NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6051 8.3649 120.5326 54.0464 41.9662 177.7135 2 I 4.3317 8.9171 127.0260 59.9537 39.4906 172.6776 3 Q 4.6051 9.3317 128.0075 54.5634 31.3907 174.1482 4 M 5.0027 8.6900 123.8097 53.8713 34.6127 174.6968 5 T 4.6157 9.4209 116.2908 60.0718 70.9583 173.3353 6 Q 5.3086 8.8010 127.3667 54.3270 31.6552 174.3463 7 S 4.7856 8.7841 118.9116 56.2395 66.5460 172.0748 8 P 4.9716 0.0000 0.0000 62.2021 32.5231 176.0058 9 S 4.8038 8.4854 112.1030 60.3077 64.3950 174.1972 10 S 5.3399 7.9032 114.6130 57.3354 66.9485 173.3796 11 L 4.7526 8.9290 121.6168 54.7374 43.8685 174.1334 12 S 5.2535 8.6746 115.1293 56.9522 65.9697 172.7865 13 A 4.6787 8.7997 122.9248 51.3045 22.9698 174.5430 14 S 5.0375 8.8453 112.3188 56.3560 66.5223 174.8440 15 V 3.6990 8.2215 121.1982 64.5639 31.6713 176.6098 16 G 4.2663 9.0309 114.7729 44.9637 0.0000 173.3920 17 D 4.6367 7.5481 119.9162 53.8652 42.4850 175.2581 18 R 4.6453 8.2876 120.8876 55.2830 31.6400 175.5312 19 V 4.4600 8.6051 125.9814 61.1300 34.3417 174.0147 20 T 4.8773 8.5382 117.7299 59.9004 70.9772 173.2290 21 I 4.7941 8.9168 127.3697 59.4950 40.6081 174.7736 22 T 5.4555 9.0102 115.6395 60.2862 72.6415 172.1483 23 C 5.6380 10.0248 119.4826 55.4952 42.9831 173.2581 24 R 5.3722 9.1525 122.0769 54.5159 32.6917 174.5405 25 A 5.0680 9.2275 126.1968 50.5125 20.5932 178.1661 26 S 4.3716 8.6210 118.0668 61.4937 63.5487 174.2138 27 Q 4.4356 7.5028 115.5663 54.4358 31.4327 173.1654 28 D 4.4555 8.6922 117.8978 55.0778 41.1829 175.3977 29 I 4.4844 9.0235 119.7456 60.1266 39.7810 178.3070 30 T 3.3997 8.6927 122.3354 64.8893 66.9938 173.2478 31 N 5.2235 8.0150 125.4418 53.6591 38.9287 174.9252 32 Y 4.0587 7.2713 116.2862 57.6924 36.7225 175.1506 33 V 4.6032 6.8568 120.0121 61.0039 35.5654 174.3929 34 N 5.2881 9.1408 125.1741 51.3789 41.2287 173.7819 35 W 5.0850 9.0487 122.7450 54.9769 32.0717 174.6630 36 F 5.4219 9.4810 123.7227 55.6755 42.1090 174.1269 37 Q 4.4459 9.0155 123.0031 54.2313 31.7908 174.0763 38 Q 4.6435 8.7079 127.1025 54.3054 31.8759 174.6113 39 R 4.5923 8.4762 125.9827 54.5692 31.9432 174.6615 40 P 4.4022 0.0000 0.0000 64.4671 31.4457 177.1252 41 G 3.8732 8.8494 109.2993 45.7398 0.0000 172.9990 42 Q 4.4316 7.7479 117.9904 54.1687 30.8378 174.5130 43 A 4.5092 8.0189 120.5301 50.1558 20.2027 175.6525 44 P 4.3832 0.0000 0.0000 63.1941 32.2803 175.6296 45 K 4.6490 9.1173 125.0992 54.1752 34.7569 175.1630 46 V 3.4293 8.8680 127.7534 64.1494 31.5265 174.6945 47 L 4.5513 9.1629 127.9231 56.1523 43.5579 176.6262 48 I 5.3554 7.6412 118.5186 59.5950 41.3280 173.8820 49 Y 5.1971 8.3040 123.1248 55.6132 42.1112 175.4730 50 G 4.0518 9.9054 106.7970 45.8771 0.0000 176.1875 51 A 4.2998 8.7014 128.1108 52.4787 18.3696 179.7680 52 S 4.7722 8.5235 105.6084 57.6778 64.6770 173.5348 53 I 4.0608 7.7334 123.8187 60.2054 38.0067 174.7646 54 L 4.6950 8.3601 130.1505 54.4160 43.0476 176.0263 55 E 4.3137 9.3331 128.3384 56.0102 30.9437 175.9671 56 T 3.9569 8.7137 120.6712 64.2299 67.5959 173.6563 57 G 3.9107 9.0544 115.8101 45.8399 0.0000 172.5038 58 V 4.3696 7.4487 118.8411 59.8301 32.9255 174.0286 59 P 4.3987 0.0000 0.0000 63.2539 31.6614 176.9666 60 S 4.5202 8.5852 114.9022 59.3343 63.3357 175.1591 61 R 3.9399 7.7011 118.6724 58.5180 30.5014 176.1159 62 F 4.9927 7.6029 119.5772 56.6390 39.9248 175.4538 63 S 4.7381 8.4717 117.0077 57.1058 66.7081 173.0442 64 G 4.7071 8.4500 106.8328 45.3204 0.0000 171.3329 65 S 4.6560 9.3647 114.6730 57.6461 66.9023 174.1005 66 G 4.0086 10.3545 105.0698 46.9259 0.0000 172.4814 67 S 4.8337 7.6303 112.4010 58.3923 68.4843 176.5018 68 G 3.8606 10.4834 117.0422 45.3944 0.0000 175.2922 69 T 4.7234 8.8439 116.9189 60.9146 71.8802 173.8332 70 D 5.2442 7.4811 122.5814 52.6330 43.5739 174.8387 71 F 5.2146 9.6659 122.5971 55.8915 43.0919 174.5089 72 T 5.2392 9.1307 118.3082 61.7875 72.1054 172.6109 73 F 4.7028 9.0366 128.4186 56.4129 41.7978 173.9564 74 T 4.6815 8.1287 122.8775 61.6060 71.7291 173.3007 75 I 3.7627 8.4290 127.4967 59.5796 38.1371 176.1923 76 S 3.9085 8.4098 125.2599 61.7070 63.7130 175.5746 77 S 4.3734 7.5595 115.5053 56.9627 64.1590 173.0712 78 L 4.1968 8.7385 130.3242 55.7213 43.0257 175.8111 79 Q 5.0336 9.2008 124.1239 53.0981 32.1892 174.8051 80 P 4.4686 0.0000 0.0000 65.9600 31.1774 177.5235 81 E 4.1837 8.1249 117.0670 58.8990 29.6151 177.2511 82 D 4.9036 8.4159 116.8974 54.9554 40.8492 176.5734 83 I 3.7500 7.9290 121.0598 60.7622 37.5502 175.3339 84 A 4.3707 7.3373 124.8210 52.6477 23.6585 174.4958 85 T 4.9327 7.5018 114.5153 62.3824 70.7522 173.9496 86 Y 5.0077 8.8241 124.1616 56.7614 40.4196 174.4830 87 Y 5.6342 9.5896 120.3222 56.5501 42.8565 171.8107 88 C 4.8128 9.0241 116.1674 53.5637 41.7326 172.3275 89 Q 4.6223 8.4302 121.7759 54.3047 32.0734 173.5089 90 Q 4.7950 8.8972 125.4339 54.6061 30.4079 175.0825 91 Y 4.7624 8.1669 121.1426 57.3026 37.9717 176.9228 92 D 4.1674 9.0348 120.7360 57.5696 41.8142 176.1720 93 T 4.6290 7.6258 113.2762 61.1548 71.6343 174.0817 94 L 4.2706 8.3709 125.8781 53.8697 42.3945 175.3038 95 P 4.4351 0.0000 0.0000 62.7216 32.0051 176.8327 96 L 4.5515 8.1406 120.8561 54.1126 40.8420 176.3808 97 T 4.2893 8.2292 114.0384 61.4941 70.4852 173.5365 98 F 4.8940 8.7803 121.9305 55.8468 41.2960 176.1548 99 G 4.1109 9.3537 112.9133 44.4115 0.0000 174.0857 100 G 3.7342 8.5943 107.2623 46.6848 0.0000 175.1304 101 G 3.5396 9.0737 105.2594 45.7874 0.0000 173.3423 102 T 4.6798 8.1254 116.0166 61.3189 72.3392 173.3875 103 K 4.4510 8.9274 129.8422 55.9669 33.0101 175.6647 104 V 4.6893 9.0745 129.3169 61.7473 33.1857 174.3432 105 D 5.1909 9.2164 127.6589 52.5135 44.6005 175.0404 106 I 5.0167 8.1663 121.6821 59.3374 39.4141 175.7840 107 K 4.2078 9.0059 127.7035 55.9983 32.9345 177.5168 108 R 4.0617 8.4164 121.9175 56.7207 30.0949 176.1995 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 D 8.36 4.61 0.00 2.67 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 0.00 0.00 0.00 0.00 2 I 8.92 4.33 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 1.35 0.70 0.92 0.00 0.00 3 Q 9.33 4.61 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 4 M 8.69 5.00 0.00 1.88 2.05 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.42 0.00 5 T 9.42 4.62 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 6 Q 8.80 5.31 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.76 0.00 7 S 8.78 4.79 0.00 3.97 3.68 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 8 P 0.00 4.97 0.00 2.37 2.03 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 9 S 8.49 4.80 0.00 3.93 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 10 S 7.90 5.34 0.00 3.75 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 11 L 8.93 4.75 0.00 1.65 1.74 0.94 0.93 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 12 S 8.67 5.25 0.00 3.86 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 13 A 8.80 4.68 1.23 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 0.00 0.00 14 S 8.85 5.04 0.00 3.86 3.73 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 15 V 8.22 3.70 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 0.82 0.00 0.00 0.93 0.00 0.00 16 G 9.03 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 0.00 0.00 0.00 0.00 17 D 7.55 4.64 0.00 2.66 2.54 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 18 R 8.29 4.65 0.00 1.73 1.74 0.00 3.10 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 19 V 8.61 4.46 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 0.84 0.00 0.00 0.86 0.00 0.00 20 T 8.54 4.88 4.18 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 0.00 0.00 1.12 0.00 0.00 21 I 8.92 4.79 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.65 1.20 0.00 0.00 22 T 9.01 5.46 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 1.29 0.00 0.00 23 C 10.02 5.64 0.00 2.88 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 24 R 9.15 5.37 0.00 1.79 1.84 0.00 3.14 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 25 A 9.23 5.07 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 26 S 8.62 4.37 0.00 3.87 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 27 Q 7.50 4.44 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 28 D 8.69 4.46 0.00 2.67 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 29 I 9.02 4.48 1.85 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.77 0.99 0.00 0.00 30 T 8.69 3.40 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 0.98 0.00 0.00 31 N 8.01 5.22 0.00 2.83 2.88 0.00 0.00 5.91 7.57 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 32 Y 7.27 4.06 0.00 2.80 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 0.00 0.00 0.00 0.00 33 V 6.86 4.60 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 0.30 0.00 0.00 -0.70 0.00 0.00 34 N 9.14 5.29 0.00 2.35 1.81 0.00 0.00 6.47 7.72 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 35 W 9.05 5.08 0.00 3.06 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.48 5.42 0.00 3.33 3.06 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 37 Q 9.02 4.45 0.00 1.91 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.03 1.61 0.00 38 Q 8.71 4.64 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 39 R 8.48 4.59 0.00 1.96 1.83 0.00 3.21 0.00 0.00 3.41 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 40 P 0.00 4.40 0.00 2.17 2.08 0.00 3.84 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 2.00 1.99 0.00 41 G 8.85 3.87 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 0.00 0.00 0.00 42 Q 7.75 4.43 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 43 A 8.02 4.51 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.38 0.00 1.37 1.70 0.00 3.43 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 45 K 9.12 4.65 0.00 1.84 1.86 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.39 7.81 46 V 8.87 3.43 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 0.97 0.00 0.00 47 L 9.16 4.55 0.00 1.71 1.66 0.49 0.20 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 48 I 7.64 5.36 2.18 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.89 1.17 0.00 0.00 49 Y 8.30 5.20 0.00 2.97 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 50 G 9.91 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.70 4.30 1.55 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 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.52 4.77 0.00 3.94 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 53 I 7.73 4.06 1.03 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.79 0.51 0.00 0.00 54 L 8.36 4.69 0.00 1.66 1.59 1.15 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.33 4.31 0.00 2.36 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 2.42 2.59 0.00 56 T 8.71 3.96 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 57 G 9.05 3.91 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 0.00 58 V 7.45 4.37 2.34 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 0.93 0.00 0.00 0.98 0.00 0.00 59 P 0.00 4.40 0.00 2.30 2.05 0.00 4.02 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.27 0.00 60 S 8.59 4.52 0.00 3.96 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.70 3.94 0.00 1.59 2.00 0.00 2.70 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.87 0.00 62 F 7.60 4.99 0.00 2.98 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 63 S 8.47 4.74 0.00 3.82 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 64 G 8.45 4.71 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 65 S 9.36 4.66 0.00 3.91 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 66 G 10.35 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 0.00 0.00 0.00 67 S 7.63 4.83 0.00 3.77 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 68 G 10.48 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 69 T 8.84 4.72 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 1.25 0.00 0.00 70 D 7.48 5.24 0.00 2.38 2.48 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 71 F 9.67 5.21 0.00 3.18 3.29 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 72 T 9.13 5.24 4.29 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 1.23 0.00 0.00 73 F 9.04 4.70 0.00 1.51 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 0.00 0.00 0.00 74 T 8.13 4.68 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 75 I 8.43 3.76 1.60 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.35 0.62 0.00 0.00 76 S 8.41 3.91 0.00 3.70 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 77 S 7.56 4.37 0.00 3.76 3.58 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 0.00 0.00 0.00 0.00 78 L 8.74 4.20 0.00 1.86 1.49 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 9.20 5.03 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.49 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 80 P 0.00 4.47 0.00 2.19 2.23 0.00 3.77 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 2.01 2.02 0.00 81 E 8.12 4.18 0.00 2.08 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 2.38 2.44 0.00 82 D 8.42 4.90 0.00 2.85 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 83 I 7.93 3.75 1.93 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 1.41 0.53 1.00 0.00 0.00 84 A 7.34 4.37 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 85 T 7.50 4.93 4.17 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 0.77 0.00 0.00 86 Y 8.82 5.01 0.00 2.96 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 87 Y 9.59 5.63 0.00 3.22 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 88 C 9.02 4.81 0.00 1.87 1.18 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 0.00 0.00 0.00 89 Q 8.43 4.62 0.00 0.93 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.89 0.00 0.00 0.00 0.00 0.00 1.97 1.57 0.00 90 Q 8.90 4.80 0.00 1.88 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.19 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 91 Y 8.17 4.76 0.00 2.84 2.93 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 92 D 9.03 4.17 0.00 2.75 2.86 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 93 T 7.63 4.63 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 94 L 8.37 4.27 0.00 1.62 1.60 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.44 0.00 2.19 2.05 0.00 3.76 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 1.99 1.99 0.00 96 L 8.14 4.55 0.00 1.58 1.92 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 97 T 8.23 4.29 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 1.34 0.00 0.00 98 F 8.78 4.89 0.00 2.84 3.01 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 99 G 9.35 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.59 3.73 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 0.00 0.00 0.00 101 G 9.07 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 0.00 0.00 0.00 102 T 8.13 4.68 4.38 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 1.32 0.00 0.00 103 K 8.93 4.45 0.00 1.87 1.73 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.41 7.81 104 V 9.07 4.69 2.48 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 0.97 0.00 0.00 0.99 0.00 0.00 105 D 9.22 5.19 0.00 2.65 2.53 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 0.00 106 I 8.17 5.02 1.90 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 1.38 0.67 0.92 0.00 0.00 107 K 9.01 4.21 0.00 1.61 1.74 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.54 7.81 108 R 8.42 4.06 0.00 1.78 1.81 0.00 3.27 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00