NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.3106 8.1693 120.6284 54.2587 43.7741 177.2164 32 E 4.3433 8.2128 113.9452 54.9117 29.3715 171.9119 33 E 4.4344 7.4670 117.8954 58.1389 31.9153 178.5517 34 Q 3.5912 7.8352 119.9360 58.1275 29.6770 177.2921 35 L 4.0494 7.8170 117.3937 55.1587 42.5595 175.4479 36 N 4.7805 7.6838 113.5253 55.6938 40.6363 176.1954 37 K 3.9380 8.8457 121.3604 59.1284 32.0913 178.9925 38 S 4.1531 7.5270 114.3263 61.6092 62.9186 176.4586 39 L 4.0415 7.7748 120.8892 56.9926 41.2928 179.3485 40 K 3.9215 8.1218 120.1636 59.6066 32.3039 178.7809 41 T 3.9835 8.2037 113.4933 64.8075 67.2443 175.8960 42 I 3.8598 8.0654 121.9969 63.7280 37.2746 177.7172 43 A 4.1532 8.1945 120.3793 53.9549 18.4872 179.0535 44 S 4.3210 8.3714 112.5080 61.0457 62.9477 175.8565 45 Q 4.0036 8.0810 120.8383 59.2267 28.4793 179.3839 46 K 4.0134 8.1283 119.8024 59.1699 32.0871 178.4332 47 A 3.9565 7.9981 121.1623 55.0855 18.3117 179.0420 48 A 3.9533 8.0413 117.8405 55.8319 18.2756 179.2337 49 I 3.6120 7.7404 117.5867 64.7487 37.2128 178.0673 50 E 3.9671 9.0431 119.1727 60.3747 28.9646 179.1656 51 N 4.3529 8.4851 116.4570 56.4204 38.4465 176.5187 52 Y 4.0690 8.4119 120.9104 60.0877 38.7987 177.9035 53 N 4.5109 8.0134 117.1014 55.5593 39.0682 176.0943 54 Q 4.5769 7.9224 119.2459 55.9154 29.5291 176.0145 55 L 4.6015 7.3439 119.7431 57.3021 43.3763 177.9086 56 K 3.8098 7.4569 119.0053 58.8886 32.1129 178.4138 57 E 3.9380 7.8791 118.6870 59.1323 29.5358 178.0482 58 D 4.5805 7.8685 118.0335 56.5470 41.3622 177.9504 59 Y 4.2172 8.2875 120.8041 60.3600 38.6901 177.6713 60 N 4.1114 7.9339 117.7081 56.5813 38.7174 177.5645 61 T 3.8774 7.3399 115.5525 66.2572 68.7205 176.0431 62 L 4.1045 7.7675 122.4123 57.6489 42.2965 178.4755 63 K 3.7706 7.6022 118.9004 58.8916 31.9602 178.7823 64 R 3.9110 7.6587 117.8578 59.5389 30.0963 178.4569 65 E 3.9627 8.1230 118.3562 59.1509 29.4974 179.2431 66 L 3.8887 7.7661 119.9907 58.1852 41.9132 178.7153 67 S 4.1939 7.7037 112.9875 61.6460 60.7597 175.8262 68 D 4.4305 8.2499 122.4925 55.7815 40.1355 177.8525 69 R 3.9244 8.0489 117.1503 56.5823 30.2998 177.3529 70 D 4.6901 7.7833 119.2909 55.9704 40.8869 178.1506 71 D 4.4214 7.6196 119.0219 56.4337 40.8257 178.3880 72 E 3.9019 7.4647 119.8754 59.4222 29.7169 179.0497 73 V 3.6629 7.2947 118.5421 65.6315 31.1386 177.9673 74 K 4.1123 7.8758 118.4606 58.7517 31.9615 179.6199 75 R 3.9329 8.1884 118.7289 59.3218 30.0347 178.9032 76 L 4.0070 7.8051 118.6525 57.7267 41.3445 179.3310 77 R 3.8502 7.7627 118.2694 59.8211 29.7869 178.2838 78 E 4.0676 7.9079 117.3342 59.1243 29.7545 178.8412 79 D 4.3769 8.5790 119.4622 58.0257 40.8845 178.0920 80 I 3.8578 8.7000 121.3703 63.0849 36.7870 177.7787 81 A 4.0202 8.0948 122.6732 55.3150 18.2217 179.5850 82 K 3.9689 7.8999 116.4077 58.1820 32.4598 177.7477 83 E 4.4950 7.7977 116.2435 56.4896 29.6386 176.3650 84 N 4.5798 8.1698 116.8732 56.0860 38.4029 176.0643 85 E 4.6435 7.6134 119.8750 57.0408 29.7059 178.3273 86 L 4.3178 7.4869 117.1099 56.3800 41.7078 177.6685 87 R 4.6495 7.2140 117.2831 56.4497 30.9424 177.5573 88 T 4.3748 7.6910 116.8651 65.2810 69.7393 176.5995 89 K 4.9456 7.8341 121.4987 58.5063 31.8895 179.0099 90 A 4.3028 8.0254 120.6736 54.2028 18.0381 178.4409 91 E 4.1129 7.9515 116.7847 57.8596 29.9821 178.0772 92 E 4.0641 7.8666 118.8274 59.2230 29.8502 178.5493 93 E 3.9910 8.5246 117.7928 59.8549 29.4258 178.0971 94 A 3.9717 7.9387 121.8848 54.3462 18.2181 178.5880 95 D 4.3299 8.1047 113.5534 57.3452 41.5162 179.6548 96 K 3.9231 7.9293 118.2015 59.5233 32.2304 179.1294 97 L 3.9854 8.1786 119.3724 58.1265 41.6296 179.5553 98 N 4.3551 8.4279 116.3964 56.3346 38.5998 177.7116 99 K 4.1180 8.3386 120.1017 59.3661 32.1067 179.0315 100 E 3.9812 8.2216 119.7113 58.9670 29.3788 179.1936 101 V 3.5395 7.6286 118.3590 65.9582 31.5100 177.4251 102 E 3.8596 8.6047 119.3901 59.5180 28.9827 178.6896 103 D 4.3866 7.9027 118.3270 57.1606 41.1271 178.2567 104 L 4.0222 7.8064 119.2754 58.6570 41.7585 180.0883 105 T 3.9583 8.2810 115.2007 66.3553 68.4543 176.7104 106 A 4.0416 7.6660 122.8289 54.9882 18.6213 179.1959 107 S 4.5809 9.6201 111.6102 59.3292 62.4892 175.5934 108 L 4.1065 7.8647 122.9315 58.2166 42.3343 178.0071 109 F 4.1135 8.3749 120.4041 61.3437 38.5937 176.6199 110 D 4.3726 7.9196 117.7408 57.2030 40.8152 177.9880 111 E 3.9432 7.9223 118.0987 59.9334 29.5313 179.7668 112 A 3.9742 8.0735 120.3319 55.0550 17.8681 179.4905 113 N 4.2075 7.9315 114.9540 56.3855 38.6523 177.4596 114 N 4.3866 9.2166 118.8415 55.8292 38.5049 176.9671 115 L 4.0468 7.6461 122.0228 57.8108 42.1992 178.4432 116 V 3.7585 7.8560 115.1697 64.1233 31.3874 176.7591 117 A 4.3114 7.3352 118.7804 55.0915 19.8049 178.7240 118 D 4.4058 7.6873 115.5101 56.7507 41.1808 177.7565 119 A 4.3617 8.0211 119.7705 53.1166 18.2992 177.6302 120 R 4.5032 7.4722 113.3791 55.9019 29.7718 177.5553 *122 E 4.2935 8.1580 118.9072 56.5545 31.1932 176.2239 123 K 4.1238 7.7611 115.9892 58.6045 33.0968 177.0052 124 Y 4.3790 7.9070 117.0857 59.4875 38.9480 177.4387 125 A 4.1530 8.1641 120.8251 54.6019 18.8008 178.8431 126 I 4.0405 7.3664 111.1639 63.4495 38.4159 177.8264 127 E 4.1294 8.0286 118.8171 58.1909 29.3731 178.6542 128 I 3.8761 7.4674 119.1345 63.5628 37.0019 177.7220 129 L 4.0291 7.8646 121.9622 57.3989 42.1146 177.4817 130 N 4.5838 7.7811 114.6765 54.2264 39.0070 174.8409 131 K 4.4294 7.6062 117.0285 56.9915 32.4579 176.4722 132 R 4.5794 7.6062 115.7335 56.2041 32.1061 177.3600 133 L 4.1168 7.9194 119.1737 56.9271 42.3402 176.9854 134 T 4.6928 7.6388 107.5214 60.8029 69.2042 174.4328 135 E 4.7579 7.9801 119.9922 56.9007 35.7481 176.7059 136 Q 4.3517 8.0231 116.1685 56.2607 29.7629 176.4188 137 L 4.4839 7.6785 120.1336 55.8788 43.0472 177.9285 138 R 4.1952 7.8228 117.0530 58.1764 30.4572 176.9652 139 E 4.2666 7.8428 114.6213 57.0133 30.1533 177.0065 140 K 4.4574 7.8544 117.2162 56.7516 33.9814 175.8626 141 D 4.6580 7.5953 117.9210 54.5735 40.8062 177.5678 *143 L 4.2523 7.8648 119.2456 54.4282 43.3813 176.3606 144 L 4.6996 7.9921 116.9109 55.3717 43.4562 176.1046 145 D 4.7996 7.9979 116.8023 56.5988 42.6635 178.2835 146 T 4.0349 7.7726 113.8222 65.3629 68.8055 175.1141 147 L 4.2636 7.8415 120.9017 55.7732 42.5776 176.3889 148 T 4.2048 7.3298 119.5455 64.4356 68.7024 173.8306 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 31 L 8.17 4.31 0.00 1.65 1.80 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.21 4.34 0.00 2.13 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 0.00 2.18 2.36 0.00 33 E 7.47 4.43 0.00 2.03 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 2.26 2.31 0.00 34 Q 7.84 3.59 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.65 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 35 L 7.82 4.05 0.00 1.61 1.82 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.68 4.78 0.00 2.81 2.83 0.00 0.00 6.77 7.07 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 37 K 8.85 3.94 0.00 1.96 1.79 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.48 7.81 38 S 7.53 4.15 0.00 3.93 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 39 L 7.77 4.04 0.00 1.86 1.72 0.92 0.84 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 40 K 8.12 3.92 0.00 1.81 1.94 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.44 7.81 41 T 8.20 3.98 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 1.31 0.00 0.00 42 I 8.07 3.86 2.05 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 1.45 1.22 0.91 0.00 0.00 43 A 8.19 4.15 1.36 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 44 S 8.37 4.32 0.00 3.93 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 45 Q 8.08 4.00 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.64 0.00 46 K 8.13 4.01 0.00 1.89 1.90 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.46 7.81 47 A 8.00 3.96 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.04 3.95 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 49 I 7.74 3.61 2.01 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 1.53 1.13 0.94 0.00 0.00 50 E 9.04 3.97 0.00 2.13 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 0.00 2.56 2.55 0.00 51 N 8.49 4.35 0.00 2.99 2.85 0.00 0.00 6.62 8.31 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 52 Y 8.41 4.07 0.00 3.09 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 53 N 8.01 4.51 0.00 2.90 2.86 0.00 0.00 6.45 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 54 Q 7.92 4.58 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 55 L 7.34 4.60 0.00 1.73 1.54 0.90 0.43 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 56 K 7.46 3.81 0.00 1.35 1.61 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.26 7.81 57 E 7.88 3.94 0.00 2.29 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 2.30 2.34 0.00 58 D 7.87 4.58 0.00 2.84 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 59 Y 8.29 4.22 0.00 2.99 3.08 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 60 N 7.93 4.11 0.00 2.71 2.78 0.00 0.00 6.92 6.90 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 61 T 7.34 3.88 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 1.19 0.00 0.00 62 L 7.77 4.10 0.00 1.84 1.63 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.60 3.77 0.00 1.45 1.46 0.00 1.25 0.00 0.00 1.39 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.33 7.81 64 R 7.66 3.91 0.00 2.01 1.91 0.00 3.14 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 65 E 8.12 3.96 0.00 2.11 1.98 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 2.31 2.49 0.00 66 L 7.77 3.89 0.00 1.71 1.79 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.70 4.19 0.00 3.84 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 68 D 8.25 4.43 0.00 2.72 2.68 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 0.00 0.00 0.00 0.00 69 R 8.05 3.92 0.00 1.86 1.93 0.00 3.26 0.00 0.00 3.16 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 70 D 7.78 4.69 0.00 2.87 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 71 D 7.62 4.42 0.00 2.84 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 72 E 7.46 3.90 0.00 2.14 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 2.30 2.35 0.00 73 V 7.29 3.66 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 0.97 0.00 0.00 0.93 0.00 0.00 74 K 7.88 4.11 0.00 1.78 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.67 7.81 75 R 8.19 3.93 0.00 2.05 2.10 0.00 3.13 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 76 L 7.81 4.01 0.00 1.71 1.72 0.92 0.83 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 77 R 7.76 3.85 0.00 1.99 2.14 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 78 E 7.91 4.07 0.00 2.06 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 2.31 2.46 0.00 79 D 8.58 4.38 0.00 2.63 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 I 8.70 3.86 1.91 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 1.64 1.02 0.91 0.00 0.00 81 A 8.09 4.02 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 82 K 7.90 3.97 0.00 1.90 1.85 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.53 7.81 83 E 7.80 4.49 0.00 1.99 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 2.27 2.30 0.00 84 N 8.17 4.58 0.00 2.96 2.81 0.00 0.00 7.14 7.36 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 85 E 7.61 4.64 0.00 2.12 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 2.29 2.29 0.00 86 L 7.49 4.32 0.00 1.66 1.72 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 87 R 7.21 4.65 0.00 1.88 1.91 0.00 3.13 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 88 T 7.69 4.37 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 1.26 0.00 0.00 89 K 7.83 4.95 0.00 1.98 1.86 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 90 A 8.03 4.30 1.31 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 91 E 7.95 4.11 0.00 2.04 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 0.00 2.34 2.38 0.00 92 E 7.87 4.06 0.00 2.24 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 2.58 0.00 93 E 8.52 3.99 0.00 2.14 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 0.00 2.49 2.33 0.00 94 A 7.94 3.97 1.41 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 0.00 0.00 95 D 8.10 4.33 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.93 3.92 0.00 1.87 1.84 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.63 7.81 97 L 8.18 3.99 0.00 1.85 1.73 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.43 4.36 0.00 2.71 2.86 0.00 0.00 7.09 8.42 0.00 0.00 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 K 8.34 4.12 0.00 1.86 1.85 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.58 7.81 100 E 8.22 3.98 0.00 2.05 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 0.00 2.31 2.32 0.00 101 V 7.63 3.54 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 1.03 0.00 0.00 0.98 0.00 0.00 102 E 8.60 3.86 0.00 2.13 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 2.29 2.35 0.00 103 D 7.90 4.39 0.00 2.97 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 0.00 104 L 7.81 4.02 0.00 1.72 1.76 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.28 3.96 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 0.00 106 A 7.67 4.04 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 0.00 107 S 9.62 4.58 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 0.00 108 L 7.86 4.11 0.00 1.99 1.81 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 109 F 8.37 4.11 0.00 3.30 3.07 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 0.00 110 D 7.92 4.37 0.00 3.04 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 0.00 111 E 7.92 3.94 0.00 2.22 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 2.61 2.51 0.00 112 A 8.07 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 7.93 4.21 0.00 2.95 2.84 0.00 0.00 6.98 6.73 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 0.00 114 N 9.22 4.39 0.00 2.73 2.86 0.00 0.00 6.65 6.62 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 0.00 115 L 7.65 4.05 0.00 1.86 1.76 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.86 3.76 2.02 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 0.84 0.00 0.00 0.89 0.00 0.00 117 A 7.34 4.31 1.37 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 0.00 118 D 7.69 4.41 0.00 2.92 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 0.00 119 A 8.02 4.36 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 0.00 120 R 7.47 4.50 0.00 2.00 2.11 0.00 2.68 0.00 0.00 3.03 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.34 0.00 *122 E 8.16 4.29 0.00 2.06 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 2.29 2.32 0.00 123 K 7.76 4.12 0.00 2.00 2.22 0.00 1.69 0.00 0.00 1.83 0.00 0.00 3.34 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.73 1.48 7.81 124 Y 7.91 4.38 0.00 3.04 3.03 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 0.00 0.00 0.00 125 A 8.16 4.15 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 0.00 126 I 7.37 4.04 1.87 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 1.73 0.69 0.98 0.00 0.00 127 E 8.03 4.13 0.00 1.92 1.93 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 2.33 2.44 0.00 128 I 7.47 3.88 2.03 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.92 0.00 0.00 129 L 7.86 4.03 0.00 1.77 1.79 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 130 N 7.78 4.58 0.00 2.80 2.78 0.00 0.00 7.05 6.03 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 0.00 131 K 7.61 4.43 0.00 1.73 1.90 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.38 7.81 132 R 7.61 4.58 0.00 1.94 1.88 0.00 3.33 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 133 L 7.92 4.12 0.00 1.58 1.68 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.64 4.69 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 1.20 0.00 0.00 135 E 7.98 4.76 0.00 1.96 1.95 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 2.30 2.27 0.00 136 Q 8.02 4.35 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 137 L 7.68 4.48 0.00 1.76 1.75 0.92 1.04 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 0.00 138 R 7.82 4.20 0.00 1.82 1.96 0.00 3.55 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 139 E 7.84 4.27 0.00 2.02 2.24 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 2.35 2.27 0.00 140 K 7.85 4.46 0.00 1.82 1.86 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.42 7.81 141 D 7.60 4.66 0.00 2.89 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 *143 L 7.86 4.25 0.00 1.85 1.70 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.99 4.70 0.00 1.72 1.73 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 145 D 8.00 4.80 0.00 2.72 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 0.00 146 T 7.77 4.03 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 0.00 147 L 7.84 4.26 0.00 1.69 1.67 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 148 T 7.33 4.20 4.40 0.00 0.00 0.00 0.00 0.00 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 * Residues marked with a * may have inaccurate shift predictions.