NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8219 8.1676 115.8741 57.1196 40.2962 177.1110 11 H 4.0495 5.2900 117.9552 54.1489 28.8734 170.4332 12 E 4.3634 9.4612 122.8244 57.5341 30.0411 176.8357 13 M 4.5472 7.1455 114.4374 55.0482 32.4002 176.3783 14 R 4.5823 7.7315 116.6159 55.5377 32.6682 175.5447 15 E 4.1246 7.9656 117.3754 54.9250 30.3789 174.5403 16 P 4.3197 0.0000 0.0000 63.1001 32.2435 174.9930 17 R 4.1576 7.5508 114.6543 55.6152 33.0521 173.6576 18 I 4.3872 8.4376 121.4570 60.3141 38.3354 174.8965 19 E 4.4947 8.7674 129.2485 54.4503 31.3179 172.1076 20 K 4.4258 8.7374 131.8595 55.4313 34.1971 174.3797 21 V 4.7509 7.8104 119.8841 60.0573 34.5584 174.3010 22 V 4.3082 8.1942 129.2791 62.0263 32.7183 175.0912 23 V 4.9273 8.3068 123.1026 59.4300 33.0181 174.7064 24 H 5.0588 8.5481 124.9361 54.5459 33.4738 172.1169 25 M 4.5059 8.4494 124.3716 53.2265 33.1339 175.0441 26 G 4.1188 7.9214 111.9216 46.2654 0.0000 171.0824 27 I 4.1387 7.7030 126.2400 60.4508 39.5532 176.2989 28 G 4.0557 7.7468 111.2231 45.3908 0.0000 172.6658 29 H 4.5613 7.8377 116.6873 55.4396 30.1377 173.8937 *35 A 4.2180 7.0373 123.2051 52.0864 19.0537 176.3824 36 N 4.2293 8.8699 111.3594 56.4858 36.6109 176.6628 37 A 3.7350 8.0022 122.5798 54.7034 18.3359 178.8458 38 E 3.9191 8.5377 118.0360 60.2537 29.4652 179.3233 39 D 4.4469 7.5426 118.4932 57.5963 40.9101 179.7033 40 I 3.9047 7.5620 113.3540 63.9856 37.5885 178.1513 41 L 4.1289 7.8933 120.4684 57.5157 41.4668 179.4685 42 G 3.6392 8.4467 106.0360 47.8267 0.0000 175.4626 43 E 4.1083 7.6763 119.8869 58.7578 29.7600 178.6706 44 I 3.9700 8.3067 118.6058 63.0221 38.0606 176.6620 45 T 4.5790 7.7674 108.4480 64.4133 70.1540 174.9723 46 G 3.9611 7.3761 107.7161 44.4297 0.0000 173.4010 47 Q 4.5694 7.7074 115.4951 54.1400 31.6818 174.2943 48 M 3.8271 8.4845 118.6713 55.5345 32.5410 174.6331 49 P 4.8710 0.0000 0.0000 61.5943 33.6952 175.0476 50 V 4.4458 8.3124 120.3089 60.8210 34.2730 175.2839 51 R 4.3596 8.8043 126.0961 57.3911 31.2989 176.7357 52 T 4.4971 8.6274 117.7038 61.4055 70.2627 173.9615 53 K 5.3330 8.7859 124.6566 55.7345 33.2297 175.8371 54 A 4.8748 8.7142 122.8313 50.2407 21.9566 175.7666 55 K 4.5349 8.5032 118.0707 55.6725 34.7653 175.0612 56 R 4.1448 8.6049 123.5476 56.2667 29.6909 175.9234 57 T 4.6034 8.2190 116.8883 62.4299 70.0576 174.5371 58 V 4.5464 8.8027 124.8187 60.7881 35.0663 175.7961 59 G 3.8121 8.8719 112.5722 48.6932 0.0000 175.0997 60 E 4.2643 8.0854 118.8267 57.9493 28.2843 176.0708 61 F 4.1551 7.8472 113.3658 60.3658 38.8736 174.9296 62 D 4.9367 7.8769 117.4772 51.8366 40.2197 175.5784 63 I 4.3860 7.6491 114.3512 61.0293 39.4937 177.2912 64 R 3.8629 7.9111 121.7275 56.2070 29.4961 174.5786 65 E 3.9916 8.2081 129.2639 58.5655 29.2347 176.3699 66 G 3.8606 8.0747 109.9626 46.6071 0.0000 172.0772 67 D 4.5140 8.3114 121.0492 51.6597 42.3226 173.6777 68 P 4.5257 0.0000 0.0000 62.7129 31.7539 176.5457 69 I 4.5515 9.0169 124.0544 59.2498 40.4106 175.1905 70 G 4.4232 7.3869 110.0133 44.0478 0.0000 171.5824 71 A 5.8484 7.9162 120.8341 49.4744 23.3681 174.8814 72 K 4.9879 8.2653 116.6895 56.0175 36.9405 175.3938 73 V 4.6282 8.2921 120.0193 61.8395 35.0535 173.0231 74 T 4.6493 8.5250 118.6435 60.2078 70.1852 173.7658 75 L 4.7923 8.2900 126.1402 52.8212 44.3815 175.8656 76 R 4.8255 8.0431 120.6251 54.4789 34.1292 176.6182 77 D 4.3188 8.9176 120.4551 55.6917 39.3028 176.4348 78 E 3.9729 8.9427 124.4626 60.9541 28.5521 178.3150 79 M 4.1282 8.2557 117.8270 58.3471 31.8585 178.3660 80 A 4.2933 7.8964 120.5298 54.6252 18.9972 179.3389 81 E 3.9510 8.0062 116.6730 59.6366 29.6201 179.0409 82 E 4.0411 8.4310 118.1892 58.8614 29.8566 178.9496 83 F 4.4039 7.5170 117.3846 60.7098 39.9681 177.6474 84 L 4.2472 8.2865 118.1893 57.3489 41.0846 178.8913 85 Q 4.1349 8.0705 115.7415 56.7532 28.3258 176.3753 86 T 4.5478 7.5821 108.1882 61.2630 73.4905 175.9574 87 A 4.0090 7.8593 124.6074 55.0156 18.3851 179.0970 88 L 3.5432 7.9959 116.8435 57.8551 41.5484 177.9580 89 P 4.1744 0.0000 0.0000 65.3484 31.2192 177.5034 90 L 4.4576 7.6925 115.2547 53.7028 41.9527 176.0076 91 A 4.8528 7.8240 121.8223 50.4613 22.0547 175.2479 92 E 4.4287 8.3107 116.3675 58.5660 31.7633 176.6111 93 L 3.7411 6.8494 116.3620 52.7284 43.4340 175.7464 94 A 4.4921 8.5951 122.4735 52.5135 21.2199 174.5862 95 T 3.1737 8.8169 110.9559 62.8949 69.4613 173.7560 96 S 3.9078 8.7316 120.8732 60.3849 63.7100 173.2502 97 Q 4.5364 7.9651 118.9661 55.8774 28.5958 174.4918 98 F 5.0274 7.7244 114.4166 55.2068 41.2236 175.0254 99 D 4.6857 10.4023 122.8639 54.3880 41.6416 175.9654 100 D 4.7002 8.5417 119.8992 55.3370 41.2501 177.5218 101 T 4.5814 7.2643 113.0343 62.2816 68.9081 174.6217 102 G 3.9644 8.3599 108.8473 46.4758 0.0000 173.0560 103 N 5.3056 7.8249 115.8429 51.2086 41.9170 173.2917 104 F 4.8106 7.5259 109.5654 56.1473 41.2255 172.9501 105 S 5.0087 8.2171 116.2548 56.4116 64.7285 172.8562 106 F 4.9532 8.6925 120.8899 55.2771 41.5138 173.0184 107 G 4.2243 8.9447 102.1851 44.4976 0.0000 173.4576 *128 L 4.0070 8.4904 123.4356 55.1623 43.6872 176.2454 129 D 5.0335 8.6137 126.0587 52.8912 43.9089 176.2338 130 V 4.1434 8.0365 120.8996 61.8613 34.5427 173.9993 131 T 4.6922 8.4855 125.2124 61.6995 71.6285 174.2408 132 V 4.2721 7.6454 124.1187 61.0751 34.4286 173.7000 133 N 4.6360 8.6253 127.5579 52.5050 40.1131 173.6409 134 L 5.2922 8.2080 125.7967 53.2463 44.9772 175.7852 135 V 4.2694 7.8997 120.6920 61.3306 34.9121 171.7892 136 R 4.4294 8.0754 116.5355 54.7322 31.6154 176.9841 137 P 4.0997 0.0000 0.0000 65.3088 32.0105 177.1954 138 G 4.1589 7.8343 106.0689 46.0114 0.0000 175.5078 139 Y 4.2269 8.2004 122.9295 60.1983 39.0061 175.9641 140 R 4.0205 8.2893 119.3434 59.5808 29.9008 178.1808 141 V 3.5767 7.5408 116.1346 64.9631 31.1756 176.6585 142 A 4.8722 7.7935 119.2347 50.8416 19.4600 176.8556 143 K 4.3050 7.6657 115.8665 55.8478 34.0141 176.6525 144 R 4.3336 7.5733 115.2394 55.1882 30.9233 176.5213 145 D 4.4389 8.4831 117.4594 57.1304 40.9663 177.7218 146 K 4.0416 7.9406 118.4351 57.4370 32.7021 176.9345 147 A 3.6491 8.6892 123.9588 52.4370 16.3213 177.1266 148 S 4.5149 7.2134 112.9009 60.8365 63.9051 173.4803 149 R 4.6269 8.8647 119.9637 55.1934 33.8646 173.6758 150 S 4.5972 8.5011 118.8542 57.4739 63.4216 173.8781 151 I 3.8347 8.3213 128.0087 60.5924 37.4309 174.2795 152 P 4.3886 0.0000 0.0000 62.8241 32.0844 177.3075 153 T 3.9251 8.6964 111.4908 64.9257 68.8230 176.6078 154 K 3.9536 8.1110 120.3501 59.5631 32.1302 177.2082 155 H 4.5245 7.8837 115.2848 56.5429 29.8246 175.1336 156 R 4.2653 7.4488 117.1974 56.3399 30.4770 175.1876 157 L 4.5290 8.1609 120.6879 53.8677 43.6363 175.4920 158 N 4.7476 8.1571 123.1415 51.5989 41.2138 174.4700 159 P 4.3332 0.0000 0.0000 65.9821 31.4391 178.7301 160 A 3.8578 7.8971 118.7165 55.3662 18.6455 179.1482 161 D 4.4165 8.2325 116.1984 56.9476 40.8118 179.1197 162 A 4.2433 7.7141 121.0857 54.9121 18.9049 179.3526 163 V 3.1689 7.5531 116.5521 66.3168 31.3316 177.6128 164 A 3.9117 7.9266 120.0445 55.2639 17.9634 178.8692 165 F 4.1093 7.7303 116.5469 61.8533 39.6817 177.5495 166 I 3.5662 7.9227 118.6703 64.4024 36.8198 177.9326 167 E 4.5499 8.3243 120.2716 58.5642 29.3742 177.9112 168 S 4.5268 8.0946 111.9952 57.8753 64.5964 175.1084 169 T 4.7625 7.8043 113.2049 62.6175 70.5895 173.1880 170 Y 3.3905 7.9109 117.7312 57.8319 35.2208 168.9270 171 D 4.4214 6.8812 117.2509 54.1047 43.7948 175.4572 172 V 4.7379 7.9721 117.0280 61.2406 35.6862 178.3664 173 E 4.3523 9.0215 121.8605 56.7252 28.6948 177.3399 174 V 3.9566 7.6374 116.5152 63.9102 31.8420 175.0977 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 10 F 8.17 4.82 0.00 3.36 3.35 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 11 H 5.29 4.05 0.00 3.12 2.39 0.00 5.61 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 9.46 4.36 0.00 1.65 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 13 M 7.15 4.55 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 14 R 7.73 4.58 0.00 1.80 1.98 0.00 3.44 0.00 0.00 3.40 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 15 E 7.97 4.12 0.00 2.17 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 2.33 2.30 0.00 16 P 0.00 4.32 0.00 0.94 1.59 0.00 3.67 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 1.99 1.99 0.00 17 R 7.55 4.16 0.00 1.74 1.82 0.00 2.73 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.45 0.00 18 I 8.44 4.39 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.93 0.97 0.00 0.00 19 E 8.77 4.49 0.00 1.84 1.69 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 2.19 2.21 0.00 20 K 8.74 4.43 0.00 2.07 1.95 0.00 1.62 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.30 7.81 21 V 7.81 4.75 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 1.33 0.00 0.00 0.96 0.00 0.00 22 V 8.19 4.31 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 0.84 0.00 0.00 0.84 0.00 0.00 23 V 8.31 4.93 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 0.55 0.00 0.00 0.69 0.00 0.00 24 H 8.55 5.06 0.00 3.17 2.99 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.45 4.51 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 26 G 7.92 4.12 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 0.00 0.00 0.00 27 I 7.70 4.14 1.77 0.00 0.00 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 1.10 0.75 0.73 0.00 0.00 28 G 7.75 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 7.84 4.56 0.00 3.16 3.33 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 7.04 4.22 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.87 4.23 0.00 2.92 3.13 0.00 0.00 5.87 7.46 0.00 0.00 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 A 8.00 3.73 1.31 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 38 E 8.54 3.92 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 39 D 7.54 4.45 0.00 2.59 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 40 I 7.56 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 1.72 1.05 0.92 0.00 0.00 41 L 7.89 4.13 0.00 1.92 1.72 0.87 0.87 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 42 G 8.45 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 43 E 7.68 4.11 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 44 I 8.31 3.97 2.01 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.88 1.08 0.00 0.00 45 T 7.77 4.58 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 46 G 7.38 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 0.00 0.00 0.00 0.00 47 Q 7.71 4.57 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.63 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 48 M 8.48 3.83 0.00 2.01 2.07 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 2.61 2.60 0.00 49 P 0.00 4.87 0.00 1.90 1.94 0.00 3.60 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 50 V 8.31 4.45 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 1.05 0.00 0.00 0.91 0.00 0.00 51 R 8.80 4.36 0.00 1.72 1.85 0.00 3.35 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 52 T 8.63 4.50 4.36 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 1.20 0.00 0.00 53 K 8.79 5.33 0.00 1.63 1.74 0.00 1.72 0.00 0.00 2.36 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.28 7.81 54 A 8.71 4.87 1.24 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 55 K 8.50 4.53 0.00 1.62 1.71 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.43 7.81 56 R 8.60 4.14 0.00 1.98 2.00 0.00 3.20 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 57 T 8.22 4.60 4.26 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 0.00 0.00 0.00 1.24 0.00 0.00 58 V 8.80 4.55 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.94 0.00 0.00 59 G 8.87 3.81 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 0.00 0.00 0.00 60 E 8.09 4.26 0.00 2.14 2.08 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 2.31 2.34 0.00 61 F 7.85 4.16 0.00 3.03 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 62 D 7.88 4.94 0.00 2.93 2.55 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 63 I 7.65 4.39 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.85 1.06 0.00 0.00 64 R 7.91 3.86 0.00 1.77 2.05 0.00 3.20 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 65 E 8.21 3.99 0.00 2.02 1.80 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 2.29 2.32 0.00 66 G 8.07 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 67 D 8.31 4.51 0.00 2.64 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 68 P 0.00 4.53 0.00 1.94 2.03 0.00 3.62 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 2.01 2.11 0.00 69 I 9.02 4.55 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.08 0.94 0.00 0.00 70 G 7.39 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.92 5.85 1.14 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 72 K 8.27 4.99 0.00 1.75 1.87 0.00 1.44 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.38 7.81 73 V 8.29 4.63 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 0.90 0.00 0.00 0.86 0.00 0.00 74 T 8.53 4.65 4.19 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 1.15 0.00 0.00 75 L 8.29 4.79 0.00 1.49 1.52 0.55 0.57 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 R 8.04 4.83 0.00 1.63 1.78 0.00 3.33 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 77 D 8.92 4.32 0.00 2.88 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 0.00 0.00 0.00 0.00 78 E 8.94 3.97 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 79 M 8.26 4.13 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.58 0.00 80 A 7.90 4.29 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 81 E 8.01 3.95 0.00 2.16 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 2.45 2.63 0.00 82 E 8.43 4.04 0.00 2.01 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 0.00 2.36 2.51 0.00 83 F 7.52 4.40 0.00 3.30 3.26 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 0.00 0.00 0.00 0.00 84 L 8.29 4.25 0.00 1.95 1.81 1.10 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.07 4.13 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.19 2.47 0.00 86 T 7.58 4.55 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 87 A 7.86 4.01 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 88 L 8.00 3.54 0.00 1.71 1.67 0.96 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.17 0.00 1.98 2.12 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.19 0.00 90 L 7.69 4.46 0.00 1.81 1.73 0.93 0.65 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 91 A 7.82 4.85 0.77 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 0.00 0.00 92 E 8.31 4.43 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 93 L 6.85 3.74 0.00 1.72 1.85 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.60 4.49 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 95 T 8.82 3.17 4.26 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 0.00 0.00 0.00 1.12 0.00 0.00 96 S 8.73 3.91 0.00 4.24 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 0.00 97 Q 7.97 4.54 0.00 2.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.86 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 98 F 7.72 5.03 0.00 3.01 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 99 D 10.40 4.69 0.00 2.82 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 0.00 100 D 8.54 4.70 0.00 2.73 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 0.00 101 T 7.26 4.58 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 1.24 0.00 0.00 102 G 8.36 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 0.00 0.00 0.00 0.00 103 N 7.82 5.31 0.00 2.97 2.69 0.00 0.00 6.58 8.13 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 0.00 104 F 7.53 4.81 0.00 2.50 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 0.00 105 S 8.22 5.01 0.00 3.75 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 0.00 106 F 8.69 4.95 0.00 3.16 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 0.00 107 G 8.94 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *128 L 8.49 4.01 0.00 1.75 1.60 0.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.61 5.03 0.00 2.71 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.04 4.14 0.95 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 0.83 0.00 0.00 0.93 0.00 0.00 131 T 8.49 4.69 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 132 V 7.65 4.27 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 1.06 0.00 0.00 0.75 0.00 0.00 133 N 8.63 4.64 0.00 2.81 2.89 0.00 0.00 6.57 5.97 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 0.00 134 L 8.21 5.29 0.00 1.74 1.50 1.32 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.90 4.27 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 0.18 0.00 0.00 0.73 0.00 0.00 136 R 8.08 4.43 0.00 1.81 1.96 0.00 2.96 0.00 0.00 2.94 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.43 0.00 137 P 0.00 4.10 0.00 2.28 2.09 0.00 3.63 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 2.04 2.12 0.00 138 G 7.83 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 0.00 0.00 0.00 139 Y 8.20 4.23 0.00 3.19 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 0.00 140 R 8.29 4.02 0.00 1.93 1.95 0.00 3.24 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 141 V 7.54 3.58 2.17 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 0.85 0.00 0.00 0.95 0.00 0.00 142 A 7.79 4.87 1.03 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 0.00 0.00 143 K 7.67 4.30 0.00 1.62 1.76 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.83 1.44 7.81 144 R 7.57 4.33 0.00 1.89 1.92 0.00 3.09 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.60 0.00 145 D 8.48 4.44 0.00 2.67 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 0.00 146 K 7.94 4.04 0.00 1.80 1.71 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.69 3.65 1.28 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 0.00 0.00 148 S 7.21 4.51 0.00 3.84 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 0.00 149 R 8.86 4.63 0.00 1.83 1.72 0.00 3.12 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 150 S 8.50 4.60 0.00 3.91 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 0.00 151 I 8.32 3.83 1.97 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 1.40 1.13 1.04 0.00 0.00 152 P 0.00 4.39 0.00 2.21 2.01 0.00 3.66 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 153 T 8.70 3.93 4.26 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 0.00 0.00 0.00 1.23 0.00 0.00 154 K 8.11 3.95 0.00 1.79 1.95 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.51 7.81 155 H 7.88 4.52 0.00 3.05 3.36 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.45 4.27 0.00 2.07 1.89 0.00 3.42 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.75 0.00 157 L 8.16 4.53 0.00 1.66 1.73 0.89 0.56 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 0.00 158 N 8.16 4.75 0.00 3.02 2.72 0.00 0.00 6.61 7.91 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 0.00 159 P 0.00 4.33 0.00 2.16 2.25 0.00 3.62 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.46 0.00 160 A 7.90 3.86 1.28 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 0.00 0.00 161 D 8.23 4.42 0.00 2.83 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 0.00 162 A 7.71 4.24 1.60 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 0.00 0.00 163 V 7.55 3.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.24 0.00 0.00 164 A 7.93 3.91 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 0.00 165 F 7.73 4.11 0.00 3.09 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 0.00 166 I 7.92 3.57 1.87 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.93 0.90 0.00 0.00 167 E 8.32 4.55 0.00 1.89 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.18 0.00 168 S 8.09 4.53 0.00 3.86 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 0.00 169 T 7.80 4.76 4.19 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 1.15 0.00 0.00 170 Y 7.91 3.39 0.00 3.01 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 0.00 171 D 6.88 4.42 0.00 2.88 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 0.00 172 V 7.97 4.74 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.89 0.00 0.00 173 E 9.02 4.35 0.00 1.98 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.20 0.00 174 V 7.64 3.96 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 1.01 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.