NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.6897 7.9332 110.8961 61.1747 71.9450 173.0592 3 K 5.1572 7.8768 120.7322 54.4377 36.8482 173.5636 4 A 5.3984 9.0057 124.3170 51.3836 24.0543 174.8135 5 V 4.9643 8.7771 116.6345 60.7697 35.2240 173.1585 6 A 5.0235 9.2754 125.2179 50.2657 22.0699 174.9694 7 V 4.4119 8.4057 123.1669 61.6700 33.2977 174.5849 8 L 4.7299 8.6512 129.2048 54.0651 43.0481 176.3421 9 K 4.8628 9.3445 122.3126 55.6641 37.2306 176.1369 10 G 4.3699 7.9066 108.1955 45.7951 0.0000 172.3019 11 D 4.4727 8.8182 118.2428 56.4120 41.5621 176.9165 12 G 4.1567 7.6696 109.0593 44.2537 0.0000 171.7201 13 P 4.5096 0.0000 0.0000 62.9240 31.9704 175.8294 14 V 4.2321 7.5493 120.6463 62.9808 31.9158 174.9832 15 Q 4.7774 8.6607 124.8623 55.5134 32.7006 174.1664 16 G 4.0162 8.2625 105.3567 46.4721 0.0000 171.8084 17 I 5.0904 8.1779 120.4233 59.9971 41.4486 174.6089 18 I 4.6080 8.8280 128.7890 59.4741 39.7370 174.6073 19 N 4.8712 8.4711 125.0961 51.6271 40.6094 174.1234 20 F 5.4064 8.8450 120.6037 55.7505 42.6502 173.9740 21 E 5.1971 9.5016 123.1273 54.8522 33.1943 174.0389 22 Q 4.8089 9.6740 127.8156 54.2572 30.6852 175.3223 23 K 4.0593 8.8978 126.0801 58.6034 33.4598 177.5863 24 E 4.7098 7.8314 118.0881 53.8925 31.9212 176.3297 25 S 4.0365 8.9244 117.7655 61.2680 62.3108 174.7854 26 N 4.8433 8.1020 114.1210 53.1061 39.0900 174.3343 27 G 3.9991 7.5810 106.6370 43.9662 0.0000 171.9457 28 P 4.6912 0.0000 0.0000 62.5014 32.4159 176.2959 29 V 4.6738 8.9210 122.3341 61.2466 33.9813 174.6706 30 K 4.7940 9.2205 128.2082 55.8096 33.7945 175.8504 31 V 4.8401 9.3811 125.7821 60.8533 33.7808 174.3228 32 W 5.5157 8.8767 124.3176 54.7721 32.1518 175.5661 33 G 4.0496 7.4317 105.5637 45.9484 0.0000 170.9028 34 S 5.1008 7.7127 113.1394 56.7308 66.3992 174.2456 35 I 5.1627 8.8147 126.7154 59.3429 41.0441 174.5655 36 K 4.8197 9.0247 124.7588 55.6937 36.4076 176.9061 37 G 3.8136 8.8634 106.3296 45.7667 0.0000 173.3756 38 L 4.4881 7.6583 119.7940 52.9169 43.0580 176.6221 39 T 4.2333 8.1618 111.6783 61.1741 69.4641 173.9041 40 E 4.1485 8.5387 124.7570 56.9721 30.5588 175.1524 41 G 3.7723 8.2084 111.1022 44.0440 0.0000 172.0165 42 L 4.8532 8.2347 119.4933 54.5110 43.0164 176.4307 43 H 4.9912 9.3651 120.1023 53.5850 32.7414 173.2111 44 G 4.1419 9.1506 111.2083 47.0744 0.0000 172.0383 45 F 5.7598 9.2694 125.5162 56.7716 42.3409 173.1979 46 H 5.2643 9.1615 123.1162 54.0032 33.4184 172.9244 47 V 4.3726 8.6992 123.2239 62.8043 32.6778 174.6929 48 H 5.2845 9.3184 125.0760 54.0520 31.3013 175.4158 49 E 3.5575 8.8202 122.4096 58.8641 29.9225 177.2853 50 F 4.8797 8.1341 118.5977 56.0583 40.6863 176.3007 51 G 4.4468 8.4481 113.3150 44.7232 0.0000 174.1154 52 D 4.6928 8.0293 119.1792 52.6755 42.1508 174.2889 53 N 5.0688 8.4669 124.6350 53.4506 39.2657 176.4387 54 T 3.8559 8.3272 109.2619 63.8359 68.8135 174.9614 55 A 4.6736 7.6273 124.0839 51.3577 19.8973 178.0864 56 G 3.7602 8.0316 110.1938 47.4593 0.0000 175.9805 57 A 4.0320 8.4592 119.6274 55.2756 18.5297 179.8081 58 T 3.8895 7.9652 114.5054 66.4636 68.3319 175.7512 59 S 4.4950 7.5980 112.7053 59.1522 63.7803 175.6202 60 A 4.5479 7.4020 126.2190 54.5013 18.2414 178.5475 61 G 3.9687 7.8857 104.8942 44.4711 0.0000 170.6364 62 P 4.7050 0.0000 0.0000 61.8745 34.0629 175.0346 63 H 4.3694 8.4769 116.4383 56.2038 29.3228 175.5015 64 F 4.3154 9.2471 126.4085 58.1511 40.0041 175.0388 65 N 4.8545 7.8979 125.4014 51.9873 39.2087 172.1979 66 P 4.1639 0.0000 0.0000 64.5413 31.9902 178.2578 *79 R 4.2000 7.7771 117.1094 55.8575 31.8841 175.2328 80 H 4.3632 7.5655 115.8296 55.5838 29.4469 176.5606 81 V 3.4623 8.2041 121.3712 66.2580 31.4604 177.3553 82 G 3.8062 8.0782 104.9316 47.3973 0.0000 173.1448 83 D 4.8435 7.9051 120.9876 53.3686 40.1266 175.0927 84 L 4.4527 8.3642 122.7239 53.1532 42.4322 178.1184 85 G 3.9836 8.3354 109.0943 46.5254 0.0000 174.2354 86 N 5.6468 8.6387 121.4401 51.3825 42.2575 173.3179 87 V 4.3906 8.6736 113.3181 59.9253 35.2442 175.1290 88 T 5.0507 8.1815 118.6766 61.7819 71.4312 173.1101 89 A 4.5213 9.0201 129.6554 51.3303 20.5410 177.3199 90 D 4.9705 8.5970 121.6464 51.8200 41.8250 176.9542 91 K 3.8784 8.6205 117.1246 60.2520 32.2893 177.1499 92 D 4.5045 8.6011 117.4049 53.9985 41.2314 177.0212 93 G 4.2804 8.4411 108.2450 44.9242 0.0000 172.6107 94 V 4.8222 7.8421 119.2221 60.7027 33.9976 174.1919 95 A 5.1556 8.9943 129.8963 49.3880 21.0321 175.1078 96 D 4.8255 8.6621 122.9585 54.5379 41.7662 176.3866 97 V 4.1270 8.8130 125.1871 61.5872 33.4178 174.9956 98 S 4.7520 8.4895 122.4668 57.4320 64.5728 172.8153 99 I 4.8140 9.5358 128.1753 59.4082 41.6084 174.1745 100 E 5.0248 8.9078 125.7158 54.5271 31.9066 174.2505 101 D 5.1685 9.2502 127.1955 52.5896 43.8850 176.3447 102 S 4.6550 8.9464 118.5742 58.3250 64.0790 174.6106 103 V 4.0674 7.9410 120.6080 64.4900 32.3319 176.1700 104 I 4.1394 8.1825 112.1507 60.7693 38.4356 174.6423 105 S 4.6918 8.2952 113.9142 57.1532 65.4506 174.3685 106 L 4.4462 9.0580 123.3285 54.8372 41.9687 176.3993 107 S 4.6582 7.5046 112.1571 57.1511 66.4980 174.8713 108 G 3.8656 8.4331 107.1533 45.2904 0.0000 173.9055 109 D 4.4094 8.6964 117.6558 57.6516 40.8423 176.7658 110 H 4.7853 8.2839 114.4247 55.6676 28.7023 174.4524 111 A 4.4885 7.7073 124.1084 52.4720 18.7203 178.2855 112 I 3.9248 8.2294 115.5807 60.2765 38.2598 175.7707 113 I 3.7391 7.2626 122.9331 62.8814 37.4611 176.4487 114 G 3.8257 9.4650 113.3612 45.4641 0.0000 173.1388 115 R 4.8191 7.2771 119.0050 54.9232 33.6455 174.5168 116 T 4.8886 8.1096 115.6540 62.1447 71.5911 173.4747 117 L 4.7171 8.7537 129.0215 54.0508 43.6521 175.2214 118 V 4.9982 8.9472 127.0689 61.0113 34.5769 174.2885 119 V 5.0595 8.6210 127.1419 60.6488 33.5161 174.7590 120 H 5.2660 9.1661 121.5538 54.0348 30.8356 174.5903 121 E 4.2062 9.1804 121.9184 58.9172 30.0304 176.8415 122 K 4.7390 7.9476 116.7574 53.8019 35.9081 175.8128 123 A 4.3983 8.3972 123.8644 52.1709 18.7387 178.1262 124 D 4.4419 9.5466 121.8850 54.3472 39.2204 175.7002 *142 S 4.3283 7.9649 119.5650 57.9252 65.4302 172.8477 143 R 4.5791 8.3010 118.7081 54.6255 30.1731 176.4267 144 L 4.2790 8.8182 125.7423 57.5493 42.9068 177.3453 145 A 4.8324 7.6910 117.4983 50.9132 22.6988 175.0342 146 A 5.1845 9.1107 121.1279 50.8068 23.6493 175.4735 147 G 4.5944 8.4963 104.2936 45.5501 0.0000 173.1710 148 V 4.1642 8.4168 125.0583 62.8540 32.6524 175.3543 149 I 4.1795 9.1787 129.7340 61.0035 38.0344 175.3160 150 G 4.4517 9.0117 114.0285 43.8285 0.0000 171.5260 151 I 4.3495 8.3228 120.5781 61.0852 37.6740 175.6769 152 A 4.8256 8.2948 127.2005 49.7729 22.1911 176.2434 153 Q 4.0754 8.5106 118.7068 56.4322 29.2281 175.8683 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 2 T 7.93 4.69 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 3 K 7.88 5.16 0.00 1.81 1.75 0.00 1.79 0.00 0.00 1.92 0.00 0.00 3.13 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.58 1.62 7.81 4 A 9.01 5.40 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 5 V 8.78 4.96 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 0.88 0.00 0.00 6 A 9.28 5.02 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 7 V 8.41 4.41 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 8.65 4.73 0.00 1.76 1.60 1.05 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.34 4.86 0.00 1.62 1.63 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.91 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 0.00 0.00 0.00 0.00 11 D 8.82 4.47 0.00 2.68 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 12 G 7.67 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 13 P 0.00 4.51 0.00 2.18 2.16 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.94 0.00 14 V 7.55 4.23 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 0.93 0.00 0.00 15 Q 8.66 4.78 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.33 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 16 G 8.26 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 17 I 8.18 5.09 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 1.20 1.09 0.82 0.00 0.00 18 I 8.83 4.61 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.40 0.56 0.00 0.00 19 N 8.47 4.87 0.00 1.44 1.57 0.00 0.00 6.34 8.74 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 20 F 8.85 5.41 0.00 2.96 2.95 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 21 E 9.50 5.20 0.00 2.54 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 2.30 2.53 0.00 22 Q 9.67 4.81 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 23 K 8.90 4.06 0.00 1.92 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.48 7.81 24 E 7.83 4.71 0.00 2.09 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 2.31 2.33 0.00 25 S 8.92 4.04 0.00 3.83 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 26 N 8.10 4.84 0.00 2.69 2.74 0.00 0.00 6.92 7.98 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 27 G 7.58 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 0.00 0.00 0.00 28 P 0.00 4.69 0.00 1.99 2.03 0.00 3.66 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 2.04 2.10 0.00 29 V 8.92 4.67 2.25 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 1.36 0.00 0.00 1.06 0.00 0.00 30 K 9.22 4.79 0.00 1.87 1.79 0.00 1.55 0.00 0.00 1.37 0.00 0.00 2.73 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.41 7.81 31 V 9.38 4.84 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 0.73 0.00 0.00 1.06 0.00 0.00 32 W 8.88 5.52 0.00 3.53 3.13 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 33 G 7.43 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 34 S 7.71 5.10 0.00 3.84 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 35 I 8.81 5.16 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.47 0.93 0.00 0.00 36 K 9.02 4.82 0.00 1.73 1.86 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.34 7.81 37 G 8.86 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 38 L 7.66 4.49 0.00 1.83 1.45 0.81 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.16 4.23 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 8.54 4.15 0.00 1.96 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 2.29 2.33 0.00 41 G 8.21 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 0.00 0.00 0.00 42 L 8.23 4.85 0.00 1.51 1.59 0.91 0.92 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 43 H 9.37 4.99 0.00 2.98 3.34 0.00 5.64 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 9.27 5.76 0.00 2.96 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 46 H 9.16 5.26 0.00 3.28 3.07 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.70 4.37 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 0.86 0.00 0.00 0.88 0.00 0.00 48 H 9.32 5.28 0.00 3.03 3.40 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.82 3.56 0.00 1.71 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 2.14 0.00 50 F 8.13 4.88 0.00 3.37 2.88 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 51 G 8.45 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 0.00 0.00 0.00 0.00 52 D 8.03 4.69 0.00 2.64 2.86 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 53 N 8.47 5.07 0.00 2.77 2.72 0.00 0.00 6.88 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 8.33 3.86 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 55 A 7.63 4.67 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 56 G 8.03 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 0.00 0.00 0.00 57 A 8.46 4.03 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 58 T 7.97 3.89 4.34 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 1.22 0.00 0.00 59 S 7.60 4.50 0.00 4.13 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 60 A 7.40 4.55 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 61 G 7.89 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 0.00 0.00 0.00 62 P 0.00 4.70 0.00 2.08 2.22 0.00 3.71 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 63 H 8.48 4.37 0.00 2.94 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.25 4.32 0.00 2.88 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 65 N 7.90 4.85 0.00 2.41 2.46 0.00 0.00 7.26 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 4.16 0.00 2.08 1.98 0.00 3.06 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.12 0.00 *79 R 7.78 4.20 0.00 1.82 2.03 0.00 3.20 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 80 H 7.57 4.36 0.00 3.13 3.28 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.20 3.46 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 0.68 0.00 0.00 0.49 0.00 0.00 82 G 8.08 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 83 D 7.91 4.84 0.00 2.67 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 84 L 8.36 4.45 0.00 1.75 1.81 0.84 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.34 3.98 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 0.00 0.00 0.00 86 N 8.64 5.65 0.00 2.58 2.71 0.00 0.00 6.59 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 8.67 4.39 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 -0.29 0.00 0.00 0.77 0.00 0.00 88 T 8.18 5.05 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 9.02 4.52 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 90 D 8.60 4.97 0.00 2.92 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 8.62 3.88 0.00 1.88 2.00 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 D 8.60 4.50 0.00 2.78 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 93 G 8.44 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 0.00 0.00 0.00 94 V 7.84 4.82 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 0.96 0.00 0.00 0.92 0.00 0.00 95 A 8.99 5.16 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 96 D 8.66 4.83 0.00 2.57 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 97 V 8.81 4.13 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 0.80 0.00 0.00 0.63 0.00 0.00 98 S 8.49 4.75 0.00 3.91 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 99 I 9.54 4.81 2.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.88 1.01 0.00 0.00 100 E 8.91 5.02 0.00 1.96 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 2.20 2.30 0.00 101 D 9.25 5.17 0.00 2.88 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 0.00 102 S 8.95 4.66 0.00 4.03 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 0.00 103 V 7.94 4.07 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 0.86 0.00 0.00 0.95 0.00 0.00 104 I 8.18 4.14 1.93 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 1.49 0.81 1.01 0.00 0.00 105 S 8.30 4.69 0.00 3.89 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 0.00 106 L 9.06 4.45 0.00 1.75 1.67 0.97 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 0.00 107 S 7.50 4.66 0.00 3.96 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 8.43 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 0.00 0.00 0.00 109 D 8.70 4.41 0.00 2.73 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 0.00 110 H 8.28 4.79 0.00 3.22 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.71 4.49 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 0.00 112 I 8.23 3.92 1.59 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.22 0.98 0.00 0.00 113 I 7.26 3.74 1.79 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.75 0.84 0.00 0.00 114 G 9.47 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 0.00 115 R 7.28 4.82 0.00 1.56 1.87 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 1.26 1.32 0.00 116 T 8.11 4.89 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 1.24 0.00 0.00 117 L 8.75 4.72 0.00 1.80 1.58 0.31 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.95 5.00 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 0.79 0.00 0.00 119 V 8.62 5.06 2.29 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 0.79 0.00 0.00 1.02 0.00 0.00 120 H 9.17 5.27 0.00 3.24 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.84 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 4.21 0.00 2.17 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 2.38 2.34 0.00 122 K 7.95 4.74 0.00 1.75 1.69 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.43 7.81 123 A 8.40 4.40 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 0.00 124 D 9.55 4.44 0.00 2.71 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 *142 S 7.96 4.33 0.00 3.99 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 8.30 4.58 0.00 1.66 1.81 0.00 3.27 0.00 0.00 3.09 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 144 L 8.82 4.28 0.00 1.70 1.70 0.89 0.65 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 0.00 145 A 7.69 4.83 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 A 9.11 5.18 1.18 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 0.00 147 G 8.50 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 0.00 148 V 8.42 4.16 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 0.77 0.00 0.00 0.94 0.00 0.00 149 I 9.18 4.18 1.81 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.53 0.46 0.00 0.00 150 G 9.01 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 0.00 0.00 0.00 0.00 151 I 8.32 4.35 1.86 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 0.55 0.91 0.00 0.00 152 A 8.29 4.83 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 0.00 153 Q 8.51 4.08 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 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.