#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gr8 h LYS 1022N 0.00 1.08 -0.59 4.33 1.57 -1.99 -2.79 116.57 118.17 2gr8 h LYS 1022Ca 0.00 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.47 2gr8 h LYS 1022Cb 0.00 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 2gr8 h LYS 1022CO 0.00 0.97 0.21 0.00 -0.57 0.00 0.00 179.45 180.06 2gr8 h ARG 1023N 1.02 0.90 -0.35 3.15 -0.00 -2.01 -1.11 114.38 115.98 2gr8 h ARG 1023Ca 0.21 -0.18 -0.14 0.00 -0.50 0.00 0.00 59.98 59.37 2gr8 h ARG 1023Cb 0.40 -0.14 -0.01 0.00 0.00 0.00 0.00 29.97 30.22 2gr8 h ARG 1023CO 0.01 0.79 -0.33 0.00 0.00 0.00 0.00 179.97 180.44 2gr8 h ALA 1024N 1.07 0.51 -0.18 0.04 0.00 -1.99 -2.38 119.26 116.33 2gr8 h ALA 1024Ca 0.19 -0.43 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 2gr8 h ALA 1024Cb 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2gr8 h ALA 1024CO -0.01 0.57 -0.35 -0.44 0.00 0.00 0.00 179.25 179.02 2gr8 h ASP 1025N 0.64 0.40 -0.01 0.00 3.32 -1.41 -1.92 116.42 117.43 2gr8 h ASP 1025Ca 0.06 -0.16 -0.14 0.00 0.02 0.00 0.00 57.03 56.81 2gr8 h ASP 1025Cb 0.92 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 2gr8 h ASP 1025CO 0.08 0.73 -0.46 0.00 -1.72 0.00 0.00 179.24 177.87 2gr8 h ALA 1026N 1.30 0.79 -0.16 3.45 0.00 -1.19 -0.64 119.26 122.81 2gr8 h ALA 1026Ca 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2gr8 h ALA 1026Cb 0.78 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2gr8 h ALA 1026CO 0.06 0.66 0.10 0.78 0.00 0.00 0.00 179.25 180.85 2gr8 h GLY 1027N 1.06 0.22 0.65 0.00 0.00 -1.21 -1.04 103.07 102.76 2gr8 h GLY 1027Ca 0.03 -0.09 0.06 0.00 0.00 0.00 0.00 47.33 47.33 2gr8 h GLY 1027CO 0.09 0.08 0.36 -0.84 0.00 0.00 0.00 176.54 176.24 2gr8 h THR 1028N 0.20 0.95 -0.75 4.70 2.02 -1.23 -2.27 112.91 116.53 2gr8 h THR 1028Ca 0.06 -0.23 0.04 0.00 0.77 0.00 0.00 66.41 67.05 2gr8 h THR 1028Cb -0.00 0.22 -0.05 0.00 -1.74 0.00 0.00 68.15 66.58 2gr8 h THR 1028CO -0.01 0.12 0.46 0.00 0.37 0.00 0.00 175.52 176.46 2gr8 h ALA 1029N 1.36 1.00 -0.47 6.16 0.00 -0.77 0.83 119.26 127.36 2gr8 h ALA 1029Ca 0.30 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.21 2gr8 h ALA 1029Cb 0.21 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2gr8 h ALA 1029CO -0.19 0.22 0.29 0.77 0.00 0.00 0.00 179.25 180.34 2gr8 h SER 1030N 0.88 0.49 -0.06 0.00 0.02 -0.74 -0.95 113.55 113.19 2gr8 h SER 1030Ca 0.31 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 61.12 2gr8 h SER 1030Cb 0.08 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 2gr8 h SER 1030CO -0.14 0.35 -0.40 0.00 -1.14 0.00 0.00 176.83 175.51 2gr8 h ALA 1031N 1.19 0.84 -0.53 3.77 0.00 -0.96 -1.57 119.26 122.00 2gr8 h ALA 1031Ca 0.18 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 2gr8 h ALA 1031Cb -0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2gr8 h ALA 1031CO -0.06 0.64 0.17 -0.07 0.00 0.00 0.00 179.25 179.93 2gr8 h LEU 1032N 0.48 0.78 -0.31 0.00 3.38 -0.62 -1.09 115.31 117.91 2gr8 h LEU 1032Ca 0.04 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 2gr8 h LEU 1032Cb 0.90 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2gr8 h LEU 1032CO 0.08 0.78 0.17 0.00 0.09 0.00 0.00 178.44 179.56 2gr8 h ALA 1033N 1.03 0.40 -0.26 1.53 0.00 -1.05 -2.87 119.26 118.04 2gr8 h ALA 1033Ca 0.17 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2gr8 h ALA 1033Cb 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2gr8 h ALA 1033CO -0.01 -0.07 0.05 0.00 0.00 0.00 0.00 179.25 179.23 2gr8 h ALA 1034N 1.04 1.61 0.00 0.00 0.00 -1.13 -2.43 119.26 118.35 2gr8 h ALA 1034Ca 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2gr8 h ALA 1034Cb 0.06 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2gr8 h ALA 1034CO -0.02 0.30 -0.06 0.66 0.00 0.00 0.00 179.25 180.13 2gr8 h SER 1035N 0.37 0.00 -0.50 0.00 4.64 -0.97 -2.94 113.55 114.16 2gr8 h SER 1035Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2gr8 h SER 1035Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2gr8 h SER 1035CO -0.00 0.06 0.00 0.00 -0.87 0.00 0.00 176.83 176.02 2gr8 n GLN 1036N -3.26 2.85 -2.04 4.77 1.13 -0.92 -4.92 117.38 114.99 2gr8 n GLN 1036Ca -0.01 -2.32 -0.42 0.00 -1.94 0.00 0.00 57.00 52.30 2gr8 n GLN 1036Cb 0.25 -1.41 -0.03 0.00 0.11 0.00 0.00 30.24 29.17 2gr8 n GLN 1036CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2gr8 s LEU 1037N -1.07 4.21 0.55 1.08 1.43 -1.11 -4.88 118.68 118.89 2gr8 s LEU 1037Ca 0.34 2.08 -0.21 0.00 -1.03 0.00 0.00 54.13 55.31 2gr8 s LEU 1037Cb 0.18 -3.53 -0.05 0.00 0.03 0.00 0.00 46.19 42.82 2gr8 s LEU 1037CO 0.22 -1.00 1.29 -2.84 0.23 0.00 0.00 176.35 174.25 2gr8 s PRO 1038N 4.18 3.14 0.03 1.29 0.02 -1.26 -5.04 135.00 137.35 2gr8 s PRO 1038Ca 0.73 2.06 0.03 0.00 0.02 0.00 0.00 61.00 63.83 2gr8 s PRO 1038Cb -0.31 -2.17 -0.04 0.00 0.02 0.00 0.00 34.50 32.01 2gr8 s PRO 1038CO 0.29 -1.14 -0.00 -1.14 -0.33 0.00 0.00 177.00 174.68 2gr8 s GLN 1039N -3.01 2.71 0.55 5.54 0.74 -1.26 -4.80 119.66 120.12 2gr8 s GLN 1039Ca 0.73 -0.68 -0.21 0.00 0.05 0.00 0.00 55.36 55.25 2gr8 s GLN 1039Cb -0.36 -2.62 -0.06 0.00 1.10 0.00 0.00 33.01 31.07 2gr8 s GLN 1039CO 0.42 0.60 1.09 0.00 -0.55 0.00 0.00 175.29 176.84 2gr8 n ALA 1040N 1.16 0.59 0.00 1.58 0.00 -1.26 -4.95 120.51 117.62 2gr8 n ALA 1040Ca -0.13 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2gr8 n ALA 1040Cb 0.52 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.80 2gr8 n ALA 1040CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2gr8 n THR 1041N -1.28 0.00 -4.07 0.00 -2.24 -1.26 -4.95 114.28 100.48 2gr8 n THR 1041Ca 0.12 -0.12 -0.35 0.00 -2.27 0.00 0.00 64.05 61.43 2gr8 n THR 1041Cb 0.45 0.58 -0.09 0.00 -2.10 0.00 0.00 70.33 69.17 2gr8 n THR 1041CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2gr8 s MET 1042N -1.10 3.64 0.29 -0.78 -1.94 -1.26 -5.07 119.30 113.08 2gr8 s MET 1042Ca 0.00 -0.32 -0.30 0.00 -1.71 0.00 0.00 55.69 53.36 2gr8 s MET 1042Cb 0.00 -3.11 -0.12 0.00 2.01 0.00 0.00 34.83 33.61 2gr8 s MET 1042CO 0.00 0.47 1.56 -2.30 -0.01 0.00 0.00 175.02 174.74 2gr8 n PRO 1043N 2.90 2.57 -1.00 2.03 -0.02 -1.26 -2.52 135.00 137.70 2gr8 n PRO 1043Ca -0.18 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 2gr8 n PRO 1043Cb 0.53 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 2gr8 n PRO 1043CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gr8 n GLY 1044N 2.12 0.63 3.65 -1.23 0.00 -0.64 -4.87 105.19 104.85 2gr8 n GLY 1044Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 2gr8 n GLY 1044CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gr8 s LYS 1045N -0.02 2.43 0.02 1.61 1.02 -1.05 -4.88 119.74 118.87 2gr8 s LYS 1045Ca 0.00 -0.88 0.02 0.00 0.02 0.00 0.00 55.97 55.13 2gr8 s LYS 1045Cb 0.00 -2.47 -0.04 0.00 -0.52 0.00 0.00 37.83 34.80 2gr8 s LYS 1045CO 0.00 0.54 0.01 -1.12 -0.92 0.00 0.00 175.35 173.86 2gr8 s SER 1046N -2.19 5.16 -0.04 2.83 0.01 -1.26 -1.93 113.70 116.28 2gr8 s SER 1046Ca 0.24 -0.03 0.05 0.00 1.31 0.00 0.00 55.95 57.52 2gr8 s SER 1046Cb -0.11 -1.34 -0.01 0.00 0.21 0.00 0.00 66.02 64.77 2gr8 s SER 1046CO 0.16 0.26 -0.20 -0.32 0.41 0.00 0.00 173.24 173.54 2gr8 s MET 1047N -1.74 1.91 -0.13 12.44 1.75 0.12 -4.98 119.30 128.66 2gr8 s MET 1047Ca 0.21 -0.71 -0.05 0.00 -1.25 0.00 0.00 55.69 53.89 2gr8 s MET 1047Cb -0.12 -1.70 -0.04 0.00 2.84 0.00 0.00 34.83 35.82 2gr8 s MET 1047CO 0.12 0.34 0.05 0.14 -0.65 0.00 0.00 175.02 175.02 2gr8 s VAL 1048N -0.18 4.67 0.03 10.11 -7.23 -1.26 -1.27 120.40 125.27 2gr8 s VAL 1048Ca 0.00 -0.10 0.01 0.00 -1.81 0.00 0.00 61.98 60.09 2gr8 s VAL 1048Cb -0.11 -3.03 -0.02 0.00 0.56 0.00 0.00 36.38 33.78 2gr8 s VAL 1048CO 0.02 0.55 -0.05 0.00 -0.31 0.00 0.00 175.10 175.30 2gr8 s ALA 1049N -0.38 0.36 0.01 1.32 0.00 0.11 -5.00 121.76 118.18 2gr8 s ALA 1049Ca 0.09 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.42 2gr8 s ALA 1049Cb -0.12 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 2gr8 s ALA 1049CO 0.02 -0.07 -0.04 -1.50 0.00 0.00 0.00 175.76 174.16 2gr8 s ILE 1050N -1.30 0.31 -0.04 0.00 2.07 -1.26 -0.32 121.20 120.66 2gr8 s ILE 1050Ca -0.12 -0.48 -0.10 0.00 -1.41 0.00 0.00 60.65 58.55 2gr8 s ILE 1050Cb -0.09 -0.32 0.02 0.00 0.13 0.00 0.00 42.46 42.19 2gr8 s ILE 1050CO -0.00 -0.12 0.22 0.00 -1.91 0.00 0.00 174.94 173.13 2gr8 s ALA 1051N -0.58 -0.55 0.16 1.50 0.00 0.45 -4.86 121.76 117.88 2gr8 s ALA 1051Ca -0.04 0.29 0.08 0.00 0.00 0.00 0.00 51.96 52.29 2gr8 s ALA 1051Cb -0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2gr8 s ALA 1051CO -0.00 -0.19 -0.18 0.20 0.00 0.00 0.00 175.76 175.60 2gr8 s GLY 1052N -0.82 1.37 0.15 0.00 0.00 -1.26 -0.45 107.32 106.30 2gr8 s GLY 1052Ca -0.09 -1.48 -0.06 0.00 0.00 0.00 0.00 44.72 43.09 2gr8 s GLY 1052CO 0.02 -1.54 0.18 -1.35 0.00 0.00 0.00 173.10 170.41 2gr8 s SER 1053N -2.69 0.16 -0.05 1.64 1.04 -0.33 -4.71 113.70 108.77 2gr8 s SER 1053Ca 0.16 -1.01 -0.02 0.00 0.48 0.00 0.00 55.95 55.56 2gr8 s SER 1053Cb -0.05 0.37 0.03 0.00 0.10 0.00 0.00 66.02 66.47 2gr8 s SER 1053CO 0.06 -0.82 0.09 -0.55 0.98 0.00 0.00 173.24 173.01 2gr8 s SER 1054N -3.00 -0.01 -0.20 7.02 0.15 -1.26 -2.03 113.70 114.37 2gr8 s SER 1054Ca 0.20 0.18 -0.05 0.00 0.70 0.00 0.00 55.95 56.98 2gr8 s SER 1054Cb 0.05 0.07 0.10 0.00 -1.71 0.00 0.00 66.02 64.53 2gr8 s SER 1054CO 0.00 -0.14 0.37 -0.47 1.20 0.00 0.00 173.24 174.20 2gr8 s TYR 1055N 1.15 -0.72 -1.51 3.44 5.04 0.67 -4.95 117.35 120.48 2gr8 s TYR 1055Ca -0.09 1.16 -0.13 0.00 -2.44 0.00 0.00 57.07 55.57 2gr8 s TYR 1055Cb -0.12 0.13 0.07 0.00 0.35 0.00 0.00 41.96 42.39 2gr8 s TYR 1055CO -0.05 -0.54 1.01 1.04 -1.34 0.00 0.00 175.55 175.67 2gr8 n GLN 1056N 5.37 -5.83 -0.27 4.97 1.13 -1.26 -1.14 117.38 120.35 2gr8 n GLN 1056Ca -0.06 0.63 0.00 0.00 -1.94 0.00 0.00 57.00 55.62 2gr8 n GLN 1056Cb 0.50 -5.53 0.00 0.00 0.11 0.00 0.00 30.24 25.31 2gr8 n GLN 1056CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2gr8 n GLY 1057N -1.73 1.85 3.81 1.08 0.00 -1.26 -5.03 105.19 103.91 2gr8 n GLY 1057Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 2gr8 n GLY 1057CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gr8 s GLN 1058N -0.22 3.17 0.06 1.61 -1.52 -0.29 -5.09 119.66 117.39 2gr8 s GLN 1058Ca 0.00 -0.41 0.06 0.00 -1.95 0.00 0.00 55.36 53.06 2gr8 s GLN 1058Cb 0.00 -2.94 -0.04 0.00 -0.22 0.00 0.00 33.01 29.82 2gr8 s GLN 1058CO 0.00 0.67 -0.12 -0.80 -0.25 0.00 0.00 175.29 174.79 2gr8 s ASN 1059N -1.64 4.26 0.11 5.90 0.01 -1.26 -0.24 114.94 122.08 2gr8 s ASN 1059Ca 0.22 -0.34 0.09 0.00 -0.71 0.00 0.00 52.86 52.12 2gr8 s ASN 1059Cb -0.12 -0.82 -0.04 0.00 0.41 0.00 0.00 41.25 40.68 2gr8 s ASN 1059CO 0.13 0.23 -0.24 -0.83 -1.51 0.00 0.00 177.10 174.88 2gr8 s GLY 1060N -1.78 1.38 -0.04 0.66 0.00 -0.86 -1.31 107.32 105.37 2gr8 s GLY 1060Ca 0.18 -1.33 0.01 0.00 0.00 0.00 0.00 44.72 43.59 2gr8 s GLY 1060CO 0.10 -1.31 -0.05 -2.27 0.00 0.00 0.00 173.10 169.57 2gr8 s LEU 1061N -1.90 1.39 -0.03 0.66 2.96 0.02 -1.18 118.68 120.61 2gr8 s LEU 1061Ca 0.10 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.92 2gr8 s LEU 1061Cb -0.10 -0.44 -0.00 0.00 0.50 0.00 0.00 46.19 46.14 2gr8 s LEU 1061CO 0.05 -0.04 -0.14 0.00 -1.32 0.00 0.00 176.35 174.90 2gr8 s ALA 1062N 0.82 1.21 -0.03 5.97 0.00 0.40 -0.75 121.76 129.37 2gr8 s ALA 1062Ca -0.11 -0.56 0.07 0.00 0.00 0.00 0.00 51.96 51.36 2gr8 s ALA 1062Cb -0.14 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.59 2gr8 s ALA 1062CO 0.00 0.24 -0.25 0.96 0.00 0.00 0.00 175.76 176.71 2gr8 s ILE 1063N -0.05 2.09 0.02 0.00 -4.36 -0.36 -0.41 121.20 118.12 2gr8 s ILE 1063Ca -0.00 -1.08 -0.01 0.00 -0.26 0.00 0.00 60.65 59.29 2gr8 s ILE 1063Cb -0.08 -1.73 -0.02 0.00 1.25 0.00 0.00 42.46 41.88 2gr8 s ILE 1063CO 0.01 0.58 -0.00 -0.83 0.24 0.00 0.00 174.94 174.93 2gr8 s GLY 1064N -0.46 0.21 0.03 6.27 0.00 0.57 -1.37 107.32 112.57 2gr8 s GLY 1064Ca 0.05 -0.53 0.06 0.00 0.00 0.00 0.00 44.72 44.30 2gr8 s GLY 1064CO 0.01 -0.61 -0.18 -1.34 0.00 0.00 0.00 173.10 170.98 2gr8 s VAL 1065N -1.53 1.41 0.04 1.40 -7.23 0.31 0.08 120.40 114.89 2gr8 s VAL 1065Ca -0.15 -1.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.98 2gr8 s VAL 1065Cb -0.09 -1.23 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 2gr8 s VAL 1065CO -0.01 0.19 0.01 -0.94 -0.31 0.00 0.00 175.10 174.04 2gr8 s SER 1066N -0.97 0.33 -0.14 4.85 1.04 -0.40 -0.45 113.70 117.96 2gr8 s SER 1066Ca 0.05 -0.72 -0.12 0.00 0.48 0.00 0.00 55.95 55.65 2gr8 s SER 1066Cb -0.08 0.18 0.04 0.00 0.10 0.00 0.00 66.02 66.26 2gr8 s SER 1066CO 0.01 -0.48 0.38 -0.60 0.98 0.00 0.00 173.24 173.52 2gr8 s ARG 1067N -2.81 0.42 -0.09 4.02 3.52 -0.75 0.11 118.95 123.37 2gr8 s ARG 1067Ca -0.03 0.57 -0.00 0.00 -0.13 0.00 0.00 55.73 56.13 2gr8 s ARG 1067Cb -0.00 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.52 2gr8 s ARG 1067CO -0.06 -0.08 -0.07 0.42 -0.81 0.00 0.00 175.30 174.71 2gr8 s ILE 1068N 0.46 3.69 0.88 4.11 1.01 -0.81 -1.41 121.20 129.13 2gr8 s ILE 1068Ca -0.02 -0.47 -0.11 0.00 0.00 0.00 0.00 60.65 60.06 2gr8 s ILE 1068Cb -0.04 -2.54 0.12 0.00 0.01 0.00 0.00 42.46 40.02 2gr8 s ILE 1068CO -0.02 0.57 1.15 -0.94 0.00 0.00 0.00 174.94 175.69 2gr8 s SER 1069N -0.44 3.24 0.48 3.58 1.04 0.25 -1.98 113.70 119.86 2gr8 s SER 1069Ca 0.07 2.16 0.13 0.00 0.48 0.00 0.00 55.95 58.78 2gr8 s SER 1069Cb -0.12 -2.56 1.11 0.00 0.10 0.00 0.00 66.02 64.55 2gr8 s SER 1069CO 0.02 -2.89 2.11 0.44 0.98 0.00 0.00 173.24 173.90 2gr8 h ASP 1070N -1.64 0.18 0.46 7.02 3.45 -1.89 0.53 116.42 124.53 2gr8 h ASP 1070Ca -0.44 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.02 2gr8 h ASP 1070Cb 1.27 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.99 2gr8 h ASP 1070CO 0.43 0.13 -0.13 -0.46 -1.57 0.00 0.00 179.24 177.64 2gr8 n ASN 1071N -4.51 0.41 0.00 6.45 6.94 -1.26 -4.38 115.26 118.91 2gr8 n ASN 1071Ca -0.01 -0.40 0.00 0.00 -0.02 0.00 0.00 54.58 54.16 2gr8 n ASN 1071Cb 0.08 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 2gr8 n ASN 1071CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2gr8 n GLY 1072N 1.33 1.23 0.08 4.83 0.00 0.08 -4.92 105.19 107.81 2gr8 n GLY 1072Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.07 2gr8 n GLY 1072CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gr8 h LYS 1073N 3.28 0.00 -5.23 1.61 1.57 -1.82 -3.45 116.57 112.51 2gr8 h LYS 1073Ca 0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 2gr8 h LYS 1073Cb 0.00 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.07 2gr8 h LYS 1073CO 0.00 0.68 -0.70 0.08 -0.57 0.00 0.00 179.45 178.95 2gr8 s VAL 1074N -2.67 3.63 -0.08 0.50 1.01 -1.26 -0.94 120.40 120.60 2gr8 s VAL 1074Ca -0.02 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.55 2gr8 s VAL 1074Cb 0.09 -2.59 0.01 0.00 0.00 0.00 0.00 36.38 33.88 2gr8 s VAL 1074CO 0.82 0.48 -0.17 -0.63 0.00 0.00 0.00 175.10 175.60 2gr8 s ILE 1075N 0.61 1.52 0.06 2.22 1.01 -0.59 -0.58 121.20 125.45 2gr8 s ILE 1075Ca -0.03 -0.71 0.07 0.00 0.00 0.00 0.00 60.65 59.97 2gr8 s ILE 1075Cb -0.15 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 40.95 2gr8 s ILE 1075CO 0.03 0.44 -0.16 0.27 0.00 0.00 0.00 174.94 175.51 2gr8 s ILE 1076N 0.46 2.94 -0.04 2.92 -4.36 -0.50 -0.62 121.20 122.00 2gr8 s ILE 1076Ca -0.15 -1.23 0.01 0.00 -0.26 0.00 0.00 60.65 59.02 2gr8 s ILE 1076Cb -0.16 -2.28 0.02 0.00 1.25 0.00 0.00 42.46 41.29 2gr8 s ILE 1076CO 0.06 0.26 -0.04 -0.13 0.24 0.00 0.00 174.94 175.32 2gr8 s ARG 1077N -1.69 0.82 -0.03 0.37 0.52 0.28 -1.80 118.95 117.42 2gr8 s ARG 1077Ca 0.16 -0.10 0.03 0.00 -0.52 0.00 0.00 55.73 55.30 2gr8 s ARG 1077Cb -0.11 -0.84 0.00 0.00 0.52 0.00 0.00 34.95 34.53 2gr8 s ARG 1077CO 0.08 -0.08 -0.11 -0.51 0.02 0.00 0.00 175.30 174.69 2gr8 s LEU 1078N 0.92 1.84 -0.02 2.53 1.43 0.40 -0.00 118.68 125.78 2gr8 s LEU 1078Ca -0.11 -0.23 -0.10 0.00 -1.03 0.00 0.00 54.13 52.66 2gr8 s LEU 1078Cb -0.14 -0.66 0.01 0.00 0.03 0.00 0.00 46.19 45.43 2gr8 s LEU 1078CO 0.00 0.09 0.22 -0.44 0.23 0.00 0.00 176.35 176.46 2gr8 s SER 1079N 0.11 -0.11 -0.01 2.29 0.01 0.77 -0.53 113.70 116.24 2gr8 s SER 1079Ca -0.03 0.04 0.06 0.00 1.31 0.00 0.00 55.95 57.34 2gr8 s SER 1079Cb -0.09 0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.43 2gr8 s SER 1079CO 0.01 -0.34 -0.20 -0.83 0.41 0.00 0.00 173.24 172.29 2gr8 s GLY 1080N -1.05 1.00 0.14 3.44 0.00 -0.47 -1.16 107.32 109.22 2gr8 s GLY 1080Ca -0.11 -0.89 0.07 0.00 0.00 0.00 0.00 44.72 43.78 2gr8 s GLY 1080CO 0.02 -0.75 -0.15 -0.51 0.00 0.00 0.00 173.10 171.71 2gr8 s THR 1081N -0.52 1.51 0.22 0.90 -4.23 0.14 -1.22 115.64 112.44 2gr8 s THR 1081Ca 0.08 -1.85 -0.05 0.00 -1.18 0.00 0.00 61.69 58.69 2gr8 s THR 1081Cb -0.08 -1.70 -0.03 0.00 1.34 0.00 0.00 72.50 72.04 2gr8 s THR 1081CO -0.00 -0.43 0.25 0.28 -0.54 0.00 0.00 174.62 174.18 2gr8 s THR 1082N -2.27 0.00 0.27 3.99 -1.32 0.07 -1.46 115.64 114.92 2gr8 s THR 1082Ca 0.13 -1.81 0.03 0.00 -1.21 0.00 0.00 61.69 58.83 2gr8 s THR 1082Cb -0.04 -2.41 -0.01 0.00 -1.51 0.00 0.00 72.50 68.53 2gr8 s THR 1082CO 0.04 0.00 0.29 -0.46 -2.21 0.00 0.00 174.62 172.28 2gr8 n ASN 1083N -0.36 -0.78 0.00 8.08 2.04 -1.20 -0.80 115.26 122.25 2gr8 n ASN 1083Ca 0.01 -2.62 0.06 0.00 -0.44 0.00 0.00 54.58 51.60 2gr8 n ASN 1083Cb 0.65 1.61 0.29 0.00 -2.53 0.00 0.00 39.78 39.79 2gr8 n ASN 1083CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 2gr8 n SER 1084N -1.87 0.01 -0.71 0.53 3.41 -0.43 -1.25 113.62 113.31 2gr8 n SER 1084Ca 0.04 0.50 0.13 0.00 -0.26 0.00 0.00 58.87 59.28 2gr8 n SER 1084Cb 0.47 -0.51 0.23 0.00 -0.26 0.00 0.00 64.21 64.14 2gr8 n SER 1084CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gr8 n GLN 1085N -1.52 1.89 -1.44 4.33 1.13 -1.26 -4.97 117.38 115.55 2gr8 n GLN 1085Ca 0.03 -1.43 -0.06 0.00 -1.94 0.00 0.00 57.00 53.60 2gr8 n GLN 1085Cb 0.16 -1.47 -0.02 0.00 0.11 0.00 0.00 30.24 29.02 2gr8 n GLN 1085CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2gr8 n GLY 1086N 1.31 0.63 3.66 1.08 0.00 -0.38 -5.02 105.19 106.47 2gr8 n GLY 1086Ca 0.15 -0.75 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 2gr8 n GLY 1086CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gr8 s LYS 1087N -3.00 4.10 0.12 1.61 -0.14 -1.26 -4.87 119.74 116.29 2gr8 s LYS 1087Ca 0.00 -0.10 -0.02 0.00 -1.36 0.00 0.00 55.97 54.49 2gr8 s LYS 1087Cb 0.00 -3.55 -0.05 0.00 -1.68 0.00 0.00 37.83 32.56 2gr8 s LYS 1087CO 0.00 0.01 0.32 0.95 -0.76 0.00 0.00 175.35 175.87 2gr8 s THR 1088N 1.19 5.25 0.02 2.17 -4.23 -1.26 -3.24 115.64 115.54 2gr8 s THR 1088Ca 0.12 -0.19 -0.01 0.00 -1.18 0.00 0.00 61.69 60.43 2gr8 s THR 1088Cb -0.14 -3.64 -0.02 0.00 1.34 0.00 0.00 72.50 70.04 2gr8 s THR 1088CO 0.06 0.04 -0.02 -0.83 -0.54 0.00 0.00 174.62 173.33 2gr8 s GLY 1089N -2.59 0.24 0.05 3.99 0.00 -0.53 -4.98 107.32 103.50 2gr8 s GLY 1089Ca 0.38 -0.59 0.07 0.00 0.00 0.00 0.00 44.72 44.59 2gr8 s GLY 1089CO 0.27 -0.66 -0.19 -1.34 0.00 0.00 0.00 173.10 171.18 2gr8 s VAL 1090N -1.56 1.51 -0.09 1.40 -7.23 -1.26 0.23 120.40 113.41 2gr8 s VAL 1090Ca -0.15 -1.21 -0.17 0.00 -1.81 0.00 0.00 61.98 58.64 2gr8 s VAL 1090Cb -0.09 -1.34 0.04 0.00 0.56 0.00 0.00 36.38 35.55 2gr8 s VAL 1090CO -0.01 0.09 0.42 0.00 -0.31 0.00 0.00 175.10 175.29 2gr8 s ALA 1091N -0.89 -1.05 -0.02 1.32 0.00 -0.30 -5.01 121.76 115.81 2gr8 s ALA 1091Ca 0.05 0.86 -0.08 0.00 0.00 0.00 0.00 51.96 52.80 2gr8 s ALA 1091Cb -0.09 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.76 2gr8 s ALA 1091CO 0.02 -0.25 0.17 0.00 0.00 0.00 0.00 175.76 175.70 2gr8 s ALA 1092N -0.62 -0.42 0.03 0.00 0.00 -1.26 -0.17 121.76 119.33 2gr8 s ALA 1092Ca -0.07 0.07 -0.07 0.00 0.00 0.00 0.00 51.96 51.89 2gr8 s ALA 1092Cb -0.04 0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.09 2gr8 s ALA 1092CO 0.03 -0.19 0.13 0.20 0.00 0.00 0.00 175.76 175.93 2gr8 s GLY 1093N -1.05 0.10 0.00 0.00 0.00 1.00 -4.99 107.32 102.38 2gr8 s GLY 1093Ca -0.11 -0.35 0.02 0.00 0.00 0.00 0.00 44.72 44.27 2gr8 s GLY 1093CO 0.02 -0.50 -0.07 0.54 0.00 0.00 0.00 173.10 173.09 2gr8 s VAL 1094N -2.17 0.55 0.04 1.40 0.11 -1.26 -0.55 120.40 118.51 2gr8 s VAL 1094Ca -0.09 -0.38 0.01 0.00 -2.93 0.00 0.00 61.98 58.59 2gr8 s VAL 1094Cb -0.03 -0.48 -0.03 0.00 -1.53 0.00 0.00 36.38 34.31 2gr8 s VAL 1094CO -0.02 0.10 -0.05 -0.83 -3.33 0.00 0.00 175.10 170.97 2gr8 s GLY 1095N -0.31 0.40 -0.05 6.54 0.00 0.21 -5.01 107.32 109.10 2gr8 s GLY 1095Ca 0.01 -0.82 0.02 0.00 0.00 0.00 0.00 44.72 43.94 2gr8 s GLY 1095CO -0.00 -0.89 -0.09 -0.47 0.00 0.00 0.00 173.10 171.64 2gr8 s TYR 1096N -2.08 1.17 -0.04 1.90 5.04 -1.26 -1.55 117.35 120.52 2gr8 s TYR 1096Ca -0.08 -0.39 0.06 0.00 -2.44 0.00 0.00 57.07 54.23 2gr8 s TYR 1096Cb -0.05 -0.89 -0.01 0.00 0.35 0.00 0.00 41.96 41.36 2gr8 s TYR 1096CO -0.03 -0.22 -0.23 1.14 -1.34 0.00 0.00 175.55 174.87 2gr8 s GLN 1097N 0.66 2.19 0.00 4.97 -2.07 -0.11 -5.03 119.66 120.27 2gr8 s GLN 1097Ca -0.12 -0.83 0.00 0.00 -1.82 0.00 0.00 55.36 52.59 2gr8 s GLN 1097Cb -0.14 -1.94 0.00 0.00 -1.09 0.00 0.00 33.01 29.83 2gr8 s GLN 1097CO 0.02 0.40 0.41 -2.67 -1.32 0.00 0.00 175.29 172.13