NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 D 4.8425 8.6004 119.7090 53.5487 40.3151 175.1267 16 A 4.1663 8.3948 124.9314 54.2664 19.5663 177.8103 17 D 4.5621 8.6347 116.6218 56.0696 41.6217 177.0753 18 E 4.0949 8.0672 119.5037 59.1487 29.6088 178.9515 19 I 3.8150 7.7059 119.5558 64.3458 37.4329 178.4030 20 K 4.1359 7.8360 118.2953 59.5537 31.7572 179.7088 21 R 4.0353 8.2314 118.3968 59.1419 29.9371 178.9745 22 L 4.3628 8.2767 119.0389 57.8548 41.6776 179.5096 23 G 3.8310 9.0325 106.0232 47.9847 0.0000 175.5441 24 K 3.9750 8.0330 120.2545 59.5433 32.1792 179.6656 25 R 4.0091 7.9803 117.8001 59.0362 29.9231 179.0039 26 F 3.6727 8.7134 120.8963 61.2353 39.2436 177.3207 27 K 3.9008 8.0279 116.6320 59.3871 31.9155 178.9210 28 K 3.9859 7.8547 118.8499 59.4228 32.1254 178.4646 29 L 4.0325 7.3496 118.4194 56.3878 43.1556 178.0366 30 D 4.3059 7.4537 119.7938 52.1577 37.6148 175.8439 31 L 3.8324 7.6428 123.7374 57.9362 42.2134 178.8018 32 D 4.5936 8.2384 114.9663 53.2798 39.1121 175.7399 33 N 4.3238 8.0838 114.4677 54.5372 36.7166 175.9089 34 S 4.1056 8.1876 115.3072 59.9167 63.1146 175.3714 35 G 4.1403 10.3524 109.3917 45.2556 0.0000 172.9563 36 S 5.1355 7.5097 112.7804 57.0394 67.7250 173.3278 37 L 4.6979 8.9476 122.9875 53.1967 43.4776 176.5238 38 S 4.7753 8.7318 119.1160 57.4223 64.9469 175.4442 39 V 3.7586 8.7880 120.4712 66.7418 31.0546 177.8311 40 E 3.9524 8.3855 117.3926 59.9699 29.0592 179.3154 41 E 3.9727 7.8992 118.2661 58.3654 29.6525 179.0134 42 F 4.2586 8.0524 117.7839 60.4365 38.9081 177.0521 43 M 4.4394 8.2568 115.5819 56.6735 32.0703 178.0877 44 S 4.3878 7.7036 116.3535 59.6271 63.2619 173.9994 45 L 4.1421 7.4297 123.1443 53.4528 41.9890 176.2916 46 P 4.3478 0.0000 0.0000 65.4835 31.6160 178.0102 47 E 4.1647 8.1521 116.8285 57.9538 29.7216 177.0818 48 L 4.5093 7.7099 117.7715 54.9133 42.5234 178.3753 49 Q 4.0685 7.8362 117.3269 57.8695 28.8307 176.6437 50 Q 4.3730 8.0020 116.7206 55.4646 29.2699 174.1100 51 N 4.6937 7.8185 116.3873 51.0662 38.6858 173.5449 52 P 4.5231 0.0000 0.0000 63.8877 31.8297 176.7621 53 L 4.4072 8.1377 119.0264 54.9779 42.8259 178.3915 54 V 3.3976 7.5798 119.6249 66.2905 31.3872 177.6927 55 Q 3.8477 7.9483 118.2851 58.9465 28.8515 178.3468 56 R 3.8215 7.7459 118.9257 59.0882 30.1701 178.8692 57 V 3.5919 7.7562 118.0698 65.9240 31.4527 178.0141 58 I 3.3169 7.5731 119.6969 64.4672 36.7320 177.9519 59 D 4.4308 7.6083 116.8031 57.3155 41.0437 178.0788 60 I 3.9254 7.6234 119.7926 64.3691 37.2133 178.0778 61 F 4.5212 8.5632 117.9572 59.9518 40.3743 176.8977 62 D 4.8465 8.6268 119.2280 54.0979 36.7358 176.4558 63 T 3.9073 7.9512 119.1030 66.2285 69.1621 175.0937 64 D 4.5975 8.3721 118.0892 52.5109 39.7469 176.6682 65 G 3.9873 8.1526 107.4413 46.8265 0.0000 174.5139 66 N 4.5205 8.5488 116.1968 52.9105 37.8060 176.0578 67 G 4.0801 9.6895 108.1098 45.1956 0.0000 173.1853 68 E 4.8836 7.9419 117.1918 54.4416 33.2237 175.6007 69 V 4.5427 8.9234 121.6654 61.5827 31.9322 175.7182 70 D 5.1517 9.6263 129.2916 52.5486 42.1798 176.7676 71 F 3.6601 8.5490 119.9982 61.0268 39.2585 176.8776 72 K 3.7292 8.0858 118.8738 59.4175 32.0988 178.3444 73 E 3.9378 8.7979 119.1183 59.3560 29.4369 179.0785 74 F 4.3887 8.5319 120.5984 61.5519 39.5380 176.8226 75 I 3.3328 7.6945 119.5919 64.7408 36.7068 178.3848 76 E 3.9645 7.9240 118.0427 58.9483 29.5291 179.6161 77 G 2.3004 7.4287 106.0191 47.3370 0.0000 176.1418 78 V 3.7298 7.1932 121.3414 65.1703 31.2874 177.5381 79 S 4.3337 7.6528 111.8235 59.7382 63.0866 175.6304 80 Q 4.0005 7.8351 121.4431 57.5441 28.5820 176.4213 81 F 4.5940 7.8676 119.0376 56.8925 39.2116 175.8702 82 S 4.6797 7.6989 115.5289 57.8550 63.7277 175.4837 83 V 3.7677 8.1962 114.5983 64.3035 31.5807 178.2802 84 K 4.0671 8.0908 118.5638 58.7722 32.1697 177.9209 85 G 3.7569 7.6714 106.0948 45.3418 0.0000 173.6526 86 D 4.6741 8.4408 124.5731 52.0684 42.2316 177.2074 87 K 3.7957 8.3848 119.2696 59.7460 32.0282 177.9395 88 E 4.0479 8.1678 118.9792 59.4375 29.4089 178.3822 89 Q 3.9697 7.9935 118.3069 59.0746 29.0358 178.4404 90 K 4.0905 7.9063 119.5382 59.3401 32.0757 179.3134 91 L 4.3625 8.3646 119.3885 57.9427 41.5158 179.8869 92 R 3.4903 8.1274 118.2133 58.9793 29.9159 178.8176 93 F 3.8889 8.1029 119.9225 61.2163 39.1529 176.9374 94 A 4.1959 8.5353 120.5583 55.2562 18.2114 179.2787 95 F 3.4220 8.5963 119.3035 61.4194 39.1592 177.5632 96 R 3.8443 7.7481 116.4946 59.0722 29.7813 178.5893 97 I 3.5378 6.9292 118.6417 64.6113 37.1541 177.4979 98 Y 4.2334 6.8066 115.5162 59.2109 39.4250 176.5905 99 D 4.6219 7.5073 121.0172 52.5962 38.3481 176.0573 100 M 3.9649 7.9754 122.7555 57.8700 32.5440 177.3774 101 D 4.5417 8.4133 114.9787 52.8383 40.0413 176.6666 102 K 3.9937 7.9563 118.4116 57.7587 29.8205 175.9615 103 D 4.6273 8.5432 116.8917 53.4893 39.6828 177.3044 104 G 3.9202 9.3786 109.1407 45.2782 0.0000 173.0649 105 Y 5.0576 8.1007 116.5756 56.2513 41.8436 174.9977 106 I 4.4061 9.0889 125.8534 60.4391 38.5757 175.8063 107 S 4.7919 9.0353 122.5705 57.1475 65.1611 174.9158 108 N 4.3704 9.1019 118.5939 57.1349 38.5139 176.8623 109 G 3.7041 8.1436 106.2353 47.9417 0.0000 175.2261 110 E 4.0116 7.9231 120.0983 59.0669 29.5561 179.2177 111 L 4.0364 8.1076 120.3596 58.0238 42.0919 178.4550 112 F 4.0043 8.4511 120.7101 61.7440 39.3727 177.2097 113 Q 4.1249 8.5022 117.4388 58.9240 28.2683 179.0854 114 V 3.5521 7.9032 118.5872 65.8963 31.9119 177.6742 115 L 4.1062 7.9859 118.7689 57.7746 41.6009 179.2144 116 K 3.6402 8.0928 119.7613 59.9936 31.7339 178.5181 117 M 4.0470 7.6575 117.3056 58.4504 31.8844 178.0445 118 M 4.2143 7.8040 117.6450 57.5133 32.8287 178.3406 119 V 3.8032 7.7548 117.8590 62.3737 32.0637 177.3178 120 G 3.7103 8.1606 105.6278 47.0835 0.0000 174.3943 121 N 4.6485 8.6582 124.1388 53.5030 38.9256 175.7603 122 N 4.4918 8.0517 114.7070 55.7752 38.8603 175.0503 123 L 4.9638 7.0341 117.6203 51.9377 45.2480 177.2040 124 K 4.2585 8.9932 121.7717 55.9646 33.9655 178.0825 125 D 4.6600 8.8314 122.3036 58.4226 40.8646 179.6970 126 T 3.9209 8.0009 115.2106 66.7266 68.5751 176.5550 127 Q 3.9824 8.0437 119.3704 58.9164 28.8815 178.3479 128 L 3.9402 8.1542 121.4653 58.2290 42.0220 178.7541 129 Q 4.2729 8.6944 119.7267 59.4206 29.0502 178.2841 130 Q 4.0293 8.1981 119.3297 58.9224 28.8305 178.7159 131 I 3.9048 7.8369 113.7051 63.3588 37.7913 178.5028 132 V 3.5682 7.9893 120.3832 66.0433 31.3457 177.5062 133 D 4.4077 8.3009 118.6921 57.6402 40.7481 179.2392 134 K 3.9911 8.0275 118.5255 59.5653 31.9478 179.7480 135 T 3.8748 7.9055 116.1083 66.5284 68.4013 176.7643 136 I 3.7146 7.7915 121.6556 64.5993 36.9721 178.3690 137 I 3.6973 7.7262 119.2242 64.6595 37.0357 177.7707 138 N 4.4367 8.0785 116.3151 55.9906 38.9035 175.9710 139 A 4.5570 7.9738 119.8295 51.9491 20.3514 177.8899 140 D 4.6238 7.8271 118.1889 52.9408 39.5738 176.4464 141 K 4.1174 8.4239 124.2408 58.1881 32.6753 177.7450 142 D 4.6323 8.4857 116.1383 52.5073 39.6084 176.9224 143 G 3.9017 7.8162 106.0368 46.7314 0.0000 174.2369 144 D 4.5124 8.2676 117.3097 52.5374 39.8031 177.3890 145 G 3.9354 9.2638 108.2090 46.0260 0.0000 173.2066 146 R 4.9479 8.2074 116.9151 54.2759 34.7905 174.7368 147 I 4.8665 8.8773 121.7461 59.7608 39.4264 176.2564 148 S 4.5732 9.2783 122.7063 57.4121 64.5531 175.3482 149 F 3.7397 8.3759 121.4626 61.0454 38.9082 176.4871 150 E 3.6498 8.0355 118.5247 59.3974 29.5149 178.5927 151 E 3.9957 8.1533 118.3786 59.1188 29.4685 179.1305 152 F 4.2212 8.5392 120.8629 61.7374 39.6538 176.9955 153 C 3.8683 8.1548 116.2950 62.6167 27.5709 176.0131 154 A 3.9058 7.6001 121.6144 55.0318 17.9963 179.6450 155 V 3.6094 7.3523 115.2964 65.6559 32.0415 177.8803 156 V 4.1239 7.2791 109.6808 60.5921 31.5369 177.7312 157 G 3.7228 7.6186 109.3459 48.7903 0.0000 175.0874 158 G 3.8580 7.8593 105.2377 45.6965 0.0000 174.2202 159 L 4.0905 8.1255 120.6805 55.3043 41.8272 177.2867 160 D 4.3752 8.1680 117.3147 55.3172 38.5434 175.6836 161 I 3.9126 7.2497 119.3048 63.8003 37.5593 178.0768 162 H 4.2118 8.5393 115.4211 58.6453 28.1015 176.6963 163 K 4.0737 7.3457 118.2292 58.3982 32.1767 177.6617 164 K 4.6560 7.6589 118.4713 55.7626 32.6134 177.4706 165 M 5.0395 7.5822 114.7121 54.1565 33.5095 175.2445 166 V 4.8523 7.4833 117.4782 61.2872 35.4314 175.5918 167 V 4.5234 8.9070 120.1638 59.6358 35.4544 175.2578 168 D 4.5956 8.7770 124.7391 53.5416 41.0490 176.9983 169 V 3.8203 8.2450 116.2908 61.5515 31.6983 176.5569 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 15 D 8.60 4.84 0.00 2.75 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.39 4.17 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 17 D 8.63 4.56 0.00 2.72 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 18 E 8.07 4.09 0.00 2.17 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 2.40 2.47 0.00 19 I 7.71 3.82 2.08 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 1.60 0.66 1.11 0.00 0.00 20 K 7.84 4.14 0.00 2.01 1.90 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.50 1.66 7.81 21 R 8.23 4.04 0.00 1.93 2.04 0.00 3.16 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 22 L 8.28 4.36 0.00 2.09 2.10 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 23 G 9.03 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 24 K 8.03 3.98 0.00 2.13 1.92 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.52 7.81 25 R 7.98 4.01 0.00 2.16 2.11 0.00 3.30 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 26 F 8.71 3.67 0.00 3.25 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.03 3.90 0.00 1.90 1.83 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.66 7.81 28 K 7.85 3.99 0.00 1.90 1.79 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.45 7.81 29 L 7.35 4.03 0.00 1.35 1.22 0.79 0.90 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 30 D 7.45 4.31 0.00 2.24 2.29 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 31 L 7.64 3.83 0.00 1.69 1.68 0.86 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.24 4.59 0.00 2.76 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 33 N 8.08 4.32 0.00 2.78 2.89 0.00 0.00 6.88 7.19 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 34 S 8.19 4.11 0.00 4.00 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 35 G 10.35 4.14 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 0.00 0.00 0.00 36 S 7.51 5.14 0.00 3.90 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.95 4.70 0.00 1.70 1.24 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 38 S 8.73 4.78 0.00 4.12 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 39 V 8.79 3.76 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 1.18 0.00 0.00 0.97 0.00 0.00 40 E 8.39 3.95 0.00 2.08 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 2.41 2.50 0.00 41 E 7.90 3.97 0.00 1.84 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 2.21 2.11 0.00 42 F 8.05 4.26 0.00 3.25 3.04 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 43 M 8.26 4.44 0.00 1.99 2.24 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.92 0.00 44 S 7.70 4.39 0.00 4.03 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 45 L 7.43 4.14 0.00 1.75 1.61 0.93 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.35 0.00 2.21 2.30 0.00 3.69 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 47 E 8.15 4.16 0.00 1.96 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 2.31 2.39 0.00 48 L 7.71 4.51 0.00 1.97 1.70 0.94 0.87 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 49 Q 7.84 4.07 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.21 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 50 Q 8.00 4.37 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 51 N 7.82 4.69 0.00 2.72 2.78 0.00 0.00 6.98 8.67 0.00 0.00 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 P 0.00 4.52 0.00 2.28 2.12 0.00 3.77 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 1.95 1.96 0.00 53 L 8.14 4.41 0.00 1.91 1.67 0.88 0.54 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 54 V 7.58 3.40 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 0.93 0.00 0.00 0.95 0.00 0.00 55 Q 7.95 3.85 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 56 R 7.75 3.82 0.00 1.92 1.82 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.48 0.00 57 V 7.76 3.59 1.90 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 0.56 0.00 0.00 1.00 0.00 0.00 58 I 7.57 3.32 1.70 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.02 0.88 0.00 0.00 59 D 7.61 4.43 0.00 2.76 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.62 3.93 2.13 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.62 0.94 0.00 0.00 61 F 8.56 4.52 0.00 3.13 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 62 D 8.63 4.85 0.00 2.90 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 63 T 7.95 3.91 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 1.22 0.00 0.00 64 D 8.37 4.60 0.00 2.83 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 65 G 8.15 3.99 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 0.00 0.00 0.00 66 N 8.55 4.52 0.00 2.90 2.98 0.00 0.00 7.12 7.16 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 67 G 9.69 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 0.00 0.00 0.00 68 E 7.94 4.88 0.00 2.01 1.92 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 2.42 2.26 0.00 69 V 8.92 4.54 2.58 0.00 0.00 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 0.00 0.00 1.24 0.00 0.00 70 D 9.63 5.15 0.00 3.07 2.95 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 71 F 8.55 3.66 0.00 2.39 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 8.09 3.73 0.00 1.85 1.95 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.47 7.81 73 E 8.80 3.94 0.00 2.55 2.28 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 2.47 2.47 0.00 74 F 8.53 4.39 0.00 3.55 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 75 I 7.69 3.33 1.67 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.30 0.72 0.00 0.00 76 E 7.92 3.96 0.00 1.78 1.88 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 2.19 2.38 0.00 77 G 7.43 2.30 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 0.00 78 V 7.19 3.73 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.54 0.00 0.00 79 S 7.65 4.33 0.00 4.00 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 80 Q 7.84 4.00 0.00 1.86 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 7.39 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 81 F 7.87 4.59 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 82 S 7.70 4.68 0.00 3.99 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 83 V 8.20 3.77 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 0.74 0.00 0.00 0.93 0.00 0.00 84 K 8.09 4.07 0.00 1.73 1.86 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.43 7.81 85 G 7.67 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 0.00 0.00 0.00 86 D 8.44 4.67 0.00 2.87 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 87 K 8.38 3.80 0.00 1.60 1.77 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.16 7.81 88 E 8.17 4.05 0.00 2.13 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 2.47 2.65 0.00 89 Q 7.99 3.97 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 90 K 7.91 4.09 0.00 2.06 1.94 0.00 1.52 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.65 1.41 7.81 91 L 8.36 4.36 0.00 2.22 2.24 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 92 R 8.13 3.49 0.00 1.97 1.73 0.00 2.94 0.00 0.00 2.73 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.53 0.00 93 F 8.10 3.89 0.00 2.92 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 94 A 8.54 4.20 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 F 8.60 3.42 0.00 2.88 2.95 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 96 R 7.75 3.84 0.00 1.58 1.69 0.00 3.05 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 97 I 6.93 3.54 1.63 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.69 0.41 0.00 0.00 98 Y 6.81 4.23 0.00 2.60 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 99 D 7.51 4.62 0.00 2.29 2.41 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 0.00 100 M 7.98 3.96 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.50 0.00 101 D 8.41 4.54 0.00 2.78 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 0.00 102 K 7.96 3.99 0.00 1.97 1.97 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.49 7.81 103 D 8.54 4.63 0.00 2.93 2.85 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 0.00 104 G 9.38 3.92 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 0.00 0.00 0.00 105 Y 8.10 5.06 0.00 2.94 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.09 4.41 1.78 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 -0.36 0.82 0.00 0.00 107 S 9.04 4.79 0.00 3.93 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 0.00 108 N 9.10 4.37 0.00 2.80 2.88 0.00 0.00 6.74 7.90 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 0.00 109 G 8.14 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 0.00 110 E 7.92 4.01 0.00 2.22 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 2.34 2.34 0.00 111 L 8.11 4.04 0.00 1.86 1.87 0.87 0.77 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 0.00 112 F 8.45 4.00 0.00 3.20 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 0.00 113 Q 8.50 4.12 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.59 0.00 0.00 0.00 0.00 0.00 2.53 2.68 0.00 114 V 7.90 3.55 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 0.58 0.00 0.00 1.00 0.00 0.00 115 L 7.99 4.11 0.00 1.72 1.63 0.98 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.09 3.64 0.00 1.49 1.88 0.00 1.39 0.00 0.00 1.49 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.50 7.81 117 M 7.66 4.05 0.00 2.00 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.56 0.00 118 M 7.80 4.21 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.50 0.00 119 V 7.75 3.80 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 1.01 0.00 0.00 0.94 0.00 0.00 120 G 8.16 3.71 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 0.00 0.00 0.00 121 N 8.66 4.65 0.00 2.81 2.79 0.00 0.00 6.92 6.71 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 0.00 122 N 8.05 4.49 0.00 2.89 2.86 0.00 0.00 6.70 8.02 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 0.00 123 L 7.03 4.96 0.00 1.65 1.50 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.99 4.26 0.00 1.82 1.75 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.58 7.81 125 D 8.83 4.66 0.00 2.85 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 0.00 126 T 8.00 3.92 4.28 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 1.24 0.00 0.00 127 Q 8.04 3.98 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 128 L 8.15 3.94 0.00 1.64 1.60 0.80 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 8.69 4.27 0.00 2.43 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 130 Q 8.20 4.03 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 131 I 7.84 3.90 1.88 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 1.70 0.72 0.92 0.00 0.00 132 V 7.99 3.57 2.41 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 1.21 0.00 0.00 1.10 0.00 0.00 133 D 8.30 4.41 0.00 2.92 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 0.00 134 K 8.03 3.99 0.00 1.84 1.87 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.71 7.81 135 T 7.91 3.87 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 0.00 136 I 7.79 3.71 2.01 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 1.56 0.57 0.99 0.00 0.00 137 I 7.73 3.70 1.88 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 1.42 0.57 0.92 0.00 0.00 138 N 8.08 4.44 0.00 2.90 2.84 0.00 0.00 7.19 8.01 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 0.00 139 A 7.97 4.56 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 0.00 140 D 7.83 4.62 0.00 2.99 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 0.00 141 K 8.42 4.12 0.00 1.81 1.87 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.57 7.81 142 D 8.49 4.63 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 G 7.82 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 0.00 144 D 8.27 4.51 0.00 2.71 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 G 9.26 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 0.00 146 R 8.21 4.95 0.00 1.79 2.07 0.00 3.13 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 147 I 8.88 4.87 1.97 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 1.35 0.98 1.14 0.00 0.00 148 S 9.28 4.57 0.00 3.88 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 0.00 149 F 8.38 3.74 0.00 2.11 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 0.00 150 E 8.04 3.65 0.00 2.01 1.90 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 2.33 2.33 0.00 151 E 8.15 4.00 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 152 F 8.54 4.22 0.00 3.48 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 0.00 153 C 8.15 3.87 0.00 2.76 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 0.00 154 A 7.60 3.91 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 0.00 155 V 7.35 3.61 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 0.75 0.00 0.00 0.89 0.00 0.00 156 V 7.28 4.12 1.84 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 0.27 0.00 0.00 0.33 0.00 0.00 157 G 7.62 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 0.00 158 G 7.86 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 0.00 159 L 8.13 4.09 0.00 1.79 1.72 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 160 D 8.17 4.38 0.00 2.84 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 I 7.25 3.91 1.96 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 1.39 1.26 1.01 0.00 0.00 162 H 8.54 4.21 0.00 3.29 3.52 0.00 5.53 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 K 7.35 4.07 0.00 1.82 1.88 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 0.98 7.81 164 K 7.66 4.66 0.00 1.78 1.82 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.38 7.81 165 M 7.58 5.04 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.68 0.00 166 V 7.48 4.85 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 0.84 0.00 0.00 0.97 0.00 0.00 167 V 8.91 4.52 2.06 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 0.64 0.00 0.00 0.93 0.00 0.00 168 D 8.78 4.60 0.00 2.57 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 0.00 169 V 8.25 3.82 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 0.69 0.00 0.00 0.93 0.00 0.00