NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5542 8.2649 123.5872 52.1860 19.2146 176.1255 2 T 4.2553 8.3881 119.8724 63.4929 70.0255 172.8684 3 K 5.2743 9.0113 125.0447 54.8706 37.0849 174.4889 4 A 5.4531 9.0250 123.3855 50.9916 23.4274 175.1525 5 V 4.9874 8.7677 117.1754 60.9964 35.3805 173.2434 6 C 4.9290 9.1074 121.9088 58.0634 35.1287 172.6009 7 V 4.6160 8.4356 125.9250 61.3589 33.2208 174.2233 8 L 4.7379 8.8802 129.4256 54.1852 42.9996 176.3153 9 K 5.0011 9.0477 121.9061 55.4238 37.1265 176.2602 10 G 4.6312 7.9776 108.3847 45.1495 0.0000 172.0546 11 D 4.5327 8.7983 117.8348 55.6866 41.7552 177.0128 12 G 4.3047 7.6332 109.1899 44.2102 0.0000 171.8391 13 P 4.4930 0.0000 0.0000 63.0471 32.0570 175.5459 14 V 4.0930 7.5510 120.7169 63.0884 31.9524 174.9551 15 Q 5.1495 7.8529 124.7027 55.7431 32.4332 173.5141 16 G 4.3237 7.6857 106.4026 46.5423 0.0000 171.6102 17 I 5.1138 7.6492 119.4343 59.3601 40.8525 174.9068 18 I 4.4073 8.6900 127.5401 59.4625 40.2195 174.3808 19 N 4.8866 8.1997 124.4112 51.3932 41.0695 173.9884 20 F 5.4549 8.9456 120.2466 55.8288 43.1571 173.8559 21 E 5.2564 9.6455 122.7793 54.8823 33.6795 173.7237 22 Q 4.8407 9.2729 127.3390 54.4154 31.2421 175.7909 23 K 4.1007 9.0248 127.2924 58.3385 32.7358 177.6271 24 E 4.7352 7.8486 117.4252 53.9868 32.0277 176.5116 25 S 4.0599 8.8746 117.4446 61.2580 62.3586 174.9057 26 N 4.6563 8.0114 114.8405 53.7297 39.4011 175.2433 27 G 3.9231 7.8195 107.1145 44.0517 0.0000 171.2010 28 P 4.5765 0.0000 0.0000 62.7792 32.2369 176.4493 29 V 4.6182 8.9535 123.3542 61.2156 33.6995 174.7568 30 K 4.8434 9.2841 128.5434 55.9852 33.8748 176.1144 31 V 4.8541 9.4205 124.7036 60.8873 34.2971 174.2368 32 W 5.4255 8.5473 124.1216 54.8068 31.9736 175.5629 33 G 3.6198 7.5651 106.8658 46.2222 0.0000 170.9278 34 S 5.0577 7.6093 114.4822 56.9449 66.6569 174.4063 35 I 4.8778 8.8713 126.6086 59.3373 40.6647 174.7159 36 K 4.8158 9.1420 125.4162 55.6048 36.2633 176.9824 37 G 3.7950 8.7649 105.5465 46.6320 0.0000 173.5412 38 L 4.4278 7.6058 120.0274 53.2455 43.0092 176.2134 39 T 4.3271 8.1151 110.7737 60.7482 69.7227 174.2206 40 E 4.0417 8.7086 124.4195 58.0573 30.3298 175.3328 41 G 3.7919 8.6159 110.4061 43.9182 0.0000 172.0407 42 L 4.8298 8.1970 118.8493 54.6520 42.9392 176.4997 43 H 5.0107 9.0343 119.5638 53.6177 32.8254 173.3118 44 G 4.1360 9.1527 111.0886 46.8636 0.0000 172.2802 45 F 5.7380 9.2096 124.7269 56.8137 42.3840 173.1216 46 H 5.3299 8.9565 122.8709 54.0189 33.6289 172.8309 47 V 4.3937 8.8622 122.4684 62.6762 32.7978 174.9090 48 H 5.1738 9.4350 125.2492 54.1177 31.1497 175.5879 49 E 3.6912 8.9889 122.2623 58.8922 29.8241 177.0598 50 F 4.9672 7.9883 118.0422 54.8862 41.5879 176.8402 51 G 4.4436 8.3373 111.9643 44.4888 0.0000 173.9316 52 D 4.8017 7.9483 117.5510 52.5491 43.2353 174.3441 53 N 5.2756 8.7981 123.6901 52.5719 39.5449 175.8405 54 T 3.8710 8.4911 109.6334 63.6740 68.7274 174.3459 55 A 4.6878 7.8236 124.5683 51.3947 19.9950 177.3905 56 G 3.8633 7.9890 110.6605 47.5178 0.0000 175.4995 57 C 4.1778 8.5103 115.3698 62.7446 28.1410 175.6588 58 T 3.9432 7.9744 117.6708 66.5162 67.8500 175.6994 59 S 4.4442 7.9478 112.8541 59.6164 63.7224 175.4371 60 A 4.5558 7.5179 126.4171 54.5241 18.2795 178.5633 61 G 4.1845 8.1556 105.4124 44.6879 0.0000 171.0572 62 P 4.7424 0.0000 0.0000 61.9193 33.6917 175.3813 63 H 4.2424 8.6628 116.7531 56.0425 29.3386 175.4547 64 F 4.2987 9.2393 126.0284 58.6138 40.1432 174.4194 65 N 4.4421 7.9552 122.7673 52.6714 39.8912 171.9240 66 P 4.1354 0.0000 0.0000 63.2392 32.4568 176.4785 *80 R 4.1272 7.7135 119.1237 55.7821 30.9684 175.5627 81 V 3.4476 8.3187 125.7237 66.2198 31.6653 177.2857 82 G 3.7841 8.3391 106.7320 46.1464 0.0000 172.4328 83 D 4.7715 7.8719 120.4513 53.8487 40.6688 175.3809 84 L 4.6301 8.3834 126.6499 54.2779 42.8517 179.0810 85 G 3.9206 8.7243 107.5133 46.0907 0.0000 172.6464 86 N 5.5978 8.6205 119.3476 51.6825 41.6799 174.8552 87 V 4.2477 8.4428 114.9329 60.3059 34.9689 175.0299 88 T 5.0014 8.1866 118.3121 61.8752 71.1295 173.0865 89 A 4.8595 8.8024 129.4812 50.8281 20.8182 177.3116 90 D 4.9159 8.7401 122.2845 52.1121 41.2517 176.9055 91 K 3.8799 8.5776 119.0809 59.1853 32.0743 177.0843 92 D 4.6242 8.4727 116.7669 53.9506 41.2542 177.0866 93 G 4.0735 8.5471 108.4181 44.5949 0.0000 172.6154 94 V 4.7337 7.8715 119.5925 60.8874 33.6762 174.2305 95 A 5.3653 9.0228 130.4120 49.6885 20.7383 175.0915 96 D 4.9089 8.6204 122.8186 54.1799 42.0161 176.3428 97 V 4.2013 8.7165 124.5331 61.4886 33.8383 175.0963 98 S 5.3072 8.4247 121.4359 57.6855 63.6487 172.7433 99 I 4.8805 9.4858 119.5536 58.6184 41.9187 173.7139 100 E 5.1485 8.7452 122.3594 54.4779 32.3053 174.0659 101 D 5.0666 9.2986 126.2480 52.5586 44.4146 175.8533 102 S 4.6593 8.9584 118.4590 58.2582 64.0304 174.7708 103 V 3.9834 8.5045 121.9865 65.0881 31.8516 176.5447 104 I 4.0813 7.7979 110.9040 61.0870 38.2832 174.3175 105 S 4.6540 8.5538 114.3114 57.4923 65.5227 173.9724 106 L 4.3870 8.9021 122.0043 54.0322 41.4364 176.3899 107 S 4.4566 7.9432 112.5923 58.3314 66.3740 175.9907 108 G 3.8990 8.4837 108.5166 45.3479 0.0000 173.9299 109 D 4.4486 8.8591 117.6113 57.3192 41.3582 176.8411 110 H 4.9990 8.1305 114.5681 55.4442 29.0339 173.8047 111 C 4.6133 8.0265 121.1994 59.8912 31.6994 173.4905 112 I 3.8604 8.1137 119.1449 60.3260 38.0140 175.5531 113 I 3.7199 7.2434 123.1508 62.7600 37.3763 176.3051 114 G 3.8000 9.4875 113.1926 45.5674 0.0000 173.0685 115 R 4.7501 7.5641 119.5161 54.8201 33.5650 174.5691 116 T 4.9845 7.9734 115.2534 62.1096 71.3310 173.5874 117 L 4.8619 8.6002 128.3577 53.8046 44.1204 175.3154 118 V 4.9837 8.8499 125.7761 61.0094 35.3090 174.1248 119 V 5.0925 8.6322 126.7857 60.5375 33.5278 174.8026 120 H 5.1544 9.2395 122.3221 54.2830 30.2857 174.9953 121 E 4.2170 9.1849 122.1790 58.8793 30.0276 176.9082 122 K 4.7828 8.1034 116.6294 53.7784 36.0433 175.8715 123 A 4.3089 8.5113 124.0508 52.6224 18.7565 177.6231 124 D 4.6654 9.1589 121.6179 52.7041 41.6049 177.3087 *141 G 4.0759 8.1482 116.8291 44.3174 0.0000 174.4595 142 S 4.2862 7.0370 117.0707 58.7562 64.2714 173.5423 143 R 4.4090 8.3706 120.0809 55.2716 30.0067 176.4311 144 L 4.2760 8.7781 125.9424 57.5854 42.9091 177.2508 145 A 5.0971 7.7134 117.7670 51.5146 22.8601 174.7038 146 C 5.3351 8.4431 113.4321 58.9599 33.6818 172.7253 147 G 4.4595 8.0241 104.0849 46.0677 0.0000 172.6408 148 V 4.4059 8.2832 121.0090 62.4349 32.7645 175.4515 149 I 4.2265 8.8323 129.2710 60.7500 38.1346 175.2493 150 G 4.4577 8.8862 114.6014 43.8808 0.0000 172.3091 151 I 4.2514 8.3477 121.9270 61.1997 37.5679 175.4596 152 A 4.8273 8.5217 128.2485 49.8035 22.0185 176.1662 153 Q 4.0752 8.5262 119.0647 56.4024 29.2277 175.9270 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 A 8.26 4.55 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 2 T 8.39 4.26 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 3 K 9.01 5.27 0.00 1.89 1.73 0.00 1.87 0.00 0.00 1.97 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.48 7.81 4 A 9.03 5.45 1.17 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 0.00 0.00 5 V 8.77 4.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.91 0.00 0.00 6 C 9.11 4.93 0.00 3.14 2.89 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 7 V 8.44 4.62 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 0.99 0.00 0.00 0.92 0.00 0.00 8 L 8.88 4.74 0.00 1.64 1.59 1.05 0.39 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 9 K 9.05 5.00 0.00 1.66 1.62 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 7.98 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.80 4.53 0.00 2.68 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 12 G 7.63 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 13 P 0.00 4.49 0.00 2.22 2.28 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.94 0.00 14 V 7.55 4.09 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 0.79 0.00 0.00 0.95 0.00 0.00 15 Q 7.85 5.15 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.53 0.00 0.00 0.00 0.00 0.00 2.45 2.15 0.00 16 G 7.69 4.32 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 0.00 17 I 7.65 5.11 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.91 0.81 0.00 0.00 18 I 8.69 4.41 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.18 0.48 0.00 0.00 19 N 8.20 4.89 0.00 1.44 1.52 0.00 0.00 6.38 8.16 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 20 F 8.95 5.45 0.00 2.85 2.92 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 21 E 9.65 5.26 0.00 2.41 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 0.00 2.31 2.53 0.00 22 Q 9.27 4.84 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.59 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 23 K 9.02 4.10 0.00 1.81 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.85 4.74 0.00 2.01 1.82 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 2.30 2.26 0.00 25 S 8.87 4.06 0.00 3.83 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 26 N 8.01 4.66 0.00 2.75 2.85 0.00 0.00 6.86 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 27 G 7.82 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 28 P 0.00 4.58 0.00 1.98 2.14 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 V 8.95 4.62 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 1.29 0.00 0.00 1.05 0.00 0.00 30 K 9.28 4.84 0.00 1.91 1.81 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.76 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.48 1.43 7.81 31 V 9.42 4.85 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 0.66 0.00 0.00 1.12 0.00 0.00 32 W 8.55 5.43 0.00 3.53 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 33 G 7.57 3.62 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 34 S 7.61 5.06 0.00 3.84 3.62 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 35 I 8.87 4.88 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.49 0.92 0.00 0.00 36 K 9.14 4.82 0.00 1.73 1.87 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.33 7.81 37 G 8.76 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 38 L 7.61 4.43 0.00 1.81 1.41 0.81 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.12 4.33 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 1.24 0.00 0.00 40 E 8.71 4.04 0.00 1.95 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 2.30 2.35 0.00 41 G 8.62 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 42 L 8.20 4.83 0.00 1.51 1.59 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.03 5.01 0.00 3.04 3.35 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.15 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 45 F 9.21 5.74 0.00 2.98 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 46 H 8.96 5.33 0.00 3.09 2.92 0.00 5.66 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 47 V 8.86 4.39 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 0.79 0.00 0.00 0.85 0.00 0.00 48 H 9.43 5.17 0.00 3.03 3.40 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.99 3.69 0.00 1.61 1.12 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 1.47 2.10 0.00 50 F 7.99 4.97 0.00 3.05 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 51 G 8.34 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 0.00 0.00 0.00 0.00 52 D 7.95 4.80 0.00 2.63 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 53 N 8.80 5.28 0.00 2.79 2.69 0.00 0.00 7.42 7.22 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 54 T 8.49 3.87 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 1.24 0.00 0.00 55 A 7.82 4.69 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 56 G 7.99 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 57 C 8.51 4.18 0.00 2.95 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.97 3.94 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 1.23 0.00 0.00 59 S 7.95 4.44 0.00 4.14 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 60 A 7.52 4.56 1.44 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 0.00 0.00 0.00 61 G 8.16 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 0.00 0.00 0.00 62 P 0.00 4.74 0.00 2.11 2.23 0.00 3.61 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 63 H 8.66 4.24 0.00 2.95 3.21 0.00 5.72 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.24 4.30 0.00 2.91 2.96 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 65 N 7.96 4.44 0.00 2.53 2.52 0.00 0.00 7.27 7.69 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 66 P 0.00 4.14 0.00 1.90 1.97 0.00 3.11 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.25 0.00 *80 R 7.71 4.13 0.00 1.85 1.86 0.00 3.28 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 81 V 8.32 3.45 1.68 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 0.61 0.00 0.00 0.55 0.00 0.00 82 G 8.34 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 0.00 0.00 0.00 83 D 7.87 4.77 0.00 2.75 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 84 L 8.38 4.63 0.00 1.90 1.83 0.84 1.02 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 85 G 8.72 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 86 N 8.62 5.60 0.00 2.60 2.72 0.00 0.00 6.68 7.68 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 87 V 8.44 4.25 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 -0.11 0.00 0.00 0.71 0.00 0.00 88 T 8.19 5.00 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 89 A 8.80 4.86 1.26 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 0.00 0.00 90 D 8.74 4.92 0.00 2.89 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 91 K 8.58 3.88 0.00 1.73 1.89 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.47 7.81 92 D 8.47 4.62 0.00 2.83 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 93 G 8.55 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 94 V 7.87 4.73 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 1.09 0.00 0.00 0.92 0.00 0.00 95 A 9.02 5.37 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.62 4.91 0.00 2.56 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 97 V 8.72 4.20 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 1.01 0.00 0.00 0.59 0.00 0.00 98 S 8.42 5.31 0.00 3.93 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 99 I 9.49 4.88 1.94 0.00 0.00 1.00 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 0.90 0.96 0.00 0.00 100 E 8.75 5.15 0.00 1.98 1.85 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 2.22 2.31 0.00 101 D 9.30 5.07 0.00 2.80 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 0.00 102 S 8.96 4.66 0.00 4.02 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 0.00 103 V 8.50 3.98 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 0.86 0.00 0.00 0.95 0.00 0.00 104 I 7.80 4.08 1.93 0.00 0.00 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 1.61 0.79 1.01 0.00 0.00 105 S 8.55 4.65 0.00 3.90 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 0.00 106 L 8.90 4.39 0.00 1.76 1.62 1.01 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.94 4.46 0.00 3.90 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.48 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 0.00 109 D 8.86 4.45 0.00 2.71 2.85 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 0.00 110 H 8.13 5.00 0.00 3.22 3.42 0.00 5.64 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.03 4.61 0.00 3.01 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 0.00 112 I 8.11 3.86 1.56 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.24 0.93 0.00 0.00 113 I 7.24 3.72 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.37 0.84 0.00 0.00 114 G 9.49 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.56 4.75 0.00 1.54 1.80 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.20 0.00 116 T 7.97 4.98 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 1.24 0.00 0.00 117 L 8.60 4.86 0.00 1.77 1.52 0.40 0.67 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 0.00 118 V 8.85 4.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.76 0.00 0.00 119 V 8.63 5.09 2.31 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 0.76 0.00 0.00 1.04 0.00 0.00 120 H 9.24 5.15 0.00 3.23 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.18 4.22 0.00 2.13 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 0.00 2.37 2.35 0.00 122 K 8.10 4.78 0.00 1.79 1.68 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.44 7.81 123 A 8.51 4.31 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 0.00 124 D 9.16 4.67 0.00 2.71 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 *141 G 8.15 4.08 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 0.00 0.00 0.00 142 S 7.04 4.29 0.00 3.98 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 0.00 143 R 8.37 4.41 0.00 1.68 1.84 0.00 3.18 0.00 0.00 3.11 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.65 0.00 144 L 8.78 4.28 0.00 1.73 1.70 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.71 5.10 1.22 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 0.00 146 C 8.44 5.34 0.00 3.03 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.02 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.28 4.41 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.97 0.00 0.00 149 I 8.83 4.23 1.81 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.51 0.43 0.00 0.00 150 G 8.89 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.35 4.25 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.52 4.83 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 0.00 153 Q 8.53 4.08 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.