 4.19 0.00 1.43 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 0.00 0.00 0.00 103 V 7.27 4.01 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 0.87 0.00 0.00 104 Y 7.58 4.54 0.00 3.11 2.68 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 0.00 0.00 0.00 0.00 105 G 8.36 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 0.00 106 P 0.00 4.36 0.00 2.15 2.02 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 1.95 1.92 0.00 107 I 7.77 4.03 1.51 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.52 0.58 0.00 0.00 108 P 0.00 4.32 0.00 2.32 1.94 0.00 3.67 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.09 0.00 109 H 8.54 4.29 0.00 3.42 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.03 2.58 3.45 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 0.08 0.00 0.00 111 F 7.53 4.51 0.00 2.96 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 0.00 112 E 8.01 4.21 0.00 2.24 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 2.39 2.46 0.00 113 E 8.86 3.99 0.00 2.09 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 2.43 2.44 0.00 114 E 8.21 3.94 0.00 2.12 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 2.38 2.37 0.00 115 W 8.30 3.89 0.00 3.61 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 0.00 116 V 8.31 3.76 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 1.12 0.00 0.00 1.14 0.00 0.00 117 A 8.11 4.04 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 0.00 118 K 7.99 3.77 0.00 1.63 1.57 0.00 1.46 0.00 0.00 1.32 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.46 7.81 119 Q 8.29 3.84 0.00 2.08 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 120 T 8.16 3.99 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 1.54 0.00 0.00 121 K 7.80 3.65 0.00 1.70 1.77 0.00 1.55 0.00 0.00 1.48 0.00 0.00 2.84 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.29 1.21 7.81 122 R 8.19 3.83 0.00 1.79 1.98 0.00 3.07 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 123 M 8.34 4.01 0.00 1.83 2.21 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.40 0.00 124 L 7.99 4.15 0.00 1.54 1.30 -0.86 0.77 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 0.00 125 D 8.26 4.49 0.00 2.75 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 0.00 126 M 8.11 4.30 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.79 0.00 127 K 7.75 4.19 0.00 1.92 1.91 0.00 1.51 0.00 0.00 1.19 0.00 0.00 2.43 0.00 0.00 2.33 0.00 0.00 0.00 0.00 1.52 1.24 7.81 128 V 8.24 3.49 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 0.91 0.00 0.00 0.86 0.00 0.00 129 A 8.71 3.96 1.48 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 0.00 130 P 0.00 4.52 0.00 2.24 2.37 0.00 3.82 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 131 I 7.85 4.10 1.91 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 1.44 0.45 0.94 0.00 0.00 132 Q 8.02 4.66 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 8.41 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 0.00 134 F 8.36 4.80 0.00 3.11 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 0.00 135 S 9.42 4.37 0.00 4.20 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 0.00 136 A 8.25 4.26 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 0.00 137 K 8.61 4.50 0.00 2.09 1.96 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.45 7.81 138 W 8.09 4.61 0.00 2.75 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 0.00 139 D 7.67 4.47 0.00 2.35 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 0.00 0.00 0.00 140 Y 8.46 4.22 0.00 3.09 3.09 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 0.00 141 D 8.29 4.49 0.00 2.81 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 0.00 142 K 8.00 4.01 0.00 1.55 1.69 0.00 1.85 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.28 7.81 143 N 7.40 3.99 0.00 2.77 2.75 0.00 0.00 6.92 8.93 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 0.00 144 E 5.90 3.53 0.00 1.70 1.64 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 1.85 1.94 0.00 145 W 7.83 4.29 0.00 3.17 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 0.00 146 K 8.66 3.88 0.00 1.68 1.76 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.40 1.47 7.81 147 K 8.54 4.14 0.00 1.72 1.71 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.38 7.81