NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.2804 8.2649 123.5855 51.9502 20.0606 176.1186 5 I 4.1943 8.1843 122.3688 59.1692 39.6048 172.7520 6 K 4.7031 8.5763 127.0146 54.2325 34.7474 175.7618 7 V 4.1518 9.0836 124.8308 62.5152 34.6344 175.3226 8 G 2.4312 8.2000 112.1343 43.5941 0.0000 172.5603 9 A 3.8499 7.7793 121.3531 50.9377 19.9250 176.9401 10 W 4.0948 9.8459 120.6006 54.2877 31.1760 175.5359 11 G 3.4873 6.8360 110.1736 44.6630 0.0000 171.3991 12 G 4.1373 7.9847 113.1059 43.6938 0.0000 172.7331 13 N 4.7230 8.4867 114.8224 52.7684 39.3727 175.2530 14 G 3.7275 7.8773 107.9422 45.6595 0.0000 173.8809 15 G 3.9337 8.3888 108.7617 44.8284 0.0000 172.5655 16 S 4.9368 8.4575 113.9219 56.4199 65.2953 174.2908 17 A 4.6702 8.6390 125.6585 52.0704 18.8972 176.7643 18 F 5.0862 8.7834 116.9141 55.3226 41.8268 174.3300 19 D 5.0284 8.6517 119.9067 54.1672 42.5072 174.7874 20 M 4.2783 9.3893 124.7870 55.3990 32.0200 177.5255 21 G 3.5276 8.1841 108.4381 43.7089 0.0000 170.8630 22 P 4.2038 0.0000 0.0000 62.0689 32.0405 175.4528 23 A 4.9921 8.5050 123.4613 50.3544 21.6265 176.2954 24 Y 4.3620 8.7713 121.0613 60.7982 39.6443 176.5893 25 R 4.4640 7.7675 117.3368 55.3100 33.7262 173.8663 26 I 4.4086 8.6024 128.1211 61.7336 37.5530 175.8325 27 I 4.2212 9.3556 129.4308 63.7197 38.1743 176.0565 28 S 5.0417 7.7733 114.2937 57.1206 66.5508 173.0089 29 V 4.5934 8.7908 121.5703 61.0621 34.3867 173.9457 30 K 4.6372 9.2767 130.2339 54.8755 34.0436 174.7939 31 I 4.7785 7.9422 129.3256 59.7959 39.1156 174.8249 32 F 5.0400 9.2324 127.7001 56.3872 40.3362 175.4248 33 S 5.2911 8.5795 117.5837 56.9322 66.7976 175.6588 34 G 4.2675 9.4208 107.9649 46.6807 0.0000 174.8821 35 D 4.5754 9.5186 127.0891 56.5919 42.1018 175.6549 36 V 4.5546 7.1200 115.9684 60.5030 36.1094 175.0317 37 V 4.1227 8.4123 124.0381 62.7167 31.0809 176.3518 38 D 4.8454 9.3332 128.9472 57.2435 42.1039 176.2167 39 A 4.4951 7.6345 117.5321 51.7225 22.7434 175.1608 40 V 4.8856 8.3987 118.3649 61.6671 34.9885 173.4531 41 D 5.1415 9.3482 127.7753 52.5980 43.2476 175.3117 42 V 4.7843 8.3999 123.6287 61.4648 34.1362 174.1563 43 T 5.2231 8.7970 125.1705 62.0689 71.0584 173.6364 44 F 5.4283 8.6166 119.6642 56.4720 42.0521 172.7502 45 T 5.1400 8.8449 109.6855 60.7367 71.6415 173.7417 46 Y 4.7827 9.7221 125.4702 57.0458 41.6163 174.2540 47 Y 3.3026 8.9360 127.4998 58.8978 35.6139 172.3217 48 G 3.9433 8.4159 105.7698 44.9193 0.0000 173.4970 49 K 4.7196 8.2566 119.5304 54.7298 35.2492 174.9058 50 T 4.9377 8.3960 117.4418 60.4848 69.2592 173.2032 51 E 4.6445 8.8386 127.2858 54.7235 34.0392 174.6558 52 T 4.9941 8.2155 117.6350 61.8428 72.1608 173.5353 53 R 4.4904 8.8690 124.0668 54.4816 33.8306 173.8423 54 H 4.9922 8.2954 122.6365 53.6990 31.4641 173.6301 55 F 4.6232 8.3938 124.7742 56.8621 41.3755 174.4221 56 G 3.7340 9.0842 109.3822 44.2319 0.0000 170.8959 57 G 4.3075 8.3847 110.0417 43.4351 0.0000 173.2946 58 S 4.2915 8.3758 113.2603 57.7763 63.4800 174.2261 59 G 3.8931 7.1451 109.9874 44.9948 0.0000 173.9619 60 G 4.1337 8.8416 104.3115 45.5610 0.0000 172.5547 61 T 4.6935 8.6287 115.9125 61.0653 70.4250 172.9329 62 P 4.2782 0.0000 0.0000 62.5789 32.8141 175.4558 63 H 4.5354 8.4057 118.9987 53.8570 31.8983 172.5127 64 E 4.3638 8.6506 123.8947 55.9976 30.4312 176.6210 65 I 3.7531 8.7798 126.5566 59.7865 38.4640 174.6772 66 V 4.4126 8.0183 127.6824 61.1507 32.7796 174.9569 67 L 4.3886 8.4240 128.7433 54.1620 42.7839 177.4387 68 Q 4.2581 9.0189 126.1833 55.1035 30.5805 175.2600 *69 E 4.1693 8.7173 114.8689 57.9020 29.7133 172.6671 70 G 3.7530 8.4543 112.0390 45.1999 0.0000 172.1279 71 E 4.5474 7.3673 118.8127 54.2579 31.2815 174.5283 72 Y 5.0598 9.3968 122.6123 55.9830 43.1400 174.5670 73 L 4.6296 8.6746 121.3068 54.7786 42.8348 177.5360 74 V 4.5395 8.9852 116.9253 60.6337 33.6663 175.4211 75 G 4.6039 7.8379 105.8399 46.4450 0.0000 172.4068 76 M 5.1091 8.7739 124.1674 54.3183 36.0887 174.5982 77 K 4.1020 8.0759 127.1543 54.2798 36.9830 174.1746 78 G 3.4665 5.8399 105.2965 46.6845 0.0000 171.8749 79 E 5.4881 8.5132 118.8095 54.5904 34.3042 174.8259 80 F 5.5188 8.4187 117.8863 55.5130 41.4972 174.2137 81 G 4.2975 8.7424 106.3916 45.4357 0.0000 171.8242 82 N 5.0714 8.9338 119.4806 53.7119 39.4707 173.7938 83 Y 4.5137 9.1097 128.1023 56.4209 39.8080 174.8826 84 H 3.8409 9.4709 127.5330 57.1855 26.4705 175.8033 85 G 4.1354 8.2348 106.1562 45.1381 0.0000 174.4662 86 V 4.4937 7.8187 119.8453 60.8164 34.9418 174.8381 87 V 4.4255 8.5995 127.3808 63.1390 32.1717 174.8758 88 V 4.8406 8.7577 120.8891 59.0129 36.6288 175.4921 89 V 4.2693 8.7927 122.4178 63.4403 31.4363 176.6626 90 G 3.8864 9.3984 117.2073 47.1647 0.0000 172.7814 91 K 5.1738 7.9183 118.6482 54.6750 36.7982 175.2736 92 L 4.9876 9.1940 125.1998 53.7939 46.0786 174.9447 93 G 4.3928 8.8926 111.5242 45.1693 0.0000 171.4560 94 F 5.7490 9.0862 118.5451 55.6132 43.9009 174.0129 95 S 5.3452 9.2896 115.1256 57.1417 65.1534 173.7158 96 T 5.4925 9.3699 113.2393 59.3973 71.3328 174.7863 97 N 4.4741 8.9823 117.6063 54.9104 37.7508 175.8788 98 K 4.3058 7.3877 117.8135 57.7070 33.4710 175.9591 99 K 4.3681 7.9963 116.1856 56.2137 35.4838 174.0522 100 S 5.1489 8.0579 112.9775 56.5738 65.4667 172.9419 101 Y 4.7116 8.8614 118.9987 57.2175 41.6974 176.0796 102 G 2.6156 8.3750 111.1972 45.5864 0.0000 172.0997 103 P 4.0871 0.0000 0.0000 61.8067 32.3937 175.1732 104 F 4.8550 9.0154 119.7006 56.8299 41.1363 175.8610 105 G 4.5853 8.8228 111.0118 45.8294 0.0000 173.1538 106 N 4.8587 8.4012 116.7609 52.6855 39.6391 174.5620 107 T 4.3878 7.6342 116.4731 61.4710 69.6825 174.4654 108 G 4.2252 8.5636 115.7420 45.1891 0.0000 172.8338 109 G 3.8585 7.7167 106.7166 45.8194 0.0000 173.4162 110 T 3.9392 7.5553 120.4131 62.7217 69.0858 172.9817 111 P 5.0029 0.0000 0.0000 62.6631 32.6913 175.5366 112 F 5.1583 8.5129 115.4876 55.5473 41.7448 173.4909 113 S 4.4916 8.2817 113.8243 57.0487 66.0386 173.7704 114 L 4.7606 9.3609 126.9440 52.3225 42.4653 172.2486 115 P 4.6712 0.0000 0.0000 62.0597 32.7776 176.3346 116 I 4.3453 8.2750 124.2920 59.5457 37.5837 175.4098 117 A 4.1055 8.7602 131.0176 54.3703 18.6770 177.7416 118 A 4.5161 7.8169 116.5971 51.7946 22.1414 175.4549 119 G 3.8520 9.9722 107.7331 44.3550 0.0000 172.0802 120 K 4.7932 8.3700 115.8213 55.5046 36.3786 175.3085 121 I 4.6062 8.8678 123.5220 61.3181 37.4008 176.2287 122 S 4.6114 9.4657 120.9063 57.2434 64.6063 173.7712 123 G 4.0495 6.6397 107.9508 46.4121 0.0000 171.2318 124 F 6.0140 8.1338 117.1729 56.1062 43.8441 174.0487 125 F 4.9662 8.4777 114.3054 55.1575 41.4946 174.3679 126 G 3.3644 6.3608 106.1692 45.7950 0.0000 171.6418 127 R 5.1156 7.8189 121.0658 54.7305 34.7986 174.7626 128 G 4.7014 9.3183 108.2957 44.9048 0.0000 173.0979 129 G 4.7210 9.3550 109.5151 46.4372 0.0000 174.9391 130 D 4.5243 9.2798 129.3252 53.6105 40.3343 175.5285 131 F 5.3526 7.4976 117.7265 55.5436 42.8642 173.6068 132 I 4.4713 8.5201 122.3739 60.3411 37.4800 175.7488 133 D 4.6302 8.9471 130.4276 57.2324 42.0660 176.3445 134 A 4.8898 8.2029 117.5820 50.9074 23.2096 175.3515 135 I 4.9184 8.5019 119.9880 59.5077 42.3546 174.3328 136 G 3.9018 8.8282 114.3482 44.9320 0.0000 171.3438 137 V 5.1840 9.0922 118.2713 60.3952 35.1860 173.8868 138 Y 4.7930 9.1709 121.6745 57.3069 39.4825 174.3683 139 L 5.2605 8.9810 123.7944 52.9525 44.5105 175.5319 140 E 4.7737 8.7623 123.2354 53.3971 33.3337 174.1930 141 P 4.4016 0.0000 0.0000 62.8637 31.4787 176.5295 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 4 A 8.26 4.28 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 5 I 8.18 4.19 2.07 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 1.34 0.53 0.90 0.00 0.00 6 K 8.58 4.70 0.00 1.09 0.82 0.00 1.06 0.00 0.00 1.09 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.66 7.81 7 V 9.08 4.15 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 1.37 0.00 0.00 0.97 0.00 0.00 8 G 8.20 2.43 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 0.00 9 A 7.78 3.85 0.74 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 10 W 9.85 4.09 0.00 2.19 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 0.00 0.00 0.00 0.00 11 G 6.84 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 0.00 0.00 0.00 12 G 7.98 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 13 N 8.49 4.72 0.00 2.69 2.81 0.00 0.00 6.77 7.65 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 14 G 7.88 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 15 G 8.39 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 0.00 0.00 0.00 16 S 8.46 4.94 0.00 3.85 3.82 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 17 A 8.64 4.67 1.20 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 0.00 0.00 0.00 18 F 8.78 5.09 0.00 2.81 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 19 D 8.65 5.03 0.00 2.73 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 20 M 9.39 4.28 0.00 2.83 2.30 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 3.03 0.00 21 G 8.18 3.53 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 0.00 0.00 0.00 22 P 0.00 4.20 0.00 2.15 1.89 0.00 3.54 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.91 0.00 23 A 8.51 4.99 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 24 Y 8.77 4.36 0.00 2.79 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 25 R 7.77 4.46 0.00 1.81 1.81 0.00 3.27 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 26 I 8.60 4.41 1.96 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.99 1.02 0.00 0.00 27 I 9.36 4.22 2.02 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 1.35 0.86 0.92 0.00 0.00 28 S 7.77 5.04 0.00 3.86 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 29 V 8.79 4.59 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 0.57 0.00 0.00 0.79 0.00 0.00 30 K 9.28 4.64 0.00 1.71 1.64 0.00 1.87 0.00 0.00 1.22 0.00 0.00 2.73 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.73 1.09 7.81 31 I 7.94 4.78 1.42 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 1.02 0.00 0.00 32 F 9.23 5.04 0.00 3.03 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 33 S 8.58 5.29 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 34 G 9.42 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 35 D 9.52 4.58 0.00 2.41 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 36 V 7.12 4.55 1.02 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 0.59 0.00 0.00 -0.17 0.00 0.00 37 V 8.41 4.12 2.27 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 1.09 0.00 0.00 1.10 0.00 0.00 38 D 9.33 4.85 0.00 3.08 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 39 A 7.63 4.50 1.20 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 0.00 0.00 0.00 40 V 8.40 4.89 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 0.90 0.00 0.00 1.00 0.00 0.00 41 D 9.35 5.14 0.00 2.65 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 42 V 8.40 4.78 2.26 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 1.27 0.00 0.00 0.78 0.00 0.00 43 T 8.80 5.22 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 1.21 0.00 0.00 44 F 8.62 5.43 0.00 3.28 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 45 T 8.84 5.14 4.37 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 46 Y 9.72 4.78 0.00 3.31 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 47 Y 8.94 3.30 0.00 2.84 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 48 G 8.42 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 49 K 8.26 4.72 0.00 1.98 1.83 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.43 7.81 50 T 8.40 4.94 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 1.20 0.00 0.00 51 E 8.84 4.64 0.00 1.16 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 2.01 2.18 0.00 52 T 8.22 4.99 4.15 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 0.00 0.00 1.19 0.00 0.00 53 R 8.87 4.49 0.00 1.33 1.08 0.00 3.41 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.98 0.00 54 H 8.30 4.99 0.00 2.98 3.02 0.00 5.69 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.39 4.62 0.00 2.42 1.47 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 56 G 9.08 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 57 G 8.38 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 58 S 8.38 4.29 0.00 3.85 3.78 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 59 G 7.15 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 60 G 8.84 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 0.00 0.00 0.00 0.00 61 T 8.63 4.69 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 1.10 0.00 0.00 62 P 0.00 4.28 0.00 1.42 0.49 0.00 3.54 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 1.70 1.73 0.00 63 H 8.41 4.54 0.00 1.91 2.68 0.00 5.61 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.65 4.36 0.00 1.75 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 2.15 2.18 0.00 65 I 8.78 3.75 1.51 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 -0.00 0.39 0.26 0.00 0.00 66 V 8.02 4.41 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 0.77 0.00 0.00 0.91 0.00 0.00 67 L 8.42 4.39 0.00 1.56 1.54 0.99 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 9.02 4.26 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.96 0.00 0.00 0.00 0.00 0.00 2.62 2.45 0.00 *69 E 8.72 4.17 0.00 1.98 1.77 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 2.23 1.89 0.00 70 G 8.45 3.75 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 0.00 0.00 0.00 71 E 7.37 4.55 0.00 1.87 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 2.25 2.37 0.00 72 Y 9.40 5.06 0.00 2.96 2.72 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 73 L 8.67 4.63 0.00 1.72 1.80 0.92 0.85 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 74 V 8.99 4.54 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 0.95 0.00 0.00 1.10 0.00 0.00 75 G 7.84 4.60 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 0.00 76 M 8.77 5.11 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 2.24 0.00 77 K 8.08 4.10 0.00 1.45 1.58 0.00 1.91 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.28 1.27 7.81 78 G 5.84 3.47 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 0.00 0.00 0.00 79 E 8.51 5.49 0.00 1.82 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 2.04 2.12 0.00 80 F 8.42 5.52 0.00 3.29 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 81 G 8.74 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 0.00 0.00 0.00 0.00 82 N 8.93 5.07 0.00 2.81 2.80 0.00 0.00 6.66 7.54 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 83 Y 9.11 4.51 0.00 2.94 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 84 H 9.47 3.84 0.00 2.81 3.13 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 85 G 8.23 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 86 V 7.82 4.49 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 1.19 0.00 0.00 1.03 0.00 0.00 87 V 8.60 4.43 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 1.13 0.00 0.00 1.03 0.00 0.00 88 V 8.76 4.84 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 0.94 0.00 0.00 1.01 0.00 0.00 89 V 8.79 4.27 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 1.15 0.00 0.00 1.10 0.00 0.00 90 G 9.40 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 91 K 7.92 5.17 0.00 1.66 1.54 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.70 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.58 1.55 7.81 92 L 9.19 4.99 0.00 1.77 1.61 1.18 1.03 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 93 G 8.89 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 0.00 0.00 0.00 0.00 94 F 9.09 5.75 0.00 3.16 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 95 S 9.29 5.35 0.00 3.89 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 96 T 9.37 5.49 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 1.51 0.00 0.00 97 N 8.98 4.47 0.00 2.91 3.08 0.00 0.00 5.87 7.13 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 98 K 7.39 4.31 0.00 1.89 1.90 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.50 7.81 99 K 8.00 4.37 0.00 1.69 1.78 0.00 0.80 0.00 0.00 1.33 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.23 0.71 7.81 100 S 8.06 5.15 0.00 3.92 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 0.00 101 Y 8.86 4.71 0.00 3.35 3.18 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 0.00 102 G 8.38 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 0.00 0.00 0.00 103 P 0.00 4.09 0.00 1.86 1.81 0.00 3.43 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 104 F 9.02 4.85 0.00 3.10 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 0.00 105 G 8.82 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.40 4.86 0.00 2.68 2.77 0.00 0.00 6.80 7.60 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 0.00 107 T 7.63 4.39 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 1.23 0.00 0.00 108 G 8.56 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 0.00 0.00 0.00 109 G 7.72 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 0.00 110 T 7.56 3.94 2.83 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 1.07 0.00 0.00 111 P 0.00 5.00 0.00 1.96 2.09 0.00 3.61 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 1.93 1.88 0.00 112 F 8.51 5.16 0.00 2.49 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 S 8.28 4.49 0.00 3.69 3.61 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 0.00 114 L 9.36 4.76 0.00 1.51 1.58 1.14 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.67 0.00 2.10 2.02 0.00 3.52 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 1.98 2.09 0.00 116 I 8.27 4.35 2.06 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.87 1.02 0.00 0.00 117 A 8.76 4.11 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 0.00 118 A 7.82 4.52 1.20 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 0.00 0.00 0.00 119 G 9.97 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 0.00 0.00 0.00 120 K 8.37 4.79 0.00 1.90 1.74 0.00 0.61 0.00 0.00 1.04 0.00 0.00 2.63 0.00 0.00 2.20 0.00 0.00 0.00 0.00 1.16 1.29 7.81 121 I 8.87 4.61 1.92 0.00 0.00 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 1.35 0.63 0.62 0.00 0.00 122 S 9.47 4.61 0.00 3.83 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 0.00 123 G 6.64 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 0.00 124 F 8.13 6.01 0.00 3.23 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 0.00 125 F 8.48 4.97 0.00 3.17 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 0.00 126 G 6.36 3.36 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 0.00 127 R 7.82 5.12 0.00 1.69 1.90 0.00 3.05 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.39 0.00 128 G 9.32 4.70 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 0.00 129 G 9.36 4.72 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 0.00 130 D 9.28 4.52 0.00 2.51 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 0.00 131 F 7.50 5.35 0.00 3.21 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 0.00 132 I 8.52 4.47 2.01 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 1.44 1.59 1.12 0.00 0.00 133 D 8.95 4.63 0.00 2.76 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 0.00 134 A 8.20 4.89 1.07 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 0.00 135 I 8.50 4.92 2.05 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 1.52 1.54 1.07 0.00 0.00 136 G 8.83 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 0.00 137 V 9.09 5.18 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 0.84 0.00 0.00 0.90 0.00 0.00 138 Y 9.17 4.79 0.00 3.12 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 0.00 139 L 8.98 5.26 0.00 1.48 1.57 0.98 0.89 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 0.00 140 E 8.76 4.77 0.00 2.03 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 2.14 2.28 0.00 141 P 0.00 4.40 0.00 2.19 1.91 0.00 3.65 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 2.10 2.07 0.00 * Residues marked with a * may have inaccurate shift predictions.