#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wc6 s ARG 1005N 0.00 4.15 -0.30 1.96 3.00 -1.26 0.12 118.95 126.62 1wc6 s ARG 1005Ca 0.00 2.54 -0.40 0.00 -1.00 0.00 0.00 55.73 56.87 1wc6 s ARG 1005Cb 0.00 -3.33 -0.16 0.00 0.00 0.00 0.00 34.95 31.47 1wc6 s ARG 1005CO 0.00 -0.76 1.79 -0.35 0.00 0.00 0.00 175.30 175.98 1wc6 n PRO 1006N 4.76 1.08 -3.94 5.12 -0.04 -1.26 -4.71 135.00 136.01 1wc6 n PRO 1006Ca 0.16 0.39 -0.10 0.00 -0.04 0.00 0.00 63.50 63.91 1wc6 n PRO 1006Cb 0.37 -2.10 -0.11 0.00 -0.04 0.00 0.00 33.50 31.62 1wc6 n PRO 1006CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1wc6 s GLU 1007N 3.83 0.27 0.46 0.54 0.41 -0.21 -4.91 118.70 119.09 1wc6 s GLU 1007Ca 1.00 -0.44 -0.24 0.00 -0.41 0.00 0.00 54.97 54.87 1wc6 s GLU 1007Cb -1.08 0.10 -0.07 0.00 -1.78 0.00 0.00 34.13 31.30 1wc6 s GLU 1007CO 0.65 -0.05 1.32 -1.25 -0.49 0.00 0.00 175.26 175.45 1wc6 s PRO 1008N -1.14 3.68 -0.22 0.39 0.04 -1.26 -0.89 135.00 135.60 1wc6 s PRO 1008Ca -0.12 2.17 -0.19 0.00 0.04 0.00 0.00 61.00 62.90 1wc6 s PRO 1008Cb -0.08 -2.56 0.06 0.00 0.04 0.00 0.00 34.50 31.96 1wc6 s PRO 1008CO -0.00 -0.74 0.57 0.50 0.04 0.00 0.00 177.00 177.37 1wc6 s ARG 1009N -2.51 0.66 -0.42 4.56 3.52 0.36 -4.82 118.95 120.30 1wc6 s ARG 1009Ca 0.62 0.82 -0.29 0.00 -0.13 0.00 0.00 55.73 56.76 1wc6 s ARG 1009Cb -0.38 0.30 0.02 0.00 -1.56 0.00 0.00 34.95 33.32 1wc6 s ARG 1009CO 0.48 -0.09 1.18 -1.17 -0.81 0.00 0.00 175.30 174.89 1wc6 s LEU 1010N 0.45 3.71 0.14 -0.88 2.96 -1.26 -0.90 118.68 122.90 1wc6 s LEU 1010Ca -0.01 0.70 0.02 0.00 -0.22 0.00 0.00 54.13 54.62 1wc6 s LEU 1010Cb -0.04 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 1wc6 s LEU 1010CO -0.01 -1.18 -0.03 0.27 -1.32 0.00 0.00 176.35 174.07 1wc6 s ILE 1011N 4.41 0.71 -0.30 6.68 -4.36 -0.66 -4.83 121.20 122.84 1wc6 s ILE 1011Ca 0.50 -1.97 -0.07 0.00 -0.26 0.00 0.00 60.65 58.86 1wc6 s ILE 1011Cb -0.10 -1.91 0.02 0.00 1.25 0.00 0.00 42.46 41.72 1wc6 s ILE 1011CO 0.28 -0.67 0.08 -0.89 0.24 0.00 0.00 174.94 173.98 1wc6 s THR 1012N -3.63 3.90 -0.18 8.37 2.01 0.12 -0.90 115.64 125.35 1wc6 s THR 1012Ca 0.18 -0.79 -0.18 0.00 0.31 0.00 0.00 61.69 61.21 1wc6 s THR 1012Cb 0.05 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.48 1wc6 s THR 1012CO -0.00 0.03 0.50 -0.63 -0.69 0.00 0.00 174.62 173.82 1wc6 s ILE 1013N 1.48 5.14 -0.15 1.82 1.09 0.24 -0.67 121.20 130.14 1wc6 s ILE 1013Ca 0.02 0.93 0.01 0.00 -1.10 0.00 0.00 60.65 60.51 1wc6 s ILE 1013Cb -0.18 -3.83 0.00 0.00 -1.06 0.00 0.00 42.46 37.40 1wc6 s ILE 1013CO 0.02 0.22 -0.17 -0.22 -0.10 0.00 0.00 174.94 174.70 1wc6 s LEU 1014N 1.32 2.39 -0.13 2.97 0.20 0.16 -0.31 118.68 125.29 1wc6 s LEU 1014Ca 0.24 -0.50 0.01 0.00 0.69 0.00 0.00 54.13 54.57 1wc6 s LEU 1014Cb -0.15 -1.54 -0.01 0.00 -0.43 0.00 0.00 46.19 44.06 1wc6 s LEU 1014CO 0.10 0.08 -0.16 -0.36 -0.29 0.00 0.00 176.35 175.72 1wc6 s PHE 1015N 0.84 2.75 -0.28 5.38 0.40 0.30 0.90 117.98 128.27 1wc6 s PHE 1015Ca -0.05 -0.79 0.01 0.00 -0.60 0.00 0.00 56.93 55.50 1wc6 s PHE 1015Cb -0.15 -1.82 0.08 0.00 0.51 0.00 0.00 43.02 41.64 1wc6 s PHE 1015CO -0.01 -0.29 0.02 -1.54 0.70 0.00 0.00 175.22 174.10 1wc6 s SER 1016N 0.40 4.04 -0.04 1.36 1.04 -0.04 0.13 113.70 120.60 1wc6 s SER 1016Ca -0.12 -1.50 -0.00 0.00 0.48 0.00 0.00 55.95 54.81 1wc6 s SER 1016Cb -0.16 -1.15 -0.03 0.00 0.10 0.00 0.00 66.02 64.77 1wc6 s SER 1016CO 0.06 -0.32 -0.00 -0.62 0.98 0.00 0.00 173.24 173.33 1wc6 s ASP 1017N 1.38 5.13 0.08 7.02 3.68 0.59 0.87 116.67 135.43 1wc6 s ASP 1017Ca 0.03 0.06 -0.30 0.00 2.13 0.00 0.00 52.55 54.46 1wc6 s ASP 1017Cb -0.18 -1.38 -0.05 0.00 -1.45 0.00 0.00 42.92 39.85 1wc6 s ASP 1017CO -0.12 0.33 0.99 -0.63 0.13 0.00 0.00 175.17 175.87 1wc6 s ILE 1018N -0.98 4.54 0.19 4.11 1.01 -1.12 0.29 121.20 129.24 1wc6 s ILE 1018Ca 0.16 2.01 -0.30 0.00 0.00 0.00 0.00 60.65 62.52 1wc6 s ILE 1018Cb -0.11 -4.28 -0.09 0.00 0.01 0.00 0.00 42.46 37.99 1wc6 s ILE 1018CO 0.06 0.26 1.28 -0.69 0.00 0.00 0.00 174.94 175.85 1wc6 s VAL 1019N 0.31 3.30 -1.22 2.92 1.01 0.57 -3.63 120.40 123.67 1wc6 s VAL 1019Ca 0.49 1.08 -0.28 0.00 0.00 0.00 0.00 61.98 63.27 1wc6 s VAL 1019Cb -0.23 -3.69 0.03 0.00 0.00 0.00 0.00 36.38 32.49 1wc6 s VAL 1019CO 0.30 0.16 0.66 0.61 0.00 0.00 0.00 175.10 176.83 1wc6 n GLY 1020N 2.32 -0.81 0.10 4.51 0.00 -1.26 -4.40 105.19 105.65 1wc6 n GLY 1020Ca 0.06 0.35 -0.02 0.00 0.00 0.00 0.00 46.02 46.41 1wc6 n GLY 1020CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1wc6 h PHE 1021N -2.37 0.00 -0.43 1.61 3.57 -1.94 -3.06 116.94 114.32 1wc6 h PHE 1021Ca -0.70 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 60.74 1wc6 h PHE 1021Cb 1.39 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.11 1wc6 h PHE 1021CO 0.37 0.72 0.00 1.15 -2.23 0.00 0.00 178.31 178.33 1wc6 h THR 1022N 0.00 1.23 0.00 4.41 2.02 -1.90 0.30 112.91 118.97 1wc6 h THR 1022Ca -0.05 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 66.19 1wc6 h THR 1022Cb 1.59 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1wc6 h THR 1022CO 0.09 0.33 0.00 0.54 0.37 0.00 0.00 175.52 176.84 1wc6 n ARG 1023N -4.23 0.29 0.00 6.66 1.74 -1.16 -1.64 116.66 118.33 1wc6 n ARG 1023Ca 0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 1wc6 n ARG 1023Cb 0.28 -1.07 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 1wc6 n ARG 1023CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1wc6 n MET 1024N -0.57 0.00 0.00 5.56 2.81 0.33 -3.86 117.12 121.39 1wc6 n MET 1024Ca 0.01 0.00 0.01 0.00 -1.81 0.00 0.00 57.70 55.91 1wc6 n MET 1024Cb 0.00 -0.70 0.09 0.00 -0.71 0.00 0.00 33.22 31.90 1wc6 n MET 1024CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1wc6 n SER 1025N -2.33 0.00 0.00 7.83 7.64 0.79 -1.49 113.62 126.07 1wc6 n SER 1025Ca 0.00 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.60 1wc6 n SER 1025Cb 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1wc6 n SER 1025CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1wc6 n ASN 1026N -0.75 2.49 0.00 6.43 6.94 -0.89 -4.94 115.26 124.53 1wc6 n ASN 1026Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.58 1wc6 n ASN 1026Cb 0.01 0.01 0.00 0.00 -2.36 0.00 0.00 39.78 37.44 1wc6 n ASN 1026CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wc6 n ALA 1027N -2.09 0.00 -0.40 -2.53 0.00 -0.55 -4.87 120.51 110.06 1wc6 n ALA 1027Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1wc6 n ALA 1027Cb 0.31 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.03 1wc6 n ALA 1027CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1wc6 n LEU 1028N -0.23 -1.45 -4.87 0.00 -0.00 -0.83 -4.99 117.00 104.64 1wc6 n LEU 1028Ca 0.00 -0.43 -0.31 0.00 -0.00 0.00 0.00 56.01 55.27 1wc6 n LEU 1028Cb 0.00 -1.13 -0.02 0.00 -0.00 0.00 0.00 43.42 42.26 1wc6 n LEU 1028CO 0.00 -3.77 0.57 -1.10 -0.00 0.00 0.00 177.39 173.09 1wc6 s GLN 1029N -4.50 3.80 0.16 1.47 -1.52 -1.26 -4.76 119.66 113.04 1wc6 s GLN 1029Ca 0.67 0.66 -0.29 0.00 -1.95 0.00 0.00 55.36 54.44 1wc6 s GLN 1029Cb -0.20 -2.26 -0.03 0.00 -0.22 0.00 0.00 33.01 30.30 1wc6 s GLN 1029CO 0.62 -0.21 1.55 0.66 -0.25 0.00 0.00 175.29 177.66 1wc6 h SER 1030N 0.83 -1.87 -0.99 5.90 4.64 -1.93 0.97 113.55 121.10 1wc6 h SER 1030Ca -0.47 0.29 0.14 0.00 -0.47 0.00 0.00 61.79 61.28 1wc6 h SER 1030Cb 1.19 0.83 -0.09 0.00 -0.31 0.00 0.00 62.40 64.02 1wc6 h SER 1030CO 0.63 -0.31 0.62 1.56 -0.87 0.00 0.00 176.83 178.46 1wc6 h GLN 1031N -0.16 0.88 -0.54 4.77 1.08 -1.98 0.26 115.11 119.41 1wc6 h GLN 1031Ca 0.16 -0.05 -0.08 0.00 -1.45 0.00 0.00 58.65 57.22 1wc6 h GLN 1031Cb 0.51 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.73 1wc6 h GLN 1031CO -0.79 0.58 0.02 0.78 -0.95 0.00 0.00 178.83 178.46 1wc6 h GLY 1032N 0.91 1.02 1.01 3.46 0.00 -0.21 0.69 103.07 109.94 1wc6 h GLY 1032Ca 0.50 -0.74 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 1wc6 h GLY 1032CO -0.27 0.68 0.29 -2.08 0.00 0.00 0.00 176.54 175.16 1wc6 h VAL 1033N 0.83 1.23 0.25 4.60 2.07 0.31 0.26 116.25 125.79 1wc6 h VAL 1033Ca 0.16 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1wc6 h VAL 1033Cb 0.51 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1wc6 h VAL 1033CO 0.02 0.28 -0.12 0.00 0.02 0.00 0.00 177.57 177.77 1wc6 h ALA 1034N 1.13 -0.33 -0.57 1.67 0.00 -0.39 0.18 119.26 120.94 1wc6 h ALA 1034Ca 0.22 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.05 1wc6 h ALA 1034Cb 0.16 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 17.97 1wc6 h ALA 1034CO -0.02 -0.39 -0.15 1.49 0.00 0.00 0.00 179.25 180.18 1wc6 h GLU 1035N -0.92 -0.00 0.46 0.00 4.81 0.44 0.81 114.58 120.17 1wc6 h GLU 1035Ca -0.03 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1wc6 h GLU 1035Cb 0.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1wc6 h GLU 1035CO 0.06 -0.00 -0.22 1.25 -0.73 0.00 0.00 179.01 179.36 1wc6 h LEU 1036N -0.00 -0.52 -0.17 1.64 6.46 -0.54 0.81 115.31 122.99 1wc6 h LEU 1036Ca 0.28 -0.09 0.05 0.00 -0.12 0.00 0.00 57.88 57.99 1wc6 h LEU 1036Cb 0.42 0.13 -0.07 0.00 -0.73 0.00 0.00 40.66 40.42 1wc6 h LEU 1036CO -0.59 -0.18 -0.40 0.25 -0.62 0.00 0.00 178.44 176.90 1wc6 h LEU 1037N -0.89 -1.27 -1.18 2.25 5.85 0.02 0.77 115.31 120.86 1wc6 h LEU 1037Ca -0.06 0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.88 1wc6 h LEU 1037Cb 0.58 0.53 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 1wc6 h LEU 1037CO 0.10 -0.41 0.57 0.78 -0.34 0.00 0.00 178.44 179.14 1wc6 h ASN 1038N -0.45 0.89 -0.07 1.25 2.35 0.62 0.67 115.58 120.84 1wc6 h ASN 1038Ca 0.09 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 1wc6 h ASN 1038Cb 0.61 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.78 1wc6 h ASN 1038CO -0.42 0.60 0.01 -0.08 -1.65 0.00 0.00 177.43 175.89 1wc6 h GLU 1039N 1.03 0.12 0.37 0.81 4.81 0.49 0.42 114.58 122.62 1wc6 h GLU 1039Ca 0.36 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.55 1wc6 h GLU 1039Cb 0.12 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1wc6 h GLU 1039CO -0.12 0.33 -0.36 -0.92 -0.73 0.00 0.00 179.01 177.22 1wc6 h TYR 1040N -0.12 -1.00 -0.77 0.92 3.20 0.15 -0.68 116.97 118.67 1wc6 h TYR 1040Ca 0.02 0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.11 1wc6 h TYR 1040Cb 0.27 0.39 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 1wc6 h TYR 1040CO 0.01 -0.48 0.54 -0.07 -1.64 0.00 0.00 178.16 176.53 1wc6 h LEU 1041N -0.73 0.10 0.05 2.82 3.38 0.34 0.70 115.31 121.98 1wc6 h LEU 1041Ca -0.05 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1wc6 h LEU 1041Cb 0.63 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1wc6 h LEU 1041CO -0.04 0.04 -0.03 1.23 0.09 0.00 0.00 178.44 179.74 1wc6 h GLY 1042N 0.10 -0.08 1.71 0.83 0.00 0.78 0.53 103.07 106.94 1wc6 h GLY 1042Ca 0.38 0.03 -0.17 0.00 0.00 0.00 0.00 47.33 47.56 1wc6 h GLY 1042CO -0.04 -0.03 -0.71 0.83 0.00 0.00 0.00 176.54 176.59 1wc6 h GLU 1043N -0.25 0.29 0.05 4.80 4.39 0.71 0.14 114.58 124.71 1wc6 h GLU 1043Ca -0.01 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.46 1wc6 h GLU 1043Cb 0.22 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1wc6 h GLU 1043CO 0.01 0.88 -0.02 0.52 -1.16 0.00 0.00 179.01 179.24 1wc6 h MET 1044N 0.19 -0.07 -0.42 2.33 2.86 0.38 0.24 114.93 120.44 1wc6 h MET 1044Ca -0.02 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.68 1wc6 h MET 1044Cb 1.27 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.90 1wc6 h MET 1044CO 0.11 0.25 0.13 1.15 1.06 0.00 0.00 176.91 179.62 1wc6 h THR 1045N -0.39 0.85 -0.48 2.22 2.02 0.08 0.13 112.91 117.33 1wc6 h THR 1045Ca -0.01 -0.10 0.09 0.00 0.77 0.00 0.00 66.41 67.17 1wc6 h THR 1045Cb 0.35 0.53 -0.08 0.00 -1.74 0.00 0.00 68.15 67.21 1wc6 h THR 1045CO 0.01 0.05 -0.01 -0.09 0.37 0.00 0.00 175.52 175.86 1wc6 h ARG 1046N 0.29 0.10 -0.95 6.66 2.43 -0.50 0.37 114.38 122.78 1wc6 h ARG 1046Ca 0.20 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.42 1wc6 h ARG 1046Cb 0.20 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.67 1wc6 h ARG 1046CO -0.22 0.07 0.62 0.00 -1.51 0.00 0.00 179.97 178.93 1wc6 h ALA 1047N 1.43 1.44 0.06 2.80 0.00 0.19 0.64 119.26 125.84 1wc6 h ALA 1047Ca 0.24 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1wc6 h ALA 1047Cb 0.36 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1wc6 h ALA 1047CO -0.41 0.43 -0.03 -0.39 0.00 0.00 0.00 179.25 178.85 1wc6 h VAL 1048N 1.12 1.19 -0.73 0.00 -1.51 0.13 -2.93 116.25 113.52 1wc6 h VAL 1048Ca 0.40 -1.52 0.05 0.00 -1.23 0.00 0.00 66.70 64.39 1wc6 h VAL 1048Cb 0.13 2.10 -0.05 0.00 -2.13 0.00 0.00 31.29 31.34 1wc6 h VAL 1048CO -0.14 0.34 0.44 -0.26 -1.23 0.00 0.00 177.57 176.72 1wc6 h PHE 1049N -0.85 0.82 0.00 5.19 0.04 -0.21 1.28 116.94 123.22 1wc6 h PHE 1049Ca -0.01 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1wc6 h PHE 1049Cb 0.63 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.52 1wc6 h PHE 1049CO 0.14 0.43 0.01 0.93 -0.60 0.00 0.00 178.31 179.23 1wc6 h GLU 1050N 0.83 0.00 -0.66 1.51 5.08 0.23 0.21 114.58 121.78 1wc6 h GLU 1050Ca 0.31 0.00 -0.44 0.00 -1.00 0.00 0.00 59.36 58.23 1wc6 h GLU 1050Cb 0.11 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.08 1wc6 h GLU 1050CO -0.15 0.00 -0.14 0.09 -1.00 0.00 0.00 179.01 177.81 1wc6 n ASN 1051N -2.82 4.61 0.00 1.42 3.02 0.86 -4.89 115.26 117.46 1wc6 n ASN 1051Ca -0.02 -3.78 0.00 0.00 -0.03 0.00 0.00 54.58 50.75 1wc6 n ASN 1051Cb 0.07 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 38.64 1wc6 n ASN 1051CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wc6 n GLN 1052N -0.92 -1.63 -0.79 3.52 1.13 0.74 -4.72 117.38 114.71 1wc6 n GLN 1052Ca 0.45 0.27 -0.29 0.00 -1.94 0.00 0.00 57.00 55.49 1wc6 n GLN 1052Cb 0.93 -4.02 0.22 0.00 0.11 0.00 0.00 30.24 27.49 1wc6 n GLN 1052CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1wc6 s GLY 1053N -1.34 1.56 -0.16 1.08 0.00 0.40 -4.85 107.32 104.01 1wc6 s GLY 1053Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.55 1wc6 s GLY 1053CO 0.00 0.49 -0.10 -1.59 0.00 0.00 0.00 173.10 171.90 1wc6 s THR 1054N -2.66 1.42 -0.44 0.90 2.01 0.16 -4.07 115.64 112.96 1wc6 s THR 1054Ca 0.67 -0.71 -0.28 0.00 0.31 0.00 0.00 61.69 61.68 1wc6 s THR 1054Cb -0.22 -1.46 -0.00 0.00 0.01 0.00 0.00 72.50 70.82 1wc6 s THR 1054CO 0.62 0.27 1.63 -0.69 -0.69 0.00 0.00 174.62 175.76 1wc6 s VAL 1055N 1.52 3.63 0.14 3.82 1.01 -1.26 0.17 120.40 129.43 1wc6 s VAL 1055Ca 0.02 0.59 -0.13 0.00 0.00 0.00 0.00 61.98 62.46 1wc6 s VAL 1055Cb -0.14 -4.00 0.01 0.00 0.00 0.00 0.00 36.38 32.24 1wc6 s VAL 1055CO -0.09 -0.73 1.60 -0.78 0.00 0.00 0.00 175.10 175.10 1wc6 h ASP 1056N 12.29 0.78 0.00 3.32 1.82 0.39 -3.47 116.42 131.55 1wc6 h ASP 1056Ca -0.29 -0.30 0.00 0.00 -0.39 0.00 0.00 57.03 56.05 1wc6 h ASP 1056Cb 1.14 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.94 1wc6 h ASP 1056CO 1.11 0.88 0.00 2.29 -1.61 0.00 0.00 179.24 181.91 1wc6 n LYS 1057N -4.39 -0.20 -4.69 0.28 2.85 -0.95 -4.77 118.16 106.29 1wc6 n LYS 1057Ca 0.00 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 56.93 1wc6 n LYS 1057Cb 0.29 0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 34.54 1wc6 n LYS 1057CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1wc6 s PHE 1058N -2.00 2.86 -0.86 5.58 0.40 -1.26 0.54 117.98 123.25 1wc6 s PHE 1058Ca 0.00 -0.45 0.00 0.00 -0.60 0.00 0.00 56.93 55.88 1wc6 s PHE 1058Cb 0.00 -1.84 0.25 0.00 0.51 0.00 0.00 43.02 41.94 1wc6 s PHE 1058CO 0.00 -0.08 0.95 0.28 0.70 0.00 0.00 175.22 177.06 1wc6 n VAL 1059N 3.29 3.38 0.00 -0.44 0.31 0.53 -4.93 118.33 120.47 1wc6 n VAL 1059Ca -0.18 -5.36 0.00 0.00 -0.01 0.00 0.00 64.34 58.80 1wc6 n VAL 1059Cb 0.53 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.25 1wc6 n VAL 1059CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wc6 n GLY 1060N 1.58 2.17 0.13 2.92 0.00 -1.26 -2.11 105.19 108.62 1wc6 n GLY 1060Ca 0.25 -0.50 0.15 0.00 0.00 0.00 0.00 46.02 45.92 1wc6 n GLY 1060CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wc6 n ASP 1061N 8.60 0.47 -4.77 1.61 5.75 -1.26 -4.81 116.55 122.15 1wc6 n ASP 1061Ca 0.00 -0.77 -0.37 0.00 -0.01 0.00 0.00 54.79 53.64 1wc6 n ASP 1061Cb 0.00 -0.06 -0.06 0.00 -1.03 0.00 0.00 41.12 39.96 1wc6 n ASP 1061CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wc6 s ALA 1062N -2.31 3.62 -0.12 2.12 0.00 -0.90 -2.79 121.76 121.39 1wc6 s ALA 1062Ca 0.34 -0.33 -0.04 0.00 0.00 0.00 0.00 51.96 51.94 1wc6 s ALA 1062Cb 0.21 -2.42 -0.03 0.00 0.00 0.00 0.00 23.12 20.87 1wc6 s ALA 1062CO 0.43 0.23 0.03 0.42 0.00 0.00 0.00 175.76 176.87 1wc6 s ILE 1063N -0.10 4.50 -0.29 0.00 1.09 0.25 0.20 121.20 126.84 1wc6 s ILE 1063Ca 0.21 -0.16 -0.01 0.00 -1.10 0.00 0.00 60.65 59.58 1wc6 s ILE 1063Cb -0.15 -2.94 0.05 0.00 -1.06 0.00 0.00 42.46 38.37 1wc6 s ILE 1063CO 0.08 0.57 -0.02 -0.32 -0.10 0.00 0.00 174.94 175.15 1wc6 s MET 1064N -0.51 2.41 -0.08 2.79 1.75 0.19 -0.86 119.30 124.99 1wc6 s MET 1064Ca 0.09 -1.27 -0.02 0.00 -1.25 0.00 0.00 55.69 53.24 1wc6 s MET 1064Cb -0.12 -3.14 -0.03 0.00 2.84 0.00 0.00 34.83 34.38 1wc6 s MET 1064CO 0.02 -0.61 0.02 0.00 -0.65 0.00 0.00 175.02 173.80 1wc6 s ALA 1065N 1.23 3.34 -0.01 4.11 0.00 0.26 0.29 121.76 130.98 1wc6 s ALA 1065Ca -0.06 -0.80 0.04 0.00 0.00 0.00 0.00 51.96 51.14 1wc6 s ALA 1065Cb -0.20 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.38 1wc6 s ALA 1065CO -0.02 0.60 -0.13 -0.51 0.00 0.00 0.00 175.76 175.70 1wc6 s LEU 1066N -0.97 2.82 -0.10 0.00 1.43 0.45 0.39 118.68 122.71 1wc6 s LEU 1066Ca 0.14 -0.25 0.01 0.00 -1.03 0.00 0.00 54.13 53.00 1wc6 s LEU 1066Cb -0.11 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.51 1wc6 s LEU 1066CO 0.03 0.30 -0.09 -0.31 0.23 0.00 0.00 176.35 176.51 1wc6 s TYR 1067N -0.86 1.49 0.00 0.29 1.51 0.16 0.37 117.35 120.31 1wc6 s TYR 1067Ca 0.14 -0.68 0.00 0.00 -1.01 0.00 0.00 57.07 55.52 1wc6 s TYR 1067Cb -0.11 -1.18 0.00 0.00 -0.11 0.00 0.00 41.96 40.56 1wc6 s TYR 1067CO 0.04 -0.43 0.00 0.41 -1.11 0.00 0.00 175.55 174.46 1wc6 n GLY 1068N 4.53 1.05 3.63 0.71 0.00 -1.25 0.16 105.19 114.01 1wc6 n GLY 1068Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 1wc6 n GLY 1068CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wc6 s ALA 1069N -2.00 -1.80 -0.46 4.61 0.00 -1.26 -4.27 121.76 116.57 1wc6 s ALA 1069Ca 0.00 2.12 0.24 0.00 0.00 0.00 0.00 51.96 54.32 1wc6 s ALA 1069Cb 0.00 -1.24 0.45 0.00 0.00 0.00 0.00 23.12 22.33 1wc6 s ALA 1069CO 0.00 -0.35 1.65 -1.00 0.00 0.00 0.00 175.76 176.06 1wc6 h PRO 1070N 5.48 0.00 -6.14 0.00 0.13 -1.97 -3.41 132.00 126.09 1wc6 h PRO 1070Ca -0.29 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.26 1wc6 h PRO 1070Cb 1.18 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 1wc6 h PRO 1070CO 0.08 0.00 0.78 -1.21 -0.23 0.00 0.00 178.00 177.42 1wc6 s GLU 1071N -3.21 4.17 0.45 0.86 8.01 -1.26 -4.89 118.70 122.83 1wc6 s GLU 1071Ca 0.07 1.20 -0.21 0.00 0.01 0.00 0.00 54.97 56.04 1wc6 s GLU 1071Cb 0.06 -3.68 -0.12 0.00 -4.31 0.00 0.00 34.13 26.08 1wc6 s GLU 1071CO 0.65 -0.73 0.50 -1.91 0.01 0.00 0.00 175.26 173.79 1wc6 n GLU 1072N 6.50 0.53 -3.66 1.61 2.13 -1.26 -3.90 120.64 122.60 1wc6 n GLU 1072Ca 0.11 0.20 -0.07 0.00 0.66 0.00 0.00 57.16 58.06 1wc6 n GLU 1072Cb 0.47 -1.52 -0.07 0.00 0.27 0.00 0.00 31.44 30.58 1wc6 n GLU 1072CO 0.00 0.00 0.00 1.41 -0.41 0.00 0.00 177.13 178.13 1wc6 s MET 1073N -1.64 0.56 0.24 5.31 1.75 -1.26 -4.81 119.30 119.45 1wc6 s MET 1073Ca 0.64 1.16 -0.30 0.00 -1.25 0.00 0.00 55.69 55.94 1wc6 s MET 1073Cb -0.56 0.30 -0.15 0.00 2.84 0.00 0.00 34.83 37.25 1wc6 s MET 1073CO 0.58 -0.18 1.01 -1.13 -0.65 0.00 0.00 175.02 174.65 1wc6 n SER 1074N 4.70 1.03 -0.32 1.11 3.41 -1.26 -4.50 113.62 117.80 1wc6 n SER 1074Ca -0.17 1.16 0.18 0.00 -0.26 0.00 0.00 58.87 59.78 1wc6 n SER 1074Cb 0.55 -1.23 0.38 0.00 -0.26 0.00 0.00 64.21 63.65 1wc6 n SER 1074CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1wc6 h PRO 1075N 2.36 0.30 -0.56 4.33 0.11 -1.97 0.62 132.00 137.19 1wc6 h PRO 1075Ca -0.40 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.62 1wc6 h PRO 1075Cb 1.35 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 1wc6 h PRO 1075CO 0.63 0.20 0.06 0.66 -0.21 0.00 0.00 178.00 179.34 1wc6 h SER 1076N 0.31 0.92 -0.26 -2.05 4.64 -1.99 -1.41 113.55 113.71 1wc6 h SER 1076Ca 0.64 -0.28 -0.07 0.00 -0.47 0.00 0.00 61.79 61.62 1wc6 h SER 1076Cb 1.36 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1wc6 h SER 1076CO -0.61 0.96 -0.09 -0.08 -0.87 0.00 0.00 176.83 176.14 1wc6 h GLU 1077N 0.84 0.52 -0.53 4.77 4.57 -0.38 0.48 114.58 124.85 1wc6 h GLU 1077Ca 0.17 -0.21 0.11 0.00 -1.18 0.00 0.00 59.36 58.24 1wc6 h GLU 1077Cb 0.46 -0.02 -0.11 0.00 -0.16 0.00 0.00 28.75 28.92 1wc6 h GLU 1077CO 0.02 0.76 -0.21 1.96 -1.18 0.00 0.00 179.01 180.36 1wc6 h GLN 1078N 0.25 -0.08 -0.24 1.92 4.20 0.18 1.11 115.11 122.46 1wc6 h GLN 1078Ca 0.06 0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.70 1wc6 h GLN 1078Cb 0.59 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1wc6 h GLN 1078CO 0.03 -0.05 -0.16 0.28 -0.67 0.00 0.00 178.83 178.26 1wc6 h VAL 1079N -0.08 1.31 -0.16 -0.54 2.07 -1.11 0.75 116.25 118.50 1wc6 h VAL 1079Ca 0.25 -1.28 0.05 0.00 0.82 0.00 0.00 66.70 66.54 1wc6 h VAL 1079Cb 0.47 1.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 1wc6 h VAL 1079CO -0.59 0.40 -0.30 -0.09 0.02 0.00 0.00 177.57 177.01 1wc6 h ARG 1080N 0.23 -0.34 0.06 1.57 2.43 0.15 0.66 114.38 119.14 1wc6 h ARG 1080Ca 0.05 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1wc6 h ARG 1080Cb 0.68 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1wc6 h ARG 1080CO 0.04 -0.23 -0.03 0.00 -1.51 0.00 0.00 179.97 178.25 1wc6 h ARG 1081N -0.35 -0.08 -0.12 0.20 2.47 0.13 0.50 114.38 117.13 1wc6 h ARG 1081Ca 0.11 0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.87 1wc6 h ARG 1081Cb 0.52 0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.81 1wc6 h ARG 1081CO -0.36 0.10 -0.12 0.00 0.56 0.00 0.00 179.97 180.15 1wc6 h ALA 1082N 0.69 -0.03 -0.52 0.04 0.00 0.10 1.05 119.26 120.60 1wc6 h ALA 1082Ca -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1wc6 h ALA 1082Cb 0.21 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1wc6 h ALA 1082CO 0.01 -0.57 0.27 0.82 0.00 0.00 0.00 179.25 179.78 1wc6 h ILE 1083N -0.15 1.18 -0.82 0.00 2.04 0.42 0.48 117.51 120.66 1wc6 h ILE 1083Ca 0.09 -0.48 0.04 0.00 1.00 0.00 0.00 64.86 65.51 1wc6 h ILE 1083Cb 0.27 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 1wc6 h ILE 1083CO -0.21 0.20 0.52 0.00 0.00 0.00 0.00 178.15 178.65 1wc6 h ALA 1084N 1.11 1.10 0.24 1.87 0.00 0.94 0.19 119.26 124.71 1wc6 h ALA 1084Ca 0.18 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1wc6 h ALA 1084Cb 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1wc6 h ALA 1084CO -0.03 0.31 -0.12 1.15 0.00 0.00 0.00 179.25 180.56 1wc6 h THR 1085N 0.98 0.81 -0.30 0.00 2.02 0.19 0.53 112.91 117.15 1wc6 h THR 1085Ca 0.34 -0.36 0.07 0.00 0.77 0.00 0.00 66.41 67.22 1wc6 h THR 1085Cb 0.07 1.02 -0.07 0.00 -1.74 0.00 0.00 68.15 67.43 1wc6 h THR 1085CO -0.14 0.08 -0.16 0.00 0.37 0.00 0.00 175.52 175.67 1wc6 h ALA 1086N 0.19 0.06 -0.63 6.16 0.00 0.39 1.13 119.26 126.56 1wc6 h ALA 1086Ca -0.03 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1wc6 h ALA 1086Cb 0.38 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1wc6 h ALA 1086CO 0.06 -0.56 0.24 0.00 0.00 0.00 0.00 179.25 178.98 1wc6 h ARG 1087N -0.13 0.96 -0.35 0.00 3.08 -0.48 -0.88 114.38 116.59 1wc6 h ARG 1087Ca 0.16 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 1wc6 h ARG 1087Cb 0.36 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1wc6 h ARG 1087CO -0.38 0.82 -0.09 0.37 -1.07 0.00 0.00 179.97 179.62 1wc6 h GLN 1088N 0.89 0.60 -0.37 0.04 4.15 0.11 0.17 115.11 120.71 1wc6 h GLN 1088Ca 0.21 -0.17 -0.01 0.00 0.77 0.00 0.00 58.65 59.45 1wc6 h GLN 1088Cb 0.23 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 1wc6 h GLN 1088CO -0.01 0.69 0.20 0.52 -1.93 0.00 0.00 178.83 178.30 1wc6 h MET 1089N 0.55 0.52 -0.85 1.69 2.86 0.21 1.05 114.93 120.96 1wc6 h MET 1089Ca 0.10 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1wc6 h MET 1089Cb 0.50 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1wc6 h MET 1089CO 0.03 0.43 0.56 -0.07 1.06 0.00 0.00 176.91 178.92 1wc6 h LEU 1090N 0.47 0.97 -0.17 1.22 3.38 -0.52 1.26 115.31 121.92 1wc6 h LEU 1090Ca 0.13 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1wc6 h LEU 1090Cb 0.06 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1wc6 h LEU 1090CO -0.02 0.70 0.05 0.58 0.09 0.00 0.00 178.44 179.84 1wc6 h VAL 1091N 1.14 1.18 -0.99 1.22 2.07 -0.18 0.36 116.25 121.05 1wc6 h VAL 1091Ca 0.31 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 67.34 1wc6 h VAL 1091Cb -0.12 1.25 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 1wc6 h VAL 1091CO -0.07 0.17 0.63 0.00 0.02 0.00 0.00 177.57 178.33 1wc6 h ALA 1092N 0.87 1.38 -0.19 1.67 0.00 0.22 0.19 119.26 123.41 1wc6 h ALA 1092Ca 0.05 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1wc6 h ALA 1092Cb 0.22 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1wc6 h ALA 1092CO -0.00 0.40 -0.33 1.25 0.00 0.00 0.00 179.25 180.57 1wc6 h LEU 1093N 1.13 0.39 -0.26 0.00 5.85 0.21 0.33 115.31 122.96 1wc6 h LEU 1093Ca 0.43 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 59.05 1wc6 h LEU 1093Cb 0.20 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1wc6 h LEU 1093CO -0.18 0.70 0.04 -0.08 -0.34 0.00 0.00 178.44 178.58 1wc6 h GLU 1094N 0.33 0.13 -0.20 1.25 4.22 0.28 0.41 114.58 121.00 1wc6 h GLU 1094Ca 0.04 -0.01 -0.20 0.00 0.08 0.00 0.00 59.36 59.27 1wc6 h GLU 1094Cb 0.74 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1wc6 h GLU 1094CO 0.06 0.09 -0.68 0.87 -2.18 0.00 0.00 179.01 177.17 1wc6 h LYS 1095N 0.13 0.80 -0.28 1.92 1.57 -1.00 -1.22 116.57 118.49 1wc6 h LYS 1095Ca 0.12 -0.58 0.04 0.00 -1.87 0.00 0.00 60.65 58.35 1wc6 h LYS 1095Cb 0.13 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 1wc6 h LYS 1095CO -0.17 1.20 0.06 -0.07 -0.57 0.00 0.00 179.45 179.90 1wc6 h LEU 1096N 0.57 0.03 -0.61 2.94 3.38 0.40 0.20 115.31 122.23 1wc6 h LEU 1096Ca -0.02 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1wc6 h LEU 1096Cb 1.29 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.07 1wc6 h LEU 1096CO 0.14 0.05 -0.09 0.78 0.09 0.00 0.00 178.44 179.41 1wc6 h ASN 1097N 0.17 1.00 -0.49 -0.43 2.35 -0.20 0.55 115.58 118.53 1wc6 h ASN 1097Ca 0.13 -0.32 0.10 0.00 -0.55 0.00 0.00 56.30 55.66 1wc6 h ASN 1097Cb 0.12 -0.27 -0.10 0.00 0.05 0.00 0.00 38.32 38.13 1wc6 h ASN 1097CO -0.16 1.10 -0.15 -0.61 -1.65 0.00 0.00 177.43 175.96 1wc6 h GLN 1098N 0.89 -0.04 -0.14 0.81 5.75 -0.18 1.52 115.11 123.72 1wc6 h GLN 1098Ca 0.14 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.49 1wc6 h GLN 1098Cb 0.65 0.01 0.01 0.00 1.07 0.00 0.00 27.48 29.21 1wc6 h GLN 1098CO 0.04 -0.02 -0.50 0.78 -2.65 0.00 0.00 178.83 176.48 1wc6 h GLY 1099N -0.04 0.65 1.86 2.39 0.00 -0.16 -0.56 103.07 107.21 1wc6 h GLY 1099Ca 0.24 -0.87 -0.07 0.00 0.00 0.00 0.00 47.33 46.63 1wc6 h GLY 1099CO -0.53 0.77 -0.27 1.49 0.00 0.00 0.00 176.54 178.00 1wc6 h TRP 1100N 0.24 0.19 0.17 5.60 6.55 0.82 0.97 115.95 130.49 1wc6 h TRP 1100Ca -0.02 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.78 1wc6 h TRP 1100Cb 1.13 -0.05 0.00 0.00 -0.86 0.00 0.00 29.16 29.38 1wc6 h TRP 1100CO 0.10 0.44 -0.08 0.37 -1.05 0.00 0.00 178.44 178.22 1wc6 h GLN 1101N 0.16 -0.22 0.00 0.49 -0.00 0.22 0.60 115.11 116.35 1wc6 h GLN 1101Ca 0.02 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.69 1wc6 h GLN 1101Cb 0.57 0.05 0.00 0.00 0.00 0.00 0.00 27.48 28.10 1wc6 h GLN 1101CO 0.04 0.20 0.00 -1.91 0.00 0.00 0.00 178.83 177.16 1wc6 n GLU 1102N -4.96 0.17 -0.07 1.69 4.07 -0.22 -2.45 120.64 118.86 1wc6 n GLU 1102Ca -0.08 0.16 -0.08 0.00 -0.06 0.00 0.00 57.16 57.09 1wc6 n GLU 1102Cb 0.26 -1.50 -0.08 0.00 -0.06 0.00 0.00 31.44 30.06 1wc6 n GLU 1102CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1wc6 n ARG 1103N -1.22 1.33 0.00 5.31 1.74 0.31 -5.02 116.66 119.11 1wc6 n ARG 1103Ca 0.05 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1wc6 n ARG 1103Cb 0.06 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1wc6 n ARG 1103CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wc6 n GLY 1104N 2.49 1.28 0.11 -0.13 0.00 0.90 -4.98 105.19 104.86 1wc6 n GLY 1104Ca -0.23 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.81 1wc6 n GLY 1104CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wc6 h LEU 1105N 0.00 0.00 -8.38 0.99 3.38 -0.27 -3.47 115.31 107.56 1wc6 h LEU 1105Ca 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1wc6 h LEU 1105Cb 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.60 1wc6 h LEU 1105CO 0.00 0.53 -0.63 0.68 0.09 0.00 0.00 178.44 179.11 1wc6 s VAL 1106N -2.95 0.12 0.00 1.22 -7.23 -0.66 -4.82 120.40 106.07 1wc6 s VAL 1106Ca -0.00 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.31 1wc6 s VAL 1106Cb 0.08 -1.96 0.00 0.00 0.56 0.00 0.00 36.38 35.07 1wc6 s VAL 1106CO 0.78 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 175.66 1wc6 n GLY 1107N -0.07 1.30 0.94 2.32 0.00 -1.26 -3.87 105.19 104.55 1wc6 n GLY 1107Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1wc6 n GLY 1107CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wc6 n VAL 1111N -0.30 0.00 -1.73 1.61 0.31 -1.26 -5.01 118.33 111.95 1wc6 n VAL 1111Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 1wc6 n VAL 1111Cb 0.00 -0.41 -0.02 0.00 -0.91 0.00 0.00 33.84 32.50 1wc6 n VAL 1111CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1wc6 n PRO 1112N 1.23 2.63 -1.52 5.55 -0.04 -1.26 -4.78 135.00 136.81 1wc6 n PRO 1112Ca 0.00 0.94 -0.37 0.00 -0.04 0.00 0.00 63.50 64.03 1wc6 n PRO 1112Cb 0.00 -2.73 -0.10 0.00 -0.04 0.00 0.00 33.50 30.63 1wc6 n PRO 1112CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1wc6 n PRO 1113N 2.78 0.47 -0.23 0.54 -0.02 -1.26 -4.62 135.00 132.67 1wc6 n PRO 1113Ca 0.12 -0.03 -0.10 0.00 -2.02 0.00 0.00 63.50 61.47 1wc6 n PRO 1113Cb 0.35 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.41 1wc6 n PRO 1113CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1wc6 n VAL 1114N 7.69 0.00 -4.39 -1.45 0.31 -1.26 -4.92 118.33 114.31 1wc6 n VAL 1114Ca 0.53 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.60 1wc6 n VAL 1114Cb 0.27 -0.08 -0.10 0.00 -0.91 0.00 0.00 33.84 33.02 1wc6 n VAL 1114CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1wc6 s ARG 1115N 0.75 1.75 0.00 5.55 0.52 -1.26 -4.86 118.95 121.40 1wc6 s ARG 1115Ca 0.18 -1.51 0.02 0.00 -0.52 0.00 0.00 55.73 53.90 1wc6 s ARG 1115Cb -0.24 -1.93 -0.01 0.00 0.52 0.00 0.00 34.95 33.29 1wc6 s ARG 1115CO 0.11 0.39 -0.07 -0.59 0.02 0.00 0.00 175.30 175.16 1wc6 s PHE 1116N -1.92 0.62 0.03 -0.53 -0.12 -1.26 0.21 117.98 115.01 1wc6 s PHE 1116Ca 0.25 -0.17 -0.16 0.00 -0.05 0.00 0.00 56.93 56.79 1wc6 s PHE 1116Cb -0.07 -0.39 -0.06 0.00 -0.63 0.00 0.00 43.02 41.87 1wc6 s PHE 1116CO 0.13 -0.02 0.47 1.03 -0.05 0.00 0.00 175.22 176.79 1wc6 s ARG 1117N -0.38 4.02 -0.10 1.99 0.52 0.14 0.35 118.95 125.50 1wc6 s ARG 1117Ca 0.01 0.54 0.00 0.00 -0.52 0.00 0.00 55.73 55.76 1wc6 s ARG 1117Cb -0.04 -3.22 0.02 0.00 0.52 0.00 0.00 34.95 32.24 1wc6 s ARG 1117CO -0.00 0.67 -0.09 0.00 0.02 0.00 0.00 175.30 175.89 1wc6 s GLY 1119N 1.35 1.55 -0.14 0.00 0.00 0.36 0.16 107.32 110.60 1wc6 s GLY 1119Ca -0.02 -1.14 0.02 0.00 0.00 0.00 0.00 44.72 43.59 1wc6 s GLY 1119CO -0.04 0.30 -0.21 -0.42 0.00 0.00 0.00 173.10 172.72 1wc6 s ILE 1120N 1.26 2.01 0.06 0.90 1.01 0.52 0.11 121.20 127.07 1wc6 s ILE 1120Ca 0.03 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.76 1wc6 s ILE 1120Cb -0.14 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.52 1wc6 s ILE 1120CO -0.04 0.54 -0.09 -2.28 0.00 0.00 0.00 174.94 173.07 1wc6 s HIS 1121N 0.84 0.84 -0.04 3.97 2.46 0.58 -0.86 115.29 123.07 1wc6 s HIS 1121Ca -0.07 -0.53 0.05 0.00 0.47 0.00 0.00 55.06 54.98 1wc6 s HIS 1121Cb -0.15 -0.49 -0.01 0.00 -0.13 0.00 0.00 32.58 31.80 1wc6 s HIS 1121CO -0.02 -0.05 -0.18 -1.14 -2.47 0.00 0.00 174.74 170.88 1wc6 s GLN 1122N -1.85 1.83 0.00 2.88 0.74 -1.26 0.82 119.66 122.82 1wc6 s GLN 1122Ca -0.06 -0.65 0.00 0.00 0.05 0.00 0.00 55.36 54.70 1wc6 s GLN 1122Cb -0.09 -1.61 0.00 0.00 1.10 0.00 0.00 33.01 32.42 1wc6 s GLN 1122CO 0.00 0.28 0.00 0.41 -0.55 0.00 0.00 175.29 175.44 1wc6 n GLY 1123N 3.04 -0.63 3.67 2.59 0.00 -0.07 -4.67 105.19 109.12 1wc6 n GLY 1123Ca -0.18 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 1wc6 n GLY 1123CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wc6 s MET 1124N -2.00 4.23 0.04 1.61 -1.94 -1.26 -1.65 119.30 118.33 1wc6 s MET 1124Ca 0.00 1.95 0.02 0.00 -1.71 0.00 0.00 55.69 55.95 1wc6 s MET 1124Cb 0.00 -3.77 -0.02 0.00 2.01 0.00 0.00 34.83 33.04 1wc6 s MET 1124CO 0.00 -0.71 -0.07 0.00 -0.01 0.00 0.00 175.02 174.23 1wc6 s ALA 1125N 3.29 0.51 -0.70 3.03 0.00 -0.07 -4.13 121.76 123.70 1wc6 s ALA 1125Ca 0.64 -0.71 -0.23 0.00 0.00 0.00 0.00 51.96 51.67 1wc6 s ALA 1125Cb -0.29 0.04 0.07 0.00 0.00 0.00 0.00 23.12 22.94 1wc6 s ALA 1125CO 0.24 -0.02 1.03 0.08 0.00 0.00 0.00 175.76 177.08 1wc6 s VAL 1126N -1.29 4.27 -0.02 0.00 1.01 0.20 0.14 120.40 124.71 1wc6 s VAL 1126Ca -0.10 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 1wc6 s VAL 1126Cb -0.09 -4.73 -0.04 0.00 0.00 0.00 0.00 36.38 31.52 1wc6 s VAL 1126CO 0.00 -1.52 0.17 0.68 0.00 0.00 0.00 175.10 174.43 1wc6 s VAL 1127N 4.18 5.38 -5.00 2.92 -7.23 -0.07 -0.77 120.40 119.81 1wc6 s VAL 1127Ca 0.25 -0.15 0.00 0.00 -1.81 0.00 0.00 61.98 60.27 1wc6 s VAL 1127Cb -0.14 -3.50 0.00 0.00 0.56 0.00 0.00 36.38 33.30 1wc6 s VAL 1127CO 0.09 0.35 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 1wc6 n GLY 1128N 1.06 -0.76 3.73 2.32 0.00 -0.32 -1.04 105.19 110.18 1wc6 n GLY 1128Ca -0.12 -1.49 -0.41 0.00 0.00 0.00 0.00 46.02 44.00 1wc6 n GLY 1128CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wc6 s LEU 1129N 0.00 4.49 0.14 0.99 1.43 0.32 -0.78 118.68 125.26 1wc6 s LEU 1129Ca 0.00 1.96 0.07 0.00 -1.03 0.00 0.00 54.13 55.14 1wc6 s LEU 1129Cb 0.00 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.59 1wc6 s LEU 1129CO 0.00 -0.17 -0.17 -0.36 0.23 0.00 0.00 176.35 175.88 1wc6 s PHE 1130N -0.07 1.63 0.00 0.29 0.40 -0.31 -4.18 117.98 115.74 1wc6 s PHE 1130Ca 0.49 -0.50 0.00 0.00 -0.60 0.00 0.00 56.93 56.32 1wc6 s PHE 1130Cb -0.27 -0.84 0.00 0.00 0.51 0.00 0.00 43.02 42.42 1wc6 s PHE 1130CO 0.32 0.23 0.00 0.41 0.70 0.00 0.00 175.22 176.88 1wc6 n GLY 1131N 0.52 -0.59 3.92 4.36 0.00 -1.26 -0.62 105.19 111.52 1wc6 n GLY 1131Ca -0.15 -2.19 -0.27 0.00 0.00 0.00 0.00 46.02 43.41 1wc6 n GLY 1131CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wc6 s SER 1132N -4.00 5.64 0.57 1.61 1.04 -0.58 -4.81 113.70 113.17 1wc6 s SER 1132Ca 0.00 0.73 0.36 0.00 0.48 0.00 0.00 55.95 57.51 1wc6 s SER 1132Cb 0.00 -1.74 1.63 0.00 0.10 0.00 0.00 66.02 66.01 1wc6 s SER 1132CO 0.00 -1.03 2.09 -0.61 0.98 0.00 0.00 173.24 174.66 1wc6 h GLN 1133N -0.15 0.00 0.00 4.02 -0.00 -2.00 0.31 115.11 117.28 1wc6 h GLN 1133Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.20 1wc6 h GLN 1133Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.73 1wc6 h GLN 1133CO 0.61 0.02 0.00 0.93 0.00 0.00 0.00 178.83 180.39 1wc6 h GLU 1134N 0.00 0.00 -0.34 1.69 4.39 -2.01 -3.41 114.58 114.90 1wc6 h GLU 1134Ca -0.00 0.00 0.20 0.00 0.34 0.00 0.00 59.36 59.90 1wc6 h GLU 1134Cb 0.38 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 28.83 1wc6 h GLU 1134CO 0.00 0.00 -0.01 0.50 -1.16 0.00 0.00 179.01 178.34 1wc6 s ARG 1135N -3.38 0.19 -0.00 2.33 6.06 0.10 -5.17 118.95 119.09 1wc6 s ARG 1135Ca 0.05 0.23 0.08 0.00 -2.50 0.00 0.00 55.73 53.58 1wc6 s ARG 1135Cb 0.09 0.11 -0.02 0.00 0.06 0.00 0.00 34.95 35.19 1wc6 s ARG 1135CO 0.49 -0.32 -0.25 -1.12 -2.50 0.00 0.00 175.30 171.60 1wc6 s SER 1136N 2.94 3.20 -0.06 -2.12 0.01 -0.98 -1.53 113.70 115.16 1wc6 s SER 1136Ca 0.19 -0.47 0.01 0.00 1.31 0.00 0.00 55.95 56.99 1wc6 s SER 1136Cb -0.05 -0.38 0.02 0.00 0.21 0.00 0.00 66.02 65.82 1wc6 s SER 1136CO -0.20 0.31 -0.08 -1.81 0.41 0.00 0.00 173.24 171.87 1wc6 s ASP 1137N -0.80 1.36 -0.10 2.44 1.01 0.21 -4.85 116.67 115.93 1wc6 s ASP 1137Ca 0.11 -0.20 -0.29 0.00 0.71 0.00 0.00 52.55 52.87 1wc6 s ASP 1137Cb -0.10 -0.62 -0.04 0.00 1.01 0.00 0.00 42.92 43.17 1wc6 s ASP 1137CO 0.00 -0.03 1.49 0.12 0.21 0.00 0.00 175.17 176.96 1wc6 s PHE 1138N 0.89 2.35 0.34 4.23 5.36 -1.26 -1.17 117.98 128.73 1wc6 s PHE 1138Ca -0.11 0.54 -0.08 0.00 -0.96 0.00 0.00 56.93 56.33 1wc6 s PHE 1138Cb -0.15 -3.74 0.02 0.00 -0.34 0.00 0.00 43.02 38.81 1wc6 s PHE 1138CO 0.01 -2.92 0.57 -0.08 -1.46 0.00 0.00 175.22 171.33 1wc6 s THR 1139N 3.82 0.00 -0.11 0.12 -1.32 0.04 -4.78 115.64 113.41 1wc6 s THR 1139Ca 0.65 -1.40 -0.00 0.00 -1.21 0.00 0.00 61.69 59.73 1wc6 s THR 1139Cb -0.28 -2.64 -0.02 0.00 -1.51 0.00 0.00 72.50 68.04 1wc6 s THR 1139CO 0.23 0.00 -0.10 0.00 -2.21 0.00 0.00 174.62 172.54 1wc6 s ALA 1140N -2.97 2.79 0.06 11.08 0.00 -1.26 -1.17 121.76 130.29 1wc6 s ALA 1140Ca 0.25 -0.89 0.09 0.00 0.00 0.00 0.00 51.96 51.42 1wc6 s ALA 1140Cb -0.02 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 1wc6 s ALA 1140CO 0.16 0.35 -0.26 0.42 0.00 0.00 0.00 175.76 176.44 1wc6 s ILE 1141N -0.05 2.09 0.00 0.00 1.09 0.05 -4.84 121.20 119.55 1wc6 s ILE 1141Ca -0.01 -1.44 0.00 0.00 -1.10 0.00 0.00 60.65 58.09 1wc6 s ILE 1141Cb -0.14 -1.80 0.00 0.00 -1.06 0.00 0.00 42.46 39.46 1wc6 s ILE 1141CO 0.03 0.28 0.00 0.61 -0.10 0.00 0.00 174.94 175.76 1wc6 n GLY 1142N 1.59 3.40 0.44 6.18 0.00 -1.26 0.62 105.19 116.16 1wc6 n GLY 1142Ca -0.17 -1.87 0.25 0.00 0.00 0.00 0.00 46.02 44.23 1wc6 n GLY 1142CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wc6 h PRO 1143N 0.00 0.22 -0.63 1.61 0.13 -1.98 0.14 132.00 131.49 1wc6 h PRO 1143Ca 0.00 -0.01 0.12 0.00 -0.87 0.00 0.00 66.00 65.24 1wc6 h PRO 1143Cb 0.00 -0.05 -0.12 0.00 0.13 0.00 0.00 31.00 30.96 1wc6 h PRO 1143CO 0.00 0.15 -0.18 0.77 -0.23 0.00 0.00 178.00 178.51 1wc6 h SER 1144N 0.23 -0.66 0.08 1.44 0.02 -1.88 0.86 113.55 113.64 1wc6 h SER 1144Ca 0.51 0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.66 1wc6 h SER 1144Cb 1.60 0.42 0.00 0.00 0.14 0.00 0.00 62.40 64.56 1wc6 h SER 1144CO -0.14 -0.22 -0.04 0.58 -1.14 0.00 0.00 176.83 175.86 1wc6 h VAL 1145N -0.02 1.02 -0.53 2.27 2.07 -1.29 -2.18 116.25 117.59 1wc6 h VAL 1145Ca 0.30 -0.38 0.10 0.00 0.82 0.00 0.00 66.70 67.54 1wc6 h VAL 1145Cb 0.48 1.27 -0.11 0.00 -1.52 0.00 0.00 31.29 31.41 1wc6 h VAL 1145CO -0.66 0.09 -0.28 -1.13 0.02 0.00 0.00 177.57 175.62 1wc6 h ASN 1146N -0.28 -0.96 -0.28 0.57 -0.73 -0.65 0.50 115.58 113.75 1wc6 h ASN 1146Ca -0.01 0.20 0.06 0.00 1.87 0.00 0.00 56.30 58.42 1wc6 h ASN 1146Cb 0.24 0.49 -0.08 0.00 0.27 0.00 0.00 38.32 39.25 1wc6 h ASN 1146CO 0.02 -0.28 -0.36 0.40 -0.37 0.00 0.00 177.43 176.84 1wc6 h ILE 1147N -0.15 0.21 -0.57 2.57 1.08 0.89 0.96 117.51 122.50 1wc6 h ILE 1147Ca 0.23 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.79 1wc6 h ILE 1147Cb 0.52 0.21 -0.07 0.00 -3.07 0.00 0.00 36.82 34.41 1wc6 h ILE 1147CO -0.61 0.00 0.18 0.00 -0.69 0.00 0.00 178.15 177.02 1wc6 h ALA 1148N 0.50 0.70 -0.14 1.87 0.00 -0.54 0.74 119.26 122.38 1wc6 h ALA 1148Ca 0.13 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1wc6 h ALA 1148Cb 0.56 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1wc6 h ALA 1148CO -0.47 -0.24 0.06 0.00 0.00 0.00 0.00 179.25 178.60 1wc6 h ALA 1149N 1.41 0.19 -0.56 0.00 0.00 0.87 0.36 119.26 121.53 1wc6 h ALA 1149Ca 0.29 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1wc6 h ALA 1149Cb 0.37 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1wc6 h ALA 1149CO -0.32 -0.23 0.15 0.00 0.00 0.00 0.00 179.25 178.85 1wc6 h ARG 1150N 0.08 0.85 -0.13 0.00 2.47 0.17 0.82 114.38 118.63 1wc6 h ARG 1150Ca 0.05 -0.17 -0.01 0.00 -1.26 0.00 0.00 59.98 58.59 1wc6 h ARG 1150Cb 0.17 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 1wc6 h ARG 1150CO -0.00 0.75 0.06 -0.07 0.56 0.00 0.00 179.97 181.27 1wc6 h LEU 1151N 0.82 0.18 -0.22 3.04 3.38 0.84 0.90 115.31 124.25 1wc6 h LEU 1151Ca 0.18 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.07 1wc6 h LEU 1151Cb 0.28 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.91 1wc6 h LEU 1151CO -0.00 0.28 -0.28 -0.61 0.09 0.00 0.00 178.44 177.91 1wc6 h GLN 1152N 0.07 -0.29 0.00 1.13 -0.00 0.61 0.33 115.11 116.96 1wc6 h GLN 1152Ca 0.04 0.02 -0.00 0.00 -0.00 0.00 0.00 58.65 58.71 1wc6 h GLN 1152Cb 0.15 0.07 -0.00 0.00 0.00 0.00 0.00 27.48 27.69 1wc6 h GLN 1152CO -0.00 -0.19 -0.02 1.05 0.00 0.00 0.00 178.83 179.66 1wc6 h GLU 1153N -0.30 0.00 0.10 1.69 4.11 -0.61 -3.15 114.58 116.42 1wc6 h GLU 1153Ca 0.13 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.30 1wc6 h GLU 1153Cb 0.50 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1wc6 h GLU 1153CO -0.39 0.02 -1.20 0.00 0.07 0.00 0.00 179.01 177.51 1wc6 h ALA 1154N 1.98 0.16 -2.31 1.06 0.00 0.22 -3.46 119.26 116.90 1wc6 h ALA 1154Ca -0.00 -0.90 -0.49 0.00 0.00 0.00 0.00 54.91 53.52 1wc6 h ALA 1154Cb 0.74 -0.02 0.05 0.00 0.00 0.00 0.00 17.79 18.57 1wc6 h ALA 1154CO 0.00 1.05 0.38 -0.08 0.00 0.00 0.00 179.25 180.60 1wc6 s THR 1155N -2.67 4.01 0.77 0.00 -1.32 0.10 -5.03 115.64 111.51 1wc6 s THR 1155Ca -0.03 0.93 -0.11 0.00 -1.21 0.00 0.00 61.69 61.27 1wc6 s THR 1155Cb 0.08 -3.47 0.06 0.00 -1.51 0.00 0.00 72.50 67.65 1wc6 s THR 1155CO 0.87 -0.58 1.09 0.00 -2.21 0.00 0.00 174.62 173.78 1wc6 s ALA 1156N -2.54 2.26 0.62 11.08 0.00 -1.26 -4.84 121.76 127.08 1wc6 s ALA 1156Ca 0.62 0.19 -0.18 0.00 0.00 0.00 0.00 51.96 52.60 1wc6 s ALA 1156Cb -0.14 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 1wc6 s ALA 1156CO 0.37 -1.73 0.78 -2.30 0.00 0.00 0.00 175.76 172.87 1wc6 n PRO 1157N -3.49 0.65 -4.19 0.00 -0.02 -1.26 -1.84 135.00 124.85 1wc6 n PRO 1157Ca 0.09 0.26 -0.36 0.00 -2.02 0.00 0.00 63.50 61.47 1wc6 n PRO 1157Cb 0.53 -1.99 -0.04 0.00 -0.02 0.00 0.00 33.50 31.98 1wc6 n PRO 1157CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1wc6 n ASN 1158N -0.45 -2.81 -3.99 2.55 5.03 0.15 -4.88 115.26 110.87 1wc6 n ASN 1158Ca 0.13 -0.98 -0.24 0.00 0.87 0.00 0.00 54.58 54.36 1wc6 n ASN 1158Cb 0.48 -2.34 -0.17 0.00 -1.02 0.00 0.00 39.78 36.74 1wc6 n ASN 1158CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1wc6 s SER 1159N -3.17 1.60 -0.42 6.41 0.15 -0.77 -4.88 113.70 112.63 1wc6 s SER 1159Ca 0.72 -0.26 -0.16 0.00 0.70 0.00 0.00 55.95 56.95 1wc6 s SER 1159Cb -0.40 -0.74 0.02 0.00 -1.71 0.00 0.00 66.02 63.19 1wc6 s SER 1159CO 0.89 0.00 0.37 -0.63 1.20 0.00 0.00 173.24 175.08 1wc6 s ILE 1160N 0.78 5.17 -0.29 6.45 1.01 -1.26 -1.69 121.20 131.37 1wc6 s ILE 1160Ca -0.13 -0.52 -0.10 0.00 0.00 0.00 0.00 60.65 59.90 1wc6 s ILE 1160Cb -0.15 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.29 1wc6 s ILE 1160CO 0.02 -0.38 0.16 -0.32 0.00 0.00 0.00 174.94 174.42 1wc6 s MET 1161N 1.91 3.63 0.29 2.79 1.75 0.42 0.53 119.30 130.62 1wc6 s MET 1161Ca 0.09 -0.53 0.09 0.00 -1.25 0.00 0.00 55.69 54.08 1wc6 s MET 1161Cb -0.18 -3.59 -0.04 0.00 2.84 0.00 0.00 34.83 33.86 1wc6 s MET 1161CO 0.12 -0.30 0.09 0.14 -0.65 0.00 0.00 175.02 174.42 1wc6 s VAL 1162N 1.68 3.56 0.79 10.11 -7.23 -0.56 -0.35 120.40 128.39 1wc6 s VAL 1162Ca 0.06 -1.72 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1wc6 s VAL 1162Cb -0.16 -3.02 0.08 0.00 0.56 0.00 0.00 36.38 33.84 1wc6 s VAL 1162CO 0.08 -0.31 1.14 -0.94 -0.31 0.00 0.00 175.10 174.76 1wc6 s SER 1163N -3.77 4.54 0.19 4.85 1.04 -0.04 0.10 113.70 120.61 1wc6 s SER 1163Ca 0.34 0.68 -0.12 0.00 0.48 0.00 0.00 55.95 57.33 1wc6 s SER 1163Cb -0.06 -1.19 0.18 0.00 0.10 0.00 0.00 66.02 65.05 1wc6 s SER 1163CO 0.22 -1.85 1.77 0.00 0.98 0.00 0.00 173.24 174.36 1wc6 h ALA 1164N -0.96 0.69 -0.78 5.32 0.00 -0.63 0.31 119.26 123.21 1wc6 h ALA 1164Ca -0.45 0.04 0.18 0.00 0.00 0.00 0.00 54.91 54.68 1wc6 h ALA 1164Cb 1.32 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 1wc6 h ALA 1164CO 0.64 -0.13 0.22 0.52 0.00 0.00 0.00 179.25 180.50 1wc6 h MET 1165N 0.47 0.28 0.01 0.00 0.00 -1.85 -2.12 114.93 111.72 1wc6 h MET 1165Ca 0.25 -0.02 -0.05 0.00 0.00 0.00 0.00 59.70 59.88 1wc6 h MET 1165Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 31.60 31.76 1wc6 h MET 1165CO -0.21 0.19 -0.20 0.28 0.00 0.00 0.00 176.91 176.97 1wc6 h VAL 1166N 0.29 1.59 -0.95 -2.22 2.07 -1.47 -3.34 116.25 112.22 1wc6 h VAL 1166Ca 0.45 -2.00 0.26 0.00 0.82 0.00 0.00 66.70 66.23 1wc6 h VAL 1166Cb 0.81 2.89 -0.13 0.00 -1.52 0.00 0.00 31.29 33.33 1wc6 h VAL 1166CO -0.53 0.54 0.48 0.00 0.02 0.00 0.00 177.57 178.08 1wc6 h ALA 1167N 0.21 1.66 0.00 1.67 0.00 0.19 0.75 119.26 123.75 1wc6 h ALA 1167Ca -0.03 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1wc6 h ALA 1167Cb 0.99 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1wc6 h ALA 1167CO 0.04 -0.41 0.27 -0.56 0.00 0.00 0.00 179.25 178.59 1wc6 h GLN 1168N 0.40 0.00 0.00 0.00 3.07 -1.54 0.53 115.11 117.57 1wc6 h GLN 1168Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.37 1wc6 h GLN 1168Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.86 1wc6 h GLN 1168CO -0.56 0.00 -1.13 0.66 0.09 0.00 0.00 178.83 177.89 1wc6 n TYR 1169N -2.69 0.41 -3.67 0.06 4.02 0.26 -4.83 117.16 110.72 1wc6 n TYR 1169Ca -0.02 0.12 -0.35 0.00 -0.01 0.00 0.00 57.90 57.64 1wc6 n TYR 1169Cb 0.32 -0.58 -0.08 0.00 -0.02 0.00 0.00 39.34 38.98 1wc6 n TYR 1169CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1wc6 s VAL 1170N -3.28 5.38 0.31 -0.72 0.11 0.19 -4.95 120.40 117.43 1wc6 s VAL 1170Ca 0.01 0.30 -0.28 0.00 -2.93 0.00 0.00 61.98 59.08 1wc6 s VAL 1170Cb 0.13 -3.52 -0.13 0.00 -1.53 0.00 0.00 36.38 31.33 1wc6 s VAL 1170CO 0.81 0.42 1.16 -0.81 -3.33 0.00 0.00 175.10 173.35 1wc6 n PRO 1171N 3.58 1.74 -0.30 1.54 -0.04 -1.26 -4.77 135.00 135.48 1wc6 n PRO 1171Ca -0.15 0.61 0.28 0.00 -0.04 0.00 0.00 63.50 64.20 1wc6 n PRO 1171Cb 0.52 -2.10 0.63 0.00 -0.04 0.00 0.00 33.50 32.51 1wc6 n PRO 1171CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1wc6 h ASP 1172N 2.40 0.22 -0.23 3.54 1.82 -1.94 0.49 116.42 122.73 1wc6 h ASP 1172Ca -0.43 0.04 0.06 0.00 -0.39 0.00 0.00 57.03 56.31 1wc6 h ASP 1172Cb 1.31 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 41.32 1wc6 h ASP 1172CO 0.63 0.04 0.16 1.05 -1.61 0.00 0.00 179.24 179.51 1wc6 h GLU 1173N 0.20 0.04 0.00 0.28 9.09 -2.01 0.33 114.58 122.51 1wc6 h GLU 1173Ca 0.55 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.96 1wc6 h GLU 1173Cb 1.79 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 28.88 1wc6 h GLU 1173CO -0.15 0.03 -0.50 0.39 0.05 0.00 0.00 179.01 178.83 1wc6 n GLU 1174N -4.48 0.06 -2.86 1.06 1.02 0.17 -4.66 120.64 110.95 1wc6 n GLU 1174Ca 0.02 0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 1wc6 n GLU 1174Cb 0.28 -1.53 -0.03 0.00 -0.02 0.00 0.00 31.44 30.14 1wc6 n GLU 1174CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1wc6 s ILE 1175N -3.03 4.51 0.23 -3.67 1.01 0.10 0.44 121.20 120.78 1wc6 s ILE 1175Ca 0.10 -1.10 -0.08 0.00 0.00 0.00 0.00 60.65 59.57 1wc6 s ILE 1175Cb 0.17 -4.78 0.22 0.00 0.01 0.00 0.00 42.46 38.08 1wc6 s ILE 1175CO 0.69 -1.54 1.67 0.40 0.00 0.00 0.00 174.94 176.16 1wc6 h ILE 1176N 5.99 0.49 -1.45 2.92 2.04 -1.44 -3.43 117.51 122.62 1wc6 h ILE 1176Ca 0.02 -0.06 0.12 0.00 1.00 0.00 0.00 64.86 65.94 1wc6 h ILE 1176Cb 1.04 0.28 -0.24 0.00 -0.74 0.00 0.00 36.82 37.16 1wc6 h ILE 1176CO 1.17 0.03 0.18 -1.59 0.00 0.00 0.00 178.15 177.94 1wc6 s LYS 1177N -6.10 0.42 0.66 2.37 0.00 -1.12 -5.01 119.74 110.96 1wc6 s LYS 1177Ca -0.13 0.91 -0.07 0.00 0.00 0.00 0.00 55.97 56.68 1wc6 s LYS 1177Cb 0.20 0.39 0.04 0.00 0.00 0.00 0.00 37.83 38.46 1wc6 s LYS 1177CO 0.75 -0.12 0.97 1.03 0.00 0.00 0.00 175.35 177.98 1wc6 s ARG 1178N 2.14 2.51 0.00 1.78 0.52 -1.26 -2.19 118.95 122.45 1wc6 s ARG 1178Ca -0.06 -0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.03 1wc6 s ARG 1178Cb -0.06 -2.20 0.00 0.00 0.52 0.00 0.00 34.95 33.20 1wc6 s ARG 1178CO -0.17 -1.02 0.00 -1.91 0.02 0.00 0.00 175.30 172.22 1wc6 n GLU 1179N -2.79 0.00 -2.92 3.54 2.13 0.29 -4.94 120.64 115.94 1wc6 n GLU 1179Ca 0.07 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.53 1wc6 n GLU 1179Cb 0.59 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.24 1wc6 n GLU 1179CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1wc6 s PHE 1180N -0.59 3.58 -0.01 4.31 0.40 -1.26 -0.00 117.98 124.40 1wc6 s PHE 1180Ca 0.00 1.57 0.02 0.00 -0.60 0.00 0.00 56.93 57.92 1wc6 s PHE 1180Cb 0.00 -2.77 0.00 0.00 0.51 0.00 0.00 43.02 40.76 1wc6 s PHE 1180CO 0.00 0.18 -0.06 -0.51 0.70 0.00 0.00 175.22 175.53 1wc6 s LEU 1181N -2.33 1.84 -0.65 -0.37 1.43 -0.06 -4.87 118.68 113.66 1wc6 s LEU 1181Ca 0.51 -0.11 -0.26 0.00 -1.03 0.00 0.00 54.13 53.23 1wc6 s LEU 1181Cb -0.15 -0.34 -0.02 0.00 0.03 0.00 0.00 46.19 45.71 1wc6 s LEU 1181CO 0.20 0.04 1.82 -1.61 0.23 0.00 0.00 176.35 177.03 1wc6 s GLU 1182N 0.12 2.67 -0.20 1.70 0.41 -1.26 -2.22 118.70 119.91 1wc6 s GLU 1182Ca -0.01 0.45 -0.16 0.00 -0.41 0.00 0.00 54.97 54.83 1wc6 s GLU 1182Cb -0.05 -4.44 -0.04 0.00 -1.78 0.00 0.00 34.13 27.82 1wc6 s GLU 1182CO -0.00 -2.74 0.43 -0.51 -0.49 0.00 0.00 175.26 171.94 1wc6 s LEU 1183N 8.86 4.16 0.21 1.80 1.43 -1.26 -5.02 118.68 128.86 1wc6 s LEU 1183Ca 0.65 0.56 -0.31 0.00 -1.03 0.00 0.00 54.13 54.00 1wc6 s LEU 1183Cb -0.12 -2.56 -0.16 0.00 0.03 0.00 0.00 46.19 43.39 1wc6 s LEU 1183CO 0.18 -0.09 0.95 1.17 0.23 0.00 0.00 176.35 178.79 1wc6 n LYS 1184N 4.51 0.87 -0.59 1.70 0.00 -1.26 -0.37 118.16 123.02 1wc6 n LYS 1184Ca -0.08 0.31 0.00 0.00 0.00 0.00 0.00 58.31 58.54 1wc6 n LYS 1184Cb 0.51 -1.64 0.00 0.00 0.00 0.00 0.00 35.03 33.90 1wc6 n LYS 1184CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1wc6 n GLY 1185N 1.71 1.64 3.17 3.14 0.00 -1.26 -4.92 105.19 108.68 1wc6 n GLY 1185Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1wc6 n GLY 1185CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wc6 s ILE 1186N -3.41 3.73 -0.82 -0.61 -1.09 0.51 -4.94 121.20 114.57 1wc6 s ILE 1186Ca 0.00 -1.88 0.00 0.00 -2.23 0.00 0.00 60.65 56.54 1wc6 s ILE 1186Cb 0.00 -3.48 0.00 0.00 -1.58 0.00 0.00 42.46 37.40 1wc6 s ILE 1186CO 0.00 -0.70 0.06 -0.67 -1.23 0.00 0.00 174.94 172.40 1wc6 n ASP 1187N 4.75 0.14 -3.64 3.58 2.03 -1.26 -4.53 116.55 117.62 1wc6 n ASP 1187Ca -0.05 -0.21 -0.13 0.00 0.52 0.00 0.00 54.79 54.92 1wc6 n ASP 1187Cb 0.41 -0.05 -0.07 0.00 -0.72 0.00 0.00 41.12 40.69 1wc6 n ASP 1187CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1wc6 s GLU 1188N -0.65 0.79 0.06 -0.67 2.02 -1.26 -5.12 118.70 113.86 1wc6 s GLU 1188Ca 0.00 0.97 -0.30 0.00 0.02 0.00 0.00 54.97 55.66 1wc6 s GLU 1188Cb 0.00 0.36 -0.09 0.00 0.10 0.00 0.00 34.13 34.50 1wc6 s GLU 1188CO 0.00 -0.10 1.95 -2.30 0.02 0.00 0.00 175.26 174.83 1wc6 n PRO 1189N 2.88 2.87 -3.09 0.39 -0.02 -1.26 -4.64 135.00 132.13 1wc6 n PRO 1189Ca -0.15 1.05 -0.39 0.00 -2.02 0.00 0.00 63.50 61.99 1wc6 n PRO 1189Cb 0.56 -3.00 -0.05 0.00 -0.02 0.00 0.00 33.50 30.99 1wc6 n PRO 1189CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1wc6 s VAL 1190N 4.05 4.97 -0.56 -1.45 1.01 -0.94 -4.75 120.40 122.73 1wc6 s VAL 1190Ca 0.87 1.40 -0.28 0.00 0.00 0.00 0.00 61.98 63.97 1wc6 s VAL 1190Cb -0.44 -4.01 0.01 0.00 0.00 0.00 0.00 36.38 31.94 1wc6 s VAL 1190CO 0.41 0.32 1.44 -0.32 0.00 0.00 0.00 175.10 176.94 1wc6 s MET 1191N 0.41 3.28 -0.01 2.72 1.75 -1.26 -0.89 119.30 125.31 1wc6 s MET 1191Ca 0.35 0.49 -0.06 0.00 -1.25 0.00 0.00 55.69 55.23 1wc6 s MET 1191Cb -0.18 -4.13 -0.04 0.00 2.84 0.00 0.00 34.83 33.31 1wc6 s MET 1191CO 0.18 -1.96 0.24 0.95 -0.65 0.00 0.00 175.02 173.78 1wc6 s THR 1192N 6.17 5.35 -0.31 10.11 -4.23 1.00 0.16 115.64 133.89 1wc6 s THR 1192Ca 0.53 0.08 -0.02 0.00 -1.18 0.00 0.00 61.69 61.11 1wc6 s THR 1192Cb -0.11 -3.55 0.10 0.00 1.34 0.00 0.00 72.50 70.29 1wc6 s THR 1192CO 0.25 0.37 0.12 0.00 -0.54 0.00 0.00 174.62 174.82 1wc6 s VAL 1194N 1.75 3.53 0.31 0.00 -7.23 -0.93 -1.50 120.40 116.33 1wc6 s VAL 1194Ca 0.10 0.81 0.02 0.00 -1.81 0.00 0.00 61.98 61.10 1wc6 s VAL 1194Cb -0.17 -3.52 -0.03 0.00 0.56 0.00 0.00 36.38 33.22 1wc6 s VAL 1194CO -0.28 -0.04 0.48 0.27 -0.31 0.00 0.00 175.10 175.22 1wc6 s ILE 1195N 3.23 5.16 0.01 -0.62 -5.25 0.19 -1.29 121.20 122.62 1wc6 s ILE 1195Ca 0.70 -0.62 -0.34 0.00 -0.99 0.00 0.00 60.65 59.40 1wc6 s ILE 1195Cb -0.34 -3.86 -0.13 0.00 2.95 0.00 0.00 42.46 41.09 1wc6 s ILE 1195CO 0.28 -0.47 1.75 -3.20 -1.79 0.00 0.00 174.94 171.51 1wc6 n ASN 1196N -1.61 3.25 0.00 4.36 2.85 1.50 -4.16 115.26 121.44 1wc6 n ASN 1196Ca -0.06 1.02 0.07 0.00 -0.11 0.00 0.00 54.58 55.49 1wc6 n ASN 1196Cb 0.56 -1.38 0.32 0.00 1.24 0.00 0.00 39.78 40.52 1wc6 n ASN 1196CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1wc6 n PRO 1197N 5.29 0.15 -0.09 1.20 -0.04 -1.26 -3.14 135.00 137.10 1wc6 n PRO 1197Ca 0.20 0.19 -0.09 0.00 -0.04 0.00 0.00 63.50 63.75 1wc6 n PRO 1197Cb 0.29 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 1wc6 n PRO 1197CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1wc6 n ASN 1198N -1.33 1.89 0.00 3.54 4.13 -1.26 -4.54 115.26 117.69 1wc6 n ASN 1198Ca 0.06 0.44 0.00 0.00 1.68 0.00 0.00 54.58 56.76 1wc6 n ASN 1198Cb 0.12 -0.80 0.00 0.00 -1.54 0.00 0.00 39.78 37.56 1wc6 n ASN 1198CO 0.00 0.00 0.00 0.80 0.28 0.00 0.00 177.26 178.34