#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g62 s ASP 1001N 0.00 6.30 -0.09 3.17 1.01 -1.26 -5.00 116.67 120.80 3g62 s ASP 1001Ca 0.00 1.58 -0.30 0.00 0.71 0.00 0.00 52.55 54.54 3g62 s ASP 1001Cb 0.00 -2.50 -0.03 0.00 1.01 0.00 0.00 42.92 41.40 3g62 s ASP 1001CO 0.00 -0.81 1.26 -0.63 0.21 0.00 0.00 175.17 175.19 3g62 s ILE 1002N -2.76 4.18 -0.10 0.77 -1.09 0.95 -4.83 121.20 118.32 3g62 s ILE 1002Ca 0.59 1.49 0.01 0.00 -2.23 0.00 0.00 60.65 60.51 3g62 s ILE 1002Cb -0.11 -3.96 -0.02 0.00 -1.58 0.00 0.00 42.46 36.79 3g62 s ILE 1002CO 0.39 -0.05 -0.14 0.20 -1.23 0.00 0.00 174.94 174.11 3g62 s ASN 1003N 1.74 3.93 0.14 3.58 0.01 -1.26 0.19 114.94 123.26 3g62 s ASN 1003Ca 0.57 -0.31 -0.04 0.00 -0.71 0.00 0.00 52.86 52.37 3g62 s ASN 1003Cb -0.25 -1.35 -0.03 0.00 0.41 0.00 0.00 41.25 40.03 3g62 s ASN 1003CO 0.20 0.22 0.13 -0.83 -1.51 0.00 0.00 177.10 175.32 3g62 s GLY 1004N 0.02 0.78 0.00 0.66 0.00 -1.26 -1.02 107.32 106.50 3g62 s GLY 1004Ca -0.05 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.43 3g62 s GLY 1004CO 0.04 -1.17 0.00 0.61 0.00 0.00 0.00 173.10 172.58 3g62 n GLY 1005N -0.13 -1.63 0.00 0.20 0.00 -1.22 -2.28 105.19 100.14 3g62 n GLY 1005Ca -0.07 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.88 3g62 n GLY 1005CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g62 n GLY 1006N -0.26 0.43 3.39 -0.02 0.00 0.03 -1.20 105.19 107.56 3g62 n GLY 1006Ca 0.00 -1.12 -0.55 0.00 0.00 0.00 0.00 46.02 44.35 3g62 n GLY 1006CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g62 n ALA 1007N -1.00 -3.37 0.08 4.61 0.00 0.09 -0.45 120.51 120.47 3g62 n ALA 1007Ca 0.00 0.54 -0.01 0.00 0.00 0.00 0.00 53.44 53.98 3g62 n ALA 1007Cb 0.00 -1.68 -0.05 0.00 0.00 0.00 0.00 19.45 17.72 3g62 n ALA 1007CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3g62 h THR 1008N 2.37 0.86 -0.77 0.00 1.35 -1.91 -3.35 112.91 111.46 3g62 h THR 1008Ca -0.43 -2.35 0.17 0.00 -0.55 0.00 0.00 66.41 63.25 3g62 h THR 1008Cb 1.40 2.34 -0.11 0.00 -1.73 0.00 0.00 68.15 70.05 3g62 h THR 1008CO 0.61 0.49 0.21 0.25 -0.25 0.00 0.00 175.52 176.83 3g62 h LEU 1009N 0.00 0.05 -2.99 3.87 6.46 -2.00 -1.44 115.31 119.26 3g62 h LEU 1009Ca -0.08 0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.83 3g62 h LEU 1009Cb 1.56 0.19 0.00 0.00 -0.73 0.00 0.00 40.66 41.68 3g62 h LEU 1009CO 0.07 -0.04 0.00 -0.81 -0.62 0.00 0.00 178.44 177.04 3g62 n PRO 1010N -5.14 3.32 -0.19 5.25 -0.04 -1.26 -4.68 135.00 132.27 3g62 n PRO 1010Ca 0.16 -2.78 -0.01 0.00 -0.04 0.00 0.00 63.50 60.83 3g62 n PRO 1010Cb 0.49 -1.75 0.08 0.00 -0.04 0.00 0.00 33.50 32.28 3g62 n PRO 1010CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 3g62 h GLN 1011N 4.06 0.07 0.00 0.54 4.15 -1.38 -1.32 115.11 121.23 3g62 h GLN 1011Ca 0.00 -0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.33 3g62 h GLN 1011Cb 1.26 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.92 3g62 h GLN 1011CO 0.14 0.05 -0.41 0.00 -1.93 0.00 0.00 178.83 176.68 3g62 h ALA 1012N 1.54 1.23 0.21 3.38 0.00 -1.83 -0.44 119.26 123.33 3g62 h ALA 1012Ca 0.29 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3g62 h ALA 1012Cb 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3g62 h ALA 1012CO -0.52 0.51 -0.10 1.25 0.00 0.00 0.00 179.25 180.39 3g62 h LEU 1013N 0.00 -0.24 -1.64 0.00 5.85 -1.61 -2.42 115.31 115.26 3g62 h LEU 1013Ca -0.00 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 3g62 h LEU 1013Cb 0.77 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.85 3g62 h LEU 1013CO 0.05 0.04 -0.14 1.88 -0.34 0.00 0.00 178.44 179.94 3g62 h TYR 1014N -0.52 0.00 -0.00 1.25 0.05 -1.10 -1.50 116.97 115.15 3g62 h TYR 1014Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 3g62 h TYR 1014Cb 0.39 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.13 3g62 h TYR 1014CO 0.00 0.14 -0.14 1.04 -1.05 0.00 0.00 178.16 178.15 3g62 n GLN 1015N -3.44 0.01 -2.09 4.88 6.02 -0.20 -4.38 117.38 118.16 3g62 n GLN 1015Ca -0.01 -0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.56 3g62 n GLN 1015Cb 0.31 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.04 3g62 n GLN 1015CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3g62 s THR 1016N -3.00 2.99 0.21 5.09 2.01 -0.57 -4.91 115.64 117.47 3g62 s THR 1016Ca 0.13 0.76 -0.32 0.00 0.31 0.00 0.00 61.69 62.57 3g62 s THR 1016Cb 0.19 -3.48 -0.14 0.00 0.01 0.00 0.00 72.50 69.07 3g62 s THR 1016CO 0.58 0.09 1.42 -0.24 -0.69 0.00 0.00 174.62 175.77 3g62 n SER 1017N 3.27 2.63 0.00 3.53 2.88 -1.26 -2.00 113.62 122.67 3g62 n SER 1017Ca 0.10 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 3g62 n SER 1017Cb 0.41 -1.39 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 3g62 n SER 1017CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3g62 n GLY 1018N 2.42 2.23 0.06 0.46 0.00 -1.26 -4.91 105.19 104.19 3g62 n GLY 1018Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 3g62 n GLY 1018CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3g62 h VAL 1019N 0.00 1.40 -3.58 1.61 2.07 -1.71 -3.41 116.25 112.64 3g62 h VAL 1019Ca 0.00 -1.18 -0.52 0.00 0.82 0.00 0.00 66.70 65.82 3g62 h VAL 1019Cb 0.00 2.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 3g62 h VAL 1019CO 0.00 0.31 0.21 -0.76 0.02 0.00 0.00 177.57 177.35 3g62 s LEU 1020N -9.20 4.58 0.00 2.57 1.43 -1.26 -4.87 118.68 111.92 3g62 s LEU 1020Ca -0.16 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.63 3g62 s LEU 1020Cb 0.02 -3.39 0.00 0.00 0.03 0.00 0.00 46.19 42.84 3g62 s LEU 1020CO 0.68 0.18 0.00 0.35 0.23 0.00 0.00 176.35 177.79 3g62 n THR 1021N 1.47 0.00 -1.90 5.49 -2.24 -1.26 -4.93 114.28 110.90 3g62 n THR 1021Ca -0.05 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.33 3g62 n THR 1021Cb 0.49 -1.31 -0.01 0.00 -2.10 0.00 0.00 70.33 67.40 3g62 n THR 1021CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g62 s ALA 1022N -2.62 3.56 0.00 6.98 0.00 -1.26 -2.32 121.76 126.10 3g62 s ALA 1022Ca 0.00 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.43 3g62 s ALA 1022Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.55 3g62 s ALA 1022CO 0.00 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.25 3g62 n GLY 1023N 0.73 1.87 3.67 0.00 0.00 -1.26 -4.84 105.19 105.36 3g62 n GLY 1023Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3g62 n GLY 1023CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g62 s PHE 1024N -2.39 3.42 0.75 1.61 0.40 -0.98 -0.03 117.98 120.76 3g62 s PHE 1024Ca 0.00 1.16 -0.14 0.00 -0.60 0.00 0.00 56.93 57.36 3g62 s PHE 1024Cb 0.00 -2.94 0.05 0.00 0.51 0.00 0.00 43.02 40.64 3g62 s PHE 1024CO 0.00 -0.20 1.16 0.00 0.70 0.00 0.00 175.22 176.88 3g62 s ALA 1025N 2.00 2.09 0.25 5.36 0.00 0.13 -4.91 121.76 126.69 3g62 s ALA 1025Ca 0.36 0.69 -0.31 0.00 0.00 0.00 0.00 51.96 52.70 3g62 s ALA 1025Cb -0.16 -3.41 -0.14 0.00 0.00 0.00 0.00 23.12 19.41 3g62 s ALA 1025CO 0.12 -1.90 1.30 0.94 0.00 0.00 0.00 175.76 176.23 3g62 n GLN 1026N -3.02 1.82 -2.01 0.00 7.27 -1.26 -4.69 117.38 115.50 3g62 n GLN 1026Ca 0.12 0.65 -0.40 0.00 0.07 0.00 0.00 57.00 57.43 3g62 n GLN 1026Cb 0.51 -2.23 -0.01 0.00 2.41 0.00 0.00 30.24 30.92 3g62 n GLN 1026CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 3g62 s TYR 1027N -0.36 2.85 -0.29 3.69 5.04 -1.26 -4.77 117.35 122.26 3g62 s TYR 1027Ca 0.66 1.35 -0.03 0.00 -2.44 0.00 0.00 57.07 56.61 3g62 s TYR 1027Cb -0.68 -3.77 0.04 0.00 0.35 0.00 0.00 41.96 37.90 3g62 s TYR 1027CO 0.53 -2.23 -0.00 0.42 -1.34 0.00 0.00 175.55 172.93 3g62 s ILE 1028N -1.17 3.11 -0.30 3.14 1.01 -0.97 -4.91 121.20 121.11 3g62 s ILE 1028Ca 0.52 -1.18 -0.26 0.00 0.00 0.00 0.00 60.65 59.73 3g62 s ILE 1028Cb -0.41 -2.70 0.01 0.00 0.01 0.00 0.00 42.46 39.37 3g62 s ILE 1028CO 0.54 0.00 0.91 -0.83 0.00 0.00 0.00 174.94 175.57 3g62 s GLY 1029N 1.31 1.65 0.00 6.18 0.00 -1.26 -0.79 107.32 114.41 3g62 s GLY 1029Ca -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.45 3g62 s GLY 1029CO -0.01 1.97 0.08 3.33 0.00 0.00 0.00 173.10 178.46 3g62 n VAL 1030N 5.63 0.00 0.00 1.40 0.24 0.40 -4.90 118.33 121.10 3g62 n VAL 1030Ca 0.07 -0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 3g62 n VAL 1030Cb 0.48 1.78 0.00 0.00 -1.47 0.00 0.00 33.84 34.63 3g62 n VAL 1030CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3g62 n GLY 1031N 0.01 2.36 0.31 7.63 0.00 -0.03 -4.59 105.19 110.87 3g62 n GLY 1031Ca 0.00 -1.75 -0.09 0.00 0.00 0.00 0.00 46.02 44.18 3g62 n GLY 1031CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3g62 h SER 1032N 0.00 1.05 -0.58 1.61 0.02 -1.76 -0.67 113.55 113.23 3g62 h SER 1032Ca 0.00 -0.29 0.01 0.00 -0.84 0.00 0.00 61.79 60.67 3g62 h SER 1032Cb 0.00 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.23 3g62 h SER 1032CO 0.00 1.09 0.38 1.23 -1.14 0.00 0.00 176.83 178.39 3g62 h GLY 1033N 1.00 0.81 1.28 -3.77 0.00 -1.65 0.34 103.07 101.08 3g62 h GLY 1033Ca 0.18 -0.30 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 3g62 h GLY 1033CO 0.03 0.29 0.08 3.43 0.00 0.00 0.00 176.54 180.36 3g62 h ASN 1034N 0.77 0.84 -0.36 0.19 2.35 -1.73 -1.47 115.58 116.17 3g62 h ASN 1034Ca 0.21 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 3g62 h ASN 1034Cb -0.07 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.06 3g62 h ASN 1034CO -0.05 0.86 0.09 1.23 -1.65 0.00 0.00 177.43 177.90 3g62 h GLY 1035N 1.00 0.61 0.93 2.83 0.00 -0.54 0.32 103.07 108.23 3g62 h GLY 1035Ca 0.17 -0.38 0.01 0.00 0.00 0.00 0.00 47.33 47.13 3g62 h GLY 1035CO 0.01 0.36 0.17 0.50 0.00 0.00 0.00 176.54 177.58 3g62 h LYS 1036N 0.43 0.34 -0.68 4.80 1.57 -0.84 -1.70 116.57 120.49 3g62 h LYS 1036Ca 0.11 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 3g62 h LYS 1036Cb 0.30 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 3g62 h LYS 1036CO 0.00 0.22 0.22 0.00 -0.57 0.00 0.00 179.45 179.32 3g62 h ALA 1037N 1.13 1.10 -0.21 3.86 0.00 -1.13 0.30 119.26 124.31 3g62 h ALA 1037Ca 0.11 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.85 3g62 h ALA 1037Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3g62 h ALA 1037CO -0.06 0.62 0.00 0.00 0.00 0.00 0.00 179.25 179.82 3g62 h ALA 1038N 1.23 0.19 0.02 0.00 0.00 -0.64 -1.95 119.26 118.10 3g62 h ALA 1038Ca 0.22 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 3g62 h ALA 1038Cb 0.28 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3g62 h ALA 1038CO -0.01 -0.42 -0.01 0.35 0.00 0.00 0.00 179.25 179.16 3g62 h PHE 1039N 0.07 -0.02 -0.17 0.00 3.57 -0.97 -0.30 116.94 119.12 3g62 h PHE 1039Ca 0.10 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 3g62 h PHE 1039Cb 0.12 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3g62 h PHE 1039CO -0.18 0.47 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.15 3g62 h LEU 1040N -0.53 0.26 -1.73 0.59 3.38 -0.89 -2.62 115.31 113.78 3g62 h LEU 1040Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3g62 h LEU 1040Cb 0.50 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3g62 h LEU 1040CO 0.00 0.43 0.00 0.59 0.09 0.00 0.00 178.44 179.56 3g62 n ASN 1041N -4.25 2.54 -3.74 -0.43 3.02 -0.74 -4.95 115.26 106.72 3g62 n ASN 1041Ca -0.01 -1.77 -0.31 0.00 -0.03 0.00 0.00 54.58 52.47 3g62 n ASN 1041Cb 0.29 -0.01 0.03 0.00 -0.61 0.00 0.00 39.78 39.49 3g62 n ASN 1041CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3g62 n ASN 1042N 1.03 -4.23 -3.91 6.41 5.15 -0.45 -4.95 115.26 114.32 3g62 n ASN 1042Ca 0.11 -1.02 -0.30 0.00 -0.60 0.00 0.00 54.58 52.77 3g62 n ASN 1042Cb 0.46 -3.29 -0.14 0.00 -0.53 0.00 0.00 39.78 36.27 3g62 n ASN 1042CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3g62 s ASP 1043N -3.67 4.32 0.58 1.20 2.15 -0.25 -4.70 116.67 116.30 3g62 s ASP 1043Ca 0.37 -2.52 0.36 0.00 0.43 0.00 0.00 52.55 51.19 3g62 s ASP 1043Cb -0.14 -1.45 1.73 0.00 -0.30 0.00 0.00 42.92 42.77 3g62 s ASP 1043CO 0.87 -0.31 2.13 0.22 -0.17 0.00 0.00 175.17 177.92 3g62 h TYR 1044N 7.07 0.00 0.00 -5.34 5.03 -1.82 -2.37 116.97 119.54 3g62 h TYR 1044Ca -0.06 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.25 3g62 h TYR 1044Cb 0.95 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.23 3g62 h TYR 1044CO 0.48 0.04 0.00 1.79 -1.32 0.00 0.00 178.16 179.14 3g62 h THR 1045N 0.00 0.00 0.00 1.81 1.35 -1.63 0.34 112.91 114.78 3g62 h THR 1045Ca -0.00 -0.18 -0.01 0.00 -0.55 0.00 0.00 66.41 65.67 3g62 h THR 1045Cb 0.30 0.95 -0.00 0.00 -1.73 0.00 0.00 68.15 67.67 3g62 h THR 1045CO 0.00 0.00 -0.06 0.11 -0.25 0.00 0.00 175.52 175.33 3g62 h LYS 1046N 0.00 0.00 0.16 4.72 1.79 -1.76 -1.67 116.57 119.80 3g62 h LYS 1046Ca 0.00 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.11 3g62 h LYS 1046Cb 0.22 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.87 3g62 h LYS 1046CO 0.00 0.06 -1.85 0.74 -1.08 0.00 0.00 179.45 177.32 3g62 h PHE 1047N 0.00 0.61 -2.36 -1.35 0.04 -1.19 -3.46 116.94 109.23 3g62 h PHE 1047Ca -0.00 -0.44 -0.33 0.00 2.80 0.00 0.00 57.97 60.00 3g62 h PHE 1047Cb 0.73 -0.02 -0.35 0.00 2.20 0.00 0.00 35.95 38.51 3g62 h PHE 1047CO 0.00 1.71 -0.63 -0.65 -0.60 0.00 0.00 178.31 178.14 3g62 s GLN 1048N -2.57 0.25 0.52 1.51 -0.21 -0.31 -4.95 119.66 113.90 3g62 s GLN 1048Ca -0.18 0.04 0.25 0.00 0.02 0.00 0.00 55.36 55.49 3g62 s GLN 1048Cb 0.06 -0.95 1.37 0.00 1.00 0.00 0.00 33.01 34.49 3g62 s GLN 1048CO 0.82 -0.82 1.99 0.00 -2.12 0.00 0.00 175.29 175.16 3g62 h ALA 1049N 8.29 2.47 -0.57 6.09 0.00 -1.56 -2.15 119.26 131.84 3g62 h ALA 1049Ca -0.16 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3g62 h ALA 1049Cb 1.11 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 3g62 h ALA 1049CO 0.31 -0.63 0.09 0.41 0.00 0.00 0.00 179.25 179.44 3g62 n GLY 1050N -1.63 3.50 2.95 0.00 0.00 -1.26 -4.81 105.19 103.93 3g62 n GLY 1050Ca 0.10 -0.99 -0.26 0.00 0.00 0.00 0.00 46.02 44.87 3g62 n GLY 1050CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g62 s VAL 1051N -2.89 1.08 -0.06 1.61 1.01 -0.81 -5.00 120.40 115.34 3g62 s VAL 1051Ca 0.52 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.16 3g62 s VAL 1051Cb 0.41 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.72 3g62 s VAL 1051CO 0.13 0.37 0.11 0.35 0.00 0.00 0.00 175.10 176.06 3g62 n THR 1052N 4.60 0.00 -0.21 3.92 -2.24 -1.26 -3.16 114.28 115.92 3g62 n THR 1052Ca -0.16 -0.48 0.02 0.00 -2.27 0.00 0.00 64.05 61.17 3g62 n THR 1052Cb 0.50 1.00 0.24 0.00 -2.10 0.00 0.00 70.33 69.98 3g62 n THR 1052CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3g62 n ASN 1053N -0.88 3.93 -4.29 3.42 6.94 -1.26 -4.88 115.26 118.25 3g62 n ASN 1053Ca 0.00 -2.63 -0.16 0.00 -0.02 0.00 0.00 54.58 51.77 3g62 n ASN 1053Cb 0.02 -0.63 -0.10 0.00 -2.36 0.00 0.00 39.78 36.71 3g62 n ASN 1053CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3g62 s LYS 1054N -2.11 1.17 0.27 -3.83 1.02 -1.26 -4.63 119.74 110.38 3g62 s LYS 1054Ca 0.34 -1.52 0.06 0.00 0.02 0.00 0.00 55.97 54.88 3g62 s LYS 1054Cb 0.27 -0.76 -0.03 0.00 -0.52 0.00 0.00 37.83 36.79 3g62 s LYS 1054CO 0.10 0.08 0.30 -0.80 -0.92 0.00 0.00 175.35 174.10 3g62 s ASN 1055N -3.23 5.79 -0.20 2.83 0.01 -1.26 -4.33 114.94 114.54 3g62 s ASN 1055Ca 0.20 -0.18 -0.09 0.00 -0.71 0.00 0.00 52.86 52.07 3g62 s ASN 1055Cb 0.02 -1.45 -0.05 0.00 0.41 0.00 0.00 41.25 40.18 3g62 s ASN 1055CO 0.03 -0.15 0.12 -0.69 -1.51 0.00 0.00 177.10 174.90 3g62 s VAL 1056N -2.12 5.24 -0.08 1.60 1.01 -1.26 -4.62 120.40 120.17 3g62 s VAL 1056Ca 0.36 0.13 0.12 0.00 0.00 0.00 0.00 61.98 62.59 3g62 s VAL 1056Cb -0.08 -3.39 -0.18 0.00 0.00 0.00 0.00 36.38 32.73 3g62 s VAL 1056CO 0.27 0.44 0.16 1.41 0.00 0.00 0.00 175.10 177.37 3g62 n HIS 1057N 3.61 0.00 -3.64 5.22 8.25 -0.19 -4.91 115.22 123.56 3g62 n HIS 1057Ca -0.16 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.22 3g62 n HIS 1057Cb 0.52 -0.49 -0.02 0.00 1.12 0.00 0.00 29.99 31.12 3g62 n HIS 1057CO 0.00 0.00 0.00 1.67 0.64 0.00 0.00 176.34 178.65 3g62 s TRP 1058N -2.59 -0.31 0.02 4.41 1.48 -1.10 -4.22 118.94 116.62 3g62 s TRP 1058Ca -0.06 0.02 -0.04 0.00 -1.06 0.00 0.00 56.10 54.96 3g62 s TRP 1058Cb 0.06 0.62 -0.01 0.00 -1.16 0.00 0.00 33.47 32.98 3g62 s TRP 1058CO 0.55 -0.91 0.05 0.00 -4.06 0.00 0.00 176.95 172.58 3g62 s ALA 1059N -3.58 -0.05 -0.06 2.67 0.00 -0.11 -3.42 121.76 117.21 3g62 s ALA 1059Ca 0.07 -0.45 -0.13 0.00 0.00 0.00 0.00 51.96 51.45 3g62 s ALA 1059Cb -0.03 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.20 3g62 s ALA 1059CO -0.03 -0.21 0.33 0.20 0.00 0.00 0.00 175.76 176.05 3g62 s GLY 1060N -1.62 2.36 -0.17 0.00 0.00 -0.34 -0.71 107.32 106.85 3g62 s GLY 1060Ca -0.13 -0.35 -0.12 0.00 0.00 0.00 0.00 44.72 44.12 3g62 s GLY 1060CO -0.01 0.12 0.42 -0.45 0.00 0.00 0.00 173.10 173.18 3g62 s SER 1061N -0.69 -0.48 0.00 1.64 0.15 -0.43 -0.73 113.70 113.15 3g62 s SER 1061Ca 0.21 0.88 0.20 0.00 0.70 0.00 0.00 55.95 57.94 3g62 s SER 1061Cb -0.15 0.83 0.55 0.00 -1.71 0.00 0.00 66.02 65.54 3g62 s SER 1061CO 0.10 -0.17 1.46 -0.90 1.20 0.00 0.00 173.24 174.92 3g62 n ASP 1062N 3.51 3.68 -4.58 5.45 5.75 -1.26 -0.42 116.55 128.68 3g62 n ASP 1062Ca -0.18 -1.99 -0.35 0.00 -0.01 0.00 0.00 54.79 52.26 3g62 n ASP 1062Cb 0.56 -0.41 -0.11 0.00 -1.03 0.00 0.00 41.12 40.14 3g62 n ASP 1062CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3g62 s SER 1063N -1.03 5.42 0.34 -1.12 0.15 -1.26 -4.50 113.70 111.69 3g62 s SER 1063Ca 0.42 -0.01 -0.29 0.00 0.70 0.00 0.00 55.95 56.78 3g62 s SER 1063Cb 0.22 -1.93 -0.11 0.00 -1.71 0.00 0.00 66.02 62.49 3g62 s SER 1063CO 0.29 0.13 1.41 -0.75 1.20 0.00 0.00 173.24 175.52 3g62 s LYS 1064N 0.63 4.23 0.24 5.44 2.20 -1.26 -4.96 119.74 126.26 3g62 s LYS 1064Ca 0.02 2.39 -0.31 0.00 -0.36 0.00 0.00 55.97 57.72 3g62 s LYS 1064Cb -0.13 -3.03 -0.12 0.00 -1.51 0.00 0.00 37.83 33.04 3g62 s LYS 1064CO 0.02 -0.38 1.66 1.28 -0.36 0.00 0.00 175.35 177.57 3g62 n LEU 1065N 0.88 4.12 -4.89 5.43 4.77 -1.26 -4.98 117.00 121.08 3g62 n LEU 1065Ca 0.01 1.10 -0.29 0.00 -0.03 0.00 0.00 56.01 56.80 3g62 n LEU 1065Cb 0.40 -1.58 0.08 0.00 -2.33 0.00 0.00 43.42 40.00 3g62 n LEU 1065CO 0.61 0.15 0.77 -0.94 -1.33 0.00 0.00 177.39 176.66 3g62 s SER 1066N 0.87 4.61 0.24 -1.43 1.04 -1.26 -4.84 113.70 112.93 3g62 s SER 1066Ca 0.70 0.88 -0.07 0.00 0.48 0.00 0.00 55.95 57.94 3g62 s SER 1066Cb -0.51 -1.45 0.25 0.00 0.10 0.00 0.00 66.02 64.41 3g62 s SER 1066CO 0.39 -1.85 1.90 0.00 0.98 0.00 0.00 173.24 174.66 3g62 h ALA 1067N -1.01 1.16 -0.35 5.32 0.00 -1.99 -0.43 119.26 121.96 3g62 h ALA 1067Ca -0.46 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.26 3g62 h ALA 1067Cb 1.31 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3g62 h ALA 1067CO 0.65 0.49 -0.32 1.15 0.00 0.00 0.00 179.25 181.22 3g62 h THR 1068N 1.17 1.28 -0.86 0.00 2.02 -1.98 -0.10 112.91 114.45 3g62 h THR 1068Ca 0.34 -1.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.01 3g62 h THR 1068Cb -0.07 1.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 3g62 h THR 1068CO -0.09 0.49 0.45 -0.33 0.37 0.00 0.00 175.52 176.41 3g62 h GLU 1069N 0.62 1.22 -0.09 6.66 5.08 -1.80 -0.27 114.58 126.00 3g62 h GLU 1069Ca 0.06 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 3g62 h GLU 1069Cb 0.90 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 3g62 h GLU 1069CO 0.08 0.91 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.88 3g62 h LEU 1070N 1.22 0.21 -0.67 1.33 3.38 -0.99 -2.54 115.31 117.24 3g62 h LEU 1070Ca 0.30 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 3g62 h LEU 1070Cb 0.06 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3g62 h LEU 1070CO -0.04 0.59 0.29 0.28 0.09 0.00 0.00 178.44 179.65 3g62 h SER 1071N -0.18 0.91 -0.35 -0.43 0.02 -0.84 -0.69 113.55 111.99 3g62 h SER 1071Ca 0.02 -0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 60.74 3g62 h SER 1071Cb 0.52 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 3g62 h SER 1071CO 0.02 0.81 -0.07 0.74 -1.14 0.00 0.00 176.83 177.18 3g62 h THR 1072N 0.94 1.28 -0.58 -2.27 2.02 -1.11 -2.16 112.91 111.04 3g62 h THR 1072Ca 0.23 -1.13 -0.07 0.00 0.77 0.00 0.00 66.41 66.22 3g62 h THR 1072Cb 0.17 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 3g62 h THR 1072CO -0.02 0.37 0.10 0.22 0.37 0.00 0.00 175.52 176.56 3g62 h TYR 1073N 0.46 1.01 -0.93 3.16 3.20 -1.28 -0.32 116.97 122.29 3g62 h TYR 1073Ca 0.09 -0.14 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 3g62 h TYR 1073Cb 0.57 -0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 3g62 h TYR 1073CO 0.05 0.88 0.57 0.00 -1.64 0.00 0.00 178.16 178.02 3g62 h ALA 1074N 1.01 1.18 -0.02 1.82 0.00 -1.01 0.55 119.26 122.79 3g62 h ALA 1074Ca 0.18 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3g62 h ALA 1074Cb 0.41 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.83 3g62 h ALA 1074CO 0.01 0.62 -0.31 0.77 0.00 0.00 0.00 179.25 180.34 3g62 h SER 1075N 1.27 0.31 0.30 0.00 0.02 -1.20 -3.32 113.55 110.93 3g62 h SER 1075Ca 0.33 -0.73 -0.33 0.00 -0.84 0.00 0.00 61.79 60.22 3g62 h SER 1075Cb -0.08 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.37 3g62 h SER 1075CO -0.07 0.99 -1.67 0.00 -1.14 0.00 0.00 176.83 174.94 3g62 h ALA 1076N 0.32 0.24 0.00 3.77 0.00 -0.99 -3.44 119.26 119.15 3g62 h ALA 1076Ca -0.03 -1.15 -0.13 0.00 0.00 0.00 0.00 54.91 53.59 3g62 h ALA 1076Cb 1.03 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 3g62 h ALA 1076CO 0.06 1.11 -1.49 1.63 0.00 0.00 0.00 179.25 180.55 3g62 n LYS 1077N -3.51 0.21 -0.32 0.00 4.76 0.03 -4.75 118.16 114.58 3g62 n LYS 1077Ca -0.21 0.06 0.12 0.00 -2.87 0.00 0.00 58.31 55.41 3g62 n LYS 1077Cb 1.06 -1.08 0.35 0.00 -1.84 0.00 0.00 35.03 33.52 3g62 n LYS 1077CO 0.00 0.00 0.00 0.37 -1.37 0.00 0.00 177.40 176.40 3g62 h GLN 1078N -0.09 0.73 -0.59 1.97 4.15 -1.23 0.98 115.11 121.03 3g62 h GLN 1078Ca -0.20 -0.04 0.08 0.00 0.77 0.00 0.00 58.65 59.25 3g62 h GLN 1078Cb 1.27 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.76 3g62 h GLN 1078CO -0.06 0.48 0.39 -1.35 -1.93 0.00 0.00 178.83 176.37 3g62 h PRO 1079N 0.75 0.48 0.00 -2.39 0.11 -1.85 -0.29 132.00 128.82 3g62 h PRO 1079Ca 0.51 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.46 3g62 h PRO 1079Cb 0.79 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.77 3g62 h PRO 1079CO -0.27 0.32 -1.91 0.25 -0.21 0.00 0.00 178.00 176.17 3g62 n THR 1080N -4.48 0.49 0.39 -1.15 -2.24 -0.76 -4.67 114.28 101.87 3g62 n THR 1080Ca 0.09 -0.52 0.06 0.00 -2.27 0.00 0.00 64.05 61.41 3g62 n THR 1080Cb 0.29 -0.20 -0.08 0.00 -2.10 0.00 0.00 70.33 68.24 3g62 n THR 1080CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 3g62 n TRP 1081N -2.31 0.00 0.00 4.78 8.01 0.27 -1.41 117.44 126.77 3g62 n TRP 1081Ca -0.13 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.06 3g62 n TRP 1081Cb 0.70 -0.09 0.00 0.00 -2.01 0.00 0.00 31.31 29.91 3g62 n TRP 1081CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3g62 n GLY 1082N 1.44 -0.48 3.77 6.99 0.00 -0.12 -3.73 105.19 113.06 3g62 n GLY 1082Ca 0.01 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 43.90 3g62 n GLY 1082CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g62 s LYS 1083N -1.90 3.74 0.37 1.61 1.02 -1.26 -4.21 119.74 119.10 3g62 s LYS 1083Ca 0.00 2.32 -0.27 0.00 0.02 0.00 0.00 55.97 58.03 3g62 s LYS 1083Cb 0.00 -2.66 -0.10 0.00 -0.52 0.00 0.00 37.83 34.56 3g62 s LYS 1083CO 0.00 -0.74 1.30 -1.17 -0.92 0.00 0.00 175.35 173.83 3g62 s LEU 1084N -2.69 4.32 -0.12 3.17 0.20 -1.26 -0.74 118.68 121.57 3g62 s LEU 1084Ca 0.60 2.67 0.01 0.00 0.69 0.00 0.00 54.13 58.10 3g62 s LEU 1084Cb -0.41 -3.77 -0.01 0.00 -0.43 0.00 0.00 46.19 41.56 3g62 s LEU 1084CO 0.53 -0.68 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.12 3g62 s ILE 1085N -1.20 2.83 -0.13 6.68 1.01 0.35 -4.79 121.20 125.95 3g62 s ILE 1085Ca 0.53 -0.74 -0.00 0.00 0.00 0.00 0.00 60.65 60.43 3g62 s ILE 1085Cb -0.39 -2.17 0.02 0.00 0.01 0.00 0.00 42.46 39.94 3g62 s ILE 1085CO 0.51 0.53 -0.11 -1.58 0.00 0.00 0.00 174.94 174.29 3g62 s GLN 1086N 0.31 1.92 0.00 2.79 0.74 -1.26 -1.08 119.66 123.08 3g62 s GLN 1086Ca -0.12 -0.41 -0.01 0.00 0.05 0.00 0.00 55.36 54.87 3g62 s GLN 1086Cb -0.16 -1.85 -0.01 0.00 1.10 0.00 0.00 33.01 32.10 3g62 s GLN 1086CO 0.06 -0.25 0.02 0.54 -0.55 0.00 0.00 175.29 175.12 3g62 s VAL 1087N 1.58 0.05 0.54 1.34 0.11 -0.45 -4.64 120.40 118.93 3g62 s VAL 1087Ca 0.05 -0.44 -0.20 0.00 -2.93 0.00 0.00 61.98 58.46 3g62 s VAL 1087Cb -0.13 -0.18 -0.05 0.00 -1.53 0.00 0.00 36.38 34.49 3g62 s VAL 1087CO -0.09 -0.24 1.19 -2.16 -3.33 0.00 0.00 175.10 170.47 3g62 s PRO 1088N -0.72 3.32 -0.18 1.54 0.04 -1.26 -0.29 135.00 137.45 3g62 s PRO 1088Ca -0.08 1.79 -0.17 0.00 0.04 0.00 0.00 61.00 62.58 3g62 s PRO 1088Cb -0.05 -2.12 -0.06 0.00 0.04 0.00 0.00 34.50 32.31 3g62 s PRO 1088CO -0.00 -0.92 -0.33 0.45 0.04 0.00 0.00 177.00 176.24 3g62 n SER 1089N -1.14 1.93 -3.86 6.66 2.88 0.70 -4.75 113.62 116.03 3g62 n SER 1089Ca 0.11 0.36 -0.09 0.00 -1.33 0.00 0.00 58.87 57.92 3g62 n SER 1089Cb 0.49 -0.76 -0.07 0.00 -0.75 0.00 0.00 64.21 63.13 3g62 n SER 1089CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3g62 s VAL 1090N -2.83 0.12 0.35 2.46 -7.23 -1.14 -4.62 120.40 107.51 3g62 s VAL 1090Ca -0.28 -1.17 -0.07 0.00 -1.81 0.00 0.00 61.98 58.64 3g62 s VAL 1090Cb 0.04 -1.44 -0.05 0.00 0.56 0.00 0.00 36.38 35.49 3g62 s VAL 1090CO 0.41 -0.54 0.66 -0.83 -0.31 0.00 0.00 175.10 174.49 3g62 s GLY 1091N -2.88 1.84 -0.04 2.32 0.00 -0.31 -1.99 107.32 106.25 3g62 s GLY 1091Ca 0.08 -0.42 -0.13 0.00 0.00 0.00 0.00 44.72 44.24 3g62 s GLY 1091CO -0.09 -0.28 0.30 -1.08 0.00 0.00 0.00 173.10 171.95 3g62 s THR 1092N -2.26 0.04 0.80 0.90 -1.32 -0.04 -0.78 115.64 112.98 3g62 s THR 1092Ca 0.47 -0.35 -0.12 0.00 -1.21 0.00 0.00 61.69 60.48 3g62 s THR 1092Cb -0.10 -0.55 0.08 0.00 -1.51 0.00 0.00 72.50 70.41 3g62 s THR 1092CO 0.32 -0.19 1.17 -0.94 -2.21 0.00 0.00 174.62 172.77 3g62 s SER 1093N -0.88 4.56 -0.23 8.08 1.04 -1.26 -0.92 113.70 124.10 3g62 s SER 1093Ca -0.10 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.14 3g62 s SER 1093Cb -0.05 -1.31 0.03 0.00 0.10 0.00 0.00 66.02 64.80 3g62 s SER 1093CO 0.03 -1.87 -0.12 -0.69 0.98 0.00 0.00 173.24 171.57 3g62 s VAL 1094N -3.56 2.43 0.48 5.02 1.01 -0.55 -4.31 120.40 120.92 3g62 s VAL 1094Ca 0.62 -1.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.41 3g62 s VAL 1094Cb -0.11 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3g62 s VAL 1094CO 0.49 0.27 0.79 0.00 0.00 0.00 0.00 175.10 176.65 3g62 s ALA 1095N 1.26 3.39 -0.62 5.51 0.00 -0.13 -4.79 121.76 126.38 3g62 s ALA 1095Ca -0.00 -0.48 0.05 0.00 0.00 0.00 0.00 51.96 51.53 3g62 s ALA 1095Cb -0.16 -2.61 0.20 0.00 0.00 0.00 0.00 23.12 20.55 3g62 s ALA 1095CO -0.08 -0.34 0.55 -0.89 0.00 0.00 0.00 175.76 175.00 3g62 n ILE 1096N -2.22 1.23 -2.10 0.00 2.08 -1.26 -0.64 119.36 116.45 3g62 n ILE 1096Ca 0.01 -4.69 -0.32 0.00 0.56 0.00 0.00 62.75 58.31 3g62 n ILE 1096Cb 0.55 -2.07 0.00 0.00 -0.75 0.00 0.00 39.64 37.38 3g62 n ILE 1096CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 3g62 s PRO 1097N -1.51 3.44 0.08 0.38 0.04 -1.23 -1.14 135.00 135.06 3g62 s PRO 1097Ca 0.31 1.14 -0.13 0.00 0.04 0.00 0.00 61.00 62.36 3g62 s PRO 1097Cb 0.04 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.55 3g62 s PRO 1097CO -0.13 -0.71 0.31 -0.59 0.04 0.00 0.00 177.00 175.93 3g62 s PHE 1098N -2.51 -0.08 -0.81 0.56 -0.12 0.21 -1.86 117.98 113.37 3g62 s PHE 1098Ca 0.62 -0.19 -0.06 0.00 -0.05 0.00 0.00 56.93 57.26 3g62 s PHE 1098Cb -0.15 0.12 0.21 0.00 -0.63 0.00 0.00 43.02 42.57 3g62 s PHE 1098CO 0.36 -0.59 0.69 1.21 -0.05 0.00 0.00 175.22 176.85 3g62 s ASN 1099N -2.52 6.03 -0.30 1.98 2.47 0.34 -4.63 114.94 118.31 3g62 s ASN 1099Ca 0.00 -3.18 -0.05 0.00 0.42 0.00 0.00 52.86 50.05 3g62 s ASN 1099Cb 0.02 -1.99 0.19 0.00 -1.45 0.00 0.00 41.25 38.02 3g62 s ASN 1099CO -0.08 -0.34 0.77 -0.75 -3.72 0.00 0.00 177.10 172.98 3g62 s LYS 1100N -0.56 0.42 0.76 0.43 2.47 -1.26 0.03 119.74 122.02 3g62 s LYS 1100Ca 0.22 0.69 -0.15 0.00 -1.56 0.00 0.00 55.97 55.17 3g62 s LYS 1100Cb -0.13 0.38 0.04 0.00 -1.46 0.00 0.00 37.83 36.66 3g62 s LYS 1100CO -0.08 -0.50 1.14 0.43 0.16 0.00 0.00 175.35 176.50 3g62 n SER 1101N 5.43 1.03 0.00 1.43 7.64 -1.26 -4.85 113.62 123.03 3g62 n SER 1101Ca -0.02 0.65 0.00 0.00 1.01 0.00 0.00 58.87 60.51 3g62 n SER 1101Cb 0.53 -1.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.24 3g62 n SER 1101CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g62 n GLY 1102N 0.79 4.54 0.18 0.23 0.00 -1.26 -4.92 105.19 104.75 3g62 n GLY 1102Ca 0.14 -0.79 0.05 0.00 0.00 0.00 0.00 46.02 45.43 3g62 n GLY 1102CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g62 h SER 1103N 0.00 0.00 -3.99 1.61 4.64 -1.95 -3.43 113.55 110.43 3g62 h SER 1103Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 3g62 h SER 1103Cb 0.00 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 62.21 3g62 h SER 1103CO 0.00 0.39 0.72 0.00 -0.87 0.00 0.00 176.83 177.07 3g62 s ALA 1104N -3.40 3.28 0.19 5.18 0.00 -1.26 -4.82 121.76 120.92 3g62 s ALA 1104Ca 0.01 1.50 -0.30 0.00 0.00 0.00 0.00 51.96 53.17 3g62 s ALA 1104Cb 0.10 -3.60 -0.08 0.00 0.00 0.00 0.00 23.12 19.54 3g62 s ALA 1104CO 0.70 -1.20 1.13 0.00 0.00 0.00 0.00 175.76 176.39 3g62 s ALA 1105N -1.19 3.40 -0.30 0.00 0.00 -1.26 -4.54 121.76 117.86 3g62 s ALA 1105Ca 0.60 0.87 -0.20 0.00 0.00 0.00 0.00 51.96 53.24 3g62 s ALA 1105Cb -0.44 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.29 3g62 s ALA 1105CO 0.58 -0.27 0.60 0.08 0.00 0.00 0.00 175.76 176.75 3g62 s VAL 1106N -0.25 4.97 -0.23 0.00 1.01 -0.18 -4.67 120.40 121.04 3g62 s VAL 1106Ca 0.50 0.82 -0.03 0.00 0.00 0.00 0.00 61.98 63.28 3g62 s VAL 1106Cb -0.31 -3.97 0.07 0.00 0.00 0.00 0.00 36.38 32.18 3g62 s VAL 1106CO 0.36 -0.11 0.07 0.21 0.00 0.00 0.00 175.10 175.63 3g62 s ASN 1107N 1.63 3.19 -0.03 3.32 2.47 -1.26 -1.34 114.94 122.92 3g62 s ASN 1107Ca 0.24 -1.04 -0.24 0.00 0.42 0.00 0.00 52.86 52.24 3g62 s ASN 1107Cb -0.15 -0.58 -0.04 0.00 -1.45 0.00 0.00 41.25 39.03 3g62 s ASN 1107CO 0.11 -0.35 0.71 -0.76 -3.72 0.00 0.00 177.10 173.09 3g62 s LEU 1108N 1.87 4.36 0.80 3.21 1.43 0.19 -4.75 118.68 125.79 3g62 s LEU 1108Ca 0.03 1.26 -0.11 0.00 -1.03 0.00 0.00 54.13 54.28 3g62 s LEU 1108Cb -0.17 -3.11 0.07 0.00 0.03 0.00 0.00 46.19 43.02 3g62 s LEU 1108CO -0.16 -0.06 1.09 -0.94 0.23 0.00 0.00 176.35 176.51 3g62 s SER 1109N 0.47 4.24 0.22 2.29 1.04 -1.26 -0.70 113.70 120.00 3g62 s SER 1109Ca 0.37 1.79 -0.08 0.00 0.48 0.00 0.00 55.95 58.51 3g62 s SER 1109Cb -0.19 -2.46 0.22 0.00 0.10 0.00 0.00 66.02 63.69 3g62 s SER 1109CO 0.19 -2.20 1.88 0.58 0.98 0.00 0.00 173.24 174.67 3g62 h VAL 1110N -1.24 1.16 -0.23 5.02 2.07 -1.90 -0.80 116.25 120.33 3g62 h VAL 1110Ca -0.45 -0.36 -0.07 0.00 0.82 0.00 0.00 66.70 66.64 3g62 h VAL 1110Cb 1.24 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3g62 h VAL 1110CO 0.51 0.19 -0.17 1.56 0.02 0.00 0.00 177.57 179.68 3g62 h GLN 1111N 1.06 0.39 -0.64 1.57 1.08 -1.92 -0.84 115.11 115.80 3g62 h GLN 1111Ca 0.32 -0.12 -0.07 0.00 -1.45 0.00 0.00 58.65 57.33 3g62 h GLN 1111Cb -0.04 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.32 3g62 h GLN 1111CO -0.10 0.56 0.15 0.93 -0.95 0.00 0.00 178.83 179.42 3g62 h GLU 1112N 0.36 1.04 -0.29 1.46 5.08 -1.76 -0.76 114.58 119.71 3g62 h GLU 1112Ca 0.06 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.19 3g62 h GLU 1112Cb 0.52 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 3g62 h GLU 1112CO 0.03 0.94 0.12 1.25 -1.00 0.00 0.00 179.01 180.35 3g62 h LEU 1113N 0.96 0.16 -0.58 1.33 5.85 -0.63 0.60 115.31 122.99 3g62 h LEU 1113Ca 0.20 0.02 0.08 0.00 0.84 0.00 0.00 57.88 59.02 3g62 h LEU 1113Cb 0.37 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.34 3g62 h LEU 1113CO 0.00 0.13 0.24 0.00 -0.34 0.00 0.00 178.44 178.47 3g62 h GLY 1115N 0.44 0.44 0.91 0.00 0.00 -0.47 -0.76 103.07 103.64 3g62 h GLY 1115Ca 0.29 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 3g62 h GLY 1115CO -0.27 0.40 0.11 -2.08 0.00 0.00 0.00 176.54 174.71 3g62 h VAL 1116N 0.34 1.18 0.00 4.60 2.07 -0.54 -0.32 116.25 123.57 3g62 h VAL 1116Ca 0.03 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3g62 h VAL 1116Cb 0.89 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 3g62 h VAL 1116CO 0.07 0.20 -0.04 0.49 0.02 0.00 0.00 177.57 178.31 3g62 n PHE 1117N -4.73 0.43 0.84 1.57 3.01 -0.70 -2.54 117.46 115.35 3g62 n PHE 1117Ca -0.02 0.12 0.12 0.00 1.01 0.00 0.00 57.45 58.68 3g62 n PHE 1117Cb 0.14 -0.69 0.13 0.00 -0.01 0.00 0.00 39.48 39.06 3g62 n PHE 1117CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3g62 n SER 1118N -1.85 0.62 0.00 4.37 3.41 -0.30 -4.70 113.62 115.16 3g62 n SER 1118Ca 0.06 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 3g62 n SER 1118Cb 0.38 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 3g62 n SER 1118CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g62 n GLY 1119N 1.45 1.26 0.32 5.00 0.00 -0.80 -4.54 105.19 107.88 3g62 n GLY 1119Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 3g62 n GLY 1119CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3g62 h ARG 1120N 3.35 1.10 -4.64 1.61 2.43 -1.42 -3.36 114.38 113.45 3g62 h ARG 1120Ca 0.00 -0.08 -0.70 0.00 -0.81 0.00 0.00 59.98 58.39 3g62 h ARG 1120Cb 0.00 -0.24 -0.23 0.00 -0.42 0.00 0.00 29.97 29.08 3g62 h ARG 1120CO 0.00 0.76 -0.51 0.42 -1.51 0.00 0.00 179.97 179.13 3g62 s ILE 1121N -6.05 4.77 -0.04 1.20 1.01 -0.28 -4.94 121.20 116.87 3g62 s ILE 1121Ca -0.13 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 59.94 3g62 s ILE 1121Cb 0.16 -3.57 0.09 0.00 0.01 0.00 0.00 42.46 39.14 3g62 s ILE 1121CO 0.80 -0.14 0.94 -0.46 0.00 0.00 0.00 174.94 176.08 3g62 n ASN 1122N 5.03 1.15 -4.05 3.58 0.23 -1.26 -4.09 115.26 115.84 3g62 n ASN 1122Ca -0.12 -2.12 -0.14 0.00 -0.53 0.00 0.00 54.58 51.67 3g62 n ASN 1122Cb 0.47 -0.18 -0.12 0.00 -2.08 0.00 0.00 39.78 37.87 3g62 n ASN 1122CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 3g62 s THR 1123N -1.08 0.56 0.39 5.53 -4.23 -1.26 -1.15 115.64 114.41 3g62 s THR 1123Ca 0.09 -0.97 0.22 0.00 -1.18 0.00 0.00 61.69 59.85 3g62 s THR 1123Cb 0.08 -0.60 0.23 0.00 1.34 0.00 0.00 72.50 73.55 3g62 s THR 1123CO 0.01 -0.30 1.99 -0.50 -0.54 0.00 0.00 174.62 175.28 3g62 h TRP 1124N 4.70 0.00 -0.92 3.99 4.06 -1.27 -0.96 115.95 125.55 3g62 h TRP 1124Ca -0.35 0.00 0.19 0.00 2.06 0.00 0.00 58.89 60.79 3g62 h TRP 1124Cb 1.20 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 29.29 3g62 h TRP 1124CO 0.61 0.19 0.60 -0.44 -3.56 0.00 0.00 178.44 175.84 3g62 h ASP 1125N 0.00 0.50 0.27 -3.49 5.19 -1.74 -1.57 116.42 115.57 3g62 h ASP 1125Ca -0.00 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 3g62 h ASP 1125Cb 0.42 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 39.89 3g62 h ASP 1125CO 0.02 0.20 0.00 0.61 -3.12 0.00 0.00 179.24 176.96 3g62 n GLY 1126N -1.48 -0.96 3.48 2.75 0.00 -0.36 -4.41 105.19 104.20 3g62 n GLY 1126Ca 0.20 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 3g62 n GLY 1126CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g62 s ILE 1127N -2.33 5.15 0.38 -0.61 1.01 -0.59 -5.03 121.20 119.17 3g62 s ILE 1127Ca 0.29 -0.49 -0.25 0.00 0.00 0.00 0.00 60.65 60.20 3g62 s ILE 1127Cb 0.17 -3.76 -0.12 0.00 0.01 0.00 0.00 42.46 38.76 3g62 s ILE 1127CO 0.34 -0.15 0.94 -1.54 0.00 0.00 0.00 174.94 174.52 3g62 n SER 1128N 5.11 0.93 -0.68 3.58 3.41 -1.26 -2.46 113.62 122.25 3g62 n SER 1128Ca -0.12 1.06 -0.09 0.00 -0.26 0.00 0.00 58.87 59.47 3g62 n SER 1128Cb 0.48 -1.29 -0.04 0.00 -0.26 0.00 0.00 64.21 63.10 3g62 n SER 1128CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g62 n GLY 1129N 1.29 0.92 0.21 5.00 0.00 -1.26 -4.78 105.19 106.57 3g62 n GLY 1129Ca 0.10 -0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.11 3g62 n GLY 1129CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g62 h SER 1130N 0.00 0.00 0.00 1.61 4.64 -1.75 -3.43 113.55 114.62 3g62 h SER 1130Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3g62 h SER 1130Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3g62 h SER 1130CO 0.26 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.93 3g62 n GLY 1131N 1.11 0.32 3.36 -0.77 0.00 -1.26 -4.72 105.19 103.23 3g62 n GLY 1131Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 3g62 n GLY 1131CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g62 s ARG 1132N -0.85 1.33 0.13 1.61 0.52 -1.26 -5.03 118.95 115.39 3g62 s ARG 1132Ca 0.00 -1.32 0.01 0.00 -0.52 0.00 0.00 55.73 53.90 3g62 s ARG 1132Cb 0.00 -1.71 -0.04 0.00 0.52 0.00 0.00 34.95 33.72 3g62 s ARG 1132CO 0.00 0.40 -0.01 -0.08 0.02 0.00 0.00 175.30 175.63 3g62 s THR 1133N -1.22 0.52 0.00 0.02 -1.32 -1.26 -2.61 115.64 109.78 3g62 s THR 1133Ca 0.13 -1.94 0.00 0.00 -1.21 0.00 0.00 61.69 58.67 3g62 s THR 1133Cb -0.10 -1.91 0.00 0.00 -1.51 0.00 0.00 72.50 68.98 3g62 s THR 1133CO 0.06 -0.65 0.00 0.61 -2.21 0.00 0.00 174.62 172.43 3g62 n GLY 1134N -0.12 0.78 3.79 6.08 0.00 -1.26 -4.73 105.19 109.73 3g62 n GLY 1134Ca -0.09 -2.14 -0.35 0.00 0.00 0.00 0.00 46.02 43.44 3g62 n GLY 1134CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3g62 s PRO 1135N -1.22 3.89 -0.14 1.61 0.04 -1.26 -0.90 135.00 137.01 3g62 s PRO 1135Ca 0.00 1.45 -0.14 0.00 0.04 0.00 0.00 61.00 62.36 3g62 s PRO 1135Cb 0.00 -2.25 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 3g62 s PRO 1135CO 0.00 -0.37 0.30 0.42 0.04 0.00 0.00 177.00 177.38 3g62 s ILE 1136N -1.83 5.29 -0.18 0.56 1.01 -0.30 -4.63 121.20 121.12 3g62 s ILE 1136Ca 0.64 0.56 -0.01 0.00 0.00 0.00 0.00 60.65 61.85 3g62 s ILE 1136Cb -0.19 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.65 3g62 s ILE 1136CO 0.24 0.42 -0.14 -0.69 0.00 0.00 0.00 174.94 174.77 3g62 s VAL 1137N 0.25 2.67 -0.07 2.92 1.01 -0.67 -4.84 120.40 121.67 3g62 s VAL 1137Ca 0.17 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 61.17 3g62 s VAL 1137Cb -0.13 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 3g62 s VAL 1137CO 0.05 0.50 0.68 -0.69 0.00 0.00 0.00 175.10 175.63 3g62 s VAL 1138N 1.15 5.06 -0.13 2.92 1.01 -1.26 -1.29 120.40 127.85 3g62 s VAL 1138Ca 0.01 1.39 -0.05 0.00 0.00 0.00 0.00 61.98 63.33 3g62 s VAL 1138Cb -0.14 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 3g62 s VAL 1138CO -0.05 0.26 0.05 -0.69 0.00 0.00 0.00 175.10 174.67 3g62 s VAL 1139N 0.78 4.74 0.16 2.92 1.01 -0.10 -0.66 120.40 129.25 3g62 s VAL 1139Ca 0.36 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 3g62 s VAL 1139Cb -0.17 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 3g62 s VAL 1139CO 0.17 0.55 0.10 -0.72 0.00 0.00 0.00 175.10 175.20 3g62 s TYR 1140N -0.39 0.93 -0.14 5.22 -0.85 -0.28 -4.45 117.35 117.39 3g62 s TYR 1140Ca 0.09 -1.25 -0.28 0.00 -0.52 0.00 0.00 57.07 55.11 3g62 s TYR 1140Cb -0.12 -0.48 -0.01 0.00 0.38 0.00 0.00 41.96 41.73 3g62 s TYR 1140CO 0.02 -0.58 0.93 1.03 -1.52 0.00 0.00 175.55 175.43 3g62 s ARG 1141N -4.08 4.36 0.31 -3.49 1.81 -1.26 -1.31 118.95 115.29 3g62 s ARG 1141Ca 0.29 1.22 0.04 0.00 -1.72 0.00 0.00 55.73 55.56 3g62 s ARG 1141Cb 0.07 -3.56 0.50 0.00 -0.45 0.00 0.00 34.95 31.51 3g62 s ARG 1141CO 0.05 -0.34 1.78 1.03 -0.68 0.00 0.00 175.30 177.14 3g62 h SER 1142N 7.21 0.44 -6.12 0.23 0.87 -1.34 -3.38 113.55 111.47 3g62 h SER 1142Ca -0.29 -0.13 -0.41 0.00 -1.23 0.00 0.00 61.79 59.73 3g62 h SER 1142Cb 1.13 -0.12 0.02 0.00 -0.44 0.00 0.00 62.40 62.99 3g62 h SER 1142CO 0.86 0.64 -0.07 -1.84 -0.53 0.00 0.00 176.83 175.89 3g62 n GLU 1143N -4.17 0.68 -2.34 2.24 0.00 -1.26 -4.90 120.64 110.89 3g62 n GLU 1143Ca 0.00 -2.64 -0.43 0.00 0.00 0.00 0.00 57.16 54.09 3g62 n GLU 1143Cb 0.35 -0.16 -0.02 0.00 0.00 0.00 0.00 31.44 31.61 3g62 n GLU 1143CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3g62 s SER 1144N -4.00 6.23 -0.06 -1.84 0.15 -1.26 -4.53 113.70 108.40 3g62 s SER 1144Ca 0.49 0.70 0.04 0.00 0.70 0.00 0.00 55.95 57.88 3g62 s SER 1144Cb -0.04 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 3g62 s SER 1144CO 0.31 -1.54 -0.18 -0.55 1.20 0.00 0.00 173.24 172.48 3g62 s SER 1145N 4.28 2.32 0.28 5.45 0.15 -0.02 -1.64 113.70 124.52 3g62 s SER 1145Ca 0.60 -0.39 0.09 0.00 0.70 0.00 0.00 55.95 56.95 3g62 s SER 1145Cb -0.13 -0.82 0.39 0.00 -1.71 0.00 0.00 66.02 63.75 3g62 s SER 1145CO 0.31 0.14 1.63 1.23 1.20 0.00 0.00 173.24 177.74 3g62 h GLY 1146N 6.48 0.06 0.99 9.45 0.00 -1.86 -1.96 103.07 116.22 3g62 h GLY 1146Ca -0.30 -0.07 0.01 0.00 0.00 0.00 0.00 47.33 46.97 3g62 h GLY 1146CO 0.47 0.06 0.38 -0.84 0.00 0.00 0.00 176.54 176.62 3g62 h THR 1147N 0.04 1.14 -0.61 4.70 2.02 -1.95 0.29 112.91 118.53 3g62 h THR 1147Ca -0.01 -0.27 0.05 0.00 0.77 0.00 0.00 66.41 66.96 3g62 h THR 1147Cb 1.03 0.29 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 3g62 h THR 1147CO 0.08 0.14 0.33 0.74 0.37 0.00 0.00 175.52 177.18 3g62 h THR 1148N 0.78 0.97 -0.19 3.16 2.02 -1.81 -0.68 112.91 117.16 3g62 h THR 1148Ca 0.22 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3g62 h THR 1148Cb -0.08 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.61 3g62 h THR 1148CO -0.05 0.11 0.11 -0.08 0.37 0.00 0.00 175.52 175.98 3g62 h GLU 1149N 0.63 0.26 -0.86 6.66 4.81 -0.66 0.10 114.58 125.53 3g62 h GLU 1149Ca 0.27 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.51 3g62 h GLU 1149Cb 0.16 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.43 3g62 h GLU 1149CO -0.17 0.24 0.55 -0.07 -0.73 0.00 0.00 179.01 178.83 3g62 h LEU 1150N 0.21 0.91 -0.15 1.64 3.38 -0.68 -1.18 115.31 119.44 3g62 h LEU 1150Ca 0.07 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 3g62 h LEU 1150Cb 0.05 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.60 3g62 h LEU 1150CO -0.01 0.62 -0.38 0.15 0.09 0.00 0.00 178.44 178.92 3g62 h PHE 1151N 1.07 0.67 0.00 1.13 3.57 -0.86 -3.19 116.94 119.32 3g62 h PHE 1151Ca 0.34 -0.26 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 3g62 h PHE 1151Cb 0.02 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 3g62 h PHE 1151CO -0.02 1.00 -0.18 1.79 -2.23 0.00 0.00 178.31 178.67 3g62 h THR 1152N 0.15 0.47 -0.55 4.41 1.35 -0.68 -1.35 112.91 116.71 3g62 h THR 1152Ca -0.00 -0.95 -0.04 0.00 -0.55 0.00 0.00 66.41 64.87 3g62 h THR 1152Cb 0.99 1.67 -0.03 0.00 -1.73 0.00 0.00 68.15 69.05 3g62 h THR 1152CO 0.08 0.17 0.19 0.03 -0.25 0.00 0.00 175.52 175.74 3g62 h ARG 1153N 0.00 0.81 -0.11 4.72 3.08 -1.20 0.95 114.38 122.63 3g62 h ARG 1153Ca -0.00 -0.14 -0.04 0.00 0.07 0.00 0.00 59.98 59.87 3g62 h ARG 1153Cb 0.66 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 3g62 h ARG 1153CO 0.02 0.69 -0.10 0.35 -1.07 0.00 0.00 179.97 179.87 3g62 h PHE 1154N 0.80 0.31 -0.79 3.04 3.57 -1.28 -2.18 116.94 120.41 3g62 h PHE 1154Ca 0.18 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 3g62 h PHE 1154Cb 0.21 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.85 3g62 h PHE 1154CO 0.01 0.66 0.44 -0.07 -2.23 0.00 0.00 178.31 177.13 3g62 h LEU 1155N -0.13 0.98 -1.22 0.59 3.38 -1.19 -1.10 115.31 116.62 3g62 h LEU 1155Ca 0.02 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 57.93 3g62 h LEU 1155Cb 0.60 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 3g62 h LEU 1155CO 0.02 0.79 0.54 -1.13 0.09 0.00 0.00 178.44 178.75 3g62 h ASN 1156N 1.09 0.89 0.93 -0.43 -0.73 -0.78 -0.30 115.58 116.24 3g62 h ASN 1156Ca 0.28 -0.01 -0.16 0.00 1.87 0.00 0.00 56.30 58.27 3g62 h ASN 1156Cb 0.02 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 38.38 3g62 h ASN 1156CO -0.05 0.62 -0.78 0.00 -0.37 0.00 0.00 177.43 176.85 3g62 h ALA 1157N 1.52 0.63 0.00 1.57 0.00 -0.68 -3.40 119.26 118.89 3g62 h ALA 1157Ca 0.32 -0.71 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 3g62 h ALA 1157Cb 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3g62 h ALA 1157CO -0.09 0.98 -1.30 1.63 0.00 0.00 0.00 179.25 180.46 3g62 n LYS 1158N -3.49 1.51 -3.20 0.00 4.76 -0.49 -4.78 118.16 112.47 3g62 n LYS 1158Ca -0.00 -0.03 -0.45 0.00 -2.87 0.00 0.00 58.31 54.96 3g62 n LYS 1158Cb 0.79 -1.13 0.00 0.00 -1.84 0.00 0.00 35.03 32.84 3g62 n LYS 1158CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3g62 n ASN 1160N 3.28 3.39 -0.58 0.00 6.94 -1.26 -4.40 115.26 122.63 3g62 n ASN 1160Ca 0.28 -1.98 0.05 0.00 -0.02 0.00 0.00 54.58 52.91 3g62 n ASN 1160Cb 0.39 -0.28 0.09 0.00 -2.36 0.00 0.00 39.78 37.63 3g62 n ASN 1160CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3g62 n ALA 1161N 1.43 2.50 -1.95 -2.53 0.00 -1.26 -5.06 120.51 113.64 3g62 n ALA 1161Ca 0.20 -2.25 -0.24 0.00 0.00 0.00 0.00 53.44 51.14 3g62 n ALA 1161Cb 0.59 -0.48 0.07 0.00 0.00 0.00 0.00 19.45 19.63 3g62 n ALA 1161CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3g62 s GLU 1162N -1.57 2.11 -1.15 0.00 0.41 -1.26 -4.99 118.70 112.24 3g62 s GLU 1162Ca 0.24 -0.56 -0.04 0.00 -0.41 0.00 0.00 54.97 54.21 3g62 s GLU 1162Cb 0.24 -2.27 0.24 0.00 -1.78 0.00 0.00 34.13 30.57 3g62 s GLU 1162CO -0.04 -1.20 1.93 2.41 -0.49 0.00 0.00 175.26 177.87 3g62 n THR 1163N -2.80 5.54 -0.15 3.63 -1.04 -1.26 -4.78 114.28 113.42 3g62 n THR 1163Ca 0.10 -5.33 0.00 0.00 -2.04 0.00 0.00 64.05 56.78 3g62 n THR 1163Cb 0.60 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.23 3g62 n THR 1163CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3g62 n GLY 1164N 1.02 -0.44 3.13 3.41 0.00 -1.26 -4.58 105.19 106.47 3g62 n GLY 1164Ca 0.47 -1.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 3g62 n GLY 1164CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g62 s ASN 1165N -0.40 0.84 -0.23 1.61 2.20 -1.26 -4.86 114.94 112.84 3g62 s ASN 1165Ca 0.00 -1.00 -0.18 0.00 -0.94 0.00 0.00 52.86 50.74 3g62 s ASN 1165Cb 0.00 0.14 -0.03 0.00 -2.00 0.00 0.00 41.25 39.36 3g62 s ASN 1165CO 0.00 -0.53 0.50 -0.36 -2.94 0.00 0.00 177.10 173.77 3g62 s PHE 1166N -3.75 3.31 0.35 1.54 0.08 -1.26 -0.84 117.98 117.41 3g62 s PHE 1166Ca 0.10 0.67 -0.21 0.00 0.12 0.00 0.00 56.93 57.61 3g62 s PHE 1166Cb 0.06 -2.68 -0.10 0.00 -0.57 0.00 0.00 43.02 39.74 3g62 s PHE 1166CO -0.07 -0.19 0.86 0.00 -0.10 0.00 0.00 175.22 175.72 3g62 s ALA 1167N 1.97 3.20 0.03 5.36 0.00 -0.11 -4.15 121.76 128.07 3g62 s ALA 1167Ca 0.22 0.31 -0.30 0.00 0.00 0.00 0.00 51.96 52.18 3g62 s ALA 1167Cb -0.15 -3.02 -0.06 0.00 0.00 0.00 0.00 23.12 19.88 3g62 s ALA 1167CO 0.09 0.22 1.45 0.08 0.00 0.00 0.00 175.76 177.60 3g62 s VAL 1168N -1.91 3.51 0.23 0.00 1.01 -1.26 -4.74 120.40 117.23 3g62 s VAL 1168Ca 0.55 0.94 -0.21 0.00 0.00 0.00 0.00 61.98 63.26 3g62 s VAL 1168Cb -0.13 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.69 3g62 s VAL 1168CO 0.18 0.01 0.65 0.28 0.00 0.00 0.00 175.10 176.22 3g62 s THR 1169N 2.26 0.00 -1.77 3.92 -1.32 -1.26 -5.03 115.64 112.44 3g62 s THR 1169Ca 0.66 -0.61 0.24 0.00 -1.21 0.00 0.00 61.69 60.77 3g62 s THR 1169Cb -0.34 -1.58 0.06 0.00 -1.51 0.00 0.00 72.50 69.13 3g62 s THR 1169CO 0.28 -0.01 1.25 0.35 -2.21 0.00 0.00 174.62 174.28 3g62 n THR 1170N -0.42 0.00 -3.96 5.08 -2.24 -1.26 -2.63 114.28 108.85 3g62 n THR 1170Ca -0.09 -0.17 -0.32 0.00 -2.27 0.00 0.00 64.05 61.20 3g62 n THR 1170Cb 0.62 0.87 -0.14 0.00 -2.10 0.00 0.00 70.33 69.58 3g62 n THR 1170CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3g62 s THR 1171N -2.57 2.54 0.58 4.28 -4.23 -1.26 -0.84 115.64 114.14 3g62 s THR 1171Ca 0.19 -2.62 0.27 0.00 -1.18 0.00 0.00 61.69 58.36 3g62 s THR 1171Cb 0.18 -2.82 0.35 0.00 1.34 0.00 0.00 72.50 71.56 3g62 s THR 1171CO 0.59 -0.68 2.12 0.15 -0.54 0.00 0.00 174.62 176.27 3g62 h PHE 1172N 7.32 0.00 0.00 3.99 3.04 -1.85 0.04 116.94 129.48 3g62 h PHE 1172Ca -0.06 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.89 3g62 h PHE 1172Cb 0.98 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.49 3g62 h PHE 1172CO 0.50 0.00 0.00 0.78 -2.02 0.00 0.00 178.31 177.57 3g62 h GLY 1173N 0.00 0.00 -0.03 2.40 0.00 -1.91 -1.26 103.07 102.27 3g62 h GLY 1173Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 3g62 h GLY 1173CO -0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 3g62 n THR 1174N -2.47 1.32 -0.00 4.70 -2.24 -0.00 -4.74 114.28 110.83 3g62 n THR 1174Ca -0.02 -1.44 -0.10 0.00 -2.27 0.00 0.00 64.05 60.22 3g62 n THR 1174Cb 0.05 0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.44 3g62 n THR 1174CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3g62 h SER 1175N 0.04 -0.09 -3.36 3.42 0.87 -1.21 -3.45 113.55 109.78 3g62 h SER 1175Ca 0.00 -0.48 -0.56 0.00 -1.23 0.00 0.00 61.79 59.52 3g62 h SER 1175Cb 0.68 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.62 3g62 h SER 1175CO 0.00 0.58 0.28 0.12 -0.53 0.00 0.00 176.83 177.28 3g62 s PHE 1176N -2.77 3.58 0.04 2.24 5.36 -1.26 -0.93 117.98 124.23 3g62 s PHE 1176Ca -0.12 1.44 0.32 0.00 -0.96 0.00 0.00 56.93 57.61 3g62 s PHE 1176Cb -0.01 -2.99 1.48 0.00 -0.34 0.00 0.00 43.02 41.17 3g62 s PHE 1176CO 0.46 -0.03 1.96 0.66 -1.46 0.00 0.00 175.22 176.81 3g62 h SER 1177N 6.90 0.00 -0.46 6.13 4.64 -1.29 -1.50 113.55 127.98 3g62 h SER 1177Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3g62 h SER 1177Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3g62 h SER 1177CO 0.77 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.34 3g62 n GLY 1178N -0.39 1.15 0.00 -0.77 0.00 -1.26 -4.97 105.19 98.95 3g62 n GLY 1178Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 3g62 n GLY 1178CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g62 n GLY 1179N 1.24 -0.26 3.77 -0.02 0.00 -0.56 -4.95 105.19 104.41 3g62 n GLY 1179Ca 0.16 -1.77 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 3g62 n GLY 1179CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g62 s LEU 1180N -2.24 3.38 0.49 0.99 1.43 -1.26 -4.75 118.68 116.72 3g62 s LEU 1180Ca 0.00 1.97 -0.24 0.00 -1.03 0.00 0.00 54.13 54.84 3g62 s LEU 1180Cb 0.00 -4.55 -0.07 0.00 0.03 0.00 0.00 46.19 41.61 3g62 s LEU 1180CO 0.00 -1.61 1.35 -2.84 0.23 0.00 0.00 176.35 173.49 3g62 s PRO 1181N -4.14 3.49 0.33 1.29 0.02 -1.26 -4.92 135.00 129.80 3g62 s PRO 1181Ca 0.66 2.24 -0.28 0.00 0.02 0.00 0.00 61.00 63.64 3g62 s PRO 1181Cb -0.20 -2.47 -0.13 0.00 0.02 0.00 0.00 34.50 31.72 3g62 s PRO 1181CO 0.42 -0.91 1.22 0.00 -0.33 0.00 0.00 177.00 177.40 3g62 n ALA 1182N -0.55 0.92 -0.97 -1.55 0.00 -1.26 -2.01 120.51 115.10 3g62 n ALA 1182Ca 0.07 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3g62 n ALA 1182Cb 0.44 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.69 3g62 n ALA 1182CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g62 n GLY 1183N 0.90 0.97 3.74 0.00 0.00 -1.26 -4.87 105.19 104.66 3g62 n GLY 1183Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 3g62 n GLY 1183CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g62 n ALA 1184N 0.91 1.44 -3.28 4.61 0.00 -0.85 -4.66 120.51 118.69 3g62 n ALA 1184Ca 0.00 0.08 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 3g62 n ALA 1184Cb 0.00 -2.35 -0.15 0.00 0.00 0.00 0.00 19.45 16.95 3g62 n ALA 1184CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3g62 s VAL 1185N -1.32 2.78 0.10 0.00 1.01 0.17 -4.99 120.40 118.15 3g62 s VAL 1185Ca 0.76 -0.74 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 3g62 s VAL 1185Cb -0.40 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 33.75 3g62 s VAL 1185CO 0.46 0.52 0.48 0.00 0.00 0.00 0.00 175.10 176.56 3g62 s ALA 1186N 0.60 3.65 0.18 5.51 0.00 -1.26 -1.13 121.76 129.31 3g62 s ALA 1186Ca -0.09 -0.22 -0.11 0.00 0.00 0.00 0.00 51.96 51.55 3g62 s ALA 1186Cb -0.16 -2.42 -0.00 0.00 0.00 0.00 0.00 23.12 20.54 3g62 s ALA 1186CO 0.03 0.49 0.35 0.00 0.00 0.00 0.00 175.76 176.63 3g62 s ALA 1187N -1.37 -0.15 -0.12 0.00 0.00 -0.42 -4.88 121.76 114.82 3g62 s ALA 1187Ca 0.34 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.51 3g62 s ALA 1187Cb -0.15 0.90 -0.01 0.00 0.00 0.00 0.00 23.12 23.86 3g62 s ALA 1187CO 0.18 -0.70 -0.17 0.99 0.00 0.00 0.00 175.76 176.06 3g62 s THR 1188N -3.97 2.71 0.04 0.00 2.01 -1.26 -0.86 115.64 114.32 3g62 s THR 1188Ca 0.17 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.38 3g62 s THR 1188Cb 0.02 -2.10 0.00 0.00 0.01 0.00 0.00 72.50 70.43 3g62 s THR 1188CO 0.01 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.09 3g62 n GLY 1189N 3.47 -2.67 0.10 4.40 0.00 -1.26 -2.94 105.19 106.30 3g62 n GLY 1189Ca -0.18 -1.42 -0.08 0.00 0.00 0.00 0.00 46.02 44.33 3g62 n GLY 1189CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3g62 h SER 1190N -0.10 -0.14 -0.23 1.61 0.02 -1.95 -1.40 113.55 111.36 3g62 h SER 1190Ca -0.01 0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 60.87 3g62 h SER 1190Cb 0.10 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 3g62 h SER 1190CO 0.01 -0.05 -0.29 -0.61 -1.14 0.00 0.00 176.83 174.76 3g62 h GLN 1191N 0.02 0.73 -0.58 3.45 5.75 -1.95 -1.75 115.11 120.78 3g62 h GLN 1191Ca 0.10 -0.32 -0.05 0.00 -0.15 0.00 0.00 58.65 58.23 3g62 h GLN 1191Cb 0.14 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.64 3g62 h GLN 1191CO -0.19 0.93 0.16 0.78 -2.65 0.00 0.00 178.83 177.86 3g62 h GLY 1192N 0.97 0.96 0.94 2.39 0.00 -1.38 -0.05 103.07 106.90 3g62 h GLY 1192Ca 0.08 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 3g62 h GLY 1192CO 0.07 0.52 0.12 -2.08 0.00 0.00 0.00 176.54 175.16 3g62 h VAL 1193N 0.86 1.22 -0.69 4.60 2.07 -1.03 -1.23 116.25 122.06 3g62 h VAL 1193Ca 0.19 -0.73 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 3g62 h VAL 1193Cb 0.29 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 3g62 h VAL 1193CO -0.00 0.26 0.29 0.24 0.02 0.00 0.00 177.57 178.38 3g62 h MET 1194N 0.52 1.00 -0.42 1.57 2.07 -0.75 0.54 114.93 119.46 3g62 h MET 1194Ca 0.13 -0.16 0.01 0.00 -2.07 0.00 0.00 59.70 57.61 3g62 h MET 1194Cb 0.27 -0.18 -0.02 0.00 -1.87 0.00 0.00 31.60 29.81 3g62 h MET 1194CO -0.00 0.80 0.28 1.15 1.07 0.00 0.00 176.91 180.21 3g62 h THR 1195N 0.99 1.10 -0.19 2.22 2.02 -0.87 -1.71 112.91 116.47 3g62 h THR 1195Ca 0.23 -0.19 -0.06 0.00 0.77 0.00 0.00 66.41 67.16 3g62 h THR 1195Cb 0.16 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3g62 h THR 1195CO -0.02 0.10 -0.13 0.00 0.37 0.00 0.00 175.52 175.84 3g62 h ALA 1196N 1.16 1.43 -0.43 6.16 0.00 -0.61 -2.55 119.26 124.41 3g62 h ALA 1196Ca 0.16 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3g62 h ALA 1196Cb -0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3g62 h ALA 1196CO -0.04 0.40 0.15 1.25 0.00 0.00 0.00 179.25 181.01 3g62 h LEU 1197N 0.29 0.62 -0.42 0.00 5.85 -0.53 -2.76 115.31 118.36 3g62 h LEU 1197Ca 0.06 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.59 3g62 h LEU 1197Cb 0.41 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3g62 h LEU 1197CO 0.02 0.64 0.00 0.00 -0.34 0.00 0.00 178.44 178.76 3g62 h ALA 1198N 1.00 1.00 -0.00 1.25 0.00 -1.20 -3.32 119.26 117.99 3g62 h ALA 1198Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3g62 h ALA 1198Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3g62 h ALA 1198CO -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 179.25 179.12 3g62 n ALA 1199N -1.99 2.79 -3.36 0.00 0.00 -0.97 -4.88 120.51 112.09 3g62 n ALA 1199Ca 0.03 -0.29 -0.14 0.00 0.00 0.00 0.00 53.44 53.04 3g62 n ALA 1199Cb 0.42 -1.31 -0.08 0.00 0.00 0.00 0.00 19.45 18.48 3g62 n ALA 1199CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3g62 s GLY 1200N -2.45 -0.33 0.52 0.00 0.00 -1.24 -5.09 107.32 98.73 3g62 s GLY 1200Ca 0.29 0.93 -0.19 0.00 0.00 0.00 0.00 44.72 45.76 3g62 s GLY 1200CO 0.47 0.69 1.03 -0.35 0.00 0.00 0.00 173.10 174.95 3g62 s ASP 1201N -0.74 6.24 -0.60 1.64 3.68 -1.26 -3.59 116.67 122.04 3g62 s ASP 1201Ca -0.08 1.85 0.00 0.00 2.13 0.00 0.00 52.55 56.45 3g62 s ASP 1201Cb -0.03 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 38.89 3g62 s ASP 1201CO 0.04 -0.85 0.00 0.61 0.13 0.00 0.00 175.17 175.10 3g62 n GLY 1202N -0.59 0.57 3.88 2.66 0.00 0.10 -4.77 105.19 107.06 3g62 n GLY 1202Ca 0.09 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 3g62 n GLY 1202CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g62 s ARG 1203N -3.19 3.76 0.01 1.61 0.52 -1.14 -1.66 118.95 118.86 3g62 s ARG 1203Ca 0.00 0.22 -0.04 0.00 -0.52 0.00 0.00 55.73 55.39 3g62 s ARG 1203Cb 0.00 -2.63 -0.01 0.00 0.52 0.00 0.00 34.95 32.83 3g62 s ARG 1203CO 0.00 0.26 0.06 -1.50 0.02 0.00 0.00 175.30 174.15 3g62 s ILE 1204N -1.93 0.10 0.24 1.52 2.07 -0.42 -0.50 121.20 122.29 3g62 s ILE 1204Ca 0.47 -0.84 -0.05 0.00 -1.41 0.00 0.00 60.65 58.81 3g62 s ILE 1204Cb -0.11 -0.44 0.02 0.00 0.13 0.00 0.00 42.46 42.06 3g62 s ILE 1204CO 0.24 -0.46 0.41 1.07 -1.91 0.00 0.00 174.94 174.29 3g62 n THR 1205N 1.40 0.00 -4.65 4.00 5.66 -0.78 -0.92 114.28 118.99 3g62 n THR 1205Ca -0.23 -0.89 -0.30 0.00 -3.05 0.00 0.00 64.05 59.58 3g62 n THR 1205Cb 0.56 0.67 -0.13 0.00 -1.55 0.00 0.00 70.33 69.88 3g62 n THR 1205CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 3g62 s TYR 1206N -4.17 2.50 -0.15 1.09 -0.85 -1.26 -3.51 117.35 111.00 3g62 s TYR 1206Ca 0.14 -0.29 -0.29 0.00 -0.52 0.00 0.00 57.07 56.12 3g62 s TYR 1206Cb -0.02 -1.43 0.09 0.00 0.38 0.00 0.00 41.96 40.98 3g62 s TYR 1206CO 0.10 0.25 0.82 1.41 -1.52 0.00 0.00 175.55 176.61 3g62 s MET 1207N -1.50 0.82 0.16 -3.49 1.75 0.19 -4.96 119.30 112.26 3g62 s MET 1207Ca 0.14 0.40 -0.33 0.00 -1.25 0.00 0.00 55.69 54.65 3g62 s MET 1207Cb -0.10 0.39 -0.16 0.00 2.84 0.00 0.00 34.83 37.80 3g62 s MET 1207CO 0.05 -0.21 1.15 0.45 -0.65 0.00 0.00 175.02 175.81 3g62 n SER 1208N 1.33 1.21 0.26 1.11 2.88 -1.26 -0.95 113.62 118.19 3g62 n SER 1208Ca -0.15 1.14 0.17 0.00 -1.33 0.00 0.00 58.87 58.71 3g62 n SER 1208Cb 0.57 -1.19 0.81 0.00 -0.75 0.00 0.00 64.21 63.65 3g62 n SER 1208CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3g62 h PRO 1209N 3.37 0.00 0.00 -1.46 0.13 -1.88 -0.86 132.00 131.30 3g62 h PRO 1209Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3g62 h PRO 1209Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 3g62 h PRO 1209CO 0.70 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 175.00 3g62 n ASP 1210N -2.84 0.69 -0.00 1.44 4.64 -1.26 -3.58 116.55 115.64 3g62 n ASP 1210Ca -0.01 0.57 0.04 0.00 -1.38 0.00 0.00 54.79 54.02 3g62 n ASP 1210Cb 0.18 -0.76 -0.06 0.00 -1.04 0.00 0.00 41.12 39.45 3g62 n ASP 1210CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 3g62 n PHE 1211N -2.16 0.00 0.27 -0.67 3.72 -0.62 -4.74 117.46 113.26 3g62 n PHE 1211Ca 0.05 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.61 3g62 n PHE 1211Cb 0.40 -0.16 0.67 0.00 -0.94 0.00 0.00 39.48 39.45 3g62 n PHE 1211CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g62 h ALA 1212N 0.67 1.03 -2.65 4.37 0.00 -1.25 -3.43 119.26 118.00 3g62 h ALA 1212Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3g62 h ALA 1212Cb 0.33 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 17.93 3g62 h ALA 1212CO 0.00 0.07 -0.55 0.00 0.00 0.00 0.00 179.25 178.78 3g62 s ALA 1213N -3.74 -0.06 -1.73 0.00 0.00 -1.26 -4.78 121.76 110.20 3g62 s ALA 1213Ca 0.00 -0.53 0.30 0.00 0.00 0.00 0.00 51.96 51.74 3g62 s ALA 1213Cb 0.10 0.22 1.47 0.00 0.00 0.00 0.00 23.12 24.91 3g62 s ALA 1213CO 0.56 -0.29 2.00 -0.35 0.00 0.00 0.00 175.76 177.68 3g62 n PRO 1214N 0.93 0.75 -3.95 0.00 -0.04 -1.26 -4.72 135.00 126.71 3g62 n PRO 1214Ca -0.20 -0.16 -0.09 0.00 -0.04 0.00 0.00 63.50 63.02 3g62 n PRO 1214Cb 0.58 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 3g62 n PRO 1214CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3g62 s THR 1215N -2.35 0.14 0.41 0.52 -4.23 -1.26 -5.02 115.64 103.85 3g62 s THR 1215Ca 0.34 -1.16 0.14 0.00 -1.18 0.00 0.00 61.69 59.83 3g62 s THR 1215Cb 0.21 -0.90 0.34 0.00 1.34 0.00 0.00 72.50 73.49 3g62 s THR 1215CO 0.44 -0.64 1.92 -0.07 -0.54 0.00 0.00 174.62 175.73 3g62 h LEU 1216N 3.70 0.44 -1.90 4.79 3.38 -1.92 0.14 115.31 123.92 3g62 h LEU 1216Ca -0.33 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 3g62 h LEU 1216Cb 1.18 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 3g62 h LEU 1216CO 0.51 0.24 -0.07 0.00 0.09 0.00 0.00 178.44 179.21 3g62 h ALA 1217N 1.64 1.84 0.00 1.53 0.00 -1.96 -2.81 119.26 119.50 3g62 h ALA 1217Ca 0.37 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 3g62 h ALA 1217Cb 0.76 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3g62 h ALA 1217CO -0.12 0.08 -0.02 0.78 0.00 0.00 0.00 179.25 179.97 3g62 h GLY 1218N 0.22 0.00 2.00 0.00 0.00 -1.08 -1.76 103.07 102.45 3g62 h GLY 1218Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3g62 h GLY 1218CO 0.01 0.00 -0.08 1.41 0.00 0.00 0.00 176.54 177.88 3g62 h LEU 1219N 0.00 0.00 -0.22 3.11 3.38 -1.57 -2.77 115.31 117.24 3g62 h LEU 1219Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g62 h LEU 1219Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3g62 h LEU 1219CO 0.00 0.08 -0.58 0.47 0.09 0.00 0.00 178.44 178.50 3g62 n ASP 1220N -3.51 0.92 -4.55 -0.43 8.00 -0.66 -4.42 116.55 111.89 3g62 n ASP 1220Ca -0.02 -0.73 -0.41 0.00 0.71 0.00 0.00 54.79 54.35 3g62 n ASP 1220Cb 0.21 0.45 -0.03 0.00 -0.02 0.00 0.00 41.12 41.73 3g62 n ASP 1220CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3g62 s ASP 1221N -2.84 6.13 0.00 -2.24 -1.08 -1.05 -4.88 116.67 110.72 3g62 s ASP 1221Ca 0.14 -0.47 0.11 0.00 -0.52 0.00 0.00 52.55 51.81 3g62 s ASP 1221Cb 0.18 -2.56 0.66 0.00 -1.46 0.00 0.00 42.92 39.73 3g62 s ASP 1221CO 0.69 -1.85 1.29 0.00 0.52 0.00 0.00 175.17 175.82 3g62 n ALA 1222N 9.54 2.40 1.48 3.66 0.00 -1.25 -0.87 120.51 135.46 3g62 n ALA 1222Ca 0.06 -0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.57 3g62 n ALA 1222Cb 0.49 -1.18 0.59 0.00 0.00 0.00 0.00 19.45 19.35 3g62 n ALA 1222CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3g62 n THR 1223N -0.71 0.00 0.00 0.00 -2.24 -1.26 -1.01 114.28 109.06 3g62 n THR 1223Ca 0.08 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3g62 n THR 1223Cb 0.04 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 3g62 n THR 1223CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3g62 n LYS 1224N -0.57 2.75 -3.92 -0.78 5.02 -0.62 -4.67 118.16 115.36 3g62 n LYS 1224Ca 0.17 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.17 3g62 n LYS 1224Cb 0.29 -0.45 -0.16 0.00 -0.02 0.00 0.00 35.03 34.69 3g62 n LYS 1224CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3g62 s VAL 1225N -0.49 1.25 0.35 -0.18 1.01 -0.05 -0.62 120.40 121.67 3g62 s VAL 1225Ca 0.00 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 60.99 3g62 s VAL 1225Cb 0.00 -1.39 -0.10 0.00 0.00 0.00 0.00 36.38 34.89 3g62 s VAL 1225CO 0.00 0.15 1.30 0.00 0.00 0.00 0.00 175.10 176.56 3g62 s ALA 1226N 1.57 3.44 0.59 5.51 0.00 -0.29 -3.90 121.76 128.68 3g62 s ALA 1226Ca 0.00 1.24 -0.17 0.00 0.00 0.00 0.00 51.96 53.04 3g62 s ALA 1226Cb -0.15 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 3g62 s ALA 1226CO -0.08 -0.67 1.10 1.03 0.00 0.00 0.00 175.76 177.14 3g62 s ARG 1227N -1.89 3.21 -0.03 0.00 0.52 -0.45 -4.63 118.95 115.69 3g62 s ARG 1227Ca 0.50 1.43 0.02 0.00 -0.52 0.00 0.00 55.73 57.17 3g62 s ARG 1227Cb -0.39 -2.00 0.01 0.00 0.52 0.00 0.00 34.95 33.08 3g62 s ARG 1227CO 0.52 -0.93 -0.08 0.08 0.02 0.00 0.00 175.30 174.91 3g62 s VAL 1228N -2.12 0.71 0.00 3.52 1.01 -0.60 -0.64 120.40 122.29 3g62 s VAL 1228Ca 0.68 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.36 3g62 s VAL 1228Cb -0.20 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.53 3g62 s VAL 1228CO 0.33 0.23 0.00 0.61 0.00 0.00 0.00 175.10 176.27 3g62 n GLY 1229N 3.40 1.48 3.75 4.51 0.00 0.12 -1.34 105.19 117.12 3g62 n GLY 1229Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 3g62 n GLY 1229CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g62 s LYS 1230N -0.05 3.28 -0.30 1.61 2.20 -1.06 -4.11 119.74 121.32 3g62 s LYS 1230Ca 0.00 2.31 -0.03 0.00 -0.36 0.00 0.00 55.97 57.88 3g62 s LYS 1230Cb 0.00 -2.37 0.10 0.00 -1.51 0.00 0.00 37.83 34.05 3g62 s LYS 1230CO 0.00 -1.10 0.13 1.21 -0.36 0.00 0.00 175.35 175.24 3g62 s ASN 1231N -0.81 3.54 0.25 1.43 3.84 0.12 -4.21 114.94 119.10 3g62 s ASN 1231Ca 0.69 -1.39 -0.05 0.00 0.21 0.00 0.00 52.86 52.31 3g62 s ASN 1231Cb -0.42 -0.40 0.28 0.00 -0.55 0.00 0.00 41.25 40.17 3g62 s ASN 1231CO 0.51 -0.43 1.84 0.58 -2.79 0.00 0.00 177.10 176.81 3g62 h VAL 1232N 6.30 1.24 -0.81 -5.21 2.07 -1.95 -1.44 116.25 116.46 3g62 h VAL 1232Ca -0.17 -0.71 0.08 0.00 0.82 0.00 0.00 66.70 66.72 3g62 h VAL 1232Cb 1.01 0.30 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 3g62 h VAL 1232CO 0.43 0.30 0.47 0.00 0.02 0.00 0.00 177.57 178.79 3g62 h ALA 1233N 1.29 1.14 -0.62 1.67 0.00 -1.95 -1.28 119.26 119.50 3g62 h ALA 1233Ca 0.26 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3g62 h ALA 1233Cb 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3g62 h ALA 1233CO -0.03 0.13 0.00 0.25 0.00 0.00 0.00 179.25 179.60 3g62 n THR 1234N -4.73 0.83 -3.90 0.00 -2.24 -1.12 -4.97 114.28 98.15 3g62 n THR 1234Ca 0.13 -0.85 -0.25 0.00 -2.27 0.00 0.00 64.05 60.80 3g62 n THR 1234Cb 0.24 0.48 -0.00 0.00 -2.10 0.00 0.00 70.33 68.95 3g62 n THR 1234CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3g62 n ASN 1235N 1.40 -1.17 -4.31 3.42 3.02 -0.48 -4.97 115.26 112.17 3g62 n ASN 1235Ca 0.22 -0.93 -0.33 0.00 -0.03 0.00 0.00 54.58 53.50 3g62 n ASN 1235Cb 0.55 -3.39 -0.15 0.00 -0.61 0.00 0.00 39.78 36.18 3g62 n ASN 1235CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3g62 s THR 1236N -3.77 2.77 0.33 3.41 2.01 -0.62 -5.02 115.64 114.76 3g62 s THR 1236Ca 0.12 -0.75 -0.26 0.00 0.31 0.00 0.00 61.69 61.11 3g62 s THR 1236Cb -0.06 -2.16 -0.10 0.00 0.01 0.00 0.00 72.50 70.19 3g62 s THR 1236CO 0.86 0.52 0.96 -1.10 -0.69 0.00 0.00 174.62 175.18 3g62 s GLN 1237N 0.57 4.54 1.09 4.92 -0.21 -1.26 -0.71 119.66 128.61 3g62 s GLN 1237Ca -0.09 1.36 -0.18 0.00 0.02 0.00 0.00 55.36 56.46 3g62 s GLN 1237Cb -0.16 -2.78 0.28 0.00 1.00 0.00 0.00 33.01 31.35 3g62 s GLN 1237CO 0.04 0.23 0.83 0.41 -2.12 0.00 0.00 175.29 174.68 3g62 n GLY 1238N 0.54 -3.20 3.15 3.09 0.00 -1.26 -4.57 105.19 102.95 3g62 n GLY 1238Ca 0.02 -1.40 -0.21 0.00 0.00 0.00 0.00 46.02 44.43 3g62 n GLY 1238CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g62 s VAL 1239N -2.35 1.17 0.75 1.61 1.01 -0.45 -4.79 120.40 117.35 3g62 s VAL 1239Ca 0.57 -0.99 -0.11 0.00 0.00 0.00 0.00 61.98 61.45 3g62 s VAL 1239Cb -0.07 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.30 3g62 s VAL 1239CO 0.45 0.05 1.08 -0.94 0.00 0.00 0.00 175.10 175.75 3g62 s SER 1240N -1.08 4.93 -0.03 3.32 1.04 -1.26 -1.55 113.70 119.07 3g62 s SER 1240Ca 0.03 1.38 0.03 0.00 0.48 0.00 0.00 55.95 57.86 3g62 s SER 1240Cb -0.08 -2.17 0.14 0.00 0.10 0.00 0.00 66.02 64.01 3g62 s SER 1240CO 0.01 -1.70 0.86 -0.81 0.98 0.00 0.00 173.24 172.58 3g62 n PRO 1241N -3.27 1.58 -1.61 4.02 -0.04 -1.26 -4.66 135.00 129.76 3g62 n PRO 1241Ca 0.07 -0.55 -0.40 0.00 -0.04 0.00 0.00 63.50 62.59 3g62 n PRO 1241Cb 0.55 -1.45 0.03 0.00 -0.04 0.00 0.00 33.50 32.59 3g62 n PRO 1241CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3g62 n ALA 1242N 0.04 0.15 -0.26 0.55 0.00 -1.26 -4.70 120.51 115.02 3g62 n ALA 1242Ca 0.05 0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.72 3g62 n ALA 1242Cb 0.32 -2.08 0.37 0.00 0.00 0.00 0.00 19.45 18.05 3g62 n ALA 1242CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g62 h ALA 1243N 1.04 1.81 0.00 0.00 0.00 -1.92 -0.13 119.26 120.06 3g62 h ALA 1243Ca -0.46 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 3g62 h ALA 1243Cb 1.35 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 3g62 h ALA 1243CO 0.54 -0.03 -0.01 0.00 0.00 0.00 0.00 179.25 179.75 3g62 h ALA 1244N 1.59 1.29 0.00 0.00 0.00 -1.94 -0.62 119.26 119.58 3g62 h ALA 1244Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3g62 h ALA 1244Cb 0.65 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3g62 h ALA 1244CO -0.19 0.01 -0.36 0.09 0.00 0.00 0.00 179.25 178.80 3g62 n ASN 1245N -3.51 0.57 -0.09 0.00 3.02 -0.06 -3.75 115.26 111.43 3g62 n ASN 1245Ca -0.03 0.20 0.03 0.00 -0.03 0.00 0.00 54.58 54.76 3g62 n ASN 1245Cb 0.09 -0.14 -0.02 0.00 -0.61 0.00 0.00 39.78 39.10 3g62 n ASN 1245CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3g62 n VAL 1246N -1.91 0.00 -0.11 2.41 0.24 -0.57 -1.46 118.33 116.93 3g62 n VAL 1246Ca 0.05 -0.39 -0.06 0.00 -2.04 0.00 0.00 64.34 61.89 3g62 n VAL 1246Cb 0.40 1.05 0.01 0.00 -1.47 0.00 0.00 33.84 33.83 3g62 n VAL 1246CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3g62 h SER 1247N 0.45 0.17 -0.60 -1.34 0.02 -1.25 -1.55 113.55 109.45 3g62 h SER 1247Ca 0.00 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3g62 h SER 1247Cb 0.20 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 3g62 h SER 1247CO 0.00 0.13 0.30 0.00 -1.14 0.00 0.00 176.83 176.13 3g62 h ALA 1248N 1.22 0.77 -0.50 3.77 0.00 -1.86 -0.98 119.26 121.68 3g62 h ALA 1248Ca 0.16 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3g62 h ALA 1248Cb 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3g62 h ALA 1248CO -0.15 0.32 0.03 0.00 0.00 0.00 0.00 179.25 179.44 3g62 h ALA 1249N 1.13 0.67 -0.77 0.00 0.00 -1.82 -2.24 119.26 116.24 3g62 h ALA 1249Ca 0.21 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3g62 h ALA 1249Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3g62 h ALA 1249CO -0.03 0.45 0.28 0.97 0.00 0.00 0.00 179.25 180.92 3g62 h ILE 1250N 0.73 1.26 0.00 0.00 2.10 -1.13 -2.80 117.51 117.67 3g62 h ILE 1250Ca 0.15 -0.86 0.00 0.00 1.08 0.00 0.00 64.86 65.23 3g62 h ILE 1250Cb 0.47 0.38 0.00 0.00 -1.09 0.00 0.00 36.82 36.58 3g62 h ILE 1250CO 0.02 0.34 0.00 1.23 -1.08 0.00 0.00 178.15 178.66 3g62 h GLY 1251N 1.12 0.00 0.23 8.18 0.00 -0.75 -2.33 103.07 109.52 3g62 h GLY 1251Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 3g62 h GLY 1251CO -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 176.54 176.39 3g62 n ALA 1252N -2.01 2.84 -2.35 3.60 0.00 -0.88 -4.89 120.51 116.82 3g62 n ALA 1252Ca -0.01 -0.37 -0.42 0.00 0.00 0.00 0.00 53.44 52.64 3g62 n ALA 1252Cb 0.19 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 3g62 n ALA 1252CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3g62 s VAL 1253N -2.32 3.93 0.89 0.00 1.01 -0.88 -5.00 120.40 118.03 3g62 s VAL 1253Ca 0.31 1.33 -0.12 0.00 0.00 0.00 0.00 61.98 63.50 3g62 s VAL 1253Cb 0.20 -3.85 0.12 0.00 0.00 0.00 0.00 36.38 32.85 3g62 s VAL 1253CO 0.45 0.04 1.12 -2.16 0.00 0.00 0.00 175.10 174.54 3g62 s PRO 1254N 1.85 1.34 0.70 2.72 0.05 -1.26 -5.04 135.00 135.35 3g62 s PRO 1254Ca 0.60 0.45 -0.11 0.00 0.05 0.00 0.00 61.00 61.99 3g62 s PRO 1254Cb -0.29 -1.85 0.01 0.00 0.05 0.00 0.00 34.50 32.42 3g62 s PRO 1254CO 0.26 -2.09 1.08 0.14 0.05 0.00 0.00 177.00 176.44 3g62 s VAL 1255N -3.19 3.49 0.50 -0.36 -7.23 -1.26 -4.97 120.40 107.38 3g62 s VAL 1255Ca 0.63 0.43 -0.22 0.00 -1.81 0.00 0.00 61.98 61.01 3g62 s VAL 1255Cb -0.15 -3.47 -0.06 0.00 0.56 0.00 0.00 36.38 33.26 3g62 s VAL 1255CO 0.54 -0.61 1.25 -2.16 -0.31 0.00 0.00 175.10 173.81 3g62 s PRO 1256N -5.33 3.48 0.48 4.82 0.04 -1.26 -4.97 135.00 132.26 3g62 s PRO 1256Ca 0.58 1.96 -0.23 0.00 0.04 0.00 0.00 61.00 63.35 3g62 s PRO 1256Cb -0.11 -2.33 -0.08 0.00 0.04 0.00 0.00 34.50 32.02 3g62 s PRO 1256CO 0.51 -0.84 1.13 0.00 0.04 0.00 0.00 177.00 177.84 3g62 n ALA 1257N -0.75 0.72 -0.19 8.56 0.00 -1.26 -4.89 120.51 122.69 3g62 n ALA 1257Ca 0.09 0.18 -0.04 0.00 0.00 0.00 0.00 53.44 53.67 3g62 n ALA 1257Cb 0.47 -2.18 0.06 0.00 0.00 0.00 0.00 19.45 17.80 3g62 n ALA 1257CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g62 h ALA 1258N 1.46 0.75 -0.37 0.00 0.00 -2.02 -1.27 119.26 117.80 3g62 h ALA 1258Ca -0.47 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.56 3g62 h ALA 1258Cb 1.33 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3g62 h ALA 1258CO 0.56 -0.01 0.29 0.00 0.00 0.00 0.00 179.25 180.10 3g62 h ALA 1259N 1.29 2.27 -0.38 0.00 0.00 -2.04 -2.20 119.26 118.21 3g62 h ALA 1259Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3g62 h ALA 1259Cb 0.12 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3g62 h ALA 1259CO -0.15 -0.48 0.00 -0.25 0.00 0.00 0.00 179.25 178.37 3g62 n ASP 1260N -4.27 3.47 0.25 0.00 8.00 -0.48 -4.55 116.55 118.96 3g62 n ASP 1260Ca 0.06 -2.00 0.17 0.00 0.71 0.00 0.00 54.79 53.73 3g62 n ASP 1260Cb 0.47 -0.24 0.72 0.00 -0.02 0.00 0.00 41.12 42.04 3g62 n ASP 1260CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3g62 h ARG 1261N 4.53 0.00 0.00 -1.24 3.08 -1.37 -0.75 114.38 118.63 3g62 h ARG 1261Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g62 h ARG 1261Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.05 3g62 h ARG 1261CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 179.97 179.67 3g62 h SER 1262N 0.00 0.00 -3.61 7.04 0.02 -1.83 -3.42 113.55 111.76 3g62 h SER 1262Ca 0.00 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.27 3g62 h SER 1262Cb 0.38 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 62.74 3g62 h SER 1262CO 0.00 0.00 -0.25 0.21 -1.14 0.00 0.00 176.83 175.65 3g62 s ASN 1263N -5.26 6.19 0.54 3.07 3.84 -0.29 -4.96 114.94 118.07 3g62 s ASN 1263Ca -0.02 -0.42 0.25 0.00 0.21 0.00 0.00 52.86 52.87 3g62 s ASN 1263Cb 0.11 -2.21 1.43 0.00 -0.55 0.00 0.00 41.25 40.03 3g62 s ASN 1263CO 0.45 -0.44 2.04 -0.65 -2.79 0.00 0.00 177.10 175.70 3g62 h PRO 1264N 8.57 0.00 -0.02 0.43 0.11 -1.85 -0.60 132.00 138.64 3g62 h PRO 1264Ca -0.28 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.80 3g62 h PRO 1264Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3g62 h PRO 1264CO 0.74 0.00 -0.10 0.22 -0.21 0.00 0.00 178.00 178.64 3g62 h ASP 1265N 0.00 0.03 0.86 -2.05 1.82 -1.92 -2.71 116.42 112.44 3g62 h ASP 1265Ca 0.17 -0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.81 3g62 h ASP 1265Cb 0.74 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.74 3g62 h ASP 1265CO -0.00 0.14 0.00 0.00 -1.61 0.00 0.00 179.24 177.76 3g62 n ALA 1266N -2.52 1.80 0.15 -0.78 0.00 -0.23 -3.40 120.51 115.53 3g62 n ALA 1266Ca -0.02 0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.56 3g62 n ALA 1266Cb 0.19 -1.39 0.06 0.00 0.00 0.00 0.00 19.45 18.31 3g62 n ALA 1266CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 3g62 h TRP 1267N 0.00 0.00 -3.47 0.00 4.06 -1.60 -3.40 115.95 111.53 3g62 h TRP 1267Ca 0.00 0.00 -0.72 0.00 2.06 0.00 0.00 58.89 60.23 3g62 h TRP 1267Cb 0.43 0.00 -0.23 0.00 -1.00 0.00 0.00 29.16 28.36 3g62 h TRP 1267CO 0.00 0.08 -0.44 0.08 -3.56 0.00 0.00 178.44 174.60 3g62 s VAL 1268N -3.24 4.91 0.41 1.49 1.01 -1.22 -4.28 120.40 119.48 3g62 s VAL 1268Ca 0.03 -0.92 -0.25 0.00 0.00 0.00 0.00 61.98 60.84 3g62 s VAL 1268Cb 0.08 -3.82 -0.08 0.00 0.00 0.00 0.00 36.38 32.56 3g62 s VAL 1268CO 0.74 -0.38 1.18 -2.84 0.00 0.00 0.00 175.10 173.80 3g62 s PRO 1269N 1.60 4.00 0.07 2.72 0.02 -1.26 -5.04 135.00 137.11 3g62 s PRO 1269Ca 0.04 1.85 0.08 0.00 0.02 0.00 0.00 61.00 62.98 3g62 s PRO 1269Cb -0.21 -2.63 -0.03 0.00 0.02 0.00 0.00 34.50 31.65 3g62 s PRO 1269CO 0.07 -0.37 -0.20 0.14 -0.33 0.00 0.00 177.00 176.31 3g62 s VAL 1270N -1.43 1.63 0.39 3.83 -7.23 -1.26 -4.58 120.40 111.75 3g62 s VAL 1270Ca 0.58 -1.37 -0.04 0.00 -1.81 0.00 0.00 61.98 59.34 3g62 s VAL 1270Cb -0.31 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.13 3g62 s VAL 1270CO 0.38 0.04 0.66 -0.36 -0.31 0.00 0.00 175.10 175.52 3g62 s PHE 1271N -1.01 3.51 0.00 2.82 0.40 -1.26 -0.90 117.98 121.55 3g62 s PHE 1271Ca 0.06 0.67 0.00 0.00 -0.60 0.00 0.00 56.93 57.06 3g62 s PHE 1271Cb -0.09 -2.16 0.00 0.00 0.51 0.00 0.00 43.02 41.28 3g62 s PHE 1271CO 0.03 -0.04 0.00 0.41 0.70 0.00 0.00 175.22 176.32 3g62 n GLY 1272N -1.68 0.96 3.68 4.36 0.00 -0.24 -4.78 105.19 107.48 3g62 n GLY 1272Ca -0.01 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 3g62 n GLY 1272CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3g62 n PRO 1273N 0.00 0.74 -1.34 1.61 -0.02 -1.26 -3.78 135.00 130.94 3g62 n PRO 1273Ca 0.00 0.31 -0.32 0.00 -2.02 0.00 0.00 63.50 61.47 3g62 n PRO 1273Cb 0.00 -2.40 0.09 0.00 -0.02 0.00 0.00 33.50 31.17 3g62 n PRO 1273CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3g62 s ASP 1274N -1.59 4.34 -1.16 2.55 1.11 -1.26 -3.73 116.67 116.93 3g62 s ASP 1274Ca 0.78 2.05 -0.00 0.00 0.18 0.00 0.00 52.55 55.55 3g62 s ASP 1274Cb -0.36 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.08 3g62 s ASP 1274CO 0.45 -2.15 0.02 -3.20 1.18 0.00 0.00 175.17 171.48 3g62 n ASN 1275N -3.16 -4.22 -3.71 0.27 5.15 -1.26 -5.01 115.26 103.32 3g62 n ASN 1275Ca 0.11 -0.02 -0.29 0.00 -0.60 0.00 0.00 54.58 53.78 3g62 n ASN 1275Cb 0.52 -3.38 -0.16 0.00 -0.53 0.00 0.00 39.78 36.23 3g62 n ASN 1275CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3g62 s THR 1276N -2.69 0.56 0.38 -0.44 2.01 -1.24 -5.13 115.64 109.09 3g62 s THR 1276Ca 0.01 -0.86 -0.28 0.00 0.31 0.00 0.00 61.69 60.87 3g62 s THR 1276Cb -0.00 -1.23 -0.11 0.00 0.01 0.00 0.00 72.50 71.16 3g62 s THR 1276CO 0.01 -0.43 1.44 0.00 -0.69 0.00 0.00 174.62 174.95 3g62 n ALA 1277N 5.01 2.13 0.00 7.40 0.00 -1.26 -2.72 120.51 131.07 3g62 n ALA 1277Ca -0.06 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.71 3g62 n ALA 1277Cb 0.45 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.51 3g62 n ALA 1277CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g62 n GLY 1278N 0.53 1.35 3.16 0.00 0.00 -1.26 -5.05 105.19 103.93 3g62 n GLY 1278Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 3g62 n GLY 1278CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3g62 s VAL 1279N -2.22 0.92 -0.01 1.61 -7.23 -1.10 -4.62 120.40 107.74 3g62 s VAL 1279Ca 0.00 -1.51 -0.17 0.00 -1.81 0.00 0.00 61.98 58.48 3g62 s VAL 1279Cb 0.00 -1.22 -0.06 0.00 0.56 0.00 0.00 36.38 35.67 3g62 s VAL 1279CO 0.00 -0.48 0.48 -1.10 -0.31 0.00 0.00 175.10 173.69 3g62 s GLN 1280N -2.46 4.13 0.53 4.82 -1.52 -0.08 -4.81 119.66 120.26 3g62 s GLN 1280Ca 0.02 0.54 -0.21 0.00 -1.95 0.00 0.00 55.36 53.76 3g62 s GLN 1280Cb -0.05 -3.29 -0.06 0.00 -0.22 0.00 0.00 33.01 29.40 3g62 s GLN 1280CO 0.00 0.53 1.18 -1.25 -0.25 0.00 0.00 175.29 175.50 3g62 s PRO 1281N -0.61 3.38 0.52 2.91 0.04 -1.26 -1.08 135.00 138.89 3g62 s PRO 1281Ca 0.26 1.76 -0.22 0.00 0.04 0.00 0.00 61.00 62.84 3g62 s PRO 1281Cb -0.17 -2.13 -0.06 0.00 0.04 0.00 0.00 34.50 32.18 3g62 s PRO 1281CO 0.14 -0.87 1.30 0.71 0.04 0.00 0.00 177.00 178.33 3g62 s TYR 1282N -1.62 2.47 0.56 0.56 1.51 -1.25 -4.84 117.35 114.74 3g62 s TYR 1282Ca 0.71 1.42 -0.18 0.00 -1.01 0.00 0.00 57.07 58.01 3g62 s TYR 1282Cb -0.28 -3.67 -0.05 0.00 -0.11 0.00 0.00 41.96 37.84 3g62 s TYR 1282CO 0.32 -2.48 1.10 -1.25 -1.11 0.00 0.00 175.55 172.14 3g62 s PRO 1283N -2.84 3.34 0.00 -1.71 0.04 -1.26 -4.96 135.00 127.62 3g62 s PRO 1283Ca 0.69 1.48 0.22 0.00 0.04 0.00 0.00 61.00 63.42 3g62 s PRO 1283Cb -0.37 -2.02 -0.10 0.00 0.04 0.00 0.00 34.50 32.05 3g62 s PRO 1283CO 0.44 -0.83 1.00 2.41 0.04 0.00 0.00 177.00 180.06 3g62 n THR 1284N -1.51 0.00 -4.24 1.26 -1.04 -1.26 -4.71 114.28 102.78 3g62 n THR 1284Ca 0.11 -0.08 -0.24 0.00 -2.04 0.00 0.00 64.05 61.80 3g62 n THR 1284Cb 0.52 1.01 -0.08 0.00 -1.82 0.00 0.00 70.33 69.96 3g62 n THR 1284CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 3g62 s SER 1285N -2.84 4.36 0.44 8.00 0.01 -1.26 -5.05 113.70 117.37 3g62 s SER 1285Ca 0.12 -0.95 0.00 0.00 1.31 0.00 0.00 55.95 56.43 3g62 s SER 1285Cb 0.17 -0.58 0.00 0.00 0.21 0.00 0.00 66.02 65.82 3g62 s SER 1285CO 0.77 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.72 3g62 n GLY 1286N -1.06 -1.08 3.73 3.44 0.00 -1.26 -4.79 105.19 104.16 3g62 n GLY 1286Ca -0.03 -1.18 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 3g62 n GLY 1286CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3g62 s TYR 1287N 0.00 3.80 -0.26 1.61 5.04 -0.54 -4.87 117.35 122.13 3g62 s TYR 1287Ca 0.00 1.79 0.21 0.00 -2.44 0.00 0.00 57.07 56.63 3g62 s TYR 1287Cb 0.00 -3.06 0.07 0.00 0.35 0.00 0.00 41.96 39.32 3g62 s TYR 1287CO 0.00 0.18 1.21 -1.00 -1.34 0.00 0.00 175.55 174.59 3g62 h PRO 1288N 5.67 0.00 -4.60 4.97 0.13 -1.84 -3.44 132.00 132.90 3g62 h PRO 1288Ca -0.43 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.99 3g62 h PRO 1288Cb 1.21 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.14 3g62 h PRO 1288CO 0.72 0.12 -0.40 0.42 -0.23 0.00 0.00 178.00 178.62 3g62 s ILE 1289N -3.19 5.24 0.25 -3.56 1.01 -1.26 -4.51 121.20 115.18 3g62 s ILE 1289Ca 0.02 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 3g62 s ILE 1289Cb 0.08 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.65 3g62 s ILE 1289CO 0.76 -0.27 0.57 -1.48 0.00 0.00 0.00 174.94 174.52 3g62 s LEU 1290N 1.76 0.08 0.00 2.97 2.34 -1.26 -1.49 118.68 123.08 3g62 s LEU 1290Ca 0.06 -0.76 0.00 0.00 0.06 0.00 0.00 54.13 53.49 3g62 s LEU 1290Cb -0.18 2.17 0.00 0.00 -0.56 0.00 0.00 46.19 47.61 3g62 s LEU 1290CO 0.11 -1.21 0.00 0.61 -1.06 0.00 0.00 176.35 174.80 3g62 n GLY 1291N -0.41 -0.64 3.49 -3.48 0.00 -0.09 -4.81 105.19 99.25 3g62 n GLY 1291Ca -0.03 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 3g62 n GLY 1291CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g62 s PHE 1292N -3.00 2.57 0.03 1.61 0.40 -1.26 -0.86 117.98 117.47 3g62 s PHE 1292Ca 0.00 -0.24 0.04 0.00 -0.60 0.00 0.00 56.93 56.13 3g62 s PHE 1292Cb 0.00 -1.39 -0.04 0.00 0.51 0.00 0.00 43.02 42.10 3g62 s PHE 1292CO 0.00 0.36 -0.08 -0.08 0.70 0.00 0.00 175.22 176.12 3g62 s THR 1293N -1.09 3.55 0.25 0.64 -1.32 -0.84 -4.77 115.64 112.06 3g62 s THR 1293Ca 0.17 -0.93 0.05 0.00 -1.21 0.00 0.00 61.69 59.78 3g62 s THR 1293Cb -0.11 -2.58 -0.05 0.00 -1.51 0.00 0.00 72.50 68.25 3g62 s THR 1293CO 0.09 0.31 -0.05 0.20 -2.21 0.00 0.00 174.62 172.96 3g62 s ASN 1294N -1.66 2.34 0.04 8.08 0.01 0.44 -0.22 114.94 123.97 3g62 s ASN 1294Ca 0.19 -1.17 0.03 0.00 -0.71 0.00 0.00 52.86 51.19 3g62 s ASN 1294Cb -0.11 -0.09 -0.04 0.00 0.41 0.00 0.00 41.25 41.42 3g62 s ASN 1294CO 0.10 -0.39 -0.01 -0.76 -1.51 0.00 0.00 177.10 174.53 3g62 s LEU 1295N -3.36 3.43 -0.11 0.60 1.43 0.60 -1.31 118.68 119.96 3g62 s LEU 1295Ca 0.28 -0.10 -0.00 0.00 -1.03 0.00 0.00 54.13 53.27 3g62 s LEU 1295Cb 0.04 -2.05 0.02 0.00 0.03 0.00 0.00 46.19 44.23 3g62 s LEU 1295CO 0.09 0.24 -0.08 -0.63 0.23 0.00 0.00 176.35 176.20 3g62 s ILE 1296N -1.16 1.03 0.30 -0.59 1.01 0.12 -1.34 121.20 120.56 3g62 s ILE 1296Ca 0.22 -0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.59 3g62 s ILE 1296Cb -0.12 -1.04 -0.06 0.00 0.01 0.00 0.00 42.46 41.26 3g62 s ILE 1296CO 0.13 0.37 0.08 -0.36 0.00 0.00 0.00 174.94 175.16 3g62 s PHE 1297N 1.64 1.75 0.13 3.97 0.40 -0.24 -0.93 117.98 124.69 3g62 s PHE 1297Ca 0.04 -1.09 -0.09 0.00 -0.60 0.00 0.00 56.93 55.19 3g62 s PHE 1297Cb -0.13 -1.09 -0.06 0.00 0.51 0.00 0.00 43.02 42.26 3g62 s PHE 1297CO -0.07 -0.18 0.44 0.45 0.70 0.00 0.00 175.22 176.55 3g62 s SER 1298N -3.41 6.62 0.41 1.36 0.15 -1.26 -0.49 113.70 117.08 3g62 s SER 1298Ca 0.37 0.79 0.16 0.00 0.70 0.00 0.00 55.95 57.97 3g62 s SER 1298Cb 0.08 -2.18 0.91 0.00 -1.71 0.00 0.00 66.02 63.12 3g62 s SER 1298CO 0.15 0.08 1.90 -0.61 1.20 0.00 0.00 173.24 175.96 3g62 h GLN 1299N 3.22 0.00 -4.75 5.44 4.15 -1.22 -3.46 115.11 118.50 3g62 h GLN 1299Ca -0.48 0.00 -0.41 0.00 0.77 0.00 0.00 58.65 58.53 3g62 h GLN 1299Cb 1.18 0.00 -0.29 0.00 0.21 0.00 0.00 27.48 28.58 3g62 h GLN 1299CO 0.69 0.29 -0.78 0.00 -1.93 0.00 0.00 178.83 177.09 3g62 s TYR 1301N -0.12 1.24 0.32 0.00 1.51 -1.26 -1.81 117.35 117.23 3g62 s TYR 1301Ca 0.02 -0.42 0.04 0.00 -1.01 0.00 0.00 57.07 55.70 3g62 s TYR 1301Cb -0.05 -0.93 0.64 0.00 -0.11 0.00 0.00 41.96 41.52 3g62 s TYR 1301CO -0.00 -0.23 1.89 0.00 -1.11 0.00 0.00 175.55 176.10 3g62 h ALA 1302N 6.89 1.63 -2.56 3.71 0.00 -1.07 -3.41 119.26 124.45 3g62 h ALA 1302Ca -0.33 -0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.05 3g62 h ALA 1302Cb 1.18 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 3g62 h ALA 1302CO 0.48 0.18 0.31 0.34 0.00 0.00 0.00 179.25 180.56 3g62 s ASP 1303N -5.89 7.39 0.19 0.00 2.15 -1.26 -4.96 116.67 114.29 3g62 s ASP 1303Ca -0.11 1.67 -0.07 0.00 0.43 0.00 0.00 52.55 54.47 3g62 s ASP 1303Cb 0.21 -2.55 0.11 0.00 -0.30 0.00 0.00 42.92 40.38 3g62 s ASP 1303CO 0.80 -0.09 1.61 0.00 -0.17 0.00 0.00 175.17 177.32 3g62 h ALA 1304N 5.88 0.81 -0.35 3.66 0.00 -2.00 -1.92 119.26 125.34 3g62 h ALA 1304Ca -0.43 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.06 3g62 h ALA 1304Cb 1.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3g62 h ALA 1304CO 0.72 0.65 -0.02 1.15 0.00 0.00 0.00 179.25 181.76 3g62 h THR 1305N 0.82 1.26 -0.58 0.00 2.02 -1.95 -1.31 112.91 113.17 3g62 h THR 1305Ca 0.12 -1.02 0.05 0.00 0.77 0.00 0.00 66.41 66.33 3g62 h THR 1305Cb 0.70 1.22 -0.05 0.00 -1.74 0.00 0.00 68.15 68.28 3g62 h THR 1305CO 0.05 0.34 0.31 1.56 0.37 0.00 0.00 175.52 178.15 3g62 h GLN 1306N 0.44 0.57 -0.21 6.66 4.20 -1.92 0.07 115.11 124.92 3g62 h GLN 1306Ca 0.10 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.80 3g62 h GLN 1306Cb 0.49 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 3g62 h GLN 1306CO 0.02 0.38 0.04 1.15 -0.67 0.00 0.00 178.83 179.75 3g62 h THR 1307N 0.59 0.91 -0.71 -0.54 2.02 -1.09 -1.18 112.91 112.90 3g62 h THR 1307Ca 0.26 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.39 3g62 h THR 1307Cb 0.15 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 3g62 h THR 1307CO -0.17 0.02 0.46 0.74 0.37 0.00 0.00 175.52 176.94 3g62 h THR 1308N 0.13 1.19 -0.04 3.16 2.02 -0.84 -0.93 112.91 117.61 3g62 h THR 1308Ca 0.10 -0.38 -0.11 0.00 0.77 0.00 0.00 66.41 66.79 3g62 h THR 1308Cb 0.09 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 3g62 h THR 1308CO -0.13 0.19 -0.49 1.56 0.37 0.00 0.00 175.52 177.03 3g62 h GLN 1309N 0.97 0.09 -0.21 6.66 4.20 -0.64 0.05 115.11 126.22 3g62 h GLN 1309Ca 0.26 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.90 3g62 h GLN 1309Cb -0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3g62 h GLN 1309CO -0.05 0.56 0.04 0.28 -0.67 0.00 0.00 178.83 178.99 3g62 h VAL 1310N 0.07 1.22 -0.77 -0.54 2.07 -0.91 -2.31 116.25 115.07 3g62 h VAL 1310Ca 0.00 -0.72 0.07 0.00 0.82 0.00 0.00 66.70 66.87 3g62 h VAL 1310Cb 0.89 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 3g62 h VAL 1310CO 0.07 0.22 0.45 0.03 0.02 0.00 0.00 177.57 178.36 3g62 h ARG 1311N 0.16 0.78 -0.34 1.57 3.08 -0.81 -1.74 114.38 117.08 3g62 h ARG 1311Ca 0.07 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 3g62 h ARG 1311Cb 0.30 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 3g62 h ARG 1311CO 0.00 0.52 0.00 -0.44 -1.07 0.00 0.00 179.97 178.98 3g62 h ASP 1312N 0.81 0.50 -0.18 7.04 3.32 -0.82 -0.13 116.42 126.95 3g62 h ASP 1312Ca 0.35 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 3g62 h ASP 1312Cb 0.23 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3g62 h ASP 1312CO -0.20 0.57 0.06 0.15 -1.72 0.00 0.00 179.24 178.10 3g62 h PHE 1313N 0.51 0.29 -0.81 4.55 3.57 -0.81 -2.51 116.94 121.73 3g62 h PHE 1313Ca 0.11 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.60 3g62 h PHE 1313Cb 0.33 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.94 3g62 h PHE 1313CO 0.01 0.37 0.53 0.74 -2.23 0.00 0.00 178.31 177.73 3g62 h PHE 1314N 0.12 1.00 -0.72 0.41 0.04 -0.81 0.86 116.94 117.85 3g62 h PHE 1314Ca 0.06 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.88 3g62 h PHE 1314Cb 0.21 -0.34 -0.04 0.00 2.20 0.00 0.00 35.95 37.98 3g62 h PHE 1314CO -0.00 0.62 0.47 1.15 -0.60 0.00 0.00 178.31 179.95 3g62 h THR 1315N 1.07 1.11 0.02 -1.55 2.02 -0.86 -0.95 112.91 113.77 3g62 h THR 1315Ca 0.30 -0.30 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3g62 h THR 1315Cb -0.09 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.49 3g62 h THR 1315CO -0.07 0.16 -0.01 0.50 0.37 0.00 0.00 175.52 176.47 3g62 h LYS 1316N 0.87 -0.02 0.00 6.66 3.64 -0.92 -2.73 116.57 124.07 3g62 h LYS 1316Ca 0.28 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.61 3g62 h LYS 1316Cb 0.05 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3g62 h LYS 1316CO -0.08 0.52 -0.25 1.25 -2.27 0.00 0.00 179.45 178.63 3g62 h HIS 1317N -0.98 0.00 -0.21 1.91 2.76 -0.76 -2.22 115.15 115.64 3g62 h HIS 1317Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3g62 h HIS 1317Cb 0.56 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.52 3g62 h HIS 1317CO 0.15 0.25 0.00 0.66 -1.30 0.00 0.00 177.93 177.69 3g62 n TYR 1318N -3.86 0.67 -2.90 5.26 4.02 -0.37 -4.66 117.16 115.32 3g62 n TYR 1318Ca -0.02 -0.84 -0.34 0.00 -0.01 0.00 0.00 57.90 56.70 3g62 n TYR 1318Cb 0.34 -0.24 -0.07 0.00 -0.02 0.00 0.00 39.34 39.35 3g62 n TYR 1318CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3g62 s GLY 1319N -1.96 2.45 0.38 2.72 0.00 -0.84 -4.69 107.32 105.38 3g62 s GLY 1319Ca 0.36 0.32 0.19 0.00 0.00 0.00 0.00 44.72 45.59 3g62 s GLY 1319CO 0.08 0.62 1.73 0.00 0.00 0.00 0.00 173.10 175.53 3g62 h ALA 1320N 2.28 0.99 -2.38 3.20 0.00 -1.90 -3.43 119.26 118.02 3g62 h ALA 1320Ca -0.48 -0.33 -0.37 0.00 0.00 0.00 0.00 54.91 53.72 3g62 h ALA 1320Cb 1.18 -0.06 -0.14 0.00 0.00 0.00 0.00 17.79 18.77 3g62 h ALA 1320CO 0.63 0.46 -0.58 0.45 0.00 0.00 0.00 179.25 180.21 3g62 s SER 1321N -6.43 1.27 -1.28 0.00 0.15 -1.26 -4.94 113.70 101.21 3g62 s SER 1321Ca 0.00 -1.48 -0.05 0.00 0.70 0.00 0.00 55.95 55.12 3g62 s SER 1321Cb 0.11 0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.72 3g62 s SER 1321CO 0.68 -0.83 0.65 0.59 1.20 0.00 0.00 173.24 175.54 3g62 n ASN 1322N -0.71 -2.20 -2.20 5.45 3.02 -1.26 -4.95 115.26 112.41 3g62 n ASN 1322Ca 0.01 -0.91 -0.04 0.00 -0.03 0.00 0.00 54.58 53.60 3g62 n ASN 1322Cb 0.65 -3.67 -0.01 0.00 -0.61 0.00 0.00 39.78 36.14 3g62 n ASN 1322CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 3g62 n ASN 1323N -2.95 1.83 -1.24 6.41 0.23 -1.26 -4.68 115.26 113.59 3g62 n ASN 1323Ca -0.24 -1.30 0.10 0.00 -0.53 0.00 0.00 54.58 52.61 3g62 n ASN 1323Cb 0.66 0.08 0.29 0.00 -2.08 0.00 0.00 39.78 38.73 3g62 n ASN 1323CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3g62 n ASN 1324N -1.32 3.61 -0.33 0.53 3.02 -1.25 -4.67 115.26 114.85 3g62 n ASN 1324Ca -0.02 -2.05 -0.04 0.00 -0.03 0.00 0.00 54.58 52.44 3g62 n ASN 1324Cb 0.09 -0.45 0.08 0.00 -0.61 0.00 0.00 39.78 38.89 3g62 n ASN 1324CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 3g62 h ASP 1325N 3.81 1.12 -0.48 6.41 3.32 -1.92 -0.51 116.42 128.17 3g62 h ASP 1325Ca 0.00 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 3g62 h ASP 1325Cb 0.93 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.17 3g62 h ASP 1325CO 0.03 0.90 0.29 0.00 -1.72 0.00 0.00 179.24 178.74 3g62 h ALA 1326N 1.26 0.61 -0.63 3.45 0.00 -2.00 -1.13 119.26 120.81 3g62 h ALA 1326Ca 0.31 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 3g62 h ALA 1326Cb 0.05 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3g62 h ALA 1326CO -0.05 0.10 0.23 0.00 0.00 0.00 0.00 179.25 179.53 3g62 h ALA 1327N 1.14 1.22 0.05 0.00 0.00 -1.76 -1.13 119.26 118.77 3g62 h ALA 1327Ca 0.17 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3g62 h ALA 1327Cb -0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3g62 h ALA 1327CO -0.03 0.56 -0.18 0.82 0.00 0.00 0.00 179.25 180.42 3g62 h ILE 1328N 0.91 0.57 -0.11 0.00 2.04 -0.70 -2.14 117.51 118.08 3g62 h ILE 1328Ca 0.21 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 66.00 3g62 h ILE 1328Cb 0.21 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3g62 h ILE 1328CO -0.02 0.00 -0.25 0.74 0.00 0.00 0.00 178.15 178.62 3g62 h THR 1329N -0.33 1.23 0.00 -0.27 2.02 -0.96 -2.04 112.91 112.56 3g62 h THR 1329Ca 0.04 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.14 3g62 h THR 1329Cb 0.37 1.43 -0.00 0.00 -1.74 0.00 0.00 68.15 68.20 3g62 h THR 1329CO -0.14 0.32 -0.03 0.00 0.37 0.00 0.00 175.52 176.04 3g62 h ALA 1330N 1.57 1.02 -0.50 6.16 0.00 -0.85 -2.67 119.26 123.99 3g62 h ALA 1330Ca 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g62 h ALA 1330Cb 0.54 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3g62 h ALA 1330CO 0.04 0.04 0.00 0.09 0.00 0.00 0.00 179.25 179.42 3g62 n ASN 1331N -3.16 5.33 -0.81 0.00 3.02 -0.83 -4.94 115.26 113.86 3g62 n ASN 1331Ca -0.00 -2.96 -0.08 0.00 -0.03 0.00 0.00 54.58 51.50 3g62 n ASN 1331Cb 0.29 -0.66 -0.02 0.00 -0.61 0.00 0.00 39.78 38.78 3g62 n ASN 1331CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g62 n ALA 1332N 0.35 -0.19 -2.55 5.41 0.00 -1.00 -4.15 120.51 118.37 3g62 n ALA 1332Ca 0.26 0.10 -0.27 0.00 0.00 0.00 0.00 53.44 53.53 3g62 n ALA 1332Cb 1.13 -1.16 -0.09 0.00 0.00 0.00 0.00 19.45 19.34 3g62 n ALA 1332CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3g62 s PHE 1333N -2.37 2.46 -0.21 0.00 0.08 -0.83 -4.44 117.98 112.67 3g62 s PHE 1333Ca 0.00 -0.67 -0.05 0.00 0.12 0.00 0.00 56.93 56.33 3g62 s PHE 1333Cb 0.00 -1.84 -0.02 0.00 -0.57 0.00 0.00 43.02 40.59 3g62 s PHE 1333CO 0.00 0.29 -0.02 0.08 -0.10 0.00 0.00 175.22 175.47 3g62 s VAL 1334N -2.68 3.71 0.60 -0.44 1.01 0.04 -3.84 120.40 118.80 3g62 s VAL 1334Ca 0.35 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.78 3g62 s VAL 1334Cb 0.06 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 3g62 s VAL 1334CO 0.19 0.42 1.06 -2.16 0.00 0.00 0.00 175.10 174.61 3g62 s PRO 1335N 1.23 3.24 0.33 2.72 0.04 -1.26 -1.16 135.00 140.14 3g62 s PRO 1335Ca 0.03 1.22 -0.28 0.00 0.04 0.00 0.00 61.00 62.02 3g62 s PRO 1335Cb -0.15 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 3g62 s PRO 1335CO 0.00 -0.88 1.16 -0.51 0.04 0.00 0.00 177.00 176.82 3g62 s LEU 1336N -4.58 4.39 0.51 -3.56 1.43 -1.26 -4.83 118.68 110.78 3g62 s LEU 1336Ca 0.64 2.38 -0.21 0.00 -1.03 0.00 0.00 54.13 55.90 3g62 s LEU 1336Cb -0.17 -3.78 -0.08 0.00 0.03 0.00 0.00 46.19 42.19 3g62 s LEU 1336CO 0.38 -0.41 0.89 -2.65 0.23 0.00 0.00 176.35 174.79 3g62 n PRO 1337N 0.70 1.03 -0.32 1.29 -0.02 -1.26 -4.73 135.00 131.68 3g62 n PRO 1337Ca 0.01 0.38 0.10 0.00 -2.02 0.00 0.00 63.50 61.97 3g62 n PRO 1337Cb 0.45 -2.01 0.27 0.00 -0.02 0.00 0.00 33.50 32.20 3g62 n PRO 1337CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3g62 h THR 1338N 0.94 0.70 -0.10 3.45 2.02 -1.99 -0.12 112.91 117.81 3g62 h THR 1338Ca -0.46 -0.23 -0.15 0.00 0.77 0.00 0.00 66.41 66.34 3g62 h THR 1338Cb 1.36 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 3g62 h THR 1338CO 0.53 0.12 -0.58 0.00 0.37 0.00 0.00 175.52 175.96 3g62 h ALA 1339N 1.61 0.83 -0.29 6.16 0.00 -2.00 -2.07 119.26 123.50 3g62 h ALA 1339Ca 0.52 -0.53 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3g62 h ALA 1339Cb 0.79 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 3g62 h ALA 1339CO -0.38 0.71 0.11 -1.49 0.00 0.00 0.00 179.25 178.19 3g62 h TRP 1340N 0.23 0.20 -0.64 0.00 4.06 -1.41 -2.29 115.95 116.11 3g62 h TRP 1340Ca -0.00 0.01 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 3g62 h TRP 1340Cb 1.09 -0.05 -0.03 0.00 -1.00 0.00 0.00 29.16 29.18 3g62 h TRP 1340CO 0.03 0.09 0.22 0.87 -3.56 0.00 0.00 178.44 176.09 3g62 h LYS 1341N 0.24 0.96 -0.52 0.49 1.57 -1.10 -1.24 116.57 116.97 3g62 h LYS 1341Ca 0.13 -0.18 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3g62 h LYS 1341Cb 0.09 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 3g62 h LYS 1341CO -0.12 0.81 0.15 0.00 -0.57 0.00 0.00 179.45 179.72 3g62 h ALA 1342N 1.30 1.28 -0.34 3.86 0.00 -1.17 -0.61 119.26 123.58 3g62 h ALA 1342Ca 0.21 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3g62 h ALA 1342Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3g62 h ALA 1342CO -0.01 0.51 -0.21 1.15 0.00 0.00 0.00 179.25 180.69 3g62 h THR 1343N 0.77 1.29 -0.31 0.00 2.02 -0.82 -0.49 112.91 115.37 3g62 h THR 1343Ca 0.17 -1.35 0.01 0.00 0.77 0.00 0.00 66.41 66.02 3g62 h THR 1343Cb 0.25 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 3g62 h THR 1343CO -0.01 0.44 0.17 0.58 0.37 0.00 0.00 175.52 177.08 3g62 h VAL 1344N 0.53 1.02 -0.76 3.16 2.07 -0.93 -2.62 116.25 118.72 3g62 h VAL 1344Ca 0.07 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 3g62 h VAL 1344Cb 0.77 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3g62 h VAL 1344CO 0.06 0.07 0.33 0.03 0.02 0.00 0.00 177.57 178.07 3g62 h ARG 1345N 0.36 1.11 -0.59 1.57 3.08 -0.98 -0.71 114.38 118.22 3g62 h ARG 1345Ca 0.12 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3g62 h ARG 1345Cb 0.01 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.84 3g62 h ARG 1345CO -0.06 0.89 0.32 0.00 -1.07 0.00 0.00 179.97 180.05 3g62 h ALA 1346N 1.16 1.46 0.08 0.04 0.00 -0.83 0.41 119.26 121.58 3g62 h ALA 1346Ca 0.26 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 3g62 h ALA 1346Cb 0.18 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3g62 h ALA 1346CO -0.03 0.45 -0.83 0.77 0.00 0.00 0.00 179.25 179.62 3g62 h SER 1347N 0.82 0.28 0.00 0.00 0.02 -1.30 -3.39 113.55 109.97 3g62 h SER 1347Ca 0.21 -0.89 -0.04 0.00 -0.84 0.00 0.00 61.79 60.23 3g62 h SER 1347Cb 0.02 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 3g62 h SER 1347CO -0.03 1.37 -1.93 0.49 -1.14 0.00 0.00 176.83 175.58 3g62 n PHE 1348N -4.22 0.00 -0.06 3.45 3.01 -0.29 -2.15 117.46 117.20 3g62 n PHE 1348Ca -0.18 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.16 3g62 n PHE 1348Cb 0.74 -0.50 -0.04 0.00 -0.01 0.00 0.00 39.48 39.67 3g62 n PHE 1348CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 3g62 n LEU 1349N -2.24 1.18 -4.64 4.37 7.94 -0.00 -0.57 117.00 123.04 3g62 n LEU 1349Ca -0.07 0.20 -0.46 0.00 -1.11 0.00 0.00 56.01 54.57 3g62 n LEU 1349Cb 0.58 -0.46 -0.04 0.00 0.53 0.00 0.00 43.42 44.02 3g62 n LEU 1349CO 0.41 0.05 1.62 0.41 -1.11 0.00 0.00 177.39 178.77 3g62 n THR 1350N -3.76 0.59 -0.29 1.96 -1.04 0.12 -4.76 114.28 107.10 3g62 n THR 1350Ca -0.22 -0.19 0.09 0.00 -2.04 0.00 0.00 64.05 61.69 3g62 n THR 1350Cb 0.57 -2.13 0.25 0.00 -1.82 0.00 0.00 70.33 67.20 3g62 n THR 1350CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3g62 h ALA 1351N 10.90 1.30 0.00 2.41 0.00 -1.91 -1.56 119.26 130.39 3g62 h ALA 1351Ca -0.46 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3g62 h ALA 1351Cb 1.26 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3g62 h ALA 1351CO 0.95 -0.20 0.00 0.43 0.00 0.00 0.00 179.25 180.44 3g62 n SER 1352N -4.95 0.56 -4.75 0.00 7.64 -1.26 -4.76 113.62 106.10 3g62 n SER 1352Ca 0.18 0.65 -0.41 0.00 1.01 0.00 0.00 58.87 60.31 3g62 n SER 1352Cb 0.51 -0.77 -0.04 0.00 -1.01 0.00 0.00 64.21 62.90 3g62 n SER 1352CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3g62 s ASN 1353N -4.05 7.17 0.45 6.43 3.84 -0.59 -4.92 114.94 123.27 3g62 s ASN 1353Ca 0.04 2.29 0.12 0.00 0.21 0.00 0.00 52.86 55.51 3g62 s ASN 1353Cb 0.09 -2.62 1.01 0.00 -0.55 0.00 0.00 41.25 39.18 3g62 s ASN 1353CO 0.35 -0.25 2.06 0.00 -2.79 0.00 0.00 177.10 176.47 3g62 h ALA 1354N 4.28 1.78 0.00 1.71 0.00 -1.85 -1.39 119.26 123.79 3g62 h ALA 1354Ca -0.46 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3g62 h ALA 1354Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3g62 h ALA 1354CO 0.69 0.18 0.00 1.28 0.00 0.00 0.00 179.25 181.40 3g62 n LEU 1355N -4.45 0.00 -4.77 0.00 4.77 -1.26 -4.89 117.00 106.41 3g62 n LEU 1355Ca -0.00 0.09 -0.39 0.00 -0.03 0.00 0.00 56.01 55.67 3g62 n LEU 1355Cb 0.13 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.09 3g62 n LEU 1355CO 0.35 -0.00 0.81 -0.94 -1.33 0.00 0.00 177.39 176.28 3g62 s SER 1356N -2.18 7.00 0.17 -1.43 1.04 -0.53 -4.51 113.70 113.27 3g62 s SER 1356Ca 0.40 2.29 -0.32 0.00 0.48 0.00 0.00 55.95 58.81 3g62 s SER 1356Cb 0.20 -2.62 -0.11 0.00 0.10 0.00 0.00 66.02 63.59 3g62 s SER 1356CO 0.38 -0.33 1.76 -0.63 0.98 0.00 0.00 173.24 175.39 3g62 s ILE 1357N -1.28 2.29 -0.02 -1.02 1.01 0.27 -1.88 121.20 120.56 3g62 s ILE 1357Ca 0.49 0.06 0.00 0.00 0.00 0.00 0.00 60.65 61.21 3g62 s ILE 1357Cb -0.31 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.12 3g62 s ILE 1357CO 0.40 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.95 3g62 n GLY 1358N 4.07 0.39 3.68 6.18 0.00 -0.01 -4.94 105.19 114.56 3g62 n GLY 1358Ca 0.17 -0.04 -0.58 0.00 0.00 0.00 0.00 46.02 45.57 3g62 n GLY 1358CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3g62 n ASN 1359N -0.19 1.94 0.15 1.61 2.85 -0.79 -4.80 115.26 116.04 3g62 n ASN 1359Ca -0.00 1.10 0.13 0.00 -0.11 0.00 0.00 54.58 55.70 3g62 n ASN 1359Cb 0.13 -1.11 0.50 0.00 1.24 0.00 0.00 39.78 40.54 3g62 n ASN 1359CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 3g62 h THR 1360N 4.63 0.00 0.00 -0.44 1.35 -1.91 0.13 112.91 116.66 3g62 h THR 1360Ca -0.47 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 3g62 h THR 1360Cb 1.33 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 3g62 h THR 1360CO 0.90 0.00 -0.52 0.59 -0.25 0.00 0.00 175.52 176.24 3g62 n ASN 1361N -2.39 1.75 -0.29 5.36 3.02 -1.26 -3.48 115.26 117.97 3g62 n ASN 1361Ca 0.02 0.60 -0.06 0.00 -0.03 0.00 0.00 54.58 55.12 3g62 n ASN 1361Cb 0.28 -0.85 0.06 0.00 -0.61 0.00 0.00 39.78 38.66 3g62 n ASN 1361CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3g62 h VAL 1362N -0.96 1.26 -0.01 2.41 2.07 -1.89 -2.36 116.25 116.77 3g62 h VAL 1362Ca 0.00 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.66 3g62 h VAL 1362Cb 0.52 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3g62 h VAL 1362CO 0.00 0.35 -0.06 0.00 0.02 0.00 0.00 177.57 177.87 3g62 n ASN 1364N 0.01 3.53 0.00 0.00 5.15 -0.89 -1.37 115.26 121.69 3g62 n ASN 1364Ca 0.17 0.87 0.00 0.00 -0.60 0.00 0.00 54.58 55.02 3g62 n ASN 1364Cb 0.36 -1.41 0.00 0.00 -0.53 0.00 0.00 39.78 38.20 3g62 n ASN 1364CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3g62 n GLY 1365N 4.67 0.54 3.33 8.20 0.00 -1.26 -5.02 105.19 115.65 3g62 n GLY 1365Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 3g62 n GLY 1365CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g62 s ILE 1366N -2.35 1.93 0.00 -0.61 1.01 -0.47 -5.05 121.20 115.66 3g62 s ILE 1366Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 60.65 59.02 3g62 s ILE 1366Cb 0.00 -1.73 0.00 0.00 0.01 0.00 0.00 42.46 40.74 3g62 s ILE 1366CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.54 3g62 n GLY 1367N 1.00 3.59 3.50 6.18 0.00 -0.50 -4.00 105.19 114.96 3g62 n GLY 1367Ca -0.19 -1.42 -0.45 0.00 0.00 0.00 0.00 46.02 43.97 3g62 n GLY 1367CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g62 n ARG 1368N -1.72 0.75 -2.42 1.61 5.12 -0.75 -3.89 116.66 115.37 3g62 n ARG 1368Ca 0.00 0.27 -0.33 0.00 -1.93 0.00 0.00 57.85 55.86 3g62 n ARG 1368Cb 0.00 -1.50 -0.03 0.00 -1.16 0.00 0.00 32.46 29.77 3g62 n ARG 1368CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3g62 s PRO 1369N -1.37 3.83 -0.06 5.56 0.04 -1.26 -0.77 135.00 140.96 3g62 s PRO 1369Ca 0.61 1.12 -0.14 0.00 0.04 0.00 0.00 61.00 62.63 3g62 s PRO 1369Cb -0.76 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 31.58 3g62 s PRO 1369CO 0.58 -0.38 0.56 1.25 0.04 0.00 0.00 177.00 179.05 3g62 h LEU 1370N 1.11 -0.27-10.44 -3.56 6.46 -1.95 -3.46 115.31 103.19 3g62 h LEU 1370Ca -0.48 -0.12 -0.50 0.00 -0.12 0.00 0.00 57.88 56.67 3g62 h LEU 1370Cb 1.20 0.07 0.08 0.00 -0.73 0.00 0.00 40.66 41.28 3g62 h LEU 1370CO 0.60 0.22 0.41 -0.76 -0.62 0.00 0.00 178.44 178.29 3g62 s LEU 1371N -8.93 2.97 -0.07 2.25 1.43 -1.26 -4.88 118.68 110.19 3g62 s LEU 1371Ca -0.08 1.23 -0.13 0.00 -1.03 0.00 0.00 54.13 54.13 3g62 s LEU 1371Cb 0.00 -4.08 -0.05 0.00 0.03 0.00 0.00 46.19 42.09 3g62 s LEU 1371CO 0.26 -1.28 0.32 -0.70 0.23 0.00 0.00 176.35 175.19 3g62 s GLU 1372N -5.29 3.90 -0.03 1.70 -6.30 -1.26 -4.93 118.70 106.48 3g62 s GLU 1372Ca 0.58 0.22 0.02 0.00 -2.50 0.00 0.00 54.97 53.29 3g62 s GLU 1372Cb -0.11 -3.27 0.01 0.00 0.00 0.00 0.00 34.13 30.76 3g62 s GLU 1372CO 0.53 0.59 -0.08 0.00 0.02 0.00 0.00 175.26 176.32 3g62 s ALA 1373N -0.66 0.85 -2.52 6.30 0.00 -1.26 -4.98 121.76 119.48 3g62 s ALA 1373Ca 0.20 -0.28 0.28 0.00 0.00 0.00 0.00 51.96 52.16 3g62 s ALA 1373Cb -0.15 -0.35 1.01 0.00 0.00 0.00 0.00 23.12 23.63 3g62 s ALA 1373CO 0.09 0.11 1.72 0.00 0.00 0.00 0.00 175.76 177.68