NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1905 8.1727 122.0508 56.2775 34.1035 173.9029 2 V 4.6015 8.1869 127.0417 60.7531 32.5204 174.5466 3 F 4.4680 10.0252 128.9088 57.5028 40.2823 174.9415 4 E 4.3360 8.9285 120.6963 55.6833 31.0319 177.2453 5 R 3.3880 8.9535 121.4824 60.5009 29.9875 179.6258 6 C 4.3577 8.0471 115.2759 59.5895 35.9374 175.6170 7 E 3.8944 8.1072 120.8327 59.2029 29.2495 178.5065 8 L 3.5949 8.0175 120.1280 57.8103 42.0906 178.6400 9 A 3.9339 7.8128 120.7614 55.4317 18.3188 179.9296 10 R 3.9244 8.1313 116.4720 59.4831 30.1795 179.5100 11 T 3.8593 7.8502 115.6159 66.6513 68.4703 176.7611 12 L 3.8678 8.1665 121.3315 57.3958 41.5813 179.4985 13 K 3.8828 8.0692 119.6031 59.7189 31.9833 179.1212 14 R 3.9963 7.8883 116.8955 58.9233 29.9771 178.0694 15 L 4.3883 7.4341 116.0905 54.1513 41.6682 176.9615 16 G 3.8588 7.8361 106.7146 46.9991 0.0000 175.1553 17 M 3.9290 7.7913 120.9460 56.1978 32.4159 175.7763 18 D 4.4110 8.0004 117.9289 56.1755 41.0210 175.8441 19 G 3.9706 9.4423 116.1758 45.2123 0.0000 171.3687 20 Y 4.2751 8.2898 122.2410 58.7260 38.9338 176.1888 21 R 3.6425 9.0363 126.2900 57.2485 27.8136 177.2071 22 G 3.8277 8.2348 103.4451 45.6518 0.0000 173.9987 23 I 4.1044 7.6151 121.9622 59.3128 38.0984 175.9377 24 S 4.6623 8.3083 120.7801 57.8105 65.0566 174.7455 25 L 4.2193 8.6436 124.0343 58.5878 41.7266 179.2819 26 A 4.1423 8.1656 120.1247 55.3437 18.3459 179.2312 27 N 4.4453 7.9941 113.8805 56.3257 38.5741 177.7374 28 W 4.2799 8.0119 120.1563 59.9383 29.0594 178.5806 29 M 4.1598 8.5510 118.9946 58.5652 31.4973 177.9198 30 C 3.2097 8.2289 118.8321 59.0691 44.8779 175.3661 31 L 3.9723 8.0935 121.6637 58.2627 41.6878 178.7715 32 A 4.1467 8.3298 120.7615 54.9592 18.2860 179.3046 33 K 2.8130 8.0969 118.0556 59.4365 32.0036 179.0875 34 W 4.2635 7.5042 117.0046 59.0755 29.0528 178.3763 35 E 4.3431 8.2552 118.6708 58.6178 28.9302 177.7022 36 S 4.5094 8.0630 109.5106 56.6112 64.6882 174.5513 37 G 3.2447 8.2390 108.8687 46.8596 0.0000 173.3467 38 Y 3.6442 7.6743 113.7285 58.6881 35.0766 168.5067 39 N 5.3143 7.6590 118.4231 51.9386 40.2341 175.5755 40 T 4.1037 8.8361 116.8520 64.0242 69.1957 176.1410 41 R 4.3071 8.1588 119.5098 56.4555 30.7771 176.4790 42 A 4.2860 7.6383 121.7926 52.7222 19.2133 176.8132 43 T 5.0337 8.3595 111.2626 60.2499 72.5427 173.4508 44 N 4.8931 8.8067 120.7798 52.1497 42.5585 173.0544 45 Y 4.6001 8.7888 125.8815 57.3936 40.7829 173.9688 46 N 4.5290 8.5154 124.4523 51.1110 39.0650 175.1749 47 A 3.6236 8.3048 127.7019 54.7980 18.9141 179.1709 48 G 3.7203 8.0757 104.1522 48.0676 0.0000 173.8636 49 D 4.7238 7.5931 115.2394 52.0642 40.0693 175.9865 50 R 3.9626 8.1547 116.5488 57.0051 28.1887 175.8053 51 S 4.9521 7.7634 112.5974 57.1591 66.3498 172.7992 52 T 5.1172 8.9959 116.0582 61.9896 72.8792 172.8391 53 D 5.4788 9.0960 125.3988 53.2901 43.0746 175.0625 54 Y 5.0655 9.0750 121.1301 57.3947 41.4968 177.5501 55 G 4.4131 9.0283 112.0343 45.7417 0.0000 173.4931 56 I 3.8428 8.2634 116.8437 62.8769 37.7952 177.1964 57 F 4.7426 7.9968 115.4203 56.4135 39.9206 175.2525 58 Q 3.6218 7.9010 119.1877 57.1113 26.4572 173.9112 59 I 4.4948 8.3042 119.0727 60.8778 39.3420 177.0313 60 N 5.2923 9.2613 126.1279 53.6778 39.8847 175.4796 61 S 4.9402 8.9456 119.4847 59.6397 63.5189 175.3075 62 R 3.7418 8.7717 122.7414 58.9936 30.2938 177.6266 63 Y 4.1254 7.4767 115.0715 58.3716 39.8304 177.0810 64 W 4.8834 8.0969 118.7250 58.1600 30.8585 174.2555 65 C 5.6306 8.3071 112.7803 53.5342 46.0843 171.6613 66 N 5.2407 8.9999 119.3435 52.0042 40.1604 174.7169 67 D 4.8363 8.8730 123.9828 52.4090 40.3834 177.3444 68 G 4.0656 8.4851 108.8220 45.8171 0.0000 174.7023 69 K 4.4535 7.9784 116.0109 56.6655 33.0309 175.7300 70 T 4.4923 7.7346 116.7889 61.5163 69.6297 172.8758 71 P 4.3007 0.0000 0.0000 63.4771 31.9529 176.1475 72 G 3.7972 8.6908 108.7112 46.3866 0.0000 173.6897 73 A 4.1650 8.0039 122.2255 51.8599 19.0253 178.4656 74 V 3.8095 8.5761 122.6808 62.6356 33.1855 175.5054 75 N 4.2098 8.0233 116.4577 54.4011 36.8965 174.9631 76 A 4.0543 8.2326 121.7826 55.4008 19.0239 178.6186 77 C 4.5580 8.6826 111.7091 57.5820 41.0625 173.0486 78 H 4.0187 7.9252 116.3378 56.6238 26.3657 174.6000 79 L 4.8191 8.1746 117.4410 52.8168 46.2682 176.7071 80 S 4.6311 8.4252 116.4600 58.0241 63.2712 175.9321 81 C 4.0978 8.7582 124.7961 59.6162 38.7799 176.3277 82 S 3.8943 7.7644 114.5333 61.2061 61.6535 175.9136 83 A 4.1214 7.8658 122.5783 54.3754 17.9651 177.9408 84 L 4.4166 7.7473 116.2761 55.1736 41.8724 177.6435 85 L 4.9889 7.7983 117.5578 54.5399 42.1883 176.6854 86 Q 4.3650 7.7583 117.8488 55.4330 29.5210 175.9452 87 D 4.4317 8.4940 119.5067 56.9645 41.1925 176.8403 88 N 4.5866 8.0546 118.2201 53.2090 39.3527 174.6305 89 I 4.2910 8.4129 118.6589 61.0209 38.0773 177.0137 90 A 3.9336 8.4338 125.3392 56.0215 18.1492 180.2325 91 D 4.3027 8.0708 116.4916 57.2803 40.9310 178.6253 92 A 4.0908 7.9676 120.9005 55.1853 18.4681 179.6581 93 V 3.3904 8.1441 116.8034 66.0876 31.6030 178.0901 94 A 3.8548 7.9545 120.5023 55.2504 18.0811 178.8396 95 C 4.2346 8.3532 116.8206 59.6189 39.0796 175.5725 96 A 3.9145 8.3092 122.8703 55.0973 17.6139 179.7757 97 K 3.8219 7.6581 116.2081 59.3536 32.2925 179.2459 98 R 4.0522 7.6597 118.5937 59.3186 30.0254 178.4619 99 V 2.3079 7.4867 118.2352 65.8468 31.1546 177.9172 100 V 3.9452 7.4283 107.9463 62.4407 31.5832 177.6476 101 R 4.2499 7.7452 117.5583 56.4041 30.7217 176.2841 102 D 4.7428 7.3222 119.2921 52.7204 42.0462 175.4274 103 P 4.2344 0.0000 0.0000 66.1297 31.6940 178.1173 104 Q 4.0244 8.2094 116.3768 56.8689 29.8836 177.5585 105 G 3.6648 7.9508 106.9032 46.5694 0.0000 175.9149 106 I 3.9141 7.6949 121.4756 62.5366 38.0859 177.7934 107 R 4.1971 7.3346 117.7308 58.8367 30.0547 177.6000 108 A 4.1295 7.4430 119.8424 53.5691 18.5862 177.5100 109 W 4.7246 8.2023 116.4623 55.4423 29.7649 177.3438 110 V 3.7260 8.8034 123.9199 66.0949 30.8765 177.5033 111 A 4.0836 8.3537 120.0290 54.9684 18.0736 179.2428 112 W 3.9874 8.4139 126.9239 60.7254 30.5693 178.5119 113 R 3.6991 8.1472 116.5436 59.2086 29.6636 178.3608 114 N 4.4318 8.0954 115.6869 55.2568 38.6970 176.7057 115 R 4.2365 7.7133 113.3370 55.8531 30.5504 175.1543 116 C 4.5451 7.1441 115.7274 58.3528 42.8070 174.1894 117 Q 3.3161 6.4463 119.3047 57.4277 28.6383 175.7267 118 N 4.2026 8.7293 120.3414 54.2430 36.1494 173.6683 119 R 4.5353 7.4140 115.1172 53.9613 33.4970 175.1229 120 D 4.5594 8.5037 118.7142 54.1798 40.7002 175.9306 121 V 4.6241 8.2404 119.2323 61.1836 32.5520 178.2116 122 R 4.0547 7.9919 120.7580 59.2048 29.8826 178.8107 123 Q 3.9910 8.1943 115.5433 59.3426 28.3853 178.5680 124 Y 3.9469 7.8156 115.4590 60.0792 38.0425 176.8475 125 V 4.3844 7.8936 110.9005 60.7820 32.7794 175.3598 126 Q 4.1172 7.5343 120.6324 57.1454 28.7582 176.8255 127 G 3.9813 9.0173 111.2580 45.6559 0.0000 174.4574 128 C 4.4137 7.8366 115.9137 56.9235 40.5838 173.9073 129 G 3.8561 8.1330 107.2194 46.8289 0.0000 174.1527 130 V 4.0100 7.8886 118.0298 61.0864 32.1069 175.8571 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 4.19 0.00 1.83 1.65 0.00 1.25 0.00 0.00 0.95 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 1.13 7.81 2 V 8.19 4.60 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.03 4.47 0.00 2.80 2.82 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 4 E 8.93 4.34 0.00 1.97 1.86 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 2.31 2.24 0.00 5 R 8.95 3.39 0.00 1.95 1.95 0.00 3.43 0.00 0.00 3.48 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 6 C 8.05 4.36 0.00 3.00 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 7 E 8.11 3.89 0.00 2.05 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 0.00 2.60 2.41 0.00 8 L 8.02 3.59 0.00 1.36 1.35 -0.12 0.50 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 9 A 7.81 3.93 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 10 R 8.13 3.92 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.85 3.86 4.25 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 1.22 0.00 0.00 12 L 8.17 3.87 0.00 1.71 1.57 0.92 0.31 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 13 K 8.07 3.88 0.00 1.96 1.94 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.89 4.00 0.00 1.96 1.96 0.00 3.20 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 15 L 7.43 4.39 0.00 1.52 1.56 0.84 0.74 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 16 G 7.84 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 17 M 7.79 3.93 0.00 1.24 1.94 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.21 0.00 18 D 8.00 4.41 0.00 2.67 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 19 G 9.44 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 20 Y 8.29 4.28 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 21 R 9.04 3.64 0.00 1.79 1.88 0.00 3.24 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.27 0.00 22 G 8.23 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 0.00 0.00 0.00 23 I 7.62 4.10 1.69 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.60 -0.18 0.00 0.00 24 S 8.31 4.66 0.00 4.11 4.03 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 25 L 8.64 4.22 0.00 2.09 1.82 0.98 1.28 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 26 A 8.17 4.14 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 27 N 7.99 4.45 0.00 2.86 2.76 0.00 0.00 7.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.01 4.28 0.00 3.51 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 29 M 8.55 4.16 0.00 2.16 2.36 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.93 0.00 30 C 8.23 3.21 0.00 2.54 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 31 L 8.09 3.97 0.00 1.84 1.89 0.59 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.33 4.15 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 K 8.10 2.81 0.00 1.58 1.61 0.00 0.61 0.00 0.00 0.91 0.00 0.00 2.62 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.98 0.21 7.81 34 W 7.50 4.26 0.00 3.36 3.27 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 35 E 8.26 4.34 0.00 2.02 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 2.57 2.38 0.00 36 S 8.06 4.51 0.00 4.04 4.16 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 37 G 8.24 3.24 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 0.00 38 Y 7.67 3.64 0.00 3.20 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 39 N 7.66 5.31 0.00 2.83 2.82 0.00 0.00 7.01 7.10 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 40 T 8.84 4.10 4.43 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 1.45 0.00 0.00 41 R 8.16 4.31 0.00 1.94 2.04 0.00 3.19 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 42 A 7.64 4.29 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 43 T 8.36 5.03 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 1.33 0.00 0.00 44 N 8.81 4.89 0.00 2.84 2.73 0.00 0.00 6.67 6.84 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 45 Y 8.79 4.60 0.00 3.02 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 46 N 8.52 4.53 0.00 2.63 2.58 0.00 0.00 6.67 7.34 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 47 A 8.30 3.62 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 48 G 8.08 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 49 D 7.59 4.72 0.00 2.68 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 50 R 8.15 3.96 0.00 2.04 2.19 0.00 3.15 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 51 S 7.76 4.95 0.00 3.90 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 52 T 9.00 5.12 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 0.70 0.00 0.00 53 D 9.10 5.48 0.00 2.72 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 54 Y 9.08 5.07 0.00 3.03 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 55 G 9.03 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 0.00 0.00 0.00 0.00 56 I 8.26 3.84 1.67 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.74 0.09 0.00 0.00 57 F 8.00 4.74 0.00 3.20 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 58 Q 7.90 3.62 0.00 2.54 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.71 0.00 59 I 8.30 4.49 2.16 0.00 0.00 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 1.48 1.18 1.16 0.00 0.00 60 N 9.26 5.29 0.00 3.09 3.03 0.00 0.00 6.98 7.26 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 61 S 8.95 4.94 0.00 4.06 4.35 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 62 R 8.77 3.74 0.00 1.51 1.21 0.00 2.64 0.00 0.00 2.86 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.15 0.00 63 Y 7.48 4.13 0.00 1.58 1.74 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 64 W 8.10 4.88 0.00 3.56 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 65 C 8.31 5.63 0.00 3.08 3.24 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 66 N 9.00 5.24 0.00 2.81 2.68 0.00 0.00 7.08 8.60 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 67 D 8.87 4.84 0.00 2.83 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 68 G 8.49 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.98 4.45 0.00 1.90 1.90 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.44 7.81 70 T 7.73 4.49 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 1.15 0.00 0.00 71 P 0.00 4.30 0.00 2.01 1.96 0.00 3.79 0.00 0.00 3.85 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 72 G 8.69 3.80 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 0.00 0.00 0.00 73 A 8.00 4.16 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 V 8.58 3.81 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 0.68 0.00 0.00 0.90 0.00 0.00 75 N 8.02 4.21 0.00 2.92 2.68 0.00 0.00 7.11 7.87 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 76 A 8.23 4.05 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 77 C 8.68 4.56 0.00 3.29 3.25 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 78 H 7.93 4.02 0.00 3.31 3.39 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.17 4.82 0.00 1.70 1.50 0.99 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.43 4.63 0.00 3.83 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 81 C 8.76 4.10 0.00 2.24 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 82 S 7.76 3.89 0.00 3.84 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 83 A 7.87 4.12 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 84 L 7.75 4.42 0.00 1.93 1.82 1.06 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.80 4.99 0.00 1.79 1.72 1.12 1.10 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 86 Q 7.76 4.36 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 87 D 8.49 4.43 0.00 2.64 2.66 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 0.00 0.00 0.00 0.00 88 N 8.05 4.59 0.00 2.69 2.74 0.00 0.00 6.93 7.94 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 89 I 8.41 4.29 1.76 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.75 0.95 0.00 0.00 90 A 8.43 3.93 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 91 D 8.07 4.30 0.00 2.71 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 92 A 7.97 4.09 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 93 V 8.14 3.39 2.20 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 0.73 0.00 0.00 0.88 0.00 0.00 94 A 7.95 3.85 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 95 C 8.35 4.23 0.00 3.15 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 96 A 8.31 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.66 3.82 0.00 1.64 1.45 0.00 1.30 0.00 0.00 0.88 0.00 0.00 2.26 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.93 7.81 98 R 7.66 4.05 0.00 1.96 2.12 0.00 3.28 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 99 V 7.49 2.31 1.86 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 -0.21 0.00 0.00 -0.53 0.00 0.00 100 V 7.43 3.95 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 1.04 0.00 0.00 1.44 0.00 0.00 101 R 7.75 4.25 0.00 2.03 2.03 0.00 3.22 0.00 0.00 3.40 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.16 0.00 102 D 7.32 4.74 0.00 3.00 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 0.00 103 P 0.00 4.23 0.00 2.01 2.13 0.00 3.69 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 2.14 0.00 104 Q 8.21 4.02 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.81 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 7.95 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.69 3.91 1.04 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.91 -0.88 0.00 0.00 107 R 7.33 4.20 0.00 2.06 2.00 0.00 3.26 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.84 0.00 108 A 7.44 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.20 4.72 0.00 3.59 3.25 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 0.00 110 V 8.80 3.73 2.19 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 1.10 0.00 0.00 1.01 0.00 0.00 111 A 8.35 4.08 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 0.00 112 W 8.41 3.99 0.00 3.49 3.50 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 0.00 113 R 8.15 3.70 0.00 2.06 1.99 0.00 3.56 0.00 0.00 3.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.12 0.00 114 N 8.10 4.43 0.00 2.59 2.74 0.00 0.00 6.86 7.06 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 0.00 115 R 7.71 4.24 0.00 1.05 1.21 0.00 2.81 0.00 0.00 2.92 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.82 0.00 116 C 7.14 4.55 0.00 1.76 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 0.00 117 Q 6.45 3.32 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 118 N 8.73 4.20 0.00 2.80 2.82 0.00 0.00 6.85 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 0.00 119 R 7.41 4.54 0.00 1.86 1.79 0.00 3.24 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 120 D 8.50 4.56 0.00 2.62 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 0.00 121 V 8.24 4.62 2.40 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 0.93 0.00 0.00 1.06 0.00 0.00 122 R 7.99 4.05 0.00 1.94 2.02 0.00 3.17 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 123 Q 8.19 3.99 0.00 2.02 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.91 0.00 0.00 0.00 0.00 0.00 2.02 1.41 0.00 124 Y 7.82 3.95 0.00 3.14 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 0.00 125 V 7.89 4.38 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 1.11 0.00 0.00 1.05 0.00 0.00 126 Q 7.53 4.12 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.51 0.00 0.00 0.00 0.00 0.00 2.56 2.45 0.00 127 G 9.02 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 0.00 0.00 0.00 128 C 7.84 4.41 0.00 3.03 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 0.00 129 G 8.13 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 0.00 130 V 7.89 4.01 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 0.80 0.00 0.00 0.96 0.00 0.00