#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wc5 s ARG 1005N 0.00 3.26 0.15 2.12 3.52 -1.26 -2.77 118.95 123.97 1wc5 s ARG 1005Ca 0.00 1.20 -0.33 0.00 -0.13 0.00 0.00 55.73 56.47 1wc5 s ARG 1005Cb 0.00 -4.20 -0.16 0.00 -1.56 0.00 0.00 34.95 29.03 1wc5 s ARG 1005CO 0.00 -1.95 1.10 -2.30 -0.81 0.00 0.00 175.30 171.34 1wc5 n PRO 1006N 8.49 0.93 -3.49 5.12 -0.02 -1.26 -4.89 135.00 139.88 1wc5 n PRO 1006Ca 0.21 0.33 -0.09 0.00 -2.02 0.00 0.00 63.50 61.93 1wc5 n PRO 1006Cb 0.48 -1.79 -0.02 0.00 -0.02 0.00 0.00 33.50 32.15 1wc5 n PRO 1006CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1wc5 s GLU 1007N -0.37 0.89 0.77 -0.52 -1.05 -0.92 -4.97 118.70 112.53 1wc5 s GLU 1007Ca 0.75 -0.31 -0.14 0.00 -0.15 0.00 0.00 54.97 55.12 1wc5 s GLU 1007Cb -0.91 0.41 0.06 0.00 -0.44 0.00 0.00 34.13 33.26 1wc5 s GLU 1007CO 0.53 -0.39 1.23 -0.35 0.95 0.00 0.00 175.26 177.23 1wc5 n PRO 1008N -0.21 0.40 -3.65 -4.83 -0.04 -1.26 -2.43 135.00 122.98 1wc5 n PRO 1008Ca -0.10 0.21 -0.04 0.00 -0.04 0.00 0.00 63.50 63.53 1wc5 n PRO 1008Cb 0.62 -2.46 -0.07 0.00 -0.04 0.00 0.00 33.50 31.55 1wc5 n PRO 1008CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1wc5 s ARG 1009N -3.94 0.16 -0.21 0.54 0.52 -1.07 -4.86 118.95 110.08 1wc5 s ARG 1009Ca 0.76 0.20 -0.28 0.00 -0.52 0.00 0.00 55.73 55.88 1wc5 s ARG 1009Cb -0.31 0.08 0.00 0.00 0.52 0.00 0.00 34.95 35.24 1wc5 s ARG 1009CO 0.48 -0.02 1.01 -1.17 0.02 0.00 0.00 175.30 175.62 1wc5 s LEU 1010N 0.18 4.12 0.29 2.53 2.96 -1.26 -1.93 118.68 125.56 1wc5 s LEU 1010Ca 0.05 1.36 0.03 0.00 -0.22 0.00 0.00 54.13 55.35 1wc5 s LEU 1010Cb -0.05 -3.49 -0.04 0.00 0.50 0.00 0.00 46.19 43.11 1wc5 s LEU 1010CO -0.13 -0.61 0.17 0.27 -1.32 0.00 0.00 176.35 174.73 1wc5 s ILE 1011N 2.96 0.22 -0.12 6.68 -4.36 -1.00 -4.87 121.20 120.71 1wc5 s ILE 1011Ca 0.43 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.84 1wc5 s ILE 1011Cb -0.16 -2.51 0.02 0.00 1.25 0.00 0.00 42.46 41.06 1wc5 s ILE 1011CO 0.08 0.00 -0.15 -0.89 0.24 0.00 0.00 174.94 174.22 1wc5 s THR 1012N -3.69 1.52 -0.13 8.37 2.01 -0.70 -0.44 115.64 122.58 1wc5 s THR 1012Ca 0.37 -0.64 -0.04 0.00 0.31 0.00 0.00 61.69 61.68 1wc5 s THR 1012Cb 0.05 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 71.13 1wc5 s THR 1012CO 0.18 0.45 0.02 -0.63 -0.69 0.00 0.00 174.62 173.95 1wc5 s ILE 1013N 1.07 4.48 -0.09 1.82 1.09 0.84 -1.06 121.20 129.35 1wc5 s ILE 1013Ca -0.05 -0.17 0.04 0.00 -1.10 0.00 0.00 60.65 59.38 1wc5 s ILE 1013Cb -0.15 -2.94 -0.00 0.00 -1.06 0.00 0.00 42.46 38.31 1wc5 s ILE 1013CO -0.03 0.55 -0.23 -0.22 -0.10 0.00 0.00 174.94 174.90 1wc5 s LEU 1014N -0.31 2.06 -0.06 2.97 0.20 0.05 -1.88 118.68 121.71 1wc5 s LEU 1014Ca 0.07 -0.54 0.04 0.00 0.69 0.00 0.00 54.13 54.39 1wc5 s LEU 1014Cb -0.12 -1.37 0.00 0.00 -0.43 0.00 0.00 46.19 44.27 1wc5 s LEU 1014CO 0.02 0.16 -0.17 -0.36 -0.29 0.00 0.00 176.35 175.71 1wc5 s PHE 1015N 0.30 1.78 -0.05 5.38 0.40 -0.09 -0.42 117.98 125.28 1wc5 s PHE 1015Ca -0.17 -0.61 0.03 0.00 -0.60 0.00 0.00 56.93 55.58 1wc5 s PHE 1015Cb -0.17 -1.23 0.01 0.00 0.51 0.00 0.00 43.02 42.14 1wc5 s PHE 1015CO 0.08 -0.25 -0.13 -1.54 0.70 0.00 0.00 175.22 174.08 1wc5 s SER 1016N 0.32 1.76 -0.02 1.36 1.04 -0.40 -0.20 113.70 117.57 1wc5 s SER 1016Ca -0.11 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.04 1wc5 s SER 1016Cb -0.14 -0.68 0.02 0.00 0.10 0.00 0.00 66.02 65.32 1wc5 s SER 1016CO 0.04 0.07 -0.00 -0.62 0.98 0.00 0.00 173.24 173.71 1wc5 s ASP 1017N 0.42 0.32 0.23 7.02 2.15 -0.51 0.40 116.67 126.69 1wc5 s ASP 1017Ca -0.10 -0.02 -0.30 0.00 0.43 0.00 0.00 52.55 52.56 1wc5 s ASP 1017Cb -0.13 -0.15 -0.09 0.00 -0.30 0.00 0.00 42.92 42.25 1wc5 s ASP 1017CO 0.03 -0.07 1.22 -0.63 -0.17 0.00 0.00 175.17 175.55 1wc5 s ILE 1018N 0.74 3.34 0.22 4.11 1.01 -1.22 -0.88 121.20 128.52 1wc5 s ILE 1018Ca -0.07 1.19 -0.30 0.00 0.00 0.00 0.00 60.65 61.47 1wc5 s ILE 1018Cb -0.10 -3.76 -0.08 0.00 0.01 0.00 0.00 42.46 38.53 1wc5 s ILE 1018CO -0.01 0.22 1.03 0.54 0.00 0.00 0.00 174.94 176.72 1wc5 s VAL 1019N -0.38 3.89 -1.44 2.92 0.11 0.12 -4.10 120.40 121.52 1wc5 s VAL 1019Ca 0.52 1.79 -0.08 0.00 -2.93 0.00 0.00 61.98 61.27 1wc5 s VAL 1019Cb -0.34 -4.14 0.01 0.00 -1.53 0.00 0.00 36.38 30.38 1wc5 s VAL 1019CO 0.40 0.38 0.25 0.61 -3.33 0.00 0.00 175.10 173.41 1wc5 n GLY 1020N 1.63 -0.32 0.18 6.54 0.00 -1.26 -4.71 105.19 107.25 1wc5 n GLY 1020Ca -0.00 0.22 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 1wc5 n GLY 1020CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1wc5 h PHE 1021N -1.98 0.76 -0.43 1.61 3.57 -1.96 -3.10 116.94 115.40 1wc5 h PHE 1021Ca -0.67 -0.30 0.05 0.00 3.53 0.00 0.00 57.97 60.58 1wc5 h PHE 1021Cb 1.40 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.98 1wc5 h PHE 1021CO 0.47 1.07 0.29 0.00 -2.23 0.00 0.00 178.31 177.92 1wc5 h THR 1022N 0.23 0.99 -0.24 4.41 1.03 -1.93 -1.90 112.91 115.50 1wc5 h THR 1022Ca -0.01 -0.13 -0.02 0.00 -0.01 0.00 0.00 66.41 66.24 1wc5 h THR 1022Cb 1.08 0.57 -0.01 0.00 -1.07 0.00 0.00 68.15 68.71 1wc5 h THR 1022CO 0.10 0.07 0.09 0.03 -0.01 0.00 0.00 175.52 175.80 1wc5 h ARG 1023N 0.39 0.36 0.00 0.00 2.47 -1.92 -3.12 114.38 112.56 1wc5 h ARG 1023Ca 0.18 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 1wc5 h ARG 1023Cb 0.25 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1wc5 h ARG 1023CO -0.04 0.42 -0.16 0.00 0.56 0.00 0.00 179.97 180.74 1wc5 n MET 1024N -4.78 0.25 0.12 0.04 0.00 -1.01 -3.40 117.12 108.34 1wc5 n MET 1024Ca -0.03 0.17 0.10 0.00 0.00 0.00 0.00 57.70 57.94 1wc5 n MET 1024Cb 0.14 -1.75 0.46 0.00 0.00 0.00 0.00 33.22 32.07 1wc5 n MET 1024CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1wc5 n SER 1025N -2.17 0.51 0.04 3.17 7.64 -0.75 -1.23 113.62 120.83 1wc5 n SER 1025Ca 0.05 0.66 0.12 0.00 1.01 0.00 0.00 58.87 60.72 1wc5 n SER 1025Cb 0.43 -0.76 0.23 0.00 -1.01 0.00 0.00 64.21 63.10 1wc5 n SER 1025CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1wc5 n ASN 1026N -2.11 0.59 -0.22 6.43 3.02 -1.22 -2.96 115.26 118.79 1wc5 n ASN 1026Ca 0.01 0.03 0.04 0.00 -0.03 0.00 0.00 54.58 54.63 1wc5 n ASN 1026Cb 0.15 0.13 0.01 0.00 -0.61 0.00 0.00 39.78 39.46 1wc5 n ASN 1026CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wc5 n ALA 1027N -1.70 2.59 -0.10 5.41 0.00 -0.37 -4.58 120.51 121.77 1wc5 n ALA 1027Ca 0.04 -0.46 -0.11 0.00 0.00 0.00 0.00 53.44 52.92 1wc5 n ALA 1027Cb 0.40 -0.25 -0.14 0.00 0.00 0.00 0.00 19.45 19.45 1wc5 n ALA 1027CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wc5 n LEU 1028N 0.01 0.47 -1.03 0.00 4.77 -0.60 -5.05 117.00 115.56 1wc5 n LEU 1028Ca 0.04 -0.02 0.05 0.00 -0.03 0.00 0.00 56.01 56.05 1wc5 n LEU 1028Cb 0.17 0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1wc5 n LEU 1028CO 0.07 0.54 -0.38 0.00 -1.33 0.00 0.00 177.39 176.29 1wc5 n GLN 1029N -2.78 -2.56 -0.33 3.23 1.13 -1.16 -1.79 117.38 113.13 1wc5 n GLN 1029Ca -0.33 2.03 -0.07 0.00 -1.94 0.00 0.00 57.00 56.70 1wc5 n GLN 1029Cb 1.09 -2.69 -0.05 0.00 0.11 0.00 0.00 30.24 28.70 1wc5 n GLN 1029CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1wc5 n SER 1030N -2.86 -0.77 0.10 1.08 3.41 -1.26 0.15 113.62 113.46 1wc5 n SER 1030Ca -0.03 1.41 0.04 0.00 -0.26 0.00 0.00 58.87 60.03 1wc5 n SER 1030Cb 0.39 -0.22 0.45 0.00 -0.26 0.00 0.00 64.21 64.57 1wc5 n SER 1030CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 1wc5 h GLN 1031N 0.00 0.32 0.00 4.33 -0.00 -2.00 -1.81 115.11 115.95 1wc5 h GLN 1031Ca 0.16 -0.04 -0.03 0.00 -0.00 0.00 0.00 58.65 58.74 1wc5 h GLN 1031Cb 0.36 -0.06 -0.00 0.00 -0.00 0.00 0.00 27.48 27.78 1wc5 h GLN 1031CO -0.76 0.30 -0.14 0.78 -0.00 0.00 0.00 178.83 179.01 1wc5 h GLY 1032N 0.52 0.00 0.59 0.06 0.00 0.22 -2.75 103.07 101.71 1wc5 h GLY 1032Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.13 1wc5 h GLY 1032CO -0.00 0.00 -1.45 -2.08 0.00 0.00 0.00 176.54 173.01 1wc5 h VAL 1033N 0.00 1.01 -0.75 4.60 2.07 -0.26 -3.27 116.25 119.66 1wc5 h VAL 1033Ca -0.00 -2.41 -0.04 0.00 0.82 0.00 0.00 66.70 65.07 1wc5 h VAL 1033Cb 0.86 2.71 -0.03 0.00 -1.52 0.00 0.00 31.29 33.31 1wc5 h VAL 1033CO 0.02 0.72 0.31 0.00 0.02 0.00 0.00 177.57 178.64 1wc5 h ALA 1034N -0.03 1.14 0.70 1.67 0.00 -1.41 0.17 119.26 121.50 1wc5 h ALA 1034Ca -0.31 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1wc5 h ALA 1034Cb 1.79 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.29 1wc5 h ALA 1034CO 0.07 0.62 -0.33 0.93 0.00 0.00 0.00 179.25 180.54 1wc5 h GLU 1035N 1.08 -0.90 -0.17 0.00 4.39 -1.64 -2.22 114.58 115.11 1wc5 h GLU 1035Ca 0.25 0.06 -0.02 0.00 0.34 0.00 0.00 59.36 60.00 1wc5 h GLU 1035Cb 0.18 0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1wc5 h GLU 1035CO -0.02 -0.59 0.03 1.25 -1.16 0.00 0.00 179.01 178.52 1wc5 h LEU 1036N -0.97 0.26 -0.37 1.33 6.46 -1.58 -2.32 115.31 118.12 1wc5 h LEU 1036Ca -0.10 -0.25 0.00 0.00 -0.12 0.00 0.00 57.88 57.42 1wc5 h LEU 1036Cb 0.73 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.57 1wc5 h LEU 1036CO 0.16 0.45 0.24 0.25 -0.62 0.00 0.00 178.44 178.92 1wc5 h LEU 1037N 0.07 0.43 -1.05 2.25 7.12 -0.74 0.91 115.31 124.30 1wc5 h LEU 1037Ca 0.05 -0.02 -0.10 0.00 0.13 0.00 0.00 57.88 57.95 1wc5 h LEU 1037Cb 0.30 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 40.30 1wc5 h LEU 1037CO 0.00 0.32 -0.40 0.78 -0.13 0.00 0.00 178.44 179.01 1wc5 h ASN 1038N 0.50 0.14 -0.29 1.25 2.35 -1.42 -0.46 115.58 117.65 1wc5 h ASN 1038Ca 0.14 -0.06 -0.17 0.00 -0.55 0.00 0.00 56.30 55.66 1wc5 h ASN 1038Cb -0.05 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.28 1wc5 h ASN 1038CO -0.03 0.53 -0.47 -0.33 -1.65 0.00 0.00 177.43 175.49 1wc5 h GLU 1039N 0.12 0.83 -0.19 0.81 5.08 -1.04 -2.36 114.58 117.83 1wc5 h GLU 1039Ca 0.01 -0.50 0.01 0.00 -1.00 0.00 0.00 59.36 57.88 1wc5 h GLU 1039Cb 0.77 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 1wc5 h GLU 1039CO 0.06 1.14 0.10 -0.92 -1.00 0.00 0.00 179.01 178.39 1wc5 h TYR 1040N 0.60 0.19 -0.61 4.33 3.20 -0.50 -2.79 116.97 121.39 1wc5 h TYR 1040Ca 0.02 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1wc5 h TYR 1040Cb 1.07 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.25 1wc5 h TYR 1040CO 0.07 0.11 0.33 -0.07 -1.64 0.00 0.00 178.16 176.96 1wc5 h LEU 1041N 0.21 0.77 0.06 2.82 3.38 -1.06 -1.53 115.31 119.97 1wc5 h LEU 1041Ca 0.08 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1wc5 h LEU 1041Cb 0.01 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1wc5 h LEU 1041CO -0.05 0.65 -0.20 1.23 0.09 0.00 0.00 178.44 180.16 1wc5 h GLY 1042N 0.83 -0.33 1.07 0.83 0.00 -1.26 0.11 103.07 104.33 1wc5 h GLY 1042Ca 0.22 0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.70 1wc5 h GLY 1042CO -0.03 -0.18 0.11 0.83 0.00 0.00 0.00 176.54 177.26 1wc5 h GLU 1043N -0.36 1.12 -0.30 4.80 4.39 -1.43 -1.72 114.58 121.07 1wc5 h GLU 1043Ca 0.04 -0.30 -0.07 0.00 0.34 0.00 0.00 59.36 59.37 1wc5 h GLU 1043Cb 0.40 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1wc5 h GLU 1043CO -0.15 1.02 -0.08 0.52 -1.16 0.00 0.00 179.01 179.16 1wc5 h MET 1044N 1.04 0.59 0.00 2.33 2.86 -1.05 -2.62 114.93 118.08 1wc5 h MET 1044Ca 0.20 -0.23 -0.09 0.00 -2.06 0.00 0.00 59.70 57.53 1wc5 h MET 1044Cb 0.44 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1wc5 h MET 1044CO 0.01 0.79 -0.42 1.79 1.06 0.00 0.00 176.91 180.14 1wc5 h THR 1045N 0.36 1.17 -0.67 2.22 1.35 -0.74 -1.99 112.91 114.61 1wc5 h THR 1045Ca 0.08 -1.52 -0.03 0.00 -0.55 0.00 0.00 66.41 64.39 1wc5 h THR 1045Cb 0.57 1.85 -0.03 0.00 -1.73 0.00 0.00 68.15 68.81 1wc5 h THR 1045CO 0.03 0.42 0.31 -0.09 -0.25 0.00 0.00 175.52 175.94 1wc5 h ARG 1046N 0.00 0.96 -0.69 4.72 1.12 -1.14 -1.05 114.38 118.29 1wc5 h ARG 1046Ca -0.00 -0.13 -0.05 0.00 -1.11 0.00 0.00 59.98 58.68 1wc5 h ARG 1046Cb 0.82 -0.18 -0.03 0.00 -0.01 0.00 0.00 29.97 30.57 1wc5 h ARG 1046CO 0.06 0.75 0.23 0.00 -3.11 0.00 0.00 179.97 177.89 1wc5 h ALA 1047N 1.39 0.90 -0.06 2.80 0.00 -0.99 -0.71 119.26 122.59 1wc5 h ALA 1047Ca 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1wc5 h ALA 1047Cb 0.12 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1wc5 h ALA 1047CO -0.03 0.57 0.01 0.28 0.00 0.00 0.00 179.25 180.08 1wc5 h VAL 1048N 1.00 1.20 -0.55 0.00 2.07 -1.02 -3.17 116.25 115.79 1wc5 h VAL 1048Ca 0.22 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 1wc5 h VAL 1048Cb 0.28 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1wc5 h VAL 1048CO -0.01 0.17 0.24 -0.26 0.02 0.00 0.00 177.57 177.74 1wc5 h PHE 1049N -0.12 0.77 -0.06 1.57 0.05 -1.07 0.15 116.94 118.24 1wc5 h PHE 1049Ca 0.02 -0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.78 1wc5 h PHE 1049Cb 0.26 -0.24 0.00 0.00 2.00 0.00 0.00 35.95 37.97 1wc5 h PHE 1049CO 0.01 0.58 0.00 0.39 -0.18 0.00 0.00 178.31 179.11 1wc5 n GLU 1050N -4.35 1.21 -0.95 1.51 1.02 -0.28 -2.68 120.64 116.11 1wc5 n GLU 1050Ca 0.05 -0.24 0.03 0.00 -0.02 0.00 0.00 57.16 56.98 1wc5 n GLU 1050Cb 0.14 -1.24 0.03 0.00 -0.02 0.00 0.00 31.44 30.35 1wc5 n GLU 1050CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1wc5 n ASN 1051N -0.18 0.72 -1.39 1.62 3.02 -0.74 -4.98 115.26 113.32 1wc5 n ASN 1051Ca 0.02 -2.19 -0.17 0.00 -0.03 0.00 0.00 54.58 52.21 1wc5 n ASN 1051Cb 0.16 -0.28 -0.07 0.00 -0.61 0.00 0.00 39.78 38.97 1wc5 n ASN 1051CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wc5 n GLN 1052N 0.08 -1.48 -2.48 3.52 1.13 -1.09 -4.75 117.38 112.31 1wc5 n GLN 1052Ca 0.05 1.06 -0.30 0.00 -1.94 0.00 0.00 57.00 55.87 1wc5 n GLN 1052Cb 0.91 -5.41 -0.01 0.00 0.11 0.00 0.00 30.24 25.84 1wc5 n GLN 1052CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1wc5 s GLY 1053N -2.53 1.73 -0.19 1.08 0.00 0.45 -4.82 107.32 103.03 1wc5 s GLY 1053Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 44.72 44.46 1wc5 s GLY 1053CO 0.00 -0.03 -0.07 -1.59 0.00 0.00 0.00 173.10 171.41 1wc5 s THR 1054N -2.73 3.21 -0.46 0.90 2.01 -0.35 -4.10 115.64 114.12 1wc5 s THR 1054Ca 0.52 -0.56 -0.28 0.00 0.31 0.00 0.00 61.69 61.67 1wc5 s THR 1054Cb -0.10 -2.43 0.00 0.00 0.01 0.00 0.00 72.50 69.98 1wc5 s THR 1054CO 0.42 0.46 1.53 -0.69 -0.69 0.00 0.00 174.62 175.65 1wc5 s VAL 1055N 1.17 3.73 -0.00 3.82 1.01 -1.26 -1.23 120.40 127.64 1wc5 s VAL 1055Ca 0.02 0.70 -0.23 0.00 0.00 0.00 0.00 61.98 62.46 1wc5 s VAL 1055Cb -0.14 -4.13 -0.14 0.00 0.00 0.00 0.00 36.38 31.97 1wc5 s VAL 1055CO -0.02 -0.82 1.02 -0.78 0.00 0.00 0.00 175.10 174.50 1wc5 h ASP 1056N 11.64 -0.56 -5.49 3.32 1.82 -1.04 -3.49 116.42 122.62 1wc5 h ASP 1056Ca -0.28 -0.06 0.21 0.00 -0.39 0.00 0.00 57.03 56.51 1wc5 h ASP 1056Cb 1.12 0.14 -0.06 0.00 0.68 0.00 0.00 39.33 41.21 1wc5 h ASP 1056CO 1.11 -0.16 0.63 -1.59 -1.61 0.00 0.00 179.24 177.63 1wc5 s LYS 1057N -4.27 1.05 -0.16 0.28 -2.85 -1.20 -4.98 119.74 107.61 1wc5 s LYS 1057Ca -0.13 -0.64 -0.01 0.00 -1.00 0.00 0.00 55.97 54.19 1wc5 s LYS 1057Cb 0.01 0.32 -0.01 0.00 -2.06 0.00 0.00 37.83 36.09 1wc5 s LYS 1057CO 0.42 -0.49 -0.13 -0.06 0.10 0.00 0.00 175.35 175.19 1wc5 s PHE 1058N -2.47 2.83 -0.85 1.78 0.40 -1.26 -2.11 117.98 116.29 1wc5 s PHE 1058Ca 0.19 -0.88 0.00 0.00 -0.60 0.00 0.00 56.93 55.64 1wc5 s PHE 1058Cb -0.01 -1.91 0.24 0.00 0.51 0.00 0.00 43.02 41.85 1wc5 s PHE 1058CO 0.03 -0.39 0.86 0.28 0.70 0.00 0.00 175.22 176.69 1wc5 n VAL 1059N 3.99 3.11 0.00 -0.44 0.31 0.40 -4.95 118.33 120.75 1wc5 n VAL 1059Ca -0.19 -5.25 0.00 0.00 -0.01 0.00 0.00 64.34 58.90 1wc5 n VAL 1059Cb 0.52 -2.25 0.00 0.00 -0.91 0.00 0.00 33.84 31.19 1wc5 n VAL 1059CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wc5 n GLY 1060N 1.79 1.46 0.22 2.92 0.00 -1.26 -2.40 105.19 107.92 1wc5 n GLY 1060Ca 0.24 -0.53 0.08 0.00 0.00 0.00 0.00 46.02 45.82 1wc5 n GLY 1060CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wc5 n ASP 1061N 7.76 0.66 -4.83 1.61 5.75 -1.26 -4.85 116.55 121.38 1wc5 n ASP 1061Ca 0.00 -1.61 -0.32 0.00 -0.01 0.00 0.00 54.79 52.85 1wc5 n ASP 1061Cb 0.00 -0.05 -0.06 0.00 -1.03 0.00 0.00 41.12 39.98 1wc5 n ASP 1061CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wc5 s ALA 1062N -1.90 3.74 -0.04 2.12 0.00 -1.01 -3.40 121.76 121.27 1wc5 s ALA 1062Ca 0.26 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.38 1wc5 s ALA 1062Cb 0.13 -1.64 -0.02 0.00 0.00 0.00 0.00 23.12 21.58 1wc5 s ALA 1062CO 0.20 0.75 -0.18 0.42 0.00 0.00 0.00 175.76 176.95 1wc5 s ILE 1063N -1.35 2.73 -0.19 0.00 1.01 0.16 -0.45 121.20 123.11 1wc5 s ILE 1063Ca 0.29 -0.85 0.01 0.00 0.00 0.00 0.00 60.65 60.10 1wc5 s ILE 1063Cb -0.12 -2.04 0.03 0.00 0.01 0.00 0.00 42.46 40.34 1wc5 s ILE 1063CO 0.21 0.59 -0.14 -0.32 0.00 0.00 0.00 174.94 175.27 1wc5 s MET 1064N -0.65 2.43 0.04 2.79 1.75 -0.90 -1.27 119.30 123.49 1wc5 s MET 1064Ca 0.10 -0.83 0.09 0.00 -1.25 0.00 0.00 55.69 53.80 1wc5 s MET 1064Cb -0.11 -2.45 -0.03 0.00 2.84 0.00 0.00 34.83 35.09 1wc5 s MET 1064CO 0.00 -0.33 -0.26 0.00 -0.65 0.00 0.00 175.02 173.78 1wc5 s ALA 1065N 1.35 2.22 -0.04 4.11 0.00 0.44 -0.34 121.76 129.50 1wc5 s ALA 1065Ca 0.01 -1.24 0.06 0.00 0.00 0.00 0.00 51.96 50.79 1wc5 s ALA 1065Cb -0.15 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 1wc5 s ALA 1065CO -0.10 0.53 -0.20 -0.51 0.00 0.00 0.00 175.76 175.48 1wc5 s LEU 1066N -1.15 2.40 -0.15 0.00 1.43 -0.36 -0.77 118.68 120.08 1wc5 s LEU 1066Ca 0.11 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1wc5 s LEU 1066Cb -0.10 -1.45 0.02 0.00 0.03 0.00 0.00 46.19 44.69 1wc5 s LEU 1066CO 0.02 0.33 -0.17 -0.31 0.23 0.00 0.00 176.35 176.45 1wc5 s TYR 1067N -0.67 2.35 0.00 0.29 1.51 -0.22 -1.22 117.35 119.39 1wc5 s TYR 1067Ca 0.11 -1.29 0.00 0.00 -1.01 0.00 0.00 57.07 54.88 1wc5 s TYR 1067Cb -0.10 -1.67 0.00 0.00 -0.11 0.00 0.00 41.96 40.07 1wc5 s TYR 1067CO -0.00 -0.66 0.00 0.41 -1.11 0.00 0.00 175.55 174.19 1wc5 n GLY 1068N 4.54 1.21 3.64 0.71 0.00 -1.26 -1.72 105.19 112.31 1wc5 n GLY 1068Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1wc5 n GLY 1068CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wc5 s ALA 1069N -2.00 -1.92 0.23 4.61 0.00 -1.26 -4.46 121.76 116.97 1wc5 s ALA 1069Ca 0.00 1.96 -0.00 0.00 0.00 0.00 0.00 51.96 53.92 1wc5 s ALA 1069Cb 0.00 -1.36 0.26 0.00 0.00 0.00 0.00 23.12 22.01 1wc5 s ALA 1069CO 0.00 -0.28 1.62 -1.00 0.00 0.00 0.00 175.76 176.10 1wc5 h PRO 1070N 4.66 0.53 -6.94 0.00 0.13 -1.98 -3.42 132.00 124.98 1wc5 h PRO 1070Ca -0.29 -0.26 -0.51 0.00 -0.87 0.00 0.00 66.00 64.08 1wc5 h PRO 1070Cb 1.17 -0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.35 1wc5 h PRO 1070CO 0.09 0.83 0.51 -1.21 -0.23 0.00 0.00 178.00 178.00 1wc5 s GLU 1071N -4.27 4.08 0.63 0.86 0.41 -1.26 -4.99 118.70 114.16 1wc5 s GLU 1071Ca -0.07 1.86 -0.18 0.00 -0.41 0.00 0.00 54.97 56.17 1wc5 s GLU 1071Cb 0.13 -2.71 -0.02 0.00 -1.78 0.00 0.00 34.13 29.75 1wc5 s GLU 1071CO 0.82 -0.30 1.23 -2.00 -0.49 0.00 0.00 175.26 174.52 1wc5 s GLU 1072N -2.25 2.72 -0.20 1.61 2.56 -1.26 -4.03 118.70 117.85 1wc5 s GLU 1072Ca 0.56 1.89 -0.27 0.00 0.00 0.00 0.00 54.97 57.15 1wc5 s GLU 1072Cb -0.31 -1.89 0.08 0.00 2.00 0.00 0.00 34.13 34.00 1wc5 s GLU 1072CO 0.39 -1.42 0.74 1.41 -0.56 0.00 0.00 175.26 175.83 1wc5 s MET 1073N -3.44 0.88 0.65 4.30 -2.45 -1.26 -4.85 119.30 113.12 1wc5 s MET 1073Ca 0.79 0.70 -0.14 0.00 -1.25 0.00 0.00 55.69 55.79 1wc5 s MET 1073Cb -0.32 0.42 -0.01 0.00 1.25 0.00 0.00 34.83 36.17 1wc5 s MET 1073CO 0.37 -0.17 1.08 -1.54 1.05 0.00 0.00 175.02 175.80 1wc5 s SER 1074N -0.18 5.39 0.49 1.11 1.04 -1.26 -4.82 113.70 115.46 1wc5 s SER 1074Ca -0.03 1.84 0.17 0.00 0.48 0.00 0.00 55.95 58.40 1wc5 s SER 1074Cb -0.03 -2.53 1.19 0.00 0.10 0.00 0.00 66.02 64.74 1wc5 s SER 1074CO 0.03 -1.43 2.05 -0.65 0.98 0.00 0.00 173.24 174.22 1wc5 h PRO 1075N -0.02 0.18 0.18 4.02 0.11 -1.99 0.82 132.00 135.29 1wc5 h PRO 1075Ca -0.46 -0.01 -0.32 0.00 0.11 0.00 0.00 66.00 65.32 1wc5 h PRO 1075Cb 1.23 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.31 1wc5 h PRO 1075CO 0.56 0.12 -1.47 0.66 -0.21 0.00 0.00 178.00 177.65 1wc5 h SER 1076N 0.18 0.59 0.00 -2.05 4.64 -1.98 -3.17 113.55 111.77 1wc5 h SER 1076Ca 0.16 -0.70 -0.12 0.00 -0.47 0.00 0.00 61.79 60.66 1wc5 h SER 1076Cb 0.40 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1wc5 h SER 1076CO -0.03 1.56 -0.35 -0.33 -0.87 0.00 0.00 176.83 176.81 1wc5 h GLU 1077N 0.10 0.48 0.28 4.77 4.39 -1.79 -1.75 114.58 121.07 1wc5 h GLU 1077Ca -0.23 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 1wc5 h GLU 1077Cb 2.07 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 30.71 1wc5 h GLU 1077CO 0.21 0.77 -0.17 1.96 -1.16 0.00 0.00 179.01 180.62 1wc5 h GLN 1078N 0.41 -0.42 0.11 2.33 4.20 -0.93 0.17 115.11 120.97 1wc5 h GLN 1078Ca 0.04 0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.80 1wc5 h GLN 1078Cb 0.81 0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.66 1wc5 h GLN 1078CO 0.07 -0.28 -0.21 0.28 -0.67 0.00 0.00 178.83 178.01 1wc5 h VAL 1079N -0.44 0.52 -0.47 -0.54 2.07 -1.50 -1.26 116.25 114.63 1wc5 h VAL 1079Ca -0.03 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.54 1wc5 h VAL 1079Cb 0.36 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.60 1wc5 h VAL 1079CO 0.03 0.00 0.19 -0.09 0.02 0.00 0.00 177.57 177.72 1wc5 h ARG 1080N -0.40 0.38 -0.27 1.57 2.43 -1.17 -0.11 114.38 116.80 1wc5 h ARG 1080Ca 0.03 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1wc5 h ARG 1080Cb 0.42 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1wc5 h ARG 1080CO -0.12 0.25 -0.08 0.00 -1.51 0.00 0.00 179.97 178.51 1wc5 h ARG 1081N 0.39 0.54 -0.94 0.20 2.47 -0.87 -0.66 114.38 115.51 1wc5 h ARG 1081Ca 0.22 -0.21 0.02 0.00 -1.26 0.00 0.00 59.98 58.74 1wc5 h ARG 1081Cb 0.18 -0.03 -0.05 0.00 -1.65 0.00 0.00 29.97 28.43 1wc5 h ARG 1081CO -0.19 0.75 0.62 0.00 0.56 0.00 0.00 179.97 181.71 1wc5 h ALA 1082N 0.77 1.20 -0.21 0.04 0.00 -0.99 0.18 119.26 120.24 1wc5 h ALA 1082Ca 0.07 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1wc5 h ALA 1082Cb 0.56 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1wc5 h ALA 1082CO 0.03 0.56 -0.36 0.82 0.00 0.00 0.00 179.25 180.30 1wc5 h ILE 1083N 1.25 1.33 -0.81 0.00 2.04 -0.94 -2.37 117.51 118.01 1wc5 h ILE 1083Ca 0.35 -1.57 0.03 0.00 1.00 0.00 0.00 64.86 64.67 1wc5 h ILE 1083Cb -0.11 1.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 1wc5 h ILE 1083CO -0.09 0.49 0.53 0.00 0.00 0.00 0.00 178.15 179.08 1wc5 h ALA 1084N 0.61 1.51 -0.33 1.87 0.00 -0.71 -1.47 119.26 120.74 1wc5 h ALA 1084Ca 0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1wc5 h ALA 1084Cb 0.95 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1wc5 h ALA 1084CO 0.08 0.42 0.09 1.15 0.00 0.00 0.00 179.25 180.99 1wc5 h THR 1085N 1.00 1.21 -0.37 0.00 2.02 -0.53 -1.66 112.91 114.58 1wc5 h THR 1085Ca 0.32 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 1wc5 h THR 1085Cb 0.03 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 1wc5 h THR 1085CO -0.09 0.24 0.13 0.00 0.37 0.00 0.00 175.52 176.16 1wc5 h ALA 1086N 0.93 1.53 0.00 6.16 0.00 -0.81 -1.35 119.26 125.72 1wc5 h ALA 1086Ca 0.10 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1wc5 h ALA 1086Cb 0.27 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1wc5 h ALA 1086CO -0.00 0.36 -0.75 0.00 0.00 0.00 0.00 179.25 178.86 1wc5 h ARG 1087N 0.53 0.00 -0.01 0.00 3.08 -1.04 -2.97 114.38 113.98 1wc5 h ARG 1087Ca 0.13 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.96 1wc5 h ARG 1087Cb 0.14 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1wc5 h ARG 1087CO -0.01 0.75 -0.91 1.96 -1.07 0.00 0.00 179.97 180.70 1wc5 h GLN 1088N 0.00 0.35 -0.39 0.04 4.20 -0.83 -2.72 115.11 115.77 1wc5 h GLN 1088Ca -0.01 -0.37 0.04 0.00 0.06 0.00 0.00 58.65 58.37 1wc5 h GLN 1088Cb 1.39 0.10 -0.04 0.00 0.30 0.00 0.00 27.48 29.24 1wc5 h GLN 1088CO 0.10 1.05 0.17 0.52 -0.67 0.00 0.00 178.83 180.00 1wc5 h MET 1089N 0.20 0.34 -0.86 1.46 2.86 -1.20 0.21 114.93 117.95 1wc5 h MET 1089Ca -0.07 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1wc5 h MET 1089Cb 1.53 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 33.07 1wc5 h MET 1089CO 0.15 0.23 0.50 -0.07 1.06 0.00 0.00 176.91 178.78 1wc5 h LEU 1090N 0.35 1.03 -0.87 1.22 3.38 -1.48 0.41 115.31 119.36 1wc5 h LEU 1090Ca 0.17 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 1wc5 h LEU 1090Cb 0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1wc5 h LEU 1090CO -0.14 0.80 -0.31 0.58 0.09 0.00 0.00 178.44 179.47 1wc5 h VAL 1091N 1.18 1.28 0.01 1.22 2.07 -1.01 -1.77 116.25 119.23 1wc5 h VAL 1091Ca 0.31 -1.37 -0.20 0.00 0.82 0.00 0.00 66.70 66.25 1wc5 h VAL 1091Cb -0.03 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1wc5 h VAL 1091CO -0.06 0.43 -0.92 0.00 0.02 0.00 0.00 177.57 177.05 1wc5 h ALA 1092N 1.26 0.48 -0.25 1.67 0.00 0.26 -3.16 119.26 119.53 1wc5 h ALA 1092Ca 0.05 -0.78 -0.15 0.00 0.00 0.00 0.00 54.91 54.03 1wc5 h ALA 1092Cb 0.74 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1wc5 h ALA 1092CO 0.06 1.02 -0.46 1.25 0.00 0.00 0.00 179.25 181.12 1wc5 h LEU 1093N 0.05 0.68 -1.41 0.00 5.85 -0.03 -2.25 115.31 118.20 1wc5 h LEU 1093Ca -0.04 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1wc5 h LEU 1093Cb 1.59 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.40 1wc5 h LEU 1093CO 0.13 1.03 0.30 -0.08 -0.34 0.00 0.00 178.44 179.48 1wc5 h GLU 1094N 0.51 0.69 -0.14 1.25 4.81 -1.34 0.97 114.58 121.33 1wc5 h GLU 1094Ca 0.03 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.07 1wc5 h GLU 1094Cb 0.99 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.23 1wc5 h GLU 1094CO 0.09 0.50 -0.42 -0.22 -0.73 0.00 0.00 179.01 178.24 1wc5 h LYS 1095N 0.71 0.54 -0.83 1.92 3.64 -1.48 -2.91 116.57 118.16 1wc5 h LYS 1095Ca 0.18 -0.38 -0.03 0.00 -1.27 0.00 0.00 60.65 59.16 1wc5 h LYS 1095Cb -0.01 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 1wc5 h LYS 1095CO -0.03 1.00 0.42 -0.07 -2.27 0.00 0.00 179.45 178.50 1wc5 h LEU 1096N 0.16 1.07 -1.84 5.20 3.38 -0.81 -1.69 115.31 120.78 1wc5 h LEU 1096Ca -0.01 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1wc5 h LEU 1096Cb 1.03 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1wc5 h LEU 1096CO 0.09 0.88 -0.13 0.78 0.09 0.00 0.00 178.44 180.15 1wc5 h ASN 1097N 1.18 0.00 -0.05 -0.43 2.35 -0.80 0.96 115.58 118.78 1wc5 h ASN 1097Ca 0.29 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.97 1wc5 h ASN 1097Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1wc5 h ASN 1097CO -0.04 0.13 -0.25 1.56 -1.65 0.00 0.00 177.43 177.18 1wc5 h GLN 1098N 0.00 0.26 0.27 0.81 4.20 -1.13 -2.03 115.11 117.49 1wc5 h GLN 1098Ca -0.00 -0.21 -0.01 0.00 0.06 0.00 0.00 58.65 58.49 1wc5 h GLN 1098Cb 0.26 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1wc5 h GLN 1098CO 0.02 0.86 -0.19 0.78 -0.67 0.00 0.00 178.83 179.63 1wc5 h GLY 1099N -0.27 -0.47 2.00 3.46 0.00 -0.65 -0.84 103.07 106.30 1wc5 h GLY 1099Ca -0.02 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1wc5 h GLY 1099CO 0.05 -0.19 0.00 0.79 0.00 0.00 0.00 176.54 177.19 1wc5 n TRP 1100N -5.31 0.78 -0.03 5.60 8.01 0.27 -1.86 117.44 124.89 1wc5 n TRP 1100Ca -0.09 0.38 -0.14 0.00 -1.31 0.00 0.00 57.50 56.34 1wc5 n TRP 1100Cb 0.23 -1.10 -0.11 0.00 -2.01 0.00 0.00 31.31 28.31 1wc5 n TRP 1100CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.69 177.05 1wc5 h GLN 1101N 0.00 0.08 0.18 -0.99 5.75 -0.39 -0.77 115.11 118.98 1wc5 h GLN 1101Ca 0.00 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 1wc5 h GLN 1101Cb 0.09 0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.66 1wc5 h GLN 1101CO 0.00 0.75 -0.09 0.93 -2.65 0.00 0.00 178.83 177.77 1wc5 h GLU 1102N -0.57 -0.24 0.00 1.69 4.39 -1.05 -2.79 114.58 116.02 1wc5 h GLU 1102Ca -0.01 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1wc5 h GLU 1102Cb 0.77 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 1wc5 h GLU 1102CO 0.02 0.09 0.47 0.00 -1.16 0.00 0.00 179.01 178.43 1wc5 h ARG 1103N -0.59 0.00 -0.01 2.33 3.08 -1.47 -3.44 114.38 114.27 1wc5 h ARG 1103Ca -0.03 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1wc5 h ARG 1103Cb 0.44 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 1wc5 h ARG 1103CO 0.04 0.00 -0.01 0.41 -1.07 0.00 0.00 179.97 179.35 1wc5 n GLY 1104N -1.29 0.47 0.22 0.04 0.00 -1.03 -4.91 105.19 98.69 1wc5 n GLY 1104Ca -0.01 -0.16 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 1wc5 n GLY 1104CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wc5 h LEU 1105N 0.00 0.49 0.00 0.99 3.38 -1.41 -3.47 115.31 115.29 1wc5 h LEU 1105Ca -0.01 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1wc5 h LEU 1105Cb 0.10 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1wc5 h LEU 1105CO 0.01 0.84 0.00 1.33 0.09 0.00 0.00 178.44 180.71 1wc5 n VAL 1106N -4.03 0.00 0.00 1.22 0.24 -0.94 -4.97 118.33 109.85 1wc5 n VAL 1106Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1wc5 n VAL 1106Cb 0.50 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 1wc5 n VAL 1106CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wc5 n GLY 1107N 0.00 0.00 0.84 7.63 0.00 -1.26 -4.70 105.19 107.70 1wc5 n GLY 1107Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1wc5 n GLY 1107CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wc5 n ARG 1108N 0.00 2.18 -2.68 1.61 0.63 -1.26 -4.91 116.66 112.23 1wc5 n ARG 1108Ca 0.00 -1.41 -0.02 0.00 -0.92 0.00 0.00 57.85 55.50 1wc5 n ARG 1108Cb 0.00 -1.46 -0.02 0.00 0.45 0.00 0.00 32.46 31.43 1wc5 n ARG 1108CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1wc5 n VAL 1111N 0.51 -6.51 -2.24 5.15 0.31 -1.26 -5.18 118.33 109.11 1wc5 n VAL 1111Ca 0.13 1.36 -0.34 0.00 -0.01 0.00 0.00 64.34 65.48 1wc5 n VAL 1111Cb 0.43 -4.20 -0.00 0.00 -0.91 0.00 0.00 33.84 29.16 1wc5 n VAL 1111CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1wc5 s PRO 1112N -0.30 3.44 0.48 5.55 0.04 -1.26 -4.75 135.00 138.20 1wc5 s PRO 1112Ca -0.10 1.36 -0.22 0.00 0.04 0.00 0.00 61.00 62.08 1wc5 s PRO 1112Cb 0.01 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 1wc5 s PRO 1112CO 0.27 -0.73 0.96 -0.35 0.04 0.00 0.00 177.00 177.20 1wc5 n PRO 1113N -1.55 1.18 -1.74 0.56 -0.04 -1.26 -4.69 135.00 127.47 1wc5 n PRO 1113Ca 0.10 0.43 -0.42 0.00 -0.04 0.00 0.00 63.50 63.57 1wc5 n PRO 1113Cb 0.52 -2.05 -0.02 0.00 -0.04 0.00 0.00 33.50 31.91 1wc5 n PRO 1113CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1wc5 n VAL 1114N -0.88 0.72 -4.07 0.52 0.31 -1.26 -5.02 118.33 108.65 1wc5 n VAL 1114Ca 0.10 -0.18 -0.11 0.00 -0.01 0.00 0.00 64.34 64.14 1wc5 n VAL 1114Cb 0.42 -1.95 -0.11 0.00 -0.91 0.00 0.00 33.84 31.28 1wc5 n VAL 1114CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1wc5 s ARG 1115N -0.01 0.54 0.08 5.55 0.52 -1.26 -4.98 118.95 119.39 1wc5 s ARG 1115Ca 0.67 -0.86 0.01 0.00 -0.52 0.00 0.00 55.73 55.03 1wc5 s ARG 1115Cb -0.50 -0.16 -0.04 0.00 0.52 0.00 0.00 34.95 34.76 1wc5 s ARG 1115CO 0.44 0.01 -0.05 -0.59 0.02 0.00 0.00 175.30 175.12 1wc5 s PHE 1116N -1.97 0.74 0.08 -0.53 -0.12 -1.26 0.13 117.98 115.04 1wc5 s PHE 1116Ca -0.06 -0.97 0.06 0.00 -0.05 0.00 0.00 56.93 55.91 1wc5 s PHE 1116Cb -0.06 -0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 41.83 1wc5 s PHE 1116CO -0.02 -0.24 -0.07 1.03 -0.05 0.00 0.00 175.22 175.88 1wc5 s ARG 1117N -3.82 2.33 -0.02 1.99 0.52 -0.06 -0.43 118.95 119.46 1wc5 s ARG 1117Ca 0.09 -0.90 0.03 0.00 -0.52 0.00 0.00 55.73 54.43 1wc5 s ARG 1117Cb 0.06 -2.41 -0.00 0.00 0.52 0.00 0.00 34.95 33.12 1wc5 s ARG 1117CO -0.07 0.54 -0.11 0.00 0.02 0.00 0.00 175.30 175.68 1wc5 s GLY 1119N -0.08 0.61 -0.03 0.00 0.00 0.72 -1.77 107.32 106.78 1wc5 s GLY 1119Ca 0.01 -0.39 -0.00 0.00 0.00 0.00 0.00 44.72 44.34 1wc5 s GLY 1119CO 0.00 -0.11 0.02 -0.42 0.00 0.00 0.00 173.10 172.59 1wc5 s ILE 1120N 0.21 0.04 0.07 0.90 1.01 -0.64 -0.91 121.20 121.88 1wc5 s ILE 1120Ca -0.04 0.19 0.04 0.00 0.00 0.00 0.00 60.65 60.84 1wc5 s ILE 1120Cb -0.10 -0.18 -0.03 0.00 0.01 0.00 0.00 42.46 42.16 1wc5 s ILE 1120CO 0.01 0.13 -0.11 -2.28 0.00 0.00 0.00 174.94 172.69 1wc5 s HIS 1121N 1.22 1.02 -0.05 3.97 2.46 -0.79 -2.35 115.29 120.78 1wc5 s HIS 1121Ca -0.07 -0.54 0.06 0.00 0.47 0.00 0.00 55.06 54.98 1wc5 s HIS 1121Cb -0.13 -0.58 -0.01 0.00 -0.13 0.00 0.00 32.58 31.74 1wc5 s HIS 1121CO -0.03 0.00 -0.22 -1.14 -2.47 0.00 0.00 174.74 170.89 1wc5 s GLN 1122N -2.05 2.14 0.00 2.88 0.74 -1.26 -0.11 119.66 121.99 1wc5 s GLN 1122Ca -0.02 -0.77 0.00 0.00 0.05 0.00 0.00 55.36 54.62 1wc5 s GLN 1122Cb -0.08 -1.86 0.00 0.00 1.10 0.00 0.00 33.01 32.17 1wc5 s GLN 1122CO 0.01 0.34 0.00 0.41 -0.55 0.00 0.00 175.29 175.50 1wc5 n GLY 1123N 2.96 1.51 3.64 2.59 0.00 0.41 -4.81 105.19 111.49 1wc5 n GLY 1123Ca -0.17 -0.93 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 1wc5 n GLY 1123CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1wc5 n MET 1124N -0.58 0.60 -3.64 1.61 2.81 -1.26 -2.38 117.12 114.28 1wc5 n MET 1124Ca 0.00 0.26 -0.06 0.00 -1.81 0.00 0.00 57.70 56.10 1wc5 n MET 1124Cb 0.00 -2.29 -0.07 0.00 -0.71 0.00 0.00 33.22 30.16 1wc5 n MET 1124CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1wc5 s ALA 1125N -1.76 -2.10 -0.34 3.04 0.00 -0.81 -4.38 121.76 115.40 1wc5 s ALA 1125Ca 0.75 1.76 -0.29 0.00 0.00 0.00 0.00 51.96 54.18 1wc5 s ALA 1125Cb -0.35 -1.56 0.00 0.00 0.00 0.00 0.00 23.12 21.21 1wc5 s ALA 1125CO 0.48 -0.17 1.39 0.08 0.00 0.00 0.00 175.76 177.53 1wc5 s VAL 1126N -0.07 3.99 0.07 0.00 1.01 -0.80 -2.61 120.40 121.98 1wc5 s VAL 1126Ca 0.05 1.07 0.05 0.00 0.00 0.00 0.00 61.98 63.15 1wc5 s VAL 1126Cb -0.04 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1wc5 s VAL 1126CO -0.10 -0.58 -0.04 -0.69 0.00 0.00 0.00 175.10 173.69 1wc5 s VAL 1127N 4.94 3.79 -5.00 2.92 1.01 -1.02 -0.90 120.40 126.15 1wc5 s VAL 1127Ca 0.60 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1wc5 s VAL 1127Cb -0.16 -2.76 0.00 0.00 0.00 0.00 0.00 36.38 33.46 1wc5 s VAL 1127CO 0.28 0.18 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1wc5 n GLY 1128N 0.83 0.28 3.57 4.51 0.00 -0.82 -2.17 105.19 111.39 1wc5 n GLY 1128Ca -0.13 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 43.94 1wc5 n GLY 1128CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wc5 s LEU 1129N 0.00 4.24 -0.06 0.99 1.43 -1.12 -0.97 118.68 123.20 1wc5 s LEU 1129Ca 0.00 0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.17 1wc5 s LEU 1129Cb 0.00 -2.42 -0.03 0.00 0.03 0.00 0.00 46.19 43.77 1wc5 s LEU 1129CO 0.00 -0.29 -0.13 -0.36 0.23 0.00 0.00 176.35 175.80 1wc5 s PHE 1130N 2.11 2.74 -5.00 0.29 0.40 -0.54 -4.77 117.98 113.21 1wc5 s PHE 1130Ca 0.14 -0.18 0.00 0.00 -0.60 0.00 0.00 56.93 56.30 1wc5 s PHE 1130Cb -0.16 -1.66 0.00 0.00 0.51 0.00 0.00 43.02 41.71 1wc5 s PHE 1130CO 0.11 0.17 0.00 0.41 0.70 0.00 0.00 175.22 176.61 1wc5 n GLY 1131N 2.40 0.63 3.33 4.36 0.00 -1.26 -1.46 105.19 113.18 1wc5 n GLY 1131Ca -0.17 -1.57 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 1wc5 n GLY 1131CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wc5 n SER 1132N 0.00 2.47 0.18 1.61 7.64 0.25 -4.91 113.62 120.87 1wc5 n SER 1132Ca 0.00 -2.62 0.06 0.00 1.01 0.00 0.00 58.87 57.32 1wc5 n SER 1132Cb 0.00 -0.06 0.24 0.00 -1.01 0.00 0.00 64.21 63.37 1wc5 n SER 1132CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1wc5 h GLN 1133N 0.00 0.00 0.08 1.43 4.20 -2.00 -3.23 115.11 115.59 1wc5 h GLN 1133Ca -0.30 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.25 1wc5 h GLN 1133Cb 1.11 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.89 1wc5 h GLN 1133CO 0.46 0.35 -0.78 0.93 -0.67 0.00 0.00 178.83 179.13 1wc5 h GLU 1134N 0.00 0.17 -3.47 1.46 3.07 -2.04 -3.46 114.58 110.32 1wc5 h GLU 1134Ca -0.00 -0.30 -0.36 0.00 -0.50 0.00 0.00 59.36 58.20 1wc5 h GLU 1134Cb 1.06 0.11 -0.37 0.00 -0.84 0.00 0.00 28.75 28.71 1wc5 h GLU 1134CO 0.05 1.14 -0.74 0.50 -1.40 0.00 0.00 179.01 178.56 1wc5 s ARG 1135N -2.38 0.08 -0.15 2.33 6.06 -1.22 -5.13 118.95 118.54 1wc5 s ARG 1135Ca -0.18 0.25 -0.23 0.00 -2.50 0.00 0.00 55.73 53.07 1wc5 s ARG 1135Cb 0.01 -0.51 0.06 0.00 0.06 0.00 0.00 34.95 34.57 1wc5 s ARG 1135CO 0.75 -0.26 0.59 -1.54 -2.50 0.00 0.00 175.30 172.34 1wc5 s SER 1136N 1.72 -0.58 0.07 -2.12 1.04 -1.25 0.88 113.70 113.46 1wc5 s SER 1136Ca -0.00 0.92 0.03 0.00 0.48 0.00 0.00 55.95 57.38 1wc5 s SER 1136Cb -0.12 0.91 -0.03 0.00 0.10 0.00 0.00 66.02 66.88 1wc5 s SER 1136CO -0.03 -0.35 -0.09 -1.81 0.98 0.00 0.00 173.24 171.93 1wc5 s ASP 1137N -0.33 1.17 0.12 7.02 1.01 -0.54 -4.90 116.67 120.22 1wc5 s ASP 1137Ca -0.05 -0.70 -0.30 0.00 0.71 0.00 0.00 52.55 52.21 1wc5 s ASP 1137Cb -0.03 0.03 -0.06 0.00 1.01 0.00 0.00 42.92 43.86 1wc5 s ASP 1137CO 0.04 -0.24 1.08 0.12 0.21 0.00 0.00 175.17 176.37 1wc5 s PHE 1138N -2.01 3.61 0.09 4.23 5.36 -1.26 -1.47 117.98 126.55 1wc5 s PHE 1138Ca -0.01 1.59 -0.20 0.00 -0.96 0.00 0.00 56.93 57.35 1wc5 s PHE 1138Cb -0.06 -3.24 0.07 0.00 -0.34 0.00 0.00 43.02 39.45 1wc5 s PHE 1138CO -0.00 -0.51 0.95 -2.37 -1.46 0.00 0.00 175.22 171.83 1wc5 n THR 1139N 2.93 0.00 -4.43 0.12 5.66 -0.14 -4.94 114.28 113.48 1wc5 n THR 1139Ca 0.04 -0.35 -0.30 0.00 -3.05 0.00 0.00 64.05 60.39 1wc5 n THR 1139Cb 0.47 0.59 -0.11 0.00 -1.55 0.00 0.00 70.33 69.73 1wc5 n THR 1139CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wc5 s ALA 1140N -1.87 2.72 -0.01 1.79 0.00 -1.26 -1.95 121.76 121.18 1wc5 s ALA 1140Ca 0.22 -1.26 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1wc5 s ALA 1140Cb -0.02 -0.76 0.01 0.00 0.00 0.00 0.00 23.12 22.35 1wc5 s ALA 1140CO 0.03 0.60 -0.01 0.42 0.00 0.00 0.00 175.76 176.79 1wc5 s ILE 1141N -1.07 0.16 0.00 0.00 1.01 -0.08 -4.97 121.20 116.26 1wc5 s ILE 1141Ca 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.78 1wc5 s ILE 1141Cb -0.11 -0.17 0.00 0.00 0.01 0.00 0.00 42.46 42.20 1wc5 s ILE 1141CO 0.09 0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.71 1wc5 n GLY 1142N 3.28 1.87 0.42 6.18 0.00 -1.26 -1.91 105.19 113.77 1wc5 n GLY 1142Ca -0.16 -1.98 0.23 0.00 0.00 0.00 0.00 46.02 44.11 1wc5 n GLY 1142CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1wc5 h PRO 1143N 0.00 0.35 -0.78 1.61 0.11 -2.01 -2.09 132.00 129.20 1wc5 h PRO 1143Ca 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1wc5 h PRO 1143Cb 0.00 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 30.99 1wc5 h PRO 1143CO 0.00 0.23 0.44 0.77 -0.21 0.00 0.00 178.00 179.23 1wc5 h SER 1144N 0.36 0.97 -0.61 -2.05 0.02 -1.90 -2.44 113.55 107.90 1wc5 h SER 1144Ca 0.56 -0.09 -0.09 0.00 -0.84 0.00 0.00 61.79 61.33 1wc5 h SER 1144Cb 1.50 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 1wc5 h SER 1144CO -0.24 0.78 0.03 0.58 -1.14 0.00 0.00 176.83 176.84 1wc5 h VAL 1145N 1.08 1.26 -0.39 2.27 2.07 -1.69 -3.09 116.25 117.76 1wc5 h VAL 1145Ca 0.28 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 1wc5 h VAL 1145Cb 0.02 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1wc5 h VAL 1145CO -0.05 0.41 0.15 -1.13 0.02 0.00 0.00 177.57 176.97 1wc5 h ASN 1146N 0.98 0.55 -0.80 0.57 -0.00 -1.49 -1.80 115.58 113.59 1wc5 h ASN 1146Ca 0.18 -0.17 0.15 0.00 -0.00 0.00 0.00 56.30 56.45 1wc5 h ASN 1146Cb 0.52 -0.14 -0.10 0.00 -0.00 0.00 0.00 38.32 38.60 1wc5 h ASN 1146CO 0.03 0.57 0.36 0.40 -0.00 0.00 0.00 177.43 178.78 1wc5 h ILE 1147N 0.49 0.67 -0.19 2.57 2.04 -1.38 0.47 117.51 122.18 1wc5 h ILE 1147Ca 0.13 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.76 1wc5 h ILE 1147Cb 0.20 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.40 1wc5 h ILE 1147CO -0.01 0.09 -0.09 0.00 0.00 0.00 0.00 178.15 178.15 1wc5 h ALA 1148N 1.56 0.26 -0.88 1.87 0.00 -1.44 -0.04 119.26 120.60 1wc5 h ALA 1148Ca 0.44 -0.28 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1wc5 h ALA 1148Cb 0.67 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 1wc5 h ALA 1148CO -0.40 0.08 0.53 0.00 0.00 0.00 0.00 179.25 179.47 1wc5 h ALA 1149N 0.70 1.24 -0.00 0.00 0.00 -0.28 -1.35 119.26 119.56 1wc5 h ALA 1149Ca 0.04 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 1wc5 h ALA 1149Cb 0.57 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1wc5 h ALA 1149CO 0.03 0.22 -0.85 0.00 0.00 0.00 0.00 179.25 178.64 1wc5 h ARG 1150N 0.92 0.19 -0.67 0.00 2.47 0.01 -2.76 114.38 114.54 1wc5 h ARG 1150Ca 0.40 -0.20 -0.07 0.00 -1.26 0.00 0.00 59.98 58.85 1wc5 h ARG 1150Cb 0.29 0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.63 1wc5 h ARG 1150CO -0.21 0.93 0.14 -0.07 0.56 0.00 0.00 179.97 181.31 1wc5 h LEU 1151N 0.11 1.03 0.21 3.04 3.38 -0.39 -1.51 115.31 121.18 1wc5 h LEU 1151Ca -0.04 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1wc5 h LEU 1151Cb 1.47 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1wc5 h LEU 1151CO 0.13 1.01 -0.19 -0.61 0.09 0.00 0.00 178.44 178.87 1wc5 h GLN 1152N 1.02 -0.41 -0.91 1.13 -0.00 -1.24 -2.53 115.11 112.19 1wc5 h GLN 1152Ca 0.21 0.03 0.20 0.00 -0.00 0.00 0.00 58.65 59.09 1wc5 h GLN 1152Cb 0.40 0.09 -0.07 0.00 0.00 0.00 0.00 27.48 27.90 1wc5 h GLN 1152CO 0.01 -0.27 0.60 1.49 0.00 0.00 0.00 178.83 180.65 1wc5 h GLU 1153N -0.42 0.40 0.00 1.69 4.81 -1.14 -2.74 114.58 117.18 1wc5 h GLU 1153Ca -0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1wc5 h GLU 1153Cb 0.39 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1wc5 h GLU 1153CO -0.03 0.27 -0.92 0.00 -0.73 0.00 0.00 179.01 177.59 1wc5 n ALA 1154N -2.51 3.06 -1.81 2.92 0.00 -0.61 -4.96 120.51 116.59 1wc5 n ALA 1154Ca 0.19 -0.32 -0.33 0.00 0.00 0.00 0.00 53.44 52.98 1wc5 n ALA 1154Cb 0.70 -1.06 -0.05 0.00 0.00 0.00 0.00 19.45 19.04 1wc5 n ALA 1154CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1wc5 s THR 1155N -3.23 4.13 0.58 0.00 -1.32 -0.98 -5.02 115.64 109.80 1wc5 s THR 1155Ca 0.03 1.32 -0.19 0.00 -1.21 0.00 0.00 61.69 61.64 1wc5 s THR 1155Cb 0.13 -3.53 -0.04 0.00 -1.51 0.00 0.00 72.50 67.55 1wc5 s THR 1155CO 0.78 -0.29 1.23 0.00 -2.21 0.00 0.00 174.62 174.12 1wc5 s ALA 1156N -2.10 2.61 0.29 11.08 0.00 -1.26 -4.91 121.76 127.46 1wc5 s ALA 1156Ca 0.64 1.06 -0.30 0.00 0.00 0.00 0.00 51.96 53.37 1wc5 s ALA 1156Cb -0.12 -3.47 -0.13 0.00 0.00 0.00 0.00 23.12 19.40 1wc5 s ALA 1156CO 0.16 -1.18 1.33 -0.35 0.00 0.00 0.00 175.76 175.73 1wc5 n PRO 1157N -1.44 2.04 -1.88 0.00 -0.04 -1.26 -1.95 135.00 130.47 1wc5 n PRO 1157Ca 0.13 0.72 -0.13 0.00 -0.04 0.00 0.00 63.50 64.18 1wc5 n PRO 1157Cb 0.49 -2.33 -0.03 0.00 -0.04 0.00 0.00 33.50 31.59 1wc5 n PRO 1157CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1wc5 n ASN 1158N 1.51 -4.34 -4.39 3.54 5.03 0.43 -4.96 115.26 112.08 1wc5 n ASN 1158Ca 0.08 0.14 -0.24 0.00 0.87 0.00 0.00 54.58 55.43 1wc5 n ASN 1158Cb 0.33 -3.30 -0.11 0.00 -1.02 0.00 0.00 39.78 35.69 1wc5 n ASN 1158CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1wc5 s SER 1159N -2.60 3.09 -0.31 6.41 1.04 -0.82 -4.97 113.70 115.54 1wc5 s SER 1159Ca 0.00 -0.91 -0.03 0.00 0.48 0.00 0.00 55.95 55.49 1wc5 s SER 1159Cb 0.00 -0.21 0.05 0.00 0.10 0.00 0.00 66.02 65.95 1wc5 s SER 1159CO 0.00 0.02 0.03 -0.63 0.98 0.00 0.00 173.24 173.63 1wc5 s ILE 1160N -2.11 3.20 -0.13 -1.02 1.01 -1.26 -2.87 121.20 118.02 1wc5 s ILE 1160Ca 0.21 -1.31 -0.06 0.00 0.00 0.00 0.00 60.65 59.49 1wc5 s ILE 1160Cb -0.06 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.54 1wc5 s ILE 1160CO 0.09 -0.12 0.07 -0.32 0.00 0.00 0.00 174.94 174.66 1wc5 s MET 1161N 1.29 3.47 0.09 2.79 1.75 -0.73 -0.77 119.30 127.20 1wc5 s MET 1161Ca -0.04 -0.28 0.02 0.00 -1.25 0.00 0.00 55.69 54.14 1wc5 s MET 1161Cb -0.20 -3.08 -0.04 0.00 2.84 0.00 0.00 34.83 34.36 1wc5 s MET 1161CO -0.00 0.60 -0.07 0.14 -0.65 0.00 0.00 175.02 175.03 1wc5 s VAL 1162N -0.55 0.73 0.80 10.11 -7.23 -0.89 -1.63 120.40 121.75 1wc5 s VAL 1162Ca 0.11 -1.80 -0.12 0.00 -1.81 0.00 0.00 61.98 58.36 1wc5 s VAL 1162Cb -0.12 -1.52 0.07 0.00 0.56 0.00 0.00 36.38 35.38 1wc5 s VAL 1162CO 0.02 -0.77 1.11 -0.94 -0.31 0.00 0.00 175.10 174.21 1wc5 s SER 1163N -2.80 4.47 0.43 4.85 1.04 -0.99 -1.40 113.70 119.31 1wc5 s SER 1163Ca 0.09 1.17 0.13 0.00 0.48 0.00 0.00 55.95 57.81 1wc5 s SER 1163Cb 0.02 -1.86 0.95 0.00 0.10 0.00 0.00 66.02 65.23 1wc5 s SER 1163CO -0.03 -1.96 1.98 0.00 0.98 0.00 0.00 173.24 174.21 1wc5 h ALA 1164N -1.09 1.66 -0.47 5.32 0.00 -1.93 0.53 119.26 123.29 1wc5 h ALA 1164Ca -0.47 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.20 1wc5 h ALA 1164Cb 1.28 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1wc5 h ALA 1164CO 0.61 0.25 -0.02 1.98 0.00 0.00 0.00 179.25 182.07 1wc5 h MET 1165N 0.10 0.84 -0.38 0.00 1.85 -1.92 -0.14 114.93 115.28 1wc5 h MET 1165Ca 0.02 -0.28 -0.12 0.00 -0.61 0.00 0.00 59.70 58.72 1wc5 h MET 1165Cb 0.29 -0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.24 1wc5 h MET 1165CO 0.02 0.90 -0.23 0.28 -0.40 0.00 0.00 176.91 177.48 1wc5 h VAL 1166N 0.69 1.28 -0.07 -5.77 2.07 -1.75 -2.53 116.25 110.18 1wc5 h VAL 1166Ca 0.13 -1.37 0.02 0.00 0.82 0.00 0.00 66.70 66.30 1wc5 h VAL 1166Cb 0.53 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1wc5 h VAL 1166CO 0.03 0.46 0.08 0.00 0.02 0.00 0.00 177.57 178.15 1wc5 h ALA 1167N 0.79 1.61 0.00 1.67 0.00 -0.54 -1.08 119.26 121.72 1wc5 h ALA 1167Ca 0.08 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1wc5 h ALA 1167Cb 0.79 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1wc5 h ALA 1167CO 0.06 -0.11 -0.02 0.37 0.00 0.00 0.00 179.25 179.55 1wc5 h GLN 1168N 0.00 0.00 -0.41 0.00 5.75 -0.57 -1.67 115.11 118.20 1wc5 h GLN 1168Ca 0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1wc5 h GLN 1168Cb 0.19 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.74 1wc5 h GLN 1168CO -0.00 0.02 0.00 0.66 -2.65 0.00 0.00 178.83 176.86 1wc5 n TYR 1169N -3.29 1.06 -4.31 3.99 4.02 -0.41 -4.95 117.16 113.28 1wc5 n TYR 1169Ca -0.02 -0.70 -0.34 0.00 -0.01 0.00 0.00 57.90 56.83 1wc5 n TYR 1169Cb 0.13 -0.24 -0.15 0.00 -0.02 0.00 0.00 39.34 39.06 1wc5 n TYR 1169CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1wc5 s VAL 1170N -2.09 2.81 0.19 -0.72 1.01 -0.63 -4.85 120.40 116.13 1wc5 s VAL 1170Ca 0.41 -0.71 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1wc5 s VAL 1170Cb 0.29 -2.22 -0.16 0.00 0.00 0.00 0.00 36.38 34.29 1wc5 s VAL 1170CO 0.15 0.49 0.85 -2.65 0.00 0.00 0.00 175.10 173.95 1wc5 n PRO 1171N 4.30 0.60 -0.14 2.72 -0.02 -1.26 -4.86 135.00 136.34 1wc5 n PRO 1171Ca -0.19 0.21 -0.04 0.00 -2.02 0.00 0.00 63.50 61.46 1wc5 n PRO 1171Cb 0.51 -1.47 0.04 0.00 -0.02 0.00 0.00 33.50 32.57 1wc5 n PRO 1171CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1wc5 h ASP 1172N 1.99 0.13 -0.45 2.55 3.32 -1.98 -2.50 116.42 119.49 1wc5 h ASP 1172Ca -0.37 0.06 0.10 0.00 0.02 0.00 0.00 57.03 56.84 1wc5 h ASP 1172Cb 1.39 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.97 1wc5 h ASP 1172CO 0.62 0.11 0.31 1.05 -1.72 0.00 0.00 179.24 179.61 1wc5 h GLU 1173N 0.31 0.14 0.00 3.56 9.09 -2.04 0.12 114.58 125.76 1wc5 h GLU 1173Ca 0.21 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.61 1wc5 h GLU 1173Cb 0.22 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.29 1wc5 h GLU 1173CO -0.23 0.09 0.00 0.93 0.05 0.00 0.00 179.01 179.86 1wc5 h GLU 1174N 0.14 0.00 -6.89 1.06 5.08 -1.79 -3.43 114.58 108.75 1wc5 h GLU 1174Ca 0.21 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 58.07 1wc5 h GLU 1174Cb 0.65 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.93 1wc5 h GLU 1174CO -0.03 0.00 0.50 0.42 -1.00 0.00 0.00 179.01 178.90 1wc5 s ILE 1175N -3.87 3.28 -0.12 3.13 -1.09 0.03 -0.77 121.20 121.79 1wc5 s ILE 1175Ca -0.01 1.16 -0.02 0.00 -2.23 0.00 0.00 60.65 59.54 1wc5 s ILE 1175Cb 0.11 -3.69 -0.07 0.00 -1.58 0.00 0.00 42.46 37.23 1wc5 s ILE 1175CO 0.48 0.18 -0.13 -0.38 -1.23 0.00 0.00 174.94 173.85 1wc5 n ILE 1176N 0.52 0.69 -3.69 2.92 5.41 0.18 -4.82 119.36 120.57 1wc5 n ILE 1176Ca 0.02 -0.23 -0.10 0.00 1.00 0.00 0.00 62.75 63.44 1wc5 n ILE 1176Cb 0.46 -1.25 -0.11 0.00 -0.71 0.00 0.00 39.64 38.03 1wc5 n ILE 1176CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1wc5 s LYS 1177N -2.24 0.38 0.02 0.38 2.20 -1.18 -4.94 119.74 114.36 1wc5 s LYS 1177Ca -0.17 0.83 -0.00 0.00 -0.36 0.00 0.00 55.97 56.27 1wc5 s LYS 1177Cb 0.05 0.03 -0.04 0.00 -1.51 0.00 0.00 37.83 36.36 1wc5 s LYS 1177CO 0.25 -0.18 0.12 1.03 -0.36 0.00 0.00 175.35 176.22 1wc5 s ARG 1178N 1.61 3.15 -0.29 4.03 0.52 -1.26 -0.09 118.95 126.62 1wc5 s ARG 1178Ca -0.08 -0.49 -0.25 0.00 -0.52 0.00 0.00 55.73 54.39 1wc5 s ARG 1178Cb -0.09 -2.90 0.17 0.00 0.52 0.00 0.00 34.95 32.64 1wc5 s ARG 1178CO -0.13 0.63 1.29 -2.00 0.02 0.00 0.00 175.30 175.12 1wc5 s GLU 1179N -2.04 0.22 -0.49 3.54 2.12 -0.57 -4.98 118.70 116.51 1wc5 s GLU 1179Ca 0.27 0.26 -0.26 0.00 0.36 0.00 0.00 54.97 55.59 1wc5 s GLU 1179Cb -0.12 0.11 0.03 0.00 0.26 0.00 0.00 34.13 34.40 1wc5 s GLU 1179CO 0.19 -0.03 1.00 0.12 -0.54 0.00 0.00 175.26 176.00 1wc5 s PHE 1180N 0.08 2.85 0.39 5.30 5.36 -1.26 -1.00 117.98 129.70 1wc5 s PHE 1180Ca 0.06 0.39 0.08 0.00 -0.96 0.00 0.00 56.93 56.50 1wc5 s PHE 1180Cb -0.05 -4.14 -0.07 0.00 -0.34 0.00 0.00 43.02 38.42 1wc5 s PHE 1180CO -0.12 -1.22 -0.00 -0.51 -1.46 0.00 0.00 175.22 171.91 1wc5 s LEU 1181N 4.05 2.87 -0.22 6.12 1.43 -0.47 -4.93 118.68 127.53 1wc5 s LEU 1181Ca 0.39 -1.28 -0.10 0.00 -1.03 0.00 0.00 54.13 52.10 1wc5 s LEU 1181Cb -0.10 -0.99 -0.05 0.00 0.03 0.00 0.00 46.19 45.08 1wc5 s LEU 1181CO 0.26 -0.39 0.14 -0.70 0.23 0.00 0.00 176.35 175.90 1wc5 s GLU 1182N -3.70 4.11 -0.65 1.70 2.12 -1.26 -1.26 118.70 119.76 1wc5 s GLU 1182Ca 0.35 -0.26 -0.10 0.00 0.36 0.00 0.00 54.97 55.32 1wc5 s GLU 1182Cb 0.07 -3.47 0.17 0.00 0.26 0.00 0.00 34.13 31.16 1wc5 s GLU 1182CO 0.18 0.17 0.54 -0.51 -0.54 0.00 0.00 175.26 175.11 1wc5 s LEU 1183N 0.73 6.03 0.00 2.70 1.43 -1.26 -4.96 118.68 123.35 1wc5 s LEU 1183Ca 0.07 -2.43 0.00 0.00 -1.03 0.00 0.00 54.13 50.74 1wc5 s LEU 1183Cb -0.12 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.03 1wc5 s LEU 1183CO 0.01 -0.58 0.56 0.29 0.23 0.00 0.00 176.35 176.86 1wc5 n LYS 1184N 4.23 0.00 0.00 1.70 4.01 -1.26 0.22 118.16 127.05 1wc5 n LYS 1184Ca 0.04 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.84 1wc5 n LYS 1184Cb 0.42 -0.70 0.00 0.00 -0.51 0.00 0.00 35.03 34.24 1wc5 n LYS 1184CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1wc5 n GLY 1185N 2.86 0.42 3.47 0.72 0.00 -1.26 -4.98 105.19 106.42 1wc5 n GLY 1185Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1wc5 n GLY 1185CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wc5 s ILE 1186N 0.00 3.56 0.12 -0.61 -1.09 0.58 -5.04 121.20 118.72 1wc5 s ILE 1186Ca 0.00 -0.49 -0.19 0.00 -2.23 0.00 0.00 60.65 57.74 1wc5 s ILE 1186Cb 0.00 -2.52 -0.06 0.00 -1.58 0.00 0.00 42.46 38.30 1wc5 s ILE 1186CO 0.00 0.52 1.73 0.44 -1.23 0.00 0.00 174.94 176.41 1wc5 h ASP 1187N 6.44 0.30 -2.95 3.58 3.32 -2.00 -3.40 116.42 121.71 1wc5 h ASP 1187Ca -0.32 -0.06 -0.64 0.00 0.02 0.00 0.00 57.03 56.02 1wc5 h ASP 1187Cb 1.19 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.60 1wc5 h ASP 1187CO 0.59 0.28 -0.53 -1.61 -1.72 0.00 0.00 179.24 176.24 1wc5 s GLU 1188N -5.95 3.26 0.47 3.56 2.02 -1.26 -5.04 118.70 115.76 1wc5 s GLU 1188Ca -0.13 -0.41 -0.24 0.00 0.02 0.00 0.00 54.97 54.21 1wc5 s GLU 1188Cb 0.09 -2.98 -0.08 0.00 0.10 0.00 0.00 34.13 31.25 1wc5 s GLU 1188CO 0.71 0.66 1.23 -2.30 0.02 0.00 0.00 175.26 175.58 1wc5 n PRO 1189N 0.98 1.71 -4.49 0.39 -0.02 -1.26 -4.76 135.00 127.55 1wc5 n PRO 1189Ca -0.11 0.62 -0.28 0.00 -2.02 0.00 0.00 63.50 61.71 1wc5 n PRO 1189Cb 0.52 -2.38 -0.13 0.00 -0.02 0.00 0.00 33.50 31.49 1wc5 n PRO 1189CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1wc5 s VAL 1190N -1.26 2.07 0.17 -1.45 1.01 -0.39 -4.93 120.40 115.62 1wc5 s VAL 1190Ca 0.65 -1.59 -0.28 0.00 0.00 0.00 0.00 61.98 60.76 1wc5 s VAL 1190Cb -0.48 -1.82 -0.08 0.00 0.00 0.00 0.00 36.38 34.00 1wc5 s VAL 1190CO 0.55 0.12 0.88 -0.32 0.00 0.00 0.00 175.10 176.33 1wc5 s MET 1191N -1.78 4.71 0.15 2.72 1.75 -1.26 -1.36 119.30 124.21 1wc5 s MET 1191Ca 0.11 1.35 0.05 0.00 -1.25 0.00 0.00 55.69 55.95 1wc5 s MET 1191Cb -0.10 -3.31 -0.04 0.00 2.84 0.00 0.00 34.83 34.22 1wc5 s MET 1191CO 0.04 0.43 -0.12 0.95 -0.65 0.00 0.00 175.02 175.68 1wc5 s THR 1192N -0.77 1.26 -0.06 10.11 -4.23 -0.17 -3.66 115.64 118.14 1wc5 s THR 1192Ca 0.41 -1.98 -0.02 0.00 -1.18 0.00 0.00 61.69 58.92 1wc5 s THR 1192Cb -0.24 -1.77 0.03 0.00 1.34 0.00 0.00 72.50 71.86 1wc5 s THR 1192CO 0.29 -0.64 0.03 0.00 -0.54 0.00 0.00 174.62 173.75 1wc5 s VAL 1194N 2.05 4.54 0.29 0.00 1.01 0.87 -2.09 120.40 127.07 1wc5 s VAL 1194Ca 0.05 1.55 -0.24 0.00 0.00 0.00 0.00 61.98 63.34 1wc5 s VAL 1194Cb -0.12 -4.38 -0.09 0.00 0.00 0.00 0.00 36.38 31.78 1wc5 s VAL 1194CO -0.04 -0.49 0.88 -0.63 0.00 0.00 0.00 175.10 174.81 1wc5 s ILE 1195N 3.59 4.32 -0.03 2.22 -1.09 0.05 0.49 121.20 130.73 1wc5 s ILE 1195Ca 0.43 1.67 -0.30 0.00 -2.23 0.00 0.00 60.65 60.21 1wc5 s ILE 1195Cb -0.12 -3.97 -0.05 0.00 -1.58 0.00 0.00 42.46 36.74 1wc5 s ILE 1195CO 0.17 0.17 1.39 0.21 -1.23 0.00 0.00 174.94 175.64 1wc5 s ASN 1196N -1.62 6.87 0.00 3.58 3.84 0.05 -4.35 114.94 123.30 1wc5 s ASN 1196Ca 0.48 2.04 0.03 0.00 0.21 0.00 0.00 52.86 55.61 1wc5 s ASN 1196Cb -0.18 -2.55 0.16 0.00 -0.55 0.00 0.00 41.25 38.12 1wc5 s ASN 1196CO 0.23 -0.73 0.52 -2.65 -2.79 0.00 0.00 177.10 171.67 1wc5 n PRO 1197N 5.71 0.13 0.00 0.43 -0.02 -1.26 -5.05 135.00 134.93 1wc5 n PRO 1197Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1wc5 n PRO 1197Cb 0.44 -1.33 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 1wc5 n PRO 1197CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57