NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 L 4.3124 8.1849 120.5745 54.1576 42.9927 176.1927 30 K 4.0398 8.4941 125.2860 55.6549 32.3503 175.8886 31 D 4.6204 9.1720 125.2736 54.5936 42.3354 176.9743 32 G 3.8258 7.4774 108.1284 44.5349 0.0000 170.5793 33 D 5.3137 7.5682 119.5863 52.6150 42.9589 175.8910 34 Y 4.8800 9.0479 120.4543 56.5010 42.3490 174.7136 35 T 5.3035 8.5598 118.4785 61.8651 73.1084 173.1942 36 V 5.0156 9.1257 124.4585 60.2183 35.3523 173.9638 37 E 5.2910 8.9615 122.1462 54.7980 33.6336 174.2981 38 T 4.6010 8.6047 114.5186 61.5987 69.2340 174.7082 39 A 4.3513 8.6499 126.8568 54.3071 18.9803 178.3155 40 K 4.5015 7.7870 111.7731 54.3551 35.6964 175.9232 41 A 4.0234 8.6275 124.4872 52.4408 18.9421 177.8150 42 D 4.6485 9.0392 122.8520 52.8114 40.3485 176.2169 43 D 4.2940 8.7717 117.4320 57.6804 40.9773 177.0274 44 H 4.6961 8.5505 113.0978 55.4606 29.1456 175.6364 45 G 3.7355 8.5566 109.0840 45.0196 0.0000 172.5383 46 Y 4.8696 8.5372 118.2046 56.4107 40.3227 175.4815 47 K 4.5663 8.4762 122.5007 54.8008 35.6656 174.6311 48 A 5.1491 8.1374 120.9905 50.8637 23.1548 175.2770 49 K 5.1402 8.8644 119.6476 54.8830 36.4795 174.8150 50 L 5.5037 9.5664 128.2004 53.5765 45.4122 175.1792 51 S 5.4944 9.3252 121.7329 56.7661 66.8733 173.0853 52 I 5.1892 8.9310 115.7466 59.0770 41.6194 173.7856 53 K 4.9469 9.0468 124.7135 54.7918 34.8310 174.6846 54 V 4.8259 9.1910 127.9697 61.4364 33.9159 174.7233 55 S 4.7222 8.8811 122.7089 57.5094 64.4465 173.1124 56 D 4.3741 10.5213 130.6412 55.5792 37.6999 176.7724 57 G 4.0200 8.4923 107.2734 45.2948 0.0000 174.0981 58 K 4.5465 7.2946 118.9385 54.0151 34.1253 175.6928 59 I 4.0446 8.6270 124.0582 62.3948 37.1681 175.4043 60 T 4.5200 9.1276 120.7690 62.7797 68.9818 174.0707 61 E 4.9688 8.0007 118.4623 55.1212 34.5087 174.1146 62 A 5.0982 8.2988 121.7253 50.9142 22.5936 175.7155 63 K 4.8110 9.5013 123.4897 54.8959 35.3364 174.1422 64 Y 5.4896 9.6029 129.3378 56.0597 41.5046 174.8121 65 N 5.0546 8.4636 123.2978 52.1330 43.1056 173.4879 66 E 4.8252 9.2264 124.8849 55.7293 31.0586 175.9949 67 F 5.1666 8.6208 116.8260 55.3196 41.9414 172.9954 68 N 4.1859 9.2974 120.6253 54.0823 39.1417 175.5296 69 G 3.5555 9.0747 114.7764 49.9056 0.0000 174.8736 70 E 4.2525 8.3588 119.1312 59.1787 29.8030 178.3101 71 T 4.0108 9.4233 107.5453 62.2074 69.3249 175.0645 72 N 4.7042 8.7234 118.9196 54.0650 39.0726 175.3880 73 A 4.4900 7.3341 125.7040 51.6064 17.8928 180.7919 *75 K 3.9156 8.7065 114.7380 57.8298 33.6617 177.6021 76 R 4.0727 7.8207 112.5094 57.4442 29.7830 176.5030 77 E 4.2765 7.8383 116.7594 56.5238 30.3479 176.1835 78 D 4.5364 7.7231 119.4942 53.0461 40.9403 176.0911 79 K 3.8613 8.5605 127.9060 59.7511 32.2608 177.8181 80 D 4.3718 8.1796 118.3216 57.5006 40.5929 177.9694 81 Y 3.9355 7.9070 118.1585 60.8824 38.8871 177.6386 82 N 4.5564 8.3420 116.0548 56.3600 38.9843 176.9221 83 E 4.1555 8.5541 120.2284 59.3701 29.6219 179.5935 84 K 3.6842 8.0718 115.1356 58.3866 32.1598 178.5499 *86 T 4.3788 7.8663 118.0486 63.6795 70.4959 176.6088 87 G 3.5471 7.9730 109.1975 48.5850 0.0000 175.2145 88 V 3.8736 7.7863 112.9064 62.4376 31.8821 177.1670 89 S 4.5505 8.2608 110.9288 57.6059 63.9625 174.6696 90 G 4.0337 9.6327 109.6650 45.4688 0.0000 173.4477 91 I 4.5122 6.9904 117.4312 59.6973 41.2821 173.4815 92 G 4.3343 8.3147 113.7504 42.3801 0.0000 171.7880 93 P 2.9700 0.0000 0.0000 65.1850 30.7702 178.7231 94 A 3.9954 7.7758 117.7442 54.0823 18.4031 178.2357 95 E 4.3950 8.1899 117.1004 58.0872 30.8762 177.8552 96 Y 4.2516 7.4159 117.0257 59.4979 38.3854 177.6268 97 E 4.2592 7.8828 120.7483 59.2145 29.6238 177.6116 98 P 4.6396 0.0000 0.0000 64.9762 31.3736 178.7717 99 Q 4.0241 7.8087 117.3026 58.5918 28.6362 178.6237 100 L 3.5273 8.0276 120.3067 57.5661 41.1837 178.8792 101 E 4.0657 8.0134 118.4566 59.8242 29.6297 179.6521 102 K 3.9281 8.4513 118.1006 59.6610 32.1946 179.2841 103 A 4.0905 8.1710 120.4541 54.4451 18.0965 179.3984 104 L 4.0629 7.9170 119.3230 58.2519 42.1001 178.9210 105 I 3.8254 7.4746 118.4606 63.4608 37.0635 177.4336 106 E 4.2223 7.7055 119.3018 58.7092 29.6387 178.1188 107 K 4.0848 8.1804 118.4587 57.2371 31.8884 178.5404 108 Q 3.7265 8.3988 115.4522 56.2193 27.1093 172.9149 109 S 4.7479 7.5774 110.9518 56.1738 66.1438 174.5257 110 S 4.1465 8.6005 115.2746 60.6381 62.7628 174.5294 111 D 4.5877 7.7343 121.9644 52.5516 39.3127 174.9781 112 I 4.5371 7.5933 116.7927 58.1473 40.5042 175.6712 113 D 4.5782 8.3046 120.9973 53.6207 41.4407 177.3616 114 V 3.7058 8.1678 116.5765 61.5349 32.4258 175.6125 115 I 4.1958 8.3236 123.9077 59.8366 37.8105 175.8720 116 T 3.9023 8.4659 122.0821 65.6429 68.6332 174.0090 117 G 3.9937 9.3835 114.1697 45.1619 0.0000 173.0937 118 A 4.5757 8.0889 121.6837 50.9465 19.1651 177.1285 119 T 3.7828 7.7235 123.0081 66.5760 69.1745 176.5993 120 S 4.0959 8.0764 116.4729 62.2871 62.9087 177.1929 121 S 4.1926 7.8166 116.6715 61.4998 62.4366 176.9684 122 S 4.0251 7.8921 118.0399 61.5209 62.5852 176.4252 123 N 4.3084 8.5214 119.5395 56.4700 38.4308 177.1927 124 Q 4.0220 8.2712 121.0108 59.1793 28.9991 178.2851 125 F 3.8446 8.2801 121.5825 61.0095 39.3637 177.1194 126 K 3.8724 8.2522 118.2804 59.5449 31.9272 179.0019 127 K 3.8178 7.9381 118.4152 59.9026 32.0656 179.2663 128 L 3.9710 7.8574 118.3100 57.6322 41.5526 179.7881 129 A 3.6997 7.7277 120.9469 54.9330 18.3006 179.2487 130 E 3.8164 8.1058 117.1943 59.6931 29.6265 179.6544 131 K 3.9105 8.0308 119.5711 59.3900 32.0145 178.9014 132 V 3.7972 7.5824 118.1004 63.8512 31.7204 178.0486 133 L 4.0161 7.6860 120.0495 57.2071 41.5219 178.5830 134 K 3.8034 8.0153 119.5645 59.9305 32.1437 178.2727 135 N 4.1808 8.1861 116.1895 56.5513 38.4638 177.1630 136 A 2.7032 7.3016 121.9236 54.2780 18.1332 179.5631 137 E 3.8698 7.8812 116.9590 59.5587 29.6329 178.9843 138 E 4.2076 8.0452 117.0840 57.1108 29.6787 177.7327 139 G 3.9222 7.9891 105.7534 45.6669 0.0000 173.0698 140 K 4.1542 8.1134 121.5900 56.2701 31.6056 176.6586 141 T 4.3336 8.4849 116.2150 61.2102 69.4635 174.2513 142 E 4.3555 7.8299 120.3263 54.7547 31.1039 175.6508 143 A 4.3600 8.6406 123.5711 53.1934 18.9017 176.7544 144 T 4.7060 8.6116 112.2705 59.8778 71.9564 173.8203 145 L 4.9839 8.4434 122.9658 54.3013 43.7265 176.3586 146 V 4.3666 8.3891 120.3240 61.4843 34.7331 173.4475 147 D 5.0495 8.8414 127.8275 53.2476 41.7383 175.7937 148 L 4.6185 8.6500 126.1501 55.6352 44.3539 176.9392 149 E 4.1819 8.1939 118.3412 56.0648 29.6451 181.2770 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 29 L 8.18 4.31 0.00 1.65 1.68 0.84 0.64 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 30 K 8.49 4.04 0.00 1.92 1.87 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.67 7.81 31 D 9.17 4.62 0.00 2.58 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.48 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 33 D 7.57 5.31 0.00 2.37 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.05 4.88 0.00 2.85 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 35 T 8.56 5.30 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 1.25 0.00 0.00 36 V 9.13 5.02 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 0.76 0.00 0.00 1.03 0.00 0.00 37 E 8.96 5.29 0.00 2.13 1.83 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 2.30 2.60 0.00 38 T 8.60 4.60 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 39 A 8.65 4.35 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 40 K 7.79 4.50 0.00 1.80 1.73 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.32 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.40 7.81 41 A 8.63 4.02 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 42 D 9.04 4.65 0.00 2.85 2.91 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 43 D 8.77 4.29 0.00 2.61 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.55 4.70 0.00 3.52 3.57 0.00 5.74 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 45 G 8.56 3.74 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 0.00 0.00 0.00 46 Y 8.54 4.87 0.00 2.99 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 47 K 8.48 4.57 0.00 0.79 1.24 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.19 1.08 7.81 48 A 8.14 5.15 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 49 K 8.86 5.14 0.00 2.16 1.72 0.00 1.49 0.00 0.00 1.49 0.00 0.00 2.77 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.56 7.81 50 L 9.57 5.50 0.00 1.90 1.50 1.13 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 51 S 9.33 5.49 0.00 3.82 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 52 I 8.93 5.19 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.12 0.96 0.00 0.00 53 K 9.05 4.95 0.00 1.91 1.71 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.52 7.81 54 V 9.19 4.83 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.02 0.00 0.00 55 S 8.88 4.72 0.00 3.87 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 56 D 10.52 4.37 0.00 2.91 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 57 G 8.49 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 0.00 0.00 0.00 58 K 7.29 4.55 0.00 1.84 1.71 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.57 7.81 59 I 8.63 4.04 1.97 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 1.31 0.59 0.96 0.00 0.00 60 T 9.13 4.52 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 1.27 0.00 0.00 61 E 8.00 4.97 0.00 1.94 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 2.32 2.34 0.00 62 A 8.30 5.10 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 63 K 9.50 4.81 0.00 1.88 1.69 0.00 1.49 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.45 7.81 64 Y 9.60 5.49 0.00 3.29 3.02 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 65 N 8.46 5.05 0.00 2.62 2.66 0.00 0.00 6.70 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 66 E 9.23 4.83 0.00 1.74 1.75 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 2.22 2.06 0.00 67 F 8.62 5.17 0.00 3.25 3.05 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 68 N 9.30 4.19 0.00 2.69 2.77 0.00 0.00 7.15 7.50 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 69 G 9.07 3.56 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 0.00 0.00 0.00 70 E 8.36 4.25 0.00 1.93 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 2.27 2.21 0.00 71 T 9.42 4.01 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 72 N 8.72 4.70 0.00 2.90 2.98 0.00 0.00 7.14 7.76 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 73 A 7.33 4.49 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 *75 K 8.71 3.92 0.00 1.70 1.54 0.00 0.97 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 76 R 7.82 4.07 0.00 1.84 2.04 0.00 3.27 0.00 0.00 3.38 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 77 E 7.84 4.28 0.00 1.96 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 2.21 2.24 0.00 78 D 7.72 4.54 0.00 2.73 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 79 K 8.56 3.86 0.00 1.87 1.82 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.56 7.81 80 D 8.18 4.37 0.00 2.79 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 81 Y 7.91 3.94 0.00 3.16 3.10 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 0.00 82 N 8.34 4.56 0.00 2.95 2.88 0.00 0.00 7.14 8.46 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 83 E 8.55 4.16 0.00 2.12 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 2.33 2.36 0.00 84 K 8.07 3.68 0.00 1.70 1.70 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.67 7.81 *86 T 7.87 4.38 4.45 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 1.21 0.00 0.00 87 G 7.97 3.55 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 0.00 88 V 7.79 3.87 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 0.72 0.00 0.00 0.89 0.00 0.00 89 S 8.26 4.55 0.00 4.05 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 90 G 9.63 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 0.00 0.00 0.00 0.00 91 I 6.99 4.51 1.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.95 1.01 0.00 0.00 92 G 8.31 4.33 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 0.00 93 P 0.00 2.97 0.00 1.80 1.74 0.00 3.97 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.00 0.00 94 A 7.78 4.00 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 95 E 8.19 4.39 0.00 2.11 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 0.00 2.23 2.25 0.00 96 Y 7.42 4.25 0.00 3.13 3.22 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 97 E 7.88 4.26 0.00 2.12 2.33 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 2.65 2.25 0.00 98 P 0.00 4.64 0.00 2.15 2.10 0.00 3.95 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.03 0.00 99 Q 7.81 4.02 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 100 L 8.03 3.53 0.00 1.15 0.13 0.59 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.01 4.07 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.80 0.00 102 K 8.45 3.93 0.00 1.88 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.48 7.81 103 A 8.17 4.09 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 4.06 0.00 2.21 2.00 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.47 3.83 2.02 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 1.60 0.71 0.94 0.00 0.00 106 E 7.71 4.22 0.00 1.98 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 2.29 2.39 0.00 107 K 8.18 4.08 0.00 1.98 1.85 0.00 1.98 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.73 7.81 108 Q 8.40 3.73 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.71 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 109 S 7.58 4.75 0.00 3.91 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 0.00 110 S 8.60 4.15 0.00 4.01 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 0.00 111 D 7.73 4.59 0.00 2.65 2.64 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 0.00 112 I 7.59 4.54 1.88 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 1.59 0.77 1.07 0.00 0.00 113 D 8.30 4.58 0.00 2.68 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.17 3.71 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 0.68 0.00 0.00 0.90 0.00 0.00 115 I 8.32 4.20 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.70 0.91 0.00 0.00 116 T 8.47 3.90 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 1.20 0.00 0.00 117 G 9.38 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 0.00 118 A 8.09 4.58 0.70 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 0.00 119 T 7.72 3.78 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 120 S 8.08 4.10 0.00 3.82 3.93 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 0.00 121 S 7.82 4.19 0.00 3.18 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 0.00 122 S 7.89 4.03 0.00 4.00 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 0.00 123 N 8.52 4.31 0.00 2.86 2.87 0.00 0.00 6.70 7.27 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 0.00 124 Q 8.27 4.02 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 125 F 8.28 3.84 0.00 2.89 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 0.00 126 K 8.25 3.87 0.00 2.01 1.85 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.86 7.81 127 K 7.94 3.82 0.00 1.97 1.86 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.68 7.81 128 L 7.86 3.97 0.00 1.70 1.67 1.13 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.73 3.70 1.04 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 0.00 0.00 130 E 8.11 3.82 0.00 2.14 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 0.00 2.30 2.44 0.00 131 K 8.03 3.91 0.00 1.85 1.78 0.00 1.49 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.49 7.81 132 V 7.58 3.80 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 0.83 0.00 0.00 0.98 0.00 0.00 133 L 7.69 4.02 0.00 1.88 1.66 0.87 0.38 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 0.00 134 K 8.02 3.80 0.00 1.95 1.77 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 135 N 8.19 4.18 0.00 2.98 3.10 0.00 0.00 7.04 7.28 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 0.00 136 A 7.30 2.70 0.64 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 0.00 137 E 7.88 3.87 0.00 2.06 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 0.00 2.28 2.44 0.00 138 E 8.05 4.21 0.00 1.95 2.02 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 2.30 2.49 0.00 139 G 7.99 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 0.00 140 K 8.11 4.15 0.00 1.80 1.85 0.00 1.81 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.50 1.41 7.81 141 T 8.48 4.33 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 0.96 0.00 0.00 142 E 7.83 4.36 0.00 2.10 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 2.25 2.25 0.00 143 A 8.64 4.36 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 0.00 144 T 8.61 4.71 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 1.29 0.00 0.00 145 L 8.44 4.98 0.00 1.57 1.65 0.94 0.85 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 0.00 146 V 8.39 4.37 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 0.94 0.00 0.00 0.94 0.00 0.00 147 D 8.84 5.05 0.00 2.71 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 0.00 148 L 8.65 4.62 0.00 1.65 1.67 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 149 E 8.19 4.18 0.00 1.99 1.72 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 2.23 1.87 0.00 * Residues marked with a * may have inaccurate shift predictions.