NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 L 4.5269 8.0433 122.4816 54.9785 43.0233 175.6940 17 F 4.9636 10.3348 125.6706 54.7816 42.3431 173.6576 18 L 4.1420 9.2020 123.2571 58.6257 43.0422 179.6160 19 E 4.0058 8.3271 117.4954 59.3933 29.5622 177.4940 20 D 4.6231 7.8742 115.2871 55.3213 41.1981 176.1689 21 L 4.8589 7.0848 119.0296 53.3778 43.5791 175.8209 22 A 4.4385 9.0830 121.5759 50.9749 22.5239 176.0102 23 V 3.6201 8.3392 120.8481 64.5296 32.0976 175.6468 24 G 3.9636 8.5466 113.9744 45.3199 0.0000 173.2224 25 D 4.1569 7.8814 119.8454 54.9611 41.5526 176.1484 26 R 4.7594 8.1318 122.7364 55.0323 31.8686 175.6441 27 F 5.1068 9.1615 120.4154 56.1778 43.7753 173.1376 28 D 5.0682 8.6766 117.3720 53.6212 43.8701 174.5888 29 S 4.8401 8.3982 119.7618 56.3912 65.8906 172.8900 30 A 4.3770 8.3876 122.6076 52.0105 19.1959 176.9793 31 R 4.8374 8.3364 117.0211 55.7257 32.5960 176.3200 32 H 4.7542 8.9692 120.5691 55.0171 33.4236 172.1388 33 R 4.6059 8.4795 126.6410 55.6626 31.3552 175.4758 34 V 4.2001 9.1541 127.2805 61.6281 32.9698 174.5951 35 E 4.7497 8.6239 127.5350 55.1852 31.2772 177.6992 36 A 4.0333 8.7296 123.6449 55.2011 18.4483 180.2122 37 A 3.9621 7.9820 118.9231 55.3099 18.5770 179.5713 38 A 4.0688 8.0002 118.8532 55.0864 18.5049 179.7274 39 I 3.7884 7.6121 118.0578 64.7406 37.2428 178.7435 40 K 4.1511 8.0714 117.9558 58.5500 31.4588 179.5123 41 A 3.9401 7.7603 121.2842 55.0319 18.3442 179.4080 42 F 3.9274 8.3261 119.0031 61.4108 39.4910 177.2446 43 A 4.2711 8.3751 120.6659 55.1131 17.9373 179.8303 44 G 3.4900 8.0947 103.6308 47.5321 0.0000 174.9296 45 E 3.8263 7.3758 119.7847 57.2996 29.9274 176.7731 46 F 4.8419 7.8954 114.5392 57.2143 41.6441 175.0497 47 D 4.8104 7.9508 119.1808 52.4933 41.7452 174.6535 48 P 4.6149 0.0000 0.0000 62.9333 30.2113 176.8020 49 Q 4.4344 7.2805 117.9207 53.0527 31.9230 175.4658 50 P 4.1038 0.0000 0.0000 65.7950 31.5048 178.2814 51 F 4.4035 7.0124 110.8534 58.5469 38.0092 175.6655 52 H 5.1466 7.9140 117.6563 55.7062 29.8086 174.7191 53 L 4.5445 7.7068 117.9480 54.5357 44.0506 175.9819 54 D 4.8204 8.2546 118.4859 51.5244 43.0972 175.5137 55 E 4.0313 9.2322 129.7389 60.2982 29.3095 179.3619 56 E 4.0599 8.4965 117.0166 61.1252 29.8555 180.5920 57 A 4.3866 8.2866 121.1888 54.5796 18.3530 179.4417 58 A 4.2536 8.2353 120.1161 55.1397 18.3989 179.9364 59 R 4.0160 7.9545 113.8214 58.8362 29.1762 177.3424 60 H 4.9775 7.6829 115.0628 55.6119 29.1925 174.3451 61 S 4.8435 7.7773 113.8104 56.0533 66.1031 174.3475 62 L 3.8051 8.4572 119.4324 57.6180 41.2301 178.9247 63 F 4.1649 7.9482 115.9684 57.6436 39.6468 175.8038 64 G 4.0890 8.9083 108.7301 45.7233 0.0000 172.0863 65 G 4.1533 8.4361 101.2614 42.3788 0.0000 172.9153 66 L 3.9865 8.4046 122.9212 55.7464 42.2266 176.2727 67 A 5.0080 8.1818 124.8232 49.9269 22.4022 175.5032 68 A 4.1461 8.7774 122.7887 51.3142 19.4267 177.9731 69 S 3.6617 8.4759 115.6901 57.7535 63.4342 175.2567 70 G 2.3835 8.2660 113.6682 47.5955 0.0000 175.8963 71 W 4.3758 7.3820 120.7471 59.2292 28.9340 178.3030 72 H 2.6380 7.9708 118.9721 58.9731 29.1487 177.3358 73 T 3.7148 7.5773 116.8219 66.5056 68.0747 176.2437 74 A 4.2102 8.2010 121.8521 55.1240 18.5066 179.3223 75 A 4.1340 7.7474 118.1771 55.4378 18.9527 179.4569 76 I 3.7786 7.9812 118.7608 64.7728 37.0831 179.4178 77 T 3.9768 7.9345 113.5476 64.1478 68.0585 176.1848 *79 R 4.1737 7.9104 121.7435 56.4853 31.7638 177.3529 80 L 3.9873 7.7598 117.0735 57.9167 41.5811 179.5043 81 L 4.0178 7.8494 118.7347 57.8618 41.3248 179.9460 82 V 3.5470 7.5923 116.6747 66.2328 31.7398 177.7512 83 T 4.1588 7.9118 108.5042 64.4578 68.9120 175.1593 84 S 4.6677 7.7979 111.1052 58.7161 68.1259 175.5215 85 G 3.6620 9.2189 111.3404 47.7943 0.0000 173.2124 86 L 4.0824 7.7120 121.9511 52.0325 43.0725 174.6331 87 P 4.4970 0.0000 0.0000 62.1508 29.1091 175.2372 88 L 4.3457 7.2958 119.9130 52.5619 43.6046 178.0991 89 A 3.8970 8.0848 126.9177 54.6034 18.3102 178.1998 90 Q 4.1283 7.4716 111.4589 55.2324 29.5327 174.8877 91 G 3.6028 7.3775 102.6396 44.4168 0.0000 173.0414 92 I 4.1975 7.8865 119.1289 59.8970 38.3579 176.2299 93 I 4.2744 8.3092 129.6007 59.3893 38.2607 174.6028 94 G 4.0389 8.4773 113.6086 45.2649 0.0000 171.3854 95 A 4.4299 8.7032 126.8232 53.5554 19.8634 177.4334 96 G 4.1225 7.4382 100.5155 46.6950 0.0000 172.2843 97 T 5.1451 8.4703 113.7428 60.7232 71.1622 172.1632 98 E 4.5704 8.8794 126.1043 54.4884 31.4925 174.5232 99 L 5.0932 8.2866 126.9007 53.0988 44.2056 176.1257 100 S 4.0934 7.8781 115.4908 56.7387 66.8040 173.1233 101 W 4.8488 8.3405 122.2063 53.3911 29.0568 173.6955 102 P 4.3993 0.0000 0.0000 64.9896 31.5750 176.5622 103 N 5.2218 7.8619 114.3555 50.4465 42.1444 172.4287 104 P 4.7392 0.0000 0.0000 63.1577 32.6496 175.7798 105 T 4.4753 8.4250 118.9176 62.6271 70.1216 174.4976 106 R 4.9056 8.5502 124.1114 53.2406 33.3289 173.6580 107 P 4.4000 0.0000 0.0000 64.1215 31.7179 177.5504 108 G 3.9875 8.7856 109.6526 45.4623 0.0000 173.7128 109 D 4.5815 7.7063 120.7779 54.2939 42.4300 175.0395 110 E 5.0341 8.7777 121.7330 54.6981 32.0409 174.7913 111 L 5.4326 9.2029 124.6530 53.2899 45.2599 175.2593 112 H 5.3229 8.7315 116.2809 54.1554 32.9597 172.0302 113 V 4.7228 8.7005 119.9817 61.3480 33.8594 174.0822 114 E 4.9480 9.2696 128.3692 55.2688 31.3923 174.9381 115 T 5.1879 8.4465 122.0215 62.1299 71.4964 174.0054 116 T 5.0331 8.8360 121.7027 61.6292 72.9441 173.5241 117 V 4.0497 8.5679 126.3372 63.1097 32.2281 176.2441 118 L 4.6580 8.6994 126.5075 55.9304 44.2510 176.5715 119 A 4.6042 7.5015 116.8441 51.0488 22.6142 175.4191 120 I 4.6679 8.3499 119.9762 59.9996 40.6950 175.6026 121 T 4.4930 8.4529 123.9577 60.5855 69.8789 171.1999 122 P 4.7765 0.0000 0.0000 62.3111 32.1444 176.5434 123 S 4.2552 8.9209 121.1154 58.5397 63.2701 175.7462 124 K 4.0681 8.6425 124.9011 58.5493 32.2507 178.1370 125 S 4.4987 7.9105 111.4586 59.2665 63.9873 174.7770 126 R 4.5185 7.2547 119.7519 53.4993 30.5687 173.5496 127 P 4.6413 0.0000 0.0000 63.2300 32.0257 177.2513 128 D 4.3626 7.8797 118.8825 56.5679 41.5422 174.9379 129 R 4.8632 8.0134 114.0876 55.2211 33.5259 173.5344 130 A 4.9849 8.6713 118.6394 50.8324 23.4706 175.7165 131 I 4.6616 8.4251 121.0364 59.9666 38.6055 175.1957 132 V 4.3760 8.8192 128.7774 62.3411 33.2924 175.2573 133 T 4.8247 8.9333 125.2973 62.4658 69.1918 172.1985 134 C 5.0221 8.6255 123.8663 58.1045 30.5956 172.4723 135 Q 4.8848 9.3854 125.8874 54.8296 30.3911 174.1570 136 S 5.1600 8.7619 123.7289 57.0857 65.2322 172.9301 137 D 5.1998 9.1665 125.6276 52.9081 43.1338 175.5434 138 T 4.8267 9.0627 121.4438 62.3730 70.0901 173.8358 139 L 5.8441 8.5793 126.8427 52.2448 44.9935 177.0694 140 N 5.6334 8.7253 119.3148 51.1080 39.8068 174.6124 141 Q 4.1313 8.5815 114.8709 59.7000 28.7677 178.0713 142 R 4.0817 8.0682 113.6170 56.3914 29.6082 177.2372 143 G 3.9209 7.9624 105.2116 45.8292 0.0000 174.2237 144 E 4.2619 8.1492 119.6077 55.5188 30.7819 175.6062 145 V 4.5083 8.1061 120.3308 61.8887 32.5708 176.4903 146 V 4.8213 8.3812 119.9688 61.1726 33.7247 175.4757 147 Q 4.6079 7.4861 118.2887 55.1313 32.5001 172.2421 148 R 4.8910 8.5345 127.1215 54.5688 33.2799 174.4396 149 S 4.4127 9.0111 120.6458 56.8793 64.8295 172.5480 150 T 4.7270 8.7260 124.8668 62.4621 68.3651 173.7608 151 A 5.1994 8.8336 128.2511 49.9416 22.6402 175.3903 152 K 4.9494 8.8688 119.2949 54.8095 34.7800 175.7967 153 V 4.8547 8.6995 119.1987 59.3429 34.6972 175.5905 154 V 4.3208 8.2344 119.6863 61.2150 32.2803 175.8360 155 V 4.5691 9.0081 125.9288 61.1998 34.4458 175.2679 156 F 4.9731 8.9891 125.7363 56.9518 41.2880 174.4362 157 R 4.9888 8.0340 117.3551 54.3557 32.4092 177.1978 158 R 3.0554 8.8643 120.7064 56.4324 29.8806 176.3377 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 16 L 8.04 4.53 0.00 1.74 1.57 1.00 0.60 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 17 F 10.33 4.96 0.00 3.24 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 9.20 4.14 0.00 2.08 1.76 0.98 1.46 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 19 E 8.33 4.01 0.00 2.04 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 2.43 0.00 20 D 7.87 4.62 0.00 2.80 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 21 L 7.08 4.86 0.00 1.96 1.67 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 22 A 9.08 4.44 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 23 V 8.34 3.62 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 0.87 0.00 0.00 0.98 0.00 0.00 24 G 8.55 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 25 D 7.88 4.16 0.00 2.57 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 0.00 0.00 0.00 0.00 26 R 8.13 4.76 0.00 1.53 1.72 0.00 3.07 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 27 F 9.16 5.11 0.00 2.94 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.68 5.07 0.00 2.70 2.53 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 29 S 8.40 4.84 0.00 3.96 3.88 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 30 A 8.39 4.38 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 31 R 8.34 4.84 0.00 1.69 1.88 0.00 3.24 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 32 H 8.97 4.75 0.00 3.23 3.11 0.00 5.77 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.48 4.61 0.00 1.82 1.73 0.00 3.26 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 34 V 9.15 4.20 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 0.89 0.00 0.00 0.95 0.00 0.00 35 E 8.62 4.75 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 2.35 2.30 0.00 36 A 8.73 4.03 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 37 A 7.98 3.96 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 38 A 8.00 4.07 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 0.00 0.00 39 I 7.61 3.79 2.11 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 1.57 0.74 0.94 0.00 0.00 40 K 8.07 4.15 0.00 1.84 1.85 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.65 7.81 41 A 7.76 3.94 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 42 F 8.33 3.93 0.00 2.99 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 43 A 8.38 4.27 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.09 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 45 E 7.38 3.83 0.00 1.50 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 1.47 1.47 0.00 46 F 7.90 4.84 0.00 2.36 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 47 D 7.95 4.81 0.00 2.88 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 48 P 0.00 4.61 0.00 2.02 1.95 0.00 3.67 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 1.97 2.02 0.00 49 Q 7.28 4.43 0.00 1.41 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.94 6.80 0.00 0.00 0.00 0.00 0.00 2.17 2.35 0.00 50 P 0.00 4.10 0.00 2.07 2.07 0.00 3.22 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 51 F 7.01 4.40 0.00 2.97 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 52 H 7.91 5.15 0.00 3.12 3.33 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.71 4.54 0.00 1.53 1.64 0.81 0.93 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 54 D 8.25 4.82 0.00 2.59 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.23 4.03 0.00 2.13 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 2.47 0.00 56 E 8.50 4.06 0.00 2.10 1.84 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 2.26 2.19 0.00 57 A 8.29 4.39 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 58 A 8.24 4.25 1.49 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 59 R 7.95 4.02 0.00 2.06 2.23 0.00 2.77 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.53 0.00 60 H 7.68 4.98 0.00 3.37 3.40 0.00 5.79 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 S 7.78 4.84 0.00 4.00 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 62 L 8.46 3.81 0.00 1.16 1.26 0.70 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 63 F 7.95 4.16 0.00 2.98 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 64 G 8.91 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.44 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 0.00 0.00 0.00 0.00 66 L 8.40 3.99 0.00 1.69 1.65 0.97 0.95 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 67 A 8.18 5.01 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 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.78 4.15 1.11 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 0.00 0.00 0.00 0.00 0.00 69 S 8.48 3.66 0.00 3.82 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 70 G 8.27 2.38 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 0.00 71 W 7.38 4.38 0.00 3.56 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.97 2.64 0.00 2.28 3.05 0.00 5.79 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 73 T 7.58 3.71 4.41 0.00 0.00 0.00 0.00 0.00 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 74 A 8.20 4.21 1.61 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 0.00 0.00 75 A 7.75 4.13 1.43 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 76 I 7.98 3.78 1.91 0.00 0.00 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 1.38 0.96 0.78 0.00 0.00 77 T 7.93 3.98 4.43 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 1.20 0.00 0.00 *79 R 7.91 4.17 0.00 1.86 2.15 0.00 3.18 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 80 L 7.76 3.99 0.00 1.88 1.72 0.93 0.48 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 81 L 7.85 4.02 0.00 1.86 1.70 0.92 0.84 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 82 V 7.59 3.55 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 0.86 0.00 0.00 0.91 0.00 0.00 83 T 7.91 4.16 4.24 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 1.26 0.00 0.00 84 S 7.80 4.67 0.00 3.95 3.95 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 85 G 9.22 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 0.00 0.00 0.00 86 L 7.71 4.08 0.00 1.44 1.36 0.86 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.50 0.00 1.94 1.93 0.00 2.99 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 88 L 7.30 4.35 0.00 1.58 1.49 0.74 0.86 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 89 A 8.08 3.90 0.76 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 90 Q 7.47 4.13 0.00 1.76 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.60 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 91 G 7.38 3.60 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 92 I 7.89 4.20 1.84 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 1.27 0.62 0.89 0.00 0.00 93 I 8.31 4.27 1.90 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 1.26 1.38 0.94 0.00 0.00 94 G 8.48 4.04 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 0.00 95 A 8.70 4.43 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 96 G 7.44 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 97 T 8.47 5.15 4.24 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 1.23 0.00 0.00 98 E 8.88 4.57 0.00 2.08 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 2.13 2.19 0.00 99 L 8.29 5.09 0.00 1.02 0.42 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 100 S 7.88 4.09 0.00 3.71 3.70 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 0.00 101 W 8.34 4.85 0.00 3.29 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.40 0.00 2.27 2.10 0.00 3.58 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 103 N 7.86 5.22 0.00 2.84 2.69 0.00 0.00 7.13 7.58 0.00 0.00 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 P 0.00 4.74 0.00 2.04 2.23 0.00 3.71 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 2.12 2.24 0.00 105 T 8.42 4.48 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 1.17 0.00 0.00 106 R 8.55 4.91 0.00 1.97 1.81 0.00 3.39 0.00 0.00 3.38 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 107 P 0.00 4.40 0.00 2.05 1.99 0.00 3.73 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 108 G 8.79 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 0.00 109 D 7.71 4.58 0.00 2.82 2.60 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 0.00 110 E 8.78 5.03 0.00 1.92 1.86 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 2.30 2.31 0.00 111 L 9.20 5.43 0.00 1.55 1.53 0.91 0.91 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 0.00 112 H 8.73 5.32 0.00 3.16 3.34 0.00 5.22 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 0.00 113 V 8.70 4.72 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 0.96 0.00 0.00 0.98 0.00 0.00 114 E 9.27 4.95 0.00 1.91 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 2.43 2.26 0.00 115 T 8.45 5.19 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 1.35 0.00 0.00 116 T 8.84 5.03 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 1.18 0.00 0.00 117 V 8.57 4.05 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 1.00 0.00 0.00 1.13 0.00 0.00 118 L 8.70 4.66 0.00 1.65 1.65 0.96 0.84 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 0.00 119 A 7.50 4.60 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 0.00 120 I 8.35 4.67 1.89 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 1.38 0.74 0.93 0.00 0.00 121 T 8.45 4.49 4.24 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 1.21 0.00 0.00 122 P 0.00 4.78 0.00 1.93 1.99 0.00 3.68 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 123 S 8.92 4.26 0.00 4.04 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 0.00 124 K 8.64 4.07 0.00 1.74 1.85 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.41 7.81 125 S 7.91 4.50 0.00 3.96 3.97 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 0.00 126 R 7.25 4.52 0.00 1.76 1.73 0.00 3.07 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 127 P 0.00 4.64 0.00 2.01 2.09 0.00 3.70 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 128 D 7.88 4.36 0.00 2.57 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 0.00 129 R 8.01 4.86 0.00 1.87 1.60 0.00 2.64 0.00 0.00 3.02 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.62 0.00 130 A 8.67 4.98 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 0.00 131 I 8.43 4.66 1.87 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 1.12 0.98 0.92 0.00 0.00 132 V 8.82 4.38 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 1.08 0.00 0.00 0.96 0.00 0.00 133 T 8.93 4.82 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 1.21 0.00 0.00 134 C 8.63 5.02 0.00 2.92 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 0.00 135 Q 9.39 4.88 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 136 S 8.76 5.16 0.00 3.80 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 0.00 137 D 9.17 5.20 0.00 2.54 2.53 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 0.00 138 T 9.06 4.83 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 1.19 0.00 0.00 139 L 8.58 5.84 0.00 1.45 1.64 0.96 0.59 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 0.00 140 N 8.73 5.63 0.00 2.82 2.87 0.00 0.00 6.42 7.39 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 0.00 141 Q 8.58 4.13 0.00 2.24 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 7.14 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 142 R 8.07 4.08 0.00 1.97 2.01 0.00 3.29 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 143 G 7.96 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 0.00 144 E 8.15 4.26 0.00 2.20 1.88 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 2.32 2.39 0.00 145 V 8.11 4.51 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 1.05 0.00 0.00 0.91 0.00 0.00 146 V 8.38 4.82 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 1.24 0.00 0.00 1.01 0.00 0.00 147 Q 7.49 4.61 0.00 2.22 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.01 1.79 0.00 148 R 8.53 4.89 0.00 1.79 1.58 0.00 3.01 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.57 0.00 149 S 9.01 4.41 0.00 3.76 3.63 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 0.00 150 T 8.73 4.73 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 1.19 0.00 0.00 151 A 8.83 5.20 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 0.00 152 K 8.87 4.95 0.00 1.73 1.73 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.42 7.81 153 V 8.70 4.85 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.97 0.00 0.00 154 V 8.23 4.32 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 0.63 0.00 0.00 1.08 0.00 0.00 155 V 9.01 4.57 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 1.05 0.00 0.00 1.01 0.00 0.00 156 F 8.99 4.97 0.00 3.13 3.16 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 0.00 157 R 8.03 4.99 0.00 1.78 1.86 0.00 3.40 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 158 R 8.86 3.06 0.00 0.88 1.42 0.00 3.02 0.00 0.00 3.00 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.50 0.00 * Residues marked with a * may have inaccurate shift predictions.