NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4659 8.3049 118.7963 54.4961 33.5814 176.1175 2 M 4.0197 7.7065 117.5862 56.0227 32.8822 175.0961 3 F 4.2984 8.6591 126.0295 57.1343 40.5806 175.1904 4 L 4.2009 7.3847 128.1888 53.8282 42.5609 177.9092 5 R 4.0545 8.2022 120.0926 56.1786 31.9422 177.6920 6 Q 4.0538 8.7583 122.2460 59.6092 29.0778 178.6781 7 E 3.9852 8.2431 119.5851 59.6187 29.6912 178.4980 8 D 4.3999 8.0520 118.3529 57.1827 40.9613 178.3447 9 F 4.3160 8.5395 121.2787 61.0862 39.2723 177.0120 10 A 4.2533 8.5688 120.8187 55.6269 18.3741 179.6873 11 T 3.6264 7.7053 113.6898 66.5999 68.6195 176.9260 12 V 3.5110 7.8247 120.0456 66.1073 31.3825 178.2437 13 V 3.4875 7.6088 116.7730 66.0738 31.4249 177.8110 14 R 3.7996 7.6215 116.7950 58.5571 29.8879 178.2592 15 S 4.6091 7.3682 111.8202 58.1986 64.1194 173.7627 16 T 4.5194 6.9101 113.8637 59.8033 70.3982 170.9495 17 P 4.4968 0.0000 0.0000 62.8370 32.0934 176.0716 18 L 4.3834 8.9004 122.4903 54.4968 43.6228 175.7491 19 V 5.0527 8.3666 120.8011 61.3187 34.1487 174.5296 20 S 5.3030 9.3264 121.5016 56.6907 67.4205 172.4644 21 L 5.3720 8.8312 120.4275 53.2271 43.9766 175.3601 22 D 4.9339 8.8385 123.6711 52.4679 43.6063 175.3029 23 F 5.4375 8.6674 121.9446 56.0927 41.0615 175.6730 24 I 4.0358 8.6073 126.5009 59.9888 37.8726 174.7341 25 V 4.3454 8.2319 127.9405 61.0387 33.4736 173.9363 26 E 4.7887 9.0666 129.8641 54.7329 32.4131 174.8290 27 N 5.4672 8.6643 122.8975 50.1700 40.1166 175.4687 28 S 4.2041 8.4479 112.0748 60.2808 63.1543 174.8148 29 R 4.2485 8.0116 118.7683 55.8450 30.3217 176.6813 30 G 4.0687 8.0243 105.9577 44.8360 0.0000 173.4196 31 E 4.7447 8.0833 119.0068 54.9699 32.0003 175.0799 32 F 5.5213 9.1711 119.8157 55.6670 42.9138 174.2326 33 L 4.0083 8.5333 124.8629 54.3080 42.5311 175.9874 34 L 5.0930 8.9210 125.8186 52.9239 45.8743 175.7166 35 G 3.9223 9.1149 109.2643 44.0476 0.0000 172.2107 36 K 3.9517 7.7302 124.2374 54.4685 32.9730 176.2003 37 R 4.5023 8.7067 128.7441 56.7614 30.5155 177.7322 38 T 4.3049 8.5890 113.4026 62.0800 69.6767 174.3916 39 N 5.0459 7.8071 119.4433 51.3756 41.9006 174.6606 40 R 4.0180 8.3011 119.7022 55.0795 30.2060 174.9926 41 P 4.2691 0.0000 0.0000 62.2413 32.6605 175.5285 42 A 3.5660 8.0846 116.9263 52.8422 15.8643 176.8818 43 Q 4.1367 6.6949 116.8659 58.4680 29.4592 176.7870 44 G 3.7921 9.0182 113.7002 45.4721 0.0000 172.7925 45 Y 4.7332 7.4501 117.4358 56.3139 40.4574 175.0724 46 W 4.7236 9.3043 123.0481 56.9298 30.4075 175.2694 47 F 5.0527 9.3787 125.3991 56.6785 42.8419 173.9320 48 V 4.2200 8.0626 117.0729 60.7413 32.2662 174.6489 49 P 4.5910 0.0000 0.0000 62.5358 32.6086 175.7692 50 G 3.7601 8.4115 109.6700 46.6165 0.0000 171.3429 51 G 4.3102 7.7349 106.3922 45.4119 0.0000 172.9673 52 R 4.9981 8.6374 116.6434 55.4837 30.9758 176.2351 53 V 4.1026 8.8528 121.4735 62.5175 32.6723 175.9493 54 Q 4.4450 9.1878 126.7408 53.9844 30.2279 175.1232 55 K 4.0910 8.4017 120.7056 58.1875 32.4455 176.0344 56 D 4.4416 8.7731 123.6867 55.0568 38.4955 172.5141 57 E 4.5181 7.8648 120.8909 54.7485 30.8355 175.9576 58 T 4.1532 8.2384 116.5881 61.4593 71.1224 175.5037 59 L 4.1037 8.4625 122.1105 57.9481 41.4067 179.6669 60 E 3.9017 8.1850 117.9451 59.4499 29.4449 179.1403 61 A 4.0262 8.2087 120.5357 55.0151 18.4232 179.5079 62 A 4.2697 8.4458 121.1497 54.7182 18.4091 179.5785 63 F 4.0568 8.4974 119.2483 61.5137 39.5574 177.3106 64 E 4.2002 8.0522 119.3050 58.8660 29.2237 179.2537 65 R 3.8993 8.2131 118.8685 59.5348 30.0874 178.6294 66 L 4.1100 8.5023 119.4840 57.7936 41.5760 179.5020 67 T 3.6340 7.9347 109.9828 64.8557 68.5724 176.2318 68 M 4.0091 7.9021 120.6471 58.3581 32.0867 178.1368 69 A 4.0371 8.0658 119.7397 54.9423 18.5923 178.9130 70 E 4.3307 8.5279 116.4245 58.1399 30.3170 177.9890 71 L 4.6601 8.3249 116.9442 53.3242 43.0191 178.0751 72 G 3.8909 8.2084 105.9009 45.8530 0.0000 173.1399 73 L 4.4984 7.4723 120.1996 52.8535 44.4515 175.5595 74 R 4.1400 8.5949 126.9815 55.6964 30.9129 175.2852 75 L 4.7982 8.4672 125.0369 52.0478 45.1067 174.4239 76 P 4.6254 0.0000 0.0000 61.9104 32.5930 177.1893 77 I 2.0000 7.8354 119.7580 63.3177 37.9621 178.0991 78 T 3.7743 7.5171 109.0274 63.9345 68.6080 175.0711 79 A 4.0776 7.7175 124.6545 53.7939 18.7204 177.4644 80 G 4.3974 7.4274 103.3428 45.2846 0.0000 173.4540 81 Q 4.7762 9.3968 125.5942 54.2146 30.4989 174.6920 82 F 4.1836 9.2548 129.5169 58.5603 40.0235 173.9641 83 Y 4.4708 7.9820 127.9264 57.1451 39.5990 176.1321 84 G 3.5145 6.2883 102.1676 44.3609 0.0000 172.5575 85 V 4.8783 7.4635 118.1658 60.9710 33.2016 174.6836 86 W 5.2445 9.5068 126.9131 54.8653 33.9657 173.9956 87 Q 4.9462 8.7898 118.0025 54.9751 30.9406 174.0448 88 H 4.8485 9.0052 120.4403 53.7938 31.8585 172.6689 89 F 5.3234 8.4554 121.4879 55.8407 41.5996 174.3229 90 Y 5.0031 9.0700 120.5769 56.3762 41.5062 176.4279 91 D 4.5798 9.2290 121.5750 55.6008 41.5252 175.2168 92 D 5.0984 7.7783 117.8997 51.5521 42.4530 173.5554 93 N 5.1770 8.6350 114.8512 51.3681 40.3595 174.9150 94 F 4.3598 9.2885 112.9071 58.9577 37.4063 176.4947 95 S 4.1598 7.1723 112.5386 57.5384 64.3263 175.1514 96 G 3.6377 6.0058 109.7591 46.1507 0.0000 174.2601 97 T 4.6075 7.8282 117.4042 61.5561 69.0796 175.1832 98 D 4.5182 7.6917 122.6449 56.7696 41.2515 175.6540 99 F 5.0227 6.8360 111.1919 55.9986 40.9806 173.9376 100 T 4.6272 8.6704 110.2224 61.5538 70.6084 173.8222 101 T 4.8134 8.8869 118.2476 62.0488 72.3079 172.8749 102 H 5.3448 8.6512 123.9578 54.7334 33.2680 171.2798 103 Y 5.1834 9.2338 123.5537 56.1967 41.3078 174.6885 104 V 4.6097 8.8775 124.0669 61.3736 33.6218 174.4707 105 V 4.9254 9.1257 128.2935 61.1325 34.5785 174.0082 106 L 5.2017 9.3094 128.4405 53.2188 43.5079 176.0380 107 G 4.2054 8.9790 112.4881 45.7811 0.0000 172.1777 108 F 5.5769 9.3621 121.2919 55.5931 43.5769 173.5954 109 R 4.9658 8.9810 124.1280 54.6217 32.4711 174.5276 110 F 5.1813 8.2567 118.5572 56.1472 41.5800 172.5838 111 R 5.0597 8.8003 120.6221 55.2458 31.5042 175.3178 112 V 4.7219 8.9602 117.7079 59.5836 36.8558 174.2339 113 A 4.5773 8.2677 124.0893 50.4431 20.1125 177.4136 114 E 3.8023 8.6363 124.6886 59.5641 29.6209 178.6944 115 E 4.0156 8.0215 117.4588 58.3841 29.7715 176.7140 116 E 4.3908 8.0300 116.3681 56.5708 30.0929 175.9994 117 L 4.4253 7.4664 118.8395 53.9824 43.2727 176.8110 118 L 4.6948 8.4623 122.4281 52.7632 42.3505 173.5827 119 L 4.0740 8.0190 120.9559 53.5438 42.1514 175.3267 120 P 4.6045 0.0000 0.0000 62.5320 32.3548 175.6468 121 D 5.2113 8.6723 116.6293 52.3265 40.0082 177.1523 122 E 4.0860 8.3341 119.0296 59.3436 29.9233 177.5191 123 Q 4.5107 7.9954 116.0200 55.6800 30.7321 175.1057 124 H 5.2079 7.8385 116.1056 53.9716 33.0093 173.3168 125 D 4.8178 8.2720 120.8757 53.3043 40.1613 175.3766 126 D 4.6523 6.9194 117.1073 54.1242 44.6255 173.5074 127 Y 5.4955 8.7177 119.2987 56.6350 42.0121 174.8638 128 R 4.7898 9.3168 120.6576 54.3974 35.2641 174.2606 129 W 4.9905 8.9075 121.4539 55.3388 30.6922 175.2614 130 L 4.9718 8.9247 125.6544 52.7013 44.8148 176.8867 131 T 4.4680 8.3004 111.3795 60.6609 70.2069 173.7045 132 P 3.9564 0.0000 0.0000 66.1135 31.0942 178.6538 133 D 4.3557 8.0724 115.4928 57.2243 40.9191 178.3436 134 A 4.0894 8.0329 121.4492 55.0945 18.3130 179.7478 135 L 3.8337 7.8792 118.3845 58.8415 40.2707 179.4262 136 L 3.9715 7.8240 118.6680 56.9219 41.6071 178.3320 137 A 4.3536 7.4497 118.7117 51.5181 19.3303 176.6628 138 S 4.6546 7.2748 113.8453 55.9608 63.8681 174.5382 139 E 4.2836 8.7830 125.3567 58.2083 29.8819 177.2617 140 N 4.6065 8.1448 116.9449 54.4506 39.0884 174.5435 141 V 4.7039 7.5438 119.0371 61.5358 32.5393 175.6739 142 H 4.1227 9.0875 126.8626 56.0176 31.6449 175.6797 143 A 3.8886 8.2941 128.6185 55.7120 17.9244 179.8546 144 N 4.1199 8.2820 112.8726 55.6115 38.7526 176.8547 145 S 3.9912 7.1969 115.9513 60.4077 63.5125 176.3650 146 R 4.0185 7.9076 120.8815 59.3970 29.5683 179.4514 147 V 3.5919 7.2208 111.0624 64.2228 31.5204 177.7464 148 Y 3.9313 6.7393 115.1139 59.4023 37.5562 175.9844 149 F 4.3965 7.9680 123.4332 57.4360 39.4688 175.0256 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.47 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.14 0.00 2 M 7.71 4.02 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.78 0.00 3 F 8.66 4.30 0.00 2.90 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 4 L 7.38 4.20 0.00 1.36 1.46 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.20 4.05 0.00 1.85 1.87 0.00 3.16 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 6 Q 8.76 4.05 0.00 2.25 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.89 0.00 0.00 0.00 0.00 0.00 2.65 2.88 0.00 7 E 8.24 3.99 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 8 D 8.05 4.40 0.00 2.85 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 9 F 8.54 4.32 0.00 2.72 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 10 A 8.57 4.25 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 11 T 7.71 3.63 4.34 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 1.15 0.00 0.00 12 V 7.82 3.51 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 1.02 0.00 0.00 0.95 0.00 0.00 13 V 7.61 3.49 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 1.08 0.00 0.00 0.19 0.00 0.00 14 R 7.62 3.80 0.00 1.62 1.64 0.00 2.74 0.00 0.00 2.83 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 15 S 7.37 4.61 0.00 3.84 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 16 T 6.91 4.52 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 1.23 0.00 0.00 17 P 0.00 4.50 0.00 1.97 1.49 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 18 L 8.90 4.38 0.00 1.30 1.60 0.52 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.37 5.05 2.16 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 1.14 0.00 0.00 0.98 0.00 0.00 20 S 9.33 5.30 0.00 4.04 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 0.00 21 L 8.83 5.37 0.00 1.35 1.78 1.16 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.84 4.93 0.00 2.58 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 23 F 8.67 5.44 0.00 2.96 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 24 I 8.61 4.04 1.23 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.18 0.49 0.00 0.00 25 V 8.23 4.35 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 1.16 0.00 0.00 0.72 0.00 0.00 26 E 9.07 4.79 0.00 1.91 1.66 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 1.85 1.47 0.00 27 N 8.66 5.47 0.00 2.17 1.58 0.00 0.00 6.64 8.03 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 28 S 8.45 4.20 0.00 3.91 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 29 R 8.01 4.25 0.00 1.68 1.90 0.00 3.13 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.44 0.00 30 G 8.02 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 31 E 8.08 4.74 0.00 2.14 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 2.29 2.25 0.00 32 F 9.17 5.52 0.00 2.73 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 33 L 8.53 4.01 0.00 0.27 1.14 0.11 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.92 5.09 0.00 1.69 1.77 0.84 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 35 G 9.11 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 36 K 7.73 3.95 0.00 0.79 1.04 0.00 0.99 0.00 0.00 1.38 0.00 0.00 2.60 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.84 0.38 7.81 37 R 8.71 4.50 0.00 1.85 1.71 0.00 2.74 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 38 T 8.59 4.30 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 1.11 0.00 0.00 39 N 7.81 5.05 0.00 2.60 2.75 0.00 0.00 7.18 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 40 R 8.30 4.02 0.00 1.90 1.78 0.00 3.08 0.00 0.00 3.45 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 41 P 0.00 4.27 0.00 1.18 2.11 0.00 3.81 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.98 0.00 42 A 8.08 3.57 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 6.69 4.14 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 44 G 9.02 3.79 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 0.00 0.00 0.00 45 Y 7.45 4.73 0.00 3.14 3.08 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 46 W 9.30 4.72 0.00 3.44 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 47 F 9.38 5.05 0.00 3.16 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 48 V 8.06 4.22 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 0.77 0.00 0.00 0.99 0.00 0.00 49 P 0.00 4.59 0.00 2.35 2.27 0.00 3.98 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 50 G 8.41 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 51 G 7.73 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 0.00 0.00 0.00 0.00 52 R 8.64 5.00 0.00 2.07 2.12 0.00 3.15 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 53 V 8.85 4.10 2.16 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 0.83 0.00 0.00 1.08 0.00 0.00 54 Q 9.19 4.44 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 55 K 8.40 4.09 0.00 1.70 1.87 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.54 7.81 56 D 8.77 4.44 0.00 2.88 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 57 E 7.86 4.52 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 58 T 8.24 4.15 4.44 0.00 0.00 0.00 0.00 0.00 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 59 L 8.46 4.10 0.00 1.78 1.88 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.19 3.90 0.00 2.05 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 0.00 2.37 2.38 0.00 61 A 8.21 4.03 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 62 A 8.45 4.27 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 63 F 8.50 4.06 0.00 3.21 3.07 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 64 E 8.05 4.20 0.00 2.21 1.99 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 2.60 2.41 0.00 65 R 8.21 3.90 0.00 1.89 2.09 0.00 3.10 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 66 L 8.50 4.11 0.00 1.99 1.93 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 67 T 7.93 3.63 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 -0.15 0.00 0.00 68 M 7.90 4.01 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 69 A 8.07 4.04 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 70 E 8.53 4.33 0.00 2.22 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 2.58 2.69 0.00 71 L 8.32 4.66 0.00 1.75 1.68 1.01 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.21 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.47 4.50 0.00 1.52 1.50 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.59 4.14 0.00 1.78 1.79 0.00 3.21 0.00 0.00 3.39 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.83 0.00 75 L 8.47 4.80 0.00 1.45 1.33 0.50 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.63 0.00 2.09 2.10 0.00 3.61 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 77 I 7.84 2.00 1.37 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 0.96 -0.07 0.69 0.00 0.00 78 T 7.52 3.77 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 1.13 0.00 0.00 79 A 7.72 4.08 1.21 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 0.00 0.00 80 G 7.43 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.40 4.78 0.00 2.28 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 82 F 9.25 4.18 0.00 3.02 3.03 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 83 Y 7.98 4.47 0.00 2.77 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 84 G 6.29 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.46 4.88 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 0.96 0.00 0.00 1.15 0.00 0.00 86 W 9.51 5.24 0.00 3.28 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Q 8.79 4.95 0.00 1.66 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.63 0.00 88 H 9.01 4.85 0.00 3.15 2.99 0.00 5.57 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.46 5.32 0.00 2.79 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 90 Y 9.07 5.00 0.00 2.95 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 91 D 9.23 4.58 0.00 2.73 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 92 D 7.78 5.10 0.00 2.84 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 93 N 8.64 5.18 0.00 2.69 2.71 0.00 0.00 6.64 8.38 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 94 F 9.29 4.36 0.00 3.27 3.33 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 95 S 7.17 4.16 0.00 3.59 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 96 G 6.01 3.64 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 0.00 0.00 0.00 97 T 7.83 4.61 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 1.15 0.00 0.00 98 D 7.69 4.52 0.00 2.69 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 99 F 6.84 5.02 0.00 3.02 2.94 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 0.00 100 T 8.67 4.63 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 101 T 8.89 4.81 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 102 H 8.65 5.34 0.00 3.31 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 9.23 5.18 0.00 2.76 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 0.00 104 V 8.88 4.61 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 1.07 0.00 0.00 0.94 0.00 0.00 105 V 9.13 4.93 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 1.08 0.00 0.00 0.75 0.00 0.00 106 L 9.31 5.20 0.00 1.99 1.94 1.19 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.98 4.21 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 0.00 0.00 0.00 108 F 9.36 5.58 0.00 3.56 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.98 4.97 0.00 0.67 1.33 0.00 2.78 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.54 0.00 110 F 8.26 5.18 0.00 3.23 3.34 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 0.00 111 R 8.80 5.06 0.00 1.87 1.91 0.00 3.14 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.77 0.00 112 V 8.96 4.72 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 1.00 0.00 0.00 1.22 0.00 0.00 113 A 8.27 4.58 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 0.00 114 E 8.64 3.80 0.00 1.29 1.67 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 2.30 2.30 0.00 115 E 8.02 4.02 0.00 1.89 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 2.26 2.37 0.00 116 E 8.03 4.39 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 117 L 7.47 4.43 0.00 1.62 1.76 1.20 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.46 4.69 0.00 1.72 1.47 0.92 0.53 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 0.00 119 L 8.02 4.07 0.00 1.29 0.68 0.49 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.60 0.00 2.24 2.08 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 121 D 8.67 5.21 0.00 2.80 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 0.00 122 E 8.33 4.09 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 123 Q 8.00 4.51 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.91 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 124 H 7.84 5.21 0.00 2.42 2.55 0.00 5.80 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.27 4.82 0.00 2.59 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 0.00 126 D 6.92 4.65 0.00 2.72 2.35 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 0.00 127 Y 8.72 5.50 0.00 2.88 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 0.00 128 R 9.32 4.79 0.00 1.30 1.56 0.00 2.21 0.00 0.00 2.74 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 129 W 8.91 4.99 0.00 3.12 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 0.00 130 L 8.92 4.97 0.00 1.41 1.40 0.62 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 131 T 8.30 4.47 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 0.00 132 P 0.00 3.96 0.00 2.24 2.24 0.00 3.72 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 133 D 8.07 4.36 0.00 2.64 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 A 8.03 4.09 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 7.88 3.83 0.00 1.73 1.70 0.62 -0.57 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 0.00 136 L 7.82 3.97 0.00 1.82 1.77 1.05 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 137 A 7.45 4.35 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 0.00 138 S 7.27 4.65 0.00 3.74 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 0.00 139 E 8.78 4.28 0.00 2.18 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 2.31 2.39 0.00 140 N 8.14 4.61 0.00 2.98 3.19 0.00 0.00 6.44 8.97 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 0.00 141 V 7.54 4.70 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.90 0.00 0.00 142 H 9.09 4.12 0.00 3.35 3.20 0.00 5.66 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 8.29 3.89 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 0.00 144 N 8.28 4.12 0.00 2.75 2.42 0.00 0.00 6.87 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 0.00 145 S 7.20 3.99 0.00 3.56 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 0.00 146 R 7.91 4.02 0.00 1.78 1.96 0.00 3.12 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 147 V 7.22 3.59 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 0.72 0.00 0.00 0.27 0.00 0.00 148 Y 6.74 3.93 0.00 1.98 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 0.00 0.00 0.00 0.00 149 F 7.97 4.40 0.00 3.05 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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