NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 Y 4.6706 8.0033 121.6881 57.3906 40.0145 173.7047 26 Q 4.1899 7.3010 123.8988 51.2484 31.7778 173.2320 27 P 4.4138 0.0000 0.0000 60.6709 33.1002 173.2913 28 P 4.5868 0.0000 0.0000 61.9371 32.0138 177.6030 29 S 4.0424 8.7682 113.1415 61.2299 62.6450 174.8473 30 D 4.7924 8.0621 116.4346 53.6759 41.8215 174.7171 31 Y 4.4004 7.5834 118.1991 56.4594 38.6766 174.7890 32 K 4.5074 8.4393 126.2421 54.1031 33.8894 175.5582 33 Q 4.0204 8.6419 127.3865 56.3512 29.4025 175.3206 34 C 4.3781 8.7306 123.5633 59.6288 28.4169 172.7179 35 K 4.3702 8.8094 125.7341 57.2416 34.0071 176.2918 36 H 4.9575 7.8296 114.7689 54.7184 28.8735 174.4455 37 L 4.2035 7.2856 118.5138 54.8335 42.4869 177.8342 38 K 4.4230 8.2910 120.5593 55.2538 33.2022 177.4168 39 S 4.4014 8.4519 116.9206 58.3741 63.6750 173.3665 40 F 4.7481 8.3496 123.0087 55.8421 41.9123 173.4554 41 P 4.4100 0.0000 0.0000 62.1452 29.4576 176.9681 42 V 3.9794 8.2053 124.4527 65.2662 32.0964 178.5640 43 S 4.1773 8.0488 113.8581 61.1784 63.0306 175.4264 44 E 4.0466 7.5144 119.9489 58.7285 27.7227 178.0155 45 L 4.1047 7.4534 119.1892 57.6166 42.0509 179.3130 46 K 4.0735 8.1819 118.2285 59.4899 32.2506 177.9299 47 G 3.8733 7.2887 105.2786 45.9161 0.0000 172.6215 48 D 5.0550 8.2985 117.4423 54.0431 41.3742 177.2049 49 N 4.8067 8.1112 116.1879 53.9107 41.6834 174.0562 50 K 4.5568 7.8574 115.3635 54.7226 34.0361 175.1860 51 E 4.7108 8.3431 120.7944 54.1357 31.9648 174.8798 52 L 4.5371 8.7684 128.5600 54.9784 43.4834 175.2472 53 W 5.4490 9.2234 125.3921 54.9109 32.2693 174.4155 54 L 4.7274 8.4712 125.1483 53.8930 44.9557 175.4107 55 M 5.1488 7.7489 121.0040 55.0840 35.9089 173.4541 56 K 4.2074 8.1227 115.2930 56.5395 35.6209 174.9491 57 V 4.6499 8.4458 126.9466 60.2879 34.2202 173.4247 58 P 4.4301 0.0000 0.0000 62.3709 31.9011 177.3938 59 A 4.0940 8.5204 123.6900 55.0078 18.6027 178.7912 60 N 4.4332 8.3304 112.6856 56.1552 38.7907 175.4239 61 I 4.0278 7.2307 118.4281 60.4118 37.6238 175.5387 62 D 4.6027 8.4136 125.1455 53.0159 39.8190 176.5128 63 I 3.9709 8.0324 126.1705 62.5209 37.6186 177.8653 64 S 4.3143 7.9759 115.3418 61.2051 63.3454 175.7529 65 Q 4.0668 7.6610 118.7650 58.0438 28.6359 177.0191 66 L 3.9433 7.9035 117.7233 55.2623 41.9059 176.5927 67 K 4.3096 8.6401 124.5350 57.5574 33.2220 176.3273 68 S 4.6412 7.5791 110.3348 56.9047 66.0140 173.5758 69 L 4.7014 8.0073 122.1996 53.2927 41.4676 176.1568 70 P 4.5449 0.0000 0.0000 61.5328 29.9395 174.6954 71 L 4.4283 7.6863 122.4517 53.0912 43.6856 176.4910 72 D 4.6366 8.2888 125.9081 53.6336 39.6866 175.4146 73 T 4.3346 8.1313 115.4185 63.4795 69.6569 176.6564 74 D 4.4064 8.1296 120.1942 55.2989 39.8452 176.1748 75 A 4.3984 7.7063 121.9407 52.0527 20.9029 175.7006 76 T 4.3343 8.5184 110.9084 65.0118 69.9168 175.1453 77 V 4.7835 7.5088 121.1329 61.7697 34.2255 173.2498 78 S 4.9626 8.6355 121.9365 56.6541 67.2133 172.7667 79 T 5.1405 8.5758 109.0396 58.6182 69.9717 173.8839 80 V 3.8483 8.2840 127.6999 61.0667 32.9979 175.0316 81 E 4.3762 8.9446 127.4655 55.6792 29.9310 175.4709 82 L 4.4545 8.6722 127.4262 53.5971 42.4319 176.1602 83 G 4.2191 8.4005 113.0699 45.9465 0.0000 173.0891 84 S 4.6056 7.9628 114.8871 56.2651 64.9168 174.2157 85 K 4.4730 8.2382 119.7721 54.8418 33.7999 174.8631 86 N 4.8326 8.3833 120.2880 52.3952 39.0235 174.4241 87 F 5.0302 8.6978 122.5379 55.9551 41.9099 174.7524 88 N 5.0492 9.1348 119.5176 51.6030 41.3878 173.8911 89 V 4.7311 8.8630 123.5084 61.1662 33.5425 174.0691 90 L 4.7673 8.6649 130.6259 52.8674 44.0402 175.0672 91 Q 4.2088 8.1759 127.4524 56.5797 29.7112 176.7554 92 N 4.2522 8.4530 125.3191 56.8543 38.6843 177.3649 93 T 4.2605 7.5691 108.4854 63.1355 67.4278 174.1801 94 S 4.5334 7.2907 115.5574 60.3274 64.3747 175.0387 95 T 4.0944 7.5268 110.0337 61.2376 69.0700 175.2322 96 Q 4.0144 8.4212 123.3435 58.7645 29.6131 177.4868 97 E 4.0515 8.3390 116.9541 59.2650 29.7489 177.7503 98 G 3.9682 7.7852 105.3668 45.3812 0.0000 175.4161 99 S 4.0334 7.7552 117.7827 61.1843 62.9361 174.8672 100 D 4.7819 7.5891 117.4389 53.7461 42.6987 176.5663 101 N 5.0009 7.9519 114.9118 53.1317 40.4095 175.0283 102 T 3.7102 7.4295 106.1525 61.2992 70.2899 176.1314 103 N 4.4937 7.9738 119.8057 54.6721 38.1022 175.2255 104 L 4.6662 7.8637 118.9563 52.9700 42.9548 175.7571 105 S 4.8437 8.5938 117.5824 56.2283 64.5083 172.7440 106 L 4.6532 7.9634 123.1555 53.4983 44.4912 174.7933 107 L 5.0725 8.3457 124.9203 53.0027 43.6959 175.5887 108 I 4.2783 8.7631 119.2681 58.4998 39.7232 173.5349 109 P 4.7309 0.0000 0.0000 61.5723 30.1268 175.7297 110 S 4.0978 7.7966 120.5202 59.8305 63.7464 174.1897 *113 K 4.0916 7.5386 121.4644 55.7373 33.5030 176.4295 114 K 4.2259 8.3185 118.1346 57.4951 32.5528 178.4780 115 E 3.8964 8.0651 119.7570 57.3694 30.1672 176.0480 116 T 4.7225 7.6162 106.4488 59.4665 71.6898 172.5687 117 L 4.8970 8.2978 122.3155 53.1871 44.0962 175.7690 118 K 4.6313 8.7262 121.5573 54.4385 36.2676 174.8078 119 V 4.4914 8.0707 120.7182 61.6003 32.2220 175.3138 120 A 4.2031 8.0425 129.0844 52.2023 19.2122 176.3214 121 T 4.7177 8.4846 113.3752 59.9899 71.0161 173.4182 122 S 4.5193 8.7397 117.4968 59.4691 64.6634 175.0843 123 K 4.4167 7.6985 115.5030 55.2348 34.4751 176.7416 *127 S 3.8759 7.7993 112.1684 57.5942 62.7720 171.2460 128 V 4.0426 7.6085 125.5515 61.6841 33.0490 174.4882 129 Y 4.6509 8.0257 124.6792 55.9393 40.8972 174.6718 130 F 4.8106 8.5775 118.6234 57.6935 39.8820 175.5327 131 D 4.9185 8.6126 122.4541 54.9677 43.0715 176.6503 132 R 4.1577 7.4536 117.1158 55.0774 33.9608 173.7230 133 V 4.5605 7.6434 125.2570 60.9220 34.9506 173.8974 134 F 5.0408 8.8487 125.3607 56.3118 42.3936 174.3440 135 T 4.5911 8.2896 122.1183 62.0971 68.9641 173.2991 136 I 4.8770 8.0409 126.7909 60.6336 38.2153 175.5207 137 S 4.7365 9.2518 120.6123 57.1111 67.2314 173.6202 138 E 4.3057 8.5479 120.6326 56.7522 27.3992 176.8194 139 T 3.8369 7.7735 112.4788 61.9110 70.4868 173.2588 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 25 Y 8.00 4.67 0.00 2.97 2.90 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 26 Q 7.30 4.19 0.00 1.87 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.89 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 27 P 0.00 4.41 0.00 2.23 2.15 0.00 3.21 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 28 P 0.00 4.59 0.00 2.56 2.16 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.06 0.00 29 S 8.77 4.04 0.00 3.98 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 30 D 8.06 4.79 0.00 2.50 2.49 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 31 Y 7.58 4.40 0.00 2.80 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 32 K 8.44 4.51 0.00 1.72 1.72 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.42 7.81 33 Q 8.64 4.02 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 34 C 8.73 4.38 0.00 3.04 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 35 K 8.81 4.37 0.00 1.72 1.80 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.27 1.42 7.81 36 H 7.83 4.96 0.00 3.15 3.26 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.29 4.20 0.00 1.67 1.63 1.01 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.29 4.42 0.00 1.80 1.77 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.40 7.81 39 S 8.45 4.40 0.00 4.01 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 40 F 8.35 4.75 0.00 2.91 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 41 P 0.00 4.41 0.00 2.02 1.85 0.00 2.28 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.84 0.00 42 V 8.21 3.98 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 1.06 0.00 0.00 1.11 0.00 0.00 43 S 8.05 4.18 0.00 4.00 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 44 E 7.51 4.05 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.21 0.00 45 L 7.45 4.10 0.00 1.94 1.69 1.10 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.18 4.07 0.00 1.74 1.90 0.00 1.95 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 47 G 7.29 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 48 D 8.30 5.06 0.00 2.66 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 49 N 8.11 4.81 0.00 2.60 2.76 0.00 0.00 7.20 6.68 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 50 K 7.86 4.56 0.00 1.93 1.70 0.00 1.83 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.40 7.81 51 E 8.34 4.71 0.00 2.04 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 0.00 2.54 2.44 0.00 52 L 8.77 4.54 0.00 1.96 1.73 1.20 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 53 W 9.22 5.45 0.00 3.16 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 54 L 8.47 4.73 0.00 0.40 0.87 0.56 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 55 M 7.75 5.15 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 56 K 8.12 4.21 0.00 1.76 1.61 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.34 7.81 57 V 8.45 4.65 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 0.76 0.00 0.00 0.93 0.00 0.00 58 P 0.00 4.43 0.00 2.35 2.05 0.00 3.61 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.21 0.00 59 A 8.52 4.09 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 60 N 8.33 4.43 0.00 2.85 3.01 0.00 0.00 6.93 7.45 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 61 I 7.23 4.03 1.77 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.42 0.79 0.00 0.00 62 D 8.41 4.60 0.00 2.68 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 63 I 8.03 3.97 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.91 0.89 0.00 0.00 64 S 7.98 4.31 0.00 3.97 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 65 Q 7.66 4.07 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 66 L 7.90 3.94 0.00 1.76 1.61 0.85 0.79 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 67 K 8.64 4.31 0.00 1.70 1.81 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.40 7.81 68 S 7.58 4.64 0.00 3.95 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 69 L 8.01 4.70 0.00 1.55 1.59 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.54 0.00 2.08 2.00 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 71 L 7.69 4.43 0.00 1.62 1.34 0.25 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.29 4.64 0.00 2.67 2.59 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 73 T 8.13 4.33 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 1.24 0.00 0.00 74 D 8.13 4.41 0.00 2.82 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 75 A 7.71 4.40 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 76 T 8.52 4.33 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 77 V 7.51 4.78 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 0.83 0.00 0.00 0.95 0.00 0.00 78 S 8.64 4.96 0.00 4.01 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 79 T 8.58 5.14 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 1.26 0.00 0.00 80 V 8.28 3.85 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 0.74 0.00 0.00 0.90 0.00 0.00 81 E 8.94 4.38 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 82 L 8.67 4.45 0.00 1.84 1.48 0.67 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.40 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 0.00 0.00 0.00 0.00 84 S 7.96 4.61 0.00 3.80 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 85 K 8.24 4.47 0.00 1.62 1.51 0.00 1.87 0.00 0.00 2.08 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.52 7.81 86 N 8.38 4.83 0.00 2.54 2.74 0.00 0.00 6.91 7.45 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 87 F 8.70 5.03 0.00 3.11 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 88 N 9.13 5.05 0.00 2.73 2.73 0.00 0.00 6.53 8.48 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 89 V 8.86 4.73 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 1.06 0.00 0.00 0.90 0.00 0.00 90 L 8.66 4.77 0.00 1.76 1.52 0.93 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.18 4.21 0.00 2.44 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.59 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 92 N 8.45 4.25 0.00 2.76 2.76 0.00 0.00 6.21 6.93 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 93 T 7.57 4.26 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 0.98 0.00 0.00 94 S 7.29 4.53 0.00 4.01 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 95 T 7.53 4.09 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 1.25 0.00 0.00 96 Q 8.42 4.01 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.11 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 97 E 8.34 4.05 0.00 1.98 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 2.30 2.29 0.00 98 G 7.79 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 99 S 7.76 4.03 0.00 3.79 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 0.00 100 D 7.59 4.78 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.95 5.00 0.00 2.67 2.78 0.00 0.00 6.88 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 0.00 102 T 7.43 3.71 4.01 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 0.84 0.00 0.00 103 N 7.97 4.49 0.00 2.86 2.97 0.00 0.00 6.06 7.79 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 0.00 104 L 7.86 4.67 0.00 1.89 1.91 1.00 0.84 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 0.00 105 S 8.59 4.84 0.00 3.89 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 0.00 106 L 7.96 4.65 0.00 1.46 1.33 0.87 0.21 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 0.00 107 L 8.35 5.07 0.00 1.48 1.51 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 108 I 8.76 4.28 1.87 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 1.29 0.78 0.82 0.00 0.00 109 P 0.00 4.73 0.00 2.21 2.15 0.00 3.56 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 2.18 2.05 0.00 110 S 7.80 4.10 0.00 4.00 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 *113 K 7.54 4.09 0.00 1.90 1.89 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.41 7.81 114 K 8.32 4.23 0.00 1.83 1.87 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.62 1.43 7.81 115 E 8.07 3.90 0.00 1.91 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 2.26 2.28 0.00 116 T 7.62 4.72 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 1.21 0.00 0.00 117 L 8.30 4.90 0.00 1.48 1.57 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.73 4.63 0.00 1.65 1.66 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.32 7.81 119 V 8.07 4.49 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.88 0.00 0.00 120 A 8.04 4.20 1.15 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 0.00 121 T 8.48 4.72 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 122 S 8.74 4.52 0.00 3.92 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 0.00 123 K 7.70 4.42 0.00 1.69 1.81 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.33 1.40 7.81 *127 S 7.80 3.88 0.00 3.85 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 0.00 128 V 7.61 4.04 1.89 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 0.72 0.00 0.00 0.87 0.00 0.00 129 Y 8.03 4.65 0.00 2.95 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 0.00 130 F 8.58 4.81 0.00 3.07 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 0.00 131 D 8.61 4.92 0.00 2.66 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 R 7.45 4.16 0.00 1.37 0.91 0.00 2.45 0.00 0.00 2.81 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 133 V 7.64 4.56 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 0.83 0.00 0.00 0.71 0.00 0.00 134 F 8.85 5.04 0.00 2.91 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 0.00 135 T 8.29 4.59 4.36 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 1.23 0.00 0.00 136 I 8.04 4.88 1.86 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 1.23 0.37 0.83 0.00 0.00 137 S 9.25 4.74 0.00 3.88 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 0.00 138 E 8.55 4.31 0.00 1.86 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 1.85 1.89 0.00 139 T 7.77 3.84 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.