NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9923 8.3549 108.0269 46.2768 0.0000 172.5134 3 N 4.6536 9.3593 118.6189 51.0746 40.3727 172.8720 4 I 4.5795 8.6028 125.6077 59.9279 39.5818 174.3930 5 Y 4.6386 8.5046 123.3104 56.0368 42.2191 173.9359 6 Q 5.0442 8.7011 122.7445 54.3606 31.3867 174.2278 7 I 4.5527 8.7985 126.9059 59.4613 40.6032 174.0704 8 T 5.0578 8.4799 124.9008 61.6753 71.6190 173.3610 9 V 4.5344 8.9717 126.1167 60.9158 34.3129 173.8515 10 E 5.1996 8.6858 125.4624 54.2465 32.0566 175.5123 11 E 4.1145 9.0865 124.3245 56.4646 29.9886 178.4089 12 K 3.9946 8.9381 123.5823 58.0794 33.1414 176.2809 13 A 4.8585 7.7133 123.9786 52.1236 22.4623 176.8152 14 E 3.6045 8.5370 114.4787 58.8564 27.4768 171.6688 *15 H 4.5966 8.9828 115.7327 55.5740 28.4127 173.2857 16 Q 3.8874 7.7680 116.8510 56.8928 26.7722 174.3997 17 R 4.4086 8.2266 116.3122 56.5148 31.8081 177.5994 18 T 5.3239 8.3619 110.8728 60.0002 72.1612 172.8788 19 L 5.0284 8.8590 122.2285 54.5239 44.3987 175.1151 20 S 5.2334 8.6820 114.2847 57.2947 65.6896 172.6869 21 F 5.0704 8.8049 120.4053 56.3158 41.5743 172.4608 22 E 5.4269 9.0429 118.5810 54.9865 31.9492 175.3667 23 F 5.2311 8.7565 116.1062 55.7578 42.1279 172.9059 24 S 5.2536 8.9368 113.5341 56.5895 64.9715 172.9042 25 L 5.0199 9.0562 126.0600 53.2867 44.9706 177.3728 26 H 4.1169 9.1155 121.6409 59.3181 30.1793 175.8674 27 D 4.5569 7.8499 116.9917 53.5344 41.7750 176.3730 28 D 4.7063 8.4692 120.6157 53.6020 41.5450 176.5012 29 L 3.9807 9.1657 130.7495 58.3204 42.0487 178.9291 30 F 3.9899 8.6741 117.2475 60.3076 39.1290 177.4711 31 K 4.0112 8.6260 119.3729 59.3300 32.0166 178.6277 32 L 3.9539 8.0361 120.6597 58.1741 41.9975 178.8425 33 L 3.9744 7.9506 118.8979 57.8923 41.2923 179.3658 34 E 3.9847 7.9911 117.4325 59.3522 29.4846 179.3183 35 K 4.1463 7.7606 117.0663 59.4335 32.6118 179.1663 36 V 4.0689 7.6481 110.1288 60.2684 31.5779 175.4240 37 D 4.4118 7.3648 119.2955 55.8688 41.1610 175.8769 38 G 4.0751 9.0264 116.5001 47.0173 0.0000 174.2038 39 K 4.4126 7.7341 119.2440 53.2048 32.5169 180.5044 *41 D 4.3633 7.6256 123.3165 53.0074 41.5658 176.7492 *43 T 4.2178 7.1563 113.7910 60.8074 71.8102 173.0228 44 P 4.2158 0.0000 0.0000 66.0351 31.3155 178.8602 45 E 4.0147 8.1155 116.7483 59.3272 29.4239 179.3158 46 Q 4.0031 7.8716 118.2471 59.2958 28.6149 178.6826 47 T 3.9374 7.8210 115.4407 66.8732 68.5769 176.3841 48 Q 4.0866 7.9512 118.2167 58.9090 29.0012 178.2702 49 A 4.1867 8.1490 121.8218 55.0518 18.3592 179.2896 50 F 4.2258 8.6775 115.3980 59.9062 39.1501 176.5866 *52 V 3.8768 7.6969 118.0028 63.0588 33.2423 177.6532 53 G 3.5522 8.3150 106.5896 47.7049 0.0000 175.3521 54 L 4.0179 7.8451 123.3641 57.8570 42.1352 179.2954 55 K 4.0414 7.8901 117.9091 59.1814 31.9270 179.2796 56 L 3.6987 7.8447 119.3337 57.7050 41.3535 179.3043 57 F 4.2114 8.2458 119.3601 61.2959 39.4230 177.0210 58 G 3.6937 8.3381 104.5292 47.5833 0.0000 174.9962 59 E 4.1720 7.8319 120.6215 58.4052 31.2072 178.9774 60 V 3.7330 7.0276 120.5101 63.3433 27.8954 175.5973 *63 Q 4.2778 7.9339 120.3787 54.7825 31.2882 176.1622 64 Q 4.7846 7.7659 117.0734 54.9545 29.6076 177.8587 65 R 3.8495 8.3136 119.7194 59.5266 30.2320 177.0402 66 K 4.3323 7.9405 113.2560 56.7091 32.7878 176.5128 67 H 4.2032 8.2339 120.7574 55.5695 30.2896 174.2102 68 P 4.3088 0.0000 0.0000 65.6996 31.4063 178.6078 69 L 3.8881 8.0397 116.7120 56.8388 41.6126 177.6873 70 F 5.1424 7.9099 115.5829 57.6305 40.7729 177.6924 71 K 4.0013 7.8759 122.1094 59.8026 31.7960 178.6113 72 E 4.1444 8.2139 116.2929 58.6256 29.7382 178.0455 73 F 4.8326 8.1451 119.9726 59.2888 39.5949 177.4547 74 S 4.1015 7.9475 113.6034 61.9310 62.9414 176.0564 75 A 3.9581 8.0050 124.1621 54.4614 18.2443 177.5412 76 P 4.2182 0.0000 0.0000 65.8142 31.2098 178.6716 77 F 4.0155 7.8350 118.4865 61.1308 39.2754 177.1620 78 R 3.9511 8.3087 117.2055 59.1360 29.9499 178.4957 79 A 4.1522 7.8089 119.5336 54.4434 19.9074 179.0242 80 F 4.4131 7.9702 120.0156 58.7767 34.8535 174.9161 *83 N 4.5790 7.8801 119.2839 52.9790 41.3433 177.2302 84 L 3.8453 7.7953 118.2165 57.6380 41.8138 179.6729 85 K 3.9864 7.8396 116.4961 59.2102 32.1138 178.4115 86 K 4.0622 7.6590 119.3683 59.2170 32.3217 177.6827 87 Q 4.1524 7.6462 121.6679 55.0987 27.9791 180.6509 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 G 8.35 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 3 N 9.36 4.65 0.00 2.72 2.31 0.00 0.00 7.35 6.34 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 4 I 8.60 4.58 1.66 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.41 0.78 0.00 0.00 5 Y 8.50 4.64 0.00 1.43 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 6 Q 8.70 5.04 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 7 I 8.80 4.55 1.99 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.24 -0.00 0.00 0.00 8 T 8.48 5.06 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 1.28 0.00 0.00 9 V 8.97 4.53 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 1.03 0.00 0.00 0.98 0.00 0.00 10 E 8.69 5.20 0.00 1.97 1.90 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 2.17 2.31 0.00 11 E 9.09 4.11 0.00 2.03 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 2.31 0.00 12 K 8.94 3.99 0.00 1.75 1.87 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.44 7.81 13 A 7.71 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 14 E 8.54 3.60 0.00 2.17 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.86 0.00 *15 H 8.98 4.60 0.00 2.92 2.97 0.00 7.32 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.77 3.89 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.89 0.00 0.00 0.00 0.00 0.00 2.43 2.27 0.00 17 R 8.23 4.41 0.00 1.92 1.86 0.00 3.08 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 18 T 8.36 5.32 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 1.28 0.00 0.00 19 L 8.86 5.03 0.00 1.86 1.82 1.27 0.73 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 20 S 8.68 5.23 0.00 3.89 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 21 F 8.80 5.07 0.00 3.17 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 22 E 9.04 5.43 0.00 1.96 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 2.33 0.00 23 F 8.76 5.23 0.00 3.23 3.33 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 24 S 8.94 5.25 0.00 3.88 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 25 L 9.06 5.02 0.00 1.99 1.69 1.06 1.11 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 26 H 9.12 4.12 0.00 3.17 3.39 0.00 5.72 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 7.85 4.56 0.00 2.79 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 28 D 8.47 4.71 0.00 2.77 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 29 L 9.17 3.98 0.00 1.53 1.50 0.83 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.67 3.99 0.00 3.30 3.14 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 31 K 8.63 4.01 0.00 1.91 2.01 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.49 7.81 32 L 8.04 3.95 0.00 2.07 1.83 0.94 0.72 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 33 L 7.95 3.97 0.00 1.81 1.62 0.55 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 34 E 7.99 3.98 0.00 2.18 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 2.55 0.00 35 K 7.76 4.15 0.00 2.20 1.88 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.35 7.81 36 V 7.65 4.07 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 0.90 0.00 0.00 1.05 0.00 0.00 37 D 7.36 4.41 0.00 2.71 2.77 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 38 G 9.03 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 39 K 7.73 4.41 0.00 1.77 1.58 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.21 7.81 *41 D 7.63 4.36 0.00 2.72 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 *43 T 7.16 4.22 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 44 P 0.00 4.22 0.00 2.17 2.14 0.00 3.59 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 2.11 2.18 0.00 45 E 8.12 4.01 0.00 2.06 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 2.40 2.46 0.00 46 Q 7.87 4.00 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 47 T 7.82 3.94 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 1.24 0.00 0.00 48 Q 7.95 4.09 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 49 A 8.15 4.19 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 50 F 8.68 4.23 0.00 3.18 3.29 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 *52 V 7.70 3.88 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 0.84 0.00 0.00 0.86 0.00 0.00 53 G 8.32 3.55 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 0.00 0.00 0.00 54 L 7.85 4.02 0.00 1.37 1.44 1.18 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.89 4.04 0.00 1.78 1.89 0.00 1.76 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.46 7.81 56 L 7.84 3.70 0.00 1.87 1.64 0.87 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.25 4.21 0.00 2.95 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 58 G 8.34 3.69 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 0.00 0.00 0.00 59 E 7.83 4.17 0.00 2.23 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 0.00 2.59 2.43 0.00 60 V 7.03 3.73 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 0.97 0.00 0.00 0.91 0.00 0.00 *63 Q 7.93 4.28 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.30 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 64 Q 7.77 4.78 0.00 2.36 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 65 R 8.31 3.85 0.00 1.74 1.98 0.00 3.23 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 66 K 7.94 4.33 0.00 1.82 1.86 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.38 7.81 67 H 8.23 4.20 0.00 3.43 3.33 0.00 5.60 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 68 P 0.00 4.31 0.00 2.17 2.07 0.00 3.36 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 69 L 8.04 3.89 0.00 0.79 1.16 0.61 0.64 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 70 F 7.91 5.14 0.00 3.11 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 71 K 7.88 4.00 0.00 1.99 1.87 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.55 7.81 72 E 8.21 4.14 0.00 2.07 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 2.37 2.41 0.00 73 F 8.15 4.83 0.00 3.06 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 74 S 7.95 4.10 0.00 4.14 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 75 A 8.01 3.96 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 76 P 0.00 4.22 0.00 2.14 2.19 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 77 F 7.84 4.02 0.00 1.91 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 78 R 8.31 3.95 0.00 1.86 1.96 0.00 3.23 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 79 A 7.81 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 80 F 7.97 4.41 0.00 3.14 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 *83 N 7.88 4.58 0.00 2.90 2.83 0.00 0.00 6.99 6.74 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 84 L 7.80 3.85 0.00 1.41 1.57 0.66 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 7.84 3.99 0.00 1.68 1.83 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.39 7.81 86 K 7.66 4.06 0.00 1.88 1.84 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.34 7.81 87 Q 7.65 4.15 0.00 2.10 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.55 0.00 0.00 0.00 0.00 0.00 2.31 2.17 0.00 * Residues marked with a * may have inaccurate shift predictions.