NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 K 4.1972 8.3149 120.1224 56.2105 33.4855 174.4140 24 L 4.5661 7.7210 119.4626 50.7422 45.0551 175.7454 25 T 4.1513 8.3694 112.9983 61.1654 71.8148 175.1123 26 A 3.9765 8.4366 123.4611 55.5560 18.4270 180.2977 27 K 3.9996 8.0059 116.3602 59.5672 32.1950 179.5479 28 Q 4.0576 7.8785 118.4709 58.9295 28.5415 178.8058 29 I 3.8088 7.9518 120.9506 64.5198 37.1603 178.5439 30 Q 4.2079 8.6155 119.0805 59.0082 28.4155 178.6931 31 A 4.1252 8.7436 121.9646 54.8894 18.4513 179.6930 32 A 3.9293 8.3013 119.3608 55.6896 18.3967 179.3075 33 Y 4.1799 7.8614 114.9535 61.2646 37.7299 178.9535 34 L 4.2769 7.8963 121.4662 57.5627 42.5334 178.5439 35 L 4.0852 7.7180 120.3510 58.2282 42.0682 179.0432 36 V 3.3271 7.4116 117.6789 65.8592 30.8965 177.5049 37 E 3.8221 7.5094 118.2700 59.6044 29.0277 178.8747 38 N 4.3417 7.9699 116.2124 56.2708 39.0211 175.8551 39 E 4.4750 7.9913 117.6065 56.5768 30.6279 176.5725 40 L 4.5388 7.5766 117.3461 54.3192 42.2946 175.8395 *48 K 4.1274 7.8156 119.0507 56.3933 32.9892 174.8083 49 R 4.5903 8.2121 119.5172 53.6106 33.6023 176.5385 50 T 4.2489 8.3336 113.3461 60.8727 71.1461 175.3891 51 Q 3.9914 8.6099 119.5544 59.5630 28.6032 179.1960 52 D 4.3021 8.0311 118.1116 57.1337 41.3711 177.6785 53 E 3.9715 7.7965 117.9743 59.8767 29.5128 179.3507 54 M 4.0838 8.7438 118.5722 58.3825 31.9047 178.6996 55 A 4.0306 8.2092 121.1060 55.1542 17.9947 179.2409 56 N 4.3165 8.6409 116.0955 56.6708 38.7863 177.0868 57 E 4.0379 7.9713 119.3302 59.4657 29.7050 179.1275 58 L 4.2625 7.9090 117.4726 55.3267 41.7590 177.4713 59 G 3.8895 7.6772 105.6939 46.6188 0.0000 173.2002 60 I 4.5421 7.2152 111.1331 57.7965 40.5162 175.1109 61 N 4.5225 8.1358 118.4364 53.2208 40.4468 175.8636 62 R 3.9022 8.4060 124.0591 59.7356 30.2208 179.5226 63 T 4.0073 7.9628 114.9818 66.9836 68.6293 176.6283 64 T 3.4568 7.6861 117.1537 66.2945 68.4380 176.1958 65 L 3.6661 7.3068 122.1430 57.7371 41.8755 178.8502 66 W 4.2416 7.6433 126.8668 60.4190 30.6852 177.5256 67 E 3.3368 7.7211 117.5712 58.8894 28.9399 179.1080 68 W 4.3155 7.2584 117.2766 59.1654 30.4148 178.7919 69 R 4.5280 7.4374 117.8417 56.2011 25.5704 175.7558 *75 F 4.9741 7.7085 123.2786 58.3225 41.9558 176.1237 76 I 3.8775 7.5578 119.7204 60.3935 34.7849 174.0667 77 A 4.4597 6.6010 123.4944 52.7098 22.6957 178.5083 78 F 4.0949 8.1903 114.5151 60.6623 40.1196 177.5917 79 K 3.4720 8.0167 118.7567 59.7738 31.7568 178.6507 80 S 3.9926 7.6887 114.7375 61.3069 62.8055 176.0661 81 E 3.8183 7.7194 121.7199 59.2489 29.3084 179.3274 82 V 3.6138 7.4905 112.4298 63.8950 31.4467 178.4633 83 A 3.8285 7.6692 120.6894 55.3137 18.2156 179.4032 84 D 4.3045 8.1519 117.5078 57.5462 40.8419 179.0329 85 S 4.0895 8.5478 114.0321 61.2956 62.1488 176.1928 86 F 3.8527 8.7641 119.9298 60.4648 39.0818 177.1149 87 L 4.1010 8.1584 119.6872 58.0599 41.7383 178.6467 88 A 3.9458 8.3604 121.2080 55.3007 18.0915 179.1537 89 E 3.9177 7.9468 116.1084 58.4193 29.9309 177.5111 90 K 4.2664 7.7407 117.2796 56.6348 32.5874 178.2232 91 R 3.5180 7.6652 121.5680 59.8950 29.7025 178.3393 92 E 3.9300 7.9318 117.2534 59.3303 29.3494 179.2436 93 Q 4.0013 7.9218 117.9104 58.7528 28.8154 178.6969 94 V 3.6036 7.7275 119.3525 66.2921 31.6076 177.6750 95 Y 4.4520 8.1044 116.6000 61.1546 37.6330 178.6684 96 S 4.1649 8.4419 114.1341 61.4803 62.5628 176.3866 97 K 3.9947 7.9330 120.9649 59.2190 31.7319 178.9843 98 L 3.9875 8.1895 120.6278 58.7049 42.0319 179.1192 99 M 4.1326 8.3094 118.4968 58.4129 31.8474 178.7831 100 Q 4.0141 8.3449 118.3968 58.9404 28.8450 178.8848 101 L 4.0256 8.0370 120.0583 57.7945 41.4315 179.5988 102 I 3.7067 7.6353 118.8607 63.7905 37.1888 177.6026 103 L 4.5909 7.8649 116.6853 54.4989 42.3208 177.4477 104 G 3.9340 7.8341 107.2490 43.2793 0.0000 172.3412 105 P 4.3472 0.0000 0.0000 64.6462 31.8401 176.7039 106 Q 4.5975 7.1084 117.9173 52.7096 28.5275 172.8727 107 P 4.3929 0.0000 0.0000 63.0456 32.5338 176.2112 108 S 4.5298 8.6487 118.2301 56.9405 62.6663 175.1402 109 V 3.6852 8.3847 129.2905 64.7108 31.2105 178.1127 110 K 3.9209 8.0763 119.6565 59.2248 32.0083 178.4697 111 A 4.0547 8.1958 121.1103 55.3849 18.3073 179.4558 112 M 4.0189 8.1518 117.2472 58.4825 31.9359 178.5341 113 Q 4.0173 8.4395 120.0278 59.4404 29.1294 178.7314 114 L 4.1226 7.9819 119.7745 57.7949 41.8039 178.6072 115 Y 3.8824 8.3174 119.8115 61.2502 38.6325 178.4466 116 M 4.3782 8.4127 119.3071 58.5729 32.1955 178.8033 117 Q 3.9480 8.4307 118.5313 58.8446 28.5989 178.6920 118 R 3.5425 7.7986 119.6244 58.7227 30.0224 177.0074 119 F 4.6568 7.3173 112.3091 56.4573 39.1311 175.5948 120 G 3.9220 7.5502 107.9176 46.8672 0.0000 175.1000 121 L 4.3568 8.2227 119.5859 54.7662 42.4969 177.0537 122 L 4.6395 7.7516 119.0001 53.1830 43.0643 175.6479 123 T 4.6049 8.4060 120.0477 61.7095 70.6562 173.3157 124 D 4.8978 8.5826 125.2247 52.3024 42.9628 175.4251 125 K 4.5143 8.5325 125.0831 54.5404 33.7252 175.3680 126 K 4.5464 8.4920 124.6303 54.4536 34.9130 175.4471 127 V 4.2679 8.4055 123.0642 61.0759 32.8206 174.5530 128 I 4.4811 8.2860 127.8719 59.5577 39.0856 174.6371 129 E 4.7226 8.7064 123.1464 54.6356 33.8626 175.0819 130 G 3.9240 9.9631 104.1603 44.7656 0.0000 172.1558 131 D 4.6969 8.0812 118.5034 52.5693 41.9891 174.6211 132 L 4.6467 8.1432 119.4559 54.5450 43.3051 176.0949 133 G 3.7253 8.4993 110.2752 46.1850 0.0000 172.7077 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 23 K 8.31 4.20 0.00 1.71 1.74 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.37 7.81 24 L 7.72 4.57 0.00 1.34 1.35 0.67 0.37 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 25 T 8.37 4.15 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 1.18 0.00 0.00 26 A 8.44 3.98 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 27 K 8.01 4.00 0.00 1.88 1.91 0.00 1.58 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.63 7.81 28 Q 7.88 4.06 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 29 I 7.95 3.81 2.05 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.12 1.19 0.00 0.00 30 Q 8.62 4.21 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.62 0.00 31 A 8.74 4.13 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.30 3.93 1.45 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 33 Y 7.86 4.18 0.00 3.28 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 34 L 7.90 4.28 0.00 1.89 1.93 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.72 4.09 0.00 1.76 1.63 1.04 0.95 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 36 V 7.41 3.33 1.45 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 0.08 0.00 0.00 0.68 0.00 0.00 37 E 7.51 3.82 0.00 2.32 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 2.71 2.72 0.00 38 N 7.97 4.34 0.00 2.78 2.85 0.00 0.00 7.16 7.19 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 39 E 7.99 4.47 0.00 1.90 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 2.20 2.28 0.00 40 L 7.58 4.54 0.00 1.60 1.72 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 *48 K 7.82 4.13 0.00 1.75 1.78 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.60 7.81 49 R 8.21 4.59 0.00 1.96 1.78 0.00 3.24 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.56 0.00 50 T 8.33 4.25 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 1.22 0.00 0.00 51 Q 8.61 3.99 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.95 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 52 D 8.03 4.30 0.00 2.78 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 53 E 7.80 3.97 0.00 2.42 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 2.34 2.37 0.00 54 M 8.74 4.08 0.00 2.06 2.30 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.59 0.00 55 A 8.21 4.03 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 56 N 8.64 4.32 0.00 2.95 2.83 0.00 0.00 7.18 7.19 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 57 E 7.97 4.04 0.00 2.19 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 2.37 2.53 0.00 58 L 7.91 4.26 0.00 1.71 1.85 1.11 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 59 G 7.68 3.89 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 0.00 0.00 0.00 60 I 7.22 4.54 1.66 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.70 1.07 0.00 0.00 61 N 8.14 4.52 0.00 2.70 2.62 0.00 0.00 6.88 7.65 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 62 R 8.41 3.90 0.00 1.85 1.93 0.00 3.15 0.00 0.00 3.63 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 63 T 7.96 4.01 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 1.39 0.00 0.00 64 T 7.69 3.46 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 0.29 0.00 0.00 65 L 7.31 3.67 0.00 1.61 1.81 1.03 0.97 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 66 W 7.64 4.24 0.00 3.24 3.40 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 0.00 67 E 7.72 3.34 0.00 1.77 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 2.49 2.34 0.00 68 W 7.26 4.32 0.00 2.79 1.74 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 69 R 7.44 4.53 0.00 1.94 2.06 0.00 3.36 0.00 0.00 3.30 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 *75 F 7.71 4.97 0.00 2.77 3.11 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 76 I 7.56 3.88 1.83 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.68 0.82 0.00 0.00 77 A 6.60 4.46 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 78 F 8.19 4.09 0.00 3.05 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 79 K 8.02 3.47 0.00 1.62 1.43 0.00 1.57 0.00 0.00 1.16 0.00 0.00 2.60 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 1.34 7.81 80 S 7.69 3.99 0.00 3.77 3.78 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 81 E 7.72 3.82 0.00 2.07 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 2.25 2.26 0.00 82 V 7.49 3.61 1.80 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 -0.57 0.00 0.00 0.55 0.00 0.00 83 A 7.67 3.83 1.25 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 0.00 0.00 0.00 84 D 8.15 4.30 0.00 2.79 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 85 S 8.55 4.09 0.00 3.88 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 86 F 8.76 3.85 0.00 3.16 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 87 L 8.16 4.10 0.00 1.96 1.81 0.93 1.14 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 88 A 8.36 3.95 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 89 E 7.95 3.92 0.00 2.00 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 2.23 2.35 0.00 90 K 7.74 4.27 0.00 1.83 1.77 0.00 1.76 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.53 7.81 91 R 7.67 3.52 0.00 1.79 1.66 0.00 2.87 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 92 E 7.93 3.93 0.00 2.09 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 0.00 2.40 2.42 0.00 93 Q 7.92 4.00 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 94 V 7.73 3.60 2.12 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 1.09 0.00 0.00 0.94 0.00 0.00 95 Y 8.10 4.45 0.00 3.17 2.96 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 96 S 8.44 4.16 0.00 4.01 4.07 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 97 K 7.93 3.99 0.00 1.97 1.88 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.69 1.62 7.81 98 L 8.19 3.99 0.00 1.99 1.98 1.03 0.97 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 99 M 8.31 4.13 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.92 0.00 100 Q 8.34 4.01 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 101 L 8.04 4.03 0.00 1.90 1.73 0.94 0.90 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 0.00 102 I 7.64 3.71 1.96 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 1.50 0.58 0.81 0.00 0.00 103 L 7.86 4.59 0.00 1.59 1.68 0.90 0.73 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 0.00 104 G 7.83 3.93 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 0.00 0.00 0.00 105 P 0.00 4.35 0.00 2.19 2.19 0.00 3.71 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 1.99 1.99 0.00 106 Q 7.11 4.60 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 107 P 0.00 4.39 0.00 2.02 2.18 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 108 S 8.65 4.53 0.00 3.88 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 0.00 109 V 8.38 3.69 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 0.92 0.00 0.00 0.94 0.00 0.00 110 K 8.08 3.92 0.00 1.90 1.86 0.00 1.63 0.00 0.00 1.96 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.59 7.81 111 A 8.20 4.05 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 0.00 112 M 8.15 4.02 0.00 2.10 2.28 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.50 0.00 113 Q 8.44 4.02 0.00 2.20 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 114 L 7.98 4.12 0.00 1.94 1.71 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 115 Y 8.32 3.88 0.00 3.20 3.20 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 0.00 116 M 8.41 4.38 0.00 2.20 2.39 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.75 0.00 117 Q 8.43 3.95 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 118 R 7.80 3.54 0.00 1.38 1.33 0.00 2.94 0.00 0.00 2.99 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.50 0.00 119 F 7.32 4.66 0.00 3.10 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 0.00 120 G 7.55 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 0.00 121 L 8.22 4.36 0.00 1.77 1.78 1.06 1.23 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 0.00 122 L 7.75 4.64 0.00 1.63 1.61 0.95 0.86 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 0.00 123 T 8.41 4.60 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 1.22 0.00 0.00 124 D 8.58 4.90 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.53 4.51 0.00 1.70 1.69 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.44 7.81 126 K 8.49 4.55 0.00 1.73 1.66 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.32 7.81 127 V 8.41 4.27 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 0.83 0.00 0.00 0.93 0.00 0.00 128 I 8.29 4.48 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 1.41 0.77 0.91 0.00 0.00 129 E 8.71 4.72 0.00 1.90 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 2.19 2.26 0.00 130 G 9.96 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 0.00 131 D 8.08 4.70 0.00 2.75 2.61 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 0.00 132 L 8.14 4.65 0.00 1.72 1.63 0.92 0.30 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 0.00 133 G 8.50 3.73 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.