#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 0.41 -0.68 4.33 1.57 -1.99 -1.98 116.57 118.23 2gr8 h LYS 1022Ca 0.00 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2gr8 h LYS 1022Cb 0.00 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 2gr8 h LYS 1022CO 0.00 0.27 0.29 0.00 -0.57 0.00 0.00 179.45 179.44 2gr8 h ARG 1023N 0.42 1.01 -0.23 3.15 -0.00 -2.00 0.11 114.38 116.84 2gr8 h ARG 1023Ca 0.17 -0.17 -0.05 0.00 -0.50 0.00 0.00 59.98 59.43 2gr8 h ARG 1023Cb 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 29.97 29.86 2gr8 h ARG 1023CO -0.11 0.83 -0.05 0.00 0.00 0.00 0.00 179.97 180.63 2gr8 h ALA 1024N 1.13 0.32 -0.35 0.04 0.00 -1.98 -1.99 119.26 116.43 2gr8 h ALA 1024Ca 0.23 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2gr8 h ALA 1024Cb 0.18 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2gr8 h ALA 1024CO -0.02 0.10 -0.10 -0.44 0.00 0.00 0.00 179.25 178.79 2gr8 h ASP 1025N 0.18 0.58 -0.38 0.00 3.32 -1.24 -1.84 116.42 117.04 2gr8 h ASP 1025Ca 0.06 -0.15 -0.11 0.00 0.02 0.00 0.00 57.03 56.85 2gr8 h ASP 1025Cb 0.51 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2gr8 h ASP 1025CO 0.02 0.72 -0.15 0.00 -1.72 0.00 0.00 179.24 178.11 2gr8 h ALA 1026N 1.34 0.89 -0.25 3.45 0.00 -0.94 -0.75 119.26 123.00 2gr8 h ALA 1026Ca 0.10 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2gr8 h ALA 1026Cb 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2gr8 h ALA 1026CO 0.03 0.63 0.14 0.78 0.00 0.00 0.00 179.25 180.83 2gr8 h GLY 1027N 0.96 0.37 0.67 0.00 0.00 -1.04 -1.41 103.07 102.62 2gr8 h GLY 1027Ca 0.12 -0.17 0.06 0.00 0.00 0.00 0.00 47.33 47.34 2gr8 h GLY 1027CO 0.05 0.16 0.32 -0.84 0.00 0.00 0.00 176.54 176.23 2gr8 h THR 1028N 0.29 0.95 -0.65 4.70 2.02 -1.22 -2.24 112.91 116.76 2gr8 h THR 1028Ca 0.09 -0.21 0.06 0.00 0.77 0.00 0.00 66.41 67.12 2gr8 h THR 1028Cb 0.07 0.29 -0.05 0.00 -1.74 0.00 0.00 68.15 66.71 2gr8 h THR 1028CO -0.01 0.11 0.36 0.00 0.37 0.00 0.00 175.52 176.34 2gr8 h ALA 1029N 1.33 0.86 -0.54 6.16 0.00 -0.83 0.75 119.26 127.00 2gr8 h ALA 1029Ca 0.27 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.24 2gr8 h ALA 1029Cb 0.18 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2gr8 h ALA 1029CO -0.18 0.03 0.31 0.77 0.00 0.00 0.00 179.25 180.17 2gr8 h SER 1030N 0.66 0.48 0.03 0.00 0.02 -0.79 -0.58 113.55 113.37 2gr8 h SER 1030Ca 0.29 0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 61.12 2gr8 h SER 1030Cb 0.18 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 2gr8 h SER 1030CO -0.18 0.33 -0.45 0.00 -1.14 0.00 0.00 176.83 175.39 2gr8 h ALA 1031N 1.26 0.85 -0.60 3.77 0.00 -0.90 -1.59 119.26 122.04 2gr8 h ALA 1031Ca 0.22 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 2gr8 h ALA 1031Cb 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2gr8 h ALA 1031CO -0.12 0.65 0.17 -0.07 0.00 0.00 0.00 179.25 179.88 2gr8 h LEU 1032N 0.41 0.89 -0.05 0.00 3.38 -0.57 -1.32 115.31 118.05 2gr8 h LEU 1032Ca 0.03 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2gr8 h LEU 1032Cb 0.95 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2gr8 h LEU 1032CO 0.08 0.87 0.03 0.00 0.09 0.00 0.00 178.44 179.51 2gr8 h ALA 1033N 1.05 0.06 -0.57 1.53 0.00 -0.97 -3.03 119.26 117.34 2gr8 h ALA 1033Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2gr8 h ALA 1033Cb 0.31 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2gr8 h ALA 1033CO -0.00 -0.39 0.36 0.00 0.00 0.00 0.00 179.25 179.21 2gr8 h ALA 1034N 0.93 1.57 0.00 0.00 0.00 -1.20 -2.35 119.26 118.21 2gr8 h ALA 1034Ca 0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2gr8 h ALA 1034Cb 0.09 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2gr8 h ALA 1034CO -0.00 0.39 -0.05 0.66 0.00 0.00 0.00 179.25 180.25 2gr8 h SER 1035N 0.77 0.00 -0.42 0.00 4.64 -1.11 -2.77 113.55 114.66 2gr8 h SER 1035Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2gr8 h SER 1035Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2gr8 h SER 1035CO -0.04 0.05 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 2gr8 n GLN 1036N -3.38 2.44 -1.99 4.77 1.13 -0.89 -4.92 117.38 114.54 2gr8 n GLN 1036Ca -0.02 -2.20 -0.42 0.00 -1.94 0.00 0.00 57.00 52.42 2gr8 n GLN 1036Cb 0.18 -1.43 -0.03 0.00 0.11 0.00 0.00 30.24 29.08 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 -1.18 4.30 0.53 1.08 1.43 -1.05 -4.90 118.68 118.90 2gr8 s LEU 1037Ca 0.34 2.23 -0.22 0.00 -1.03 0.00 0.00 54.13 55.45 2gr8 s LEU 1037Cb 0.19 -3.53 -0.05 0.00 0.03 0.00 0.00 46.19 42.82 2gr8 s LEU 1037CO 0.26 -0.96 1.35 -2.84 0.23 0.00 0.00 176.35 174.39 2gr8 s PRO 1038N 4.12 3.25 0.01 1.29 0.02 -1.26 -5.03 135.00 137.40 2gr8 s PRO 1038Ca 0.75 2.23 0.03 0.00 0.02 0.00 0.00 61.00 64.02 2gr8 s PRO 1038Cb -0.33 -2.32 -0.03 0.00 0.02 0.00 0.00 34.50 31.84 2gr8 s PRO 1038CO 0.30 -1.10 -0.04 -1.14 -0.33 0.00 0.00 177.00 174.69 2gr8 s GLN 1039N -2.84 2.62 0.54 5.54 0.74 -1.26 -4.79 119.66 120.22 2gr8 s GLN 1039Ca 0.70 -0.70 -0.21 0.00 0.05 0.00 0.00 55.36 55.20 2gr8 s GLN 1039Cb -0.40 -2.55 -0.06 0.00 1.10 0.00 0.00 33.01 31.09 2gr8 s GLN 1039CO 0.48 0.60 1.05 0.00 -0.55 0.00 0.00 175.29 176.88 2gr8 n ALA 1040N 1.44 0.46 0.00 1.58 0.00 -1.26 -4.95 120.51 117.78 2gr8 n ALA 1040Ca -0.15 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2gr8 n ALA 1040Cb 0.53 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.83 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 -1.25 0.00 -4.58 0.00 -2.24 -1.26 -4.94 114.28 100.00 2gr8 n THR 1041Ca 0.12 -0.30 -0.34 0.00 -2.27 0.00 0.00 64.05 61.26 2gr8 n THR 1041Cb 0.45 0.91 -0.12 0.00 -2.10 0.00 0.00 70.33 69.47 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 -0.79 3.01 0.31 -0.78 -1.94 -1.26 -5.08 119.30 112.77 2gr8 s MET 1042Ca 0.00 -0.55 -0.29 0.00 -1.71 0.00 0.00 55.69 53.14 2gr8 s MET 1042Cb 0.00 -2.67 -0.12 0.00 2.01 0.00 0.00 34.83 34.05 2gr8 s MET 1042CO 0.00 0.54 1.47 -2.30 -0.01 0.00 0.00 175.02 174.72 2gr8 n PRO 1043N 2.61 2.46 -0.93 2.03 -0.02 -1.26 -2.47 135.00 137.42 2gr8 n PRO 1043Ca -0.18 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2gr8 n PRO 1043Cb 0.53 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 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 1.47 0.75 3.80 -1.23 0.00 -0.71 -4.89 105.19 104.38 2gr8 n GLY 1044Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.20 2.98 0.02 1.61 1.02 -1.03 -4.87 119.74 119.27 2gr8 s LYS 1045Ca 0.00 -0.65 0.03 0.00 0.02 0.00 0.00 55.97 55.38 2gr8 s LYS 1045Cb 0.00 -2.78 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 2gr8 s LYS 1045CO 0.00 0.57 -0.05 -1.12 -0.92 0.00 0.00 175.35 173.83 2gr8 s SER 1046N -2.43 4.74 -0.04 2.83 0.01 -1.26 -1.84 113.70 115.72 2gr8 s SER 1046Ca 0.30 -0.15 0.05 0.00 1.31 0.00 0.00 55.95 57.46 2gr8 s SER 1046Cb -0.12 -1.12 -0.01 0.00 0.21 0.00 0.00 66.02 64.98 2gr8 s SER 1046CO 0.23 0.26 -0.18 -0.32 0.41 0.00 0.00 173.24 173.64 2gr8 s MET 1047N -1.64 1.78 -0.12 12.44 1.75 0.10 -4.99 119.30 128.62 2gr8 s MET 1047Ca 0.19 -0.65 -0.04 0.00 -1.25 0.00 0.00 55.69 53.94 2gr8 s MET 1047Cb -0.11 -1.58 -0.03 0.00 2.84 0.00 0.00 34.83 35.94 2gr8 s MET 1047CO 0.10 0.30 0.01 0.08 -0.65 0.00 0.00 175.02 174.86 2gr8 s VAL 1048N -0.11 4.38 0.03 10.11 1.01 -1.26 -1.02 120.40 133.55 2gr8 s VAL 1048Ca -0.01 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2gr8 s VAL 1048Cb -0.11 -2.89 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 2gr8 s VAL 1048CO 0.02 0.55 -0.06 0.00 0.00 0.00 0.00 175.10 175.61 2gr8 s ALA 1049N -0.35 0.38 -0.01 5.51 0.00 0.16 -5.00 121.76 122.45 2gr8 s ALA 1049Ca 0.07 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.40 2gr8 s ALA 1049Cb -0.12 0.07 -0.00 0.00 0.00 0.00 0.00 23.12 23.07 2gr8 s ALA 1049CO 0.02 -0.06 -0.06 -1.50 0.00 0.00 0.00 175.76 174.15 2gr8 s ILE 1050N -1.31 0.51 -0.00 0.00 2.07 -1.26 -0.32 121.20 120.89 2gr8 s ILE 1050Ca -0.11 -0.25 -0.06 0.00 -1.41 0.00 0.00 60.65 58.81 2gr8 s ILE 1050Cb -0.09 -0.45 0.00 0.00 0.13 0.00 0.00 42.46 42.05 2gr8 s ILE 1050CO -0.00 0.16 0.12 0.00 -1.91 0.00 0.00 174.94 173.30 2gr8 s ALA 1051N -0.00 -0.28 0.22 1.50 0.00 0.37 -4.89 121.76 118.67 2gr8 s ALA 1051Ca 0.01 -0.13 0.02 0.00 0.00 0.00 0.00 51.96 51.85 2gr8 s ALA 1051Cb -0.04 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.11 2gr8 s ALA 1051CO -0.00 -0.19 0.03 0.20 0.00 0.00 0.00 175.76 175.80 2gr8 s GLY 1052N -1.25 1.47 0.15 0.00 0.00 -1.26 -0.02 107.32 106.41 2gr8 s GLY 1052Ca -0.13 -1.72 -0.14 0.00 0.00 0.00 0.00 44.72 42.72 2gr8 s GLY 1052CO 0.01 -1.59 0.38 -1.35 0.00 0.00 0.00 173.10 170.55 2gr8 s SER 1053N -3.25 -0.14 -0.05 1.64 1.04 -0.35 -4.58 113.70 108.01 2gr8 s SER 1053Ca 0.29 -0.52 0.01 0.00 0.48 0.00 0.00 55.95 56.22 2gr8 s SER 1053Cb 0.06 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.68 2gr8 s SER 1053CO 0.08 -0.90 -0.05 -0.44 0.98 0.00 0.00 173.24 172.91 2gr8 s SER 1054N -2.86 1.06 -0.19 7.02 0.01 -1.26 -2.07 113.70 115.41 2gr8 s SER 1054Ca 0.08 -0.14 -0.05 0.00 1.31 0.00 0.00 55.95 57.15 2gr8 s SER 1054Cb 0.02 -0.48 0.10 0.00 0.21 0.00 0.00 66.02 65.86 2gr8 s SER 1054CO -0.07 -0.06 0.35 -0.47 0.41 0.00 0.00 173.24 173.41 2gr8 s TYR 1055N 0.97 -0.67 -1.51 2.43 5.04 0.54 -4.95 117.35 119.20 2gr8 s TYR 1055Ca -0.10 1.11 -0.11 0.00 -2.44 0.00 0.00 57.07 55.53 2gr8 s TYR 1055Cb -0.14 0.10 0.08 0.00 0.35 0.00 0.00 41.96 42.34 2gr8 s TYR 1055CO -0.00 -0.52 0.88 1.04 -1.34 0.00 0.00 175.55 175.61 2gr8 n GLN 1056N 5.37 -5.00 0.00 4.97 1.13 -1.26 -0.83 117.38 121.76 2gr8 n GLN 1056Ca -0.06 0.56 0.00 0.00 -1.94 0.00 0.00 57.00 55.56 2gr8 n GLN 1056Cb 0.50 -5.33 0.00 0.00 0.11 0.00 0.00 30.24 25.52 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 -1.66 2.31 3.93 1.08 0.00 -1.26 -5.03 105.19 104.56 2gr8 n GLY 1057Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.28 3.48 0.10 1.61 -1.52 -0.01 -5.10 119.66 117.94 2gr8 s GLN 1058Ca 0.00 -0.42 0.10 0.00 -1.95 0.00 0.00 55.36 53.09 2gr8 s GLN 1058Cb 0.00 -2.96 -0.04 0.00 -0.22 0.00 0.00 33.01 29.79 2gr8 s GLN 1058CO 0.00 0.53 -0.25 -0.80 -0.25 0.00 0.00 175.29 174.52 2gr8 s ASN 1059N -2.81 3.42 0.11 5.90 0.01 -1.26 -0.34 114.94 119.97 2gr8 s ASN 1059Ca 0.36 -0.66 0.10 0.00 -0.71 0.00 0.00 52.86 51.95 2gr8 s ASN 1059Cb -0.12 -0.32 -0.04 0.00 0.41 0.00 0.00 41.25 41.18 2gr8 s ASN 1059CO 0.28 0.20 -0.24 -0.83 -1.51 0.00 0.00 177.10 175.00 2gr8 s GLY 1060N -1.84 1.41 -0.03 0.66 0.00 -0.88 -1.12 107.32 105.52 2gr8 s GLY 1060Ca 0.14 -1.35 0.01 0.00 0.00 0.00 0.00 44.72 43.52 2gr8 s GLY 1060CO 0.06 -1.33 -0.03 -2.27 0.00 0.00 0.00 173.10 169.53 2gr8 s LEU 1061N -1.92 1.47 -0.02 0.66 2.96 -0.08 -1.21 118.68 120.54 2gr8 s LEU 1061Ca 0.10 -0.07 0.03 0.00 -0.22 0.00 0.00 54.13 53.97 2gr8 s LEU 1061Cb -0.10 -0.29 -0.00 0.00 0.50 0.00 0.00 46.19 46.30 2gr8 s LEU 1061CO 0.05 -0.04 -0.09 0.00 -1.32 0.00 0.00 176.35 174.95 2gr8 s ALA 1062N 0.65 0.79 -0.04 5.97 0.00 0.97 -0.71 121.76 129.39 2gr8 s ALA 1062Ca -0.07 -0.35 0.07 0.00 0.00 0.00 0.00 51.96 51.61 2gr8 s ALA 1062Cb -0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 2gr8 s ALA 1062CO -0.01 0.15 -0.24 0.96 0.00 0.00 0.00 175.76 176.63 2gr8 s ILE 1063N 0.01 2.17 -0.01 0.00 -4.36 -0.18 -0.48 121.20 118.36 2gr8 s ILE 1063Ca -0.00 -1.04 -0.04 0.00 -0.26 0.00 0.00 60.65 59.31 2gr8 s ILE 1063Cb -0.06 -1.78 0.00 0.00 1.25 0.00 0.00 42.46 41.87 2gr8 s ILE 1063CO 0.00 0.58 0.08 -0.83 0.24 0.00 0.00 174.94 175.01 2gr8 s GLY 1064N -0.40 0.02 0.04 6.27 0.00 0.56 -0.98 107.32 112.83 2gr8 s GLY 1064Ca 0.04 -0.01 0.09 0.00 0.00 0.00 0.00 44.72 44.84 2gr8 s GLY 1064CO 0.01 -0.08 -0.26 -1.34 0.00 0.00 0.00 173.10 171.43 2gr8 s VAL 1065N -0.63 2.10 0.04 1.40 -7.23 0.62 0.37 120.40 117.08 2gr8 s VAL 1065Ca -0.07 -1.36 -0.01 0.00 -1.81 0.00 0.00 61.98 58.73 2gr8 s VAL 1065Cb -0.04 -1.80 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 2gr8 s VAL 1065CO 0.00 0.37 -0.02 -0.94 -0.31 0.00 0.00 175.10 174.21 2gr8 s SER 1066N -1.19 0.42 -0.17 4.85 1.04 -0.18 -0.70 113.70 117.76 2gr8 s SER 1066Ca 0.11 -0.87 -0.15 0.00 0.48 0.00 0.00 55.95 55.52 2gr8 s SER 1066Cb -0.10 0.19 0.04 0.00 0.10 0.00 0.00 66.02 66.25 2gr8 s SER 1066CO 0.02 -0.54 0.44 -0.60 0.98 0.00 0.00 173.24 173.54 2gr8 s ARG 1067N -3.38 0.51 -0.10 4.02 3.52 -0.75 0.03 118.95 122.80 2gr8 s ARG 1067Ca 0.02 0.62 -0.00 0.00 -0.13 0.00 0.00 55.73 56.24 2gr8 s ARG 1067Cb 0.04 0.25 -0.02 0.00 -1.56 0.00 0.00 34.95 33.65 2gr8 s ARG 1067CO -0.08 -0.06 -0.09 0.42 -0.81 0.00 0.00 175.30 174.68 2gr8 s ILE 1068N 0.25 3.48 0.86 4.11 1.01 -0.76 -1.49 121.20 128.67 2gr8 s ILE 1068Ca -0.00 -0.54 -0.12 0.00 0.00 0.00 0.00 60.65 59.99 2gr8 s ILE 1068Cb -0.03 -2.45 0.11 0.00 0.01 0.00 0.00 42.46 40.10 2gr8 s ILE 1068CO 0.00 0.55 1.12 -1.54 0.00 0.00 0.00 174.94 175.08 2gr8 n SER 1069N 2.88 0.50 0.27 3.58 3.41 0.21 -1.73 113.62 122.74 2gr8 n SER 1069Ca -0.18 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.05 2gr8 n SER 1069Cb 0.53 -1.47 0.77 0.00 -0.26 0.00 0.00 64.21 63.77 2gr8 n SER 1069CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2gr8 h ASP 1070N -1.37 0.00 0.22 4.04 3.45 -1.90 0.75 116.42 121.62 2gr8 h ASP 1070Ca -0.45 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.01 2gr8 h ASP 1070Cb 1.29 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.06 2gr8 h ASP 1070CO 0.43 0.03 -0.09 -0.46 -1.57 0.00 0.00 179.24 177.58 2gr8 n ASN 1071N -4.10 0.66 0.00 6.45 0.23 -1.26 -4.42 115.26 112.83 2gr8 n ASN 1071Ca -0.03 -0.85 0.00 0.00 -0.53 0.00 0.00 54.58 53.17 2gr8 n ASN 1071Cb 0.12 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.79 2gr8 n ASN 1071CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2gr8 n GLY 1072N 1.23 0.81 0.09 4.83 0.00 0.19 -4.91 105.19 107.42 2gr8 n GLY 1072Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.07 2gr8 n GLY 1072CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2gr8 n LYS 1073N -2.29 0.66 -4.44 1.61 5.02 -1.26 -4.85 118.16 112.60 2gr8 n LYS 1073Ca 0.00 0.26 -0.34 0.00 -2.02 0.00 0.00 58.31 56.21 2gr8 n LYS 1073Cb 0.01 -1.75 -0.13 0.00 -0.02 0.00 0.00 35.03 33.14 2gr8 n LYS 1073CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2gr8 s VAL 1074N -2.58 3.56 -0.07 -0.18 1.01 -1.26 -0.65 120.40 120.23 2gr8 s VAL 1074Ca -0.09 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.46 2gr8 s VAL 1074Cb 0.08 -2.55 -0.00 0.00 0.00 0.00 0.00 36.38 33.90 2gr8 s VAL 1074CO 0.81 0.49 -0.20 -0.63 0.00 0.00 0.00 175.10 175.57 2gr8 s ILE 1075N 0.53 1.74 0.04 2.22 1.01 -0.53 -0.62 121.20 125.59 2gr8 s ILE 1075Ca -0.05 -0.86 0.09 0.00 0.00 0.00 0.00 60.65 59.83 2gr8 s ILE 1075Cb -0.15 -1.51 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 2gr8 s ILE 1075CO 0.03 0.49 -0.25 0.27 0.00 0.00 0.00 174.94 175.48 2gr8 s ILE 1076N 0.22 2.24 -0.03 2.92 -4.36 -0.55 -0.55 121.20 121.09 2gr8 s ILE 1076Ca -0.11 -1.33 0.02 0.00 -0.26 0.00 0.00 60.65 58.97 2gr8 s ILE 1076Cb -0.15 -1.87 0.01 0.00 1.25 0.00 0.00 42.46 41.69 2gr8 s ILE 1076CO 0.05 0.38 -0.08 -0.13 0.24 0.00 0.00 174.94 175.41 2gr8 s ARG 1077N -1.21 0.92 -0.01 0.37 0.52 -0.21 -1.82 118.95 117.51 2gr8 s ARG 1077Ca 0.12 -0.25 0.01 0.00 -0.52 0.00 0.00 55.73 55.08 2gr8 s ARG 1077Cb -0.10 -0.87 0.01 0.00 0.52 0.00 0.00 34.95 34.51 2gr8 s ARG 1077CO 0.02 0.07 -0.02 -1.17 0.02 0.00 0.00 175.30 174.22 2gr8 s LEU 1078N 0.35 1.65 0.00 2.53 2.96 0.12 -0.30 118.68 125.99 2gr8 s LEU 1078Ca -0.05 -0.05 -0.06 0.00 -0.22 0.00 0.00 54.13 53.75 2gr8 s LEU 1078Cb -0.10 -0.21 -0.00 0.00 0.50 0.00 0.00 46.19 46.38 2gr8 s LEU 1078CO 0.01 -0.02 0.11 -0.94 -1.32 0.00 0.00 176.35 174.19 2gr8 s SER 1079N 0.39 0.05 -0.03 3.68 1.04 0.36 -0.27 113.70 118.92 2gr8 s SER 1079Ca -0.04 -0.22 0.07 0.00 0.48 0.00 0.00 55.95 56.24 2gr8 s SER 1079Cb -0.07 0.19 -0.02 0.00 0.10 0.00 0.00 66.02 66.23 2gr8 s SER 1079CO -0.01 -0.33 -0.25 -0.83 0.98 0.00 0.00 173.24 172.80 2gr8 s GLY 1080N -1.29 1.25 0.13 7.32 0.00 -0.15 -1.68 107.32 112.89 2gr8 s GLY 1080Ca -0.14 -1.08 0.07 0.00 0.00 0.00 0.00 44.72 43.57 2gr8 s GLY 1080CO 0.01 -0.85 -0.16 -0.51 0.00 0.00 0.00 173.10 171.58 2gr8 s THR 1081N -0.51 1.51 0.27 0.90 -4.23 0.82 -1.01 115.64 113.39 2gr8 s THR 1081Ca 0.07 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 2gr8 s THR 1081Cb -0.11 -1.59 -0.03 0.00 1.34 0.00 0.00 72.50 72.12 2gr8 s THR 1081CO -0.00 -0.31 0.25 0.28 -0.54 0.00 0.00 174.62 174.30 2gr8 s THR 1082N -1.89 0.00 0.31 3.99 -1.32 0.12 -1.05 115.64 115.81 2gr8 s THR 1082Ca 0.10 -1.89 0.00 0.00 -1.21 0.00 0.00 61.69 58.68 2gr8 s THR 1082Cb -0.06 -2.49 0.00 0.00 -1.51 0.00 0.00 72.50 68.44 2gr8 s THR 1082CO 0.04 0.00 0.40 -0.46 -2.21 0.00 0.00 174.62 172.39 2gr8 n ASN 1083N -0.85 -1.10 0.01 8.08 2.04 -1.20 -0.90 115.26 121.34 2gr8 n ASN 1083Ca 0.03 -2.77 0.05 0.00 -0.44 0.00 0.00 54.58 51.46 2gr8 n ASN 1083Cb 0.64 2.13 0.24 0.00 -2.53 0.00 0.00 39.78 40.25 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 -1.71 0.04 -0.90 0.53 3.41 -0.28 -0.59 113.62 114.13 2gr8 n SER 1084Ca 0.02 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.26 2gr8 n SER 1084Cb 0.53 -0.52 0.24 0.00 -0.26 0.00 0.00 64.21 64.20 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 -1.55 2.21 -1.33 4.33 1.13 -1.26 -4.97 117.38 115.94 2gr8 n GLN 1085Ca 0.02 -1.79 -0.09 0.00 -1.94 0.00 0.00 57.00 53.19 2gr8 n GLN 1085Cb 0.12 -1.47 -0.04 0.00 0.11 0.00 0.00 30.24 28.96 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 1.35 1.03 3.67 1.08 0.00 0.24 -5.00 105.19 107.56 2gr8 n GLY 1086Ca 0.17 -0.60 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.90 4.18 0.22 1.61 -0.14 -1.26 -4.85 119.74 116.60 2gr8 s LYS 1087Ca 0.00 0.29 -0.03 0.00 -1.36 0.00 0.00 55.97 54.87 2gr8 s LYS 1087Cb 0.00 -3.54 -0.05 0.00 -1.68 0.00 0.00 37.83 32.56 2gr8 s LYS 1087CO 0.00 -0.08 0.45 0.95 -0.76 0.00 0.00 175.35 175.91 2gr8 s THR 1088N 1.42 5.13 0.02 2.17 -4.23 -1.26 -3.24 115.64 115.65 2gr8 s THR 1088Ca 0.21 -0.14 -0.03 0.00 -1.18 0.00 0.00 61.69 60.55 2gr8 s THR 1088Cb -0.15 -3.71 -0.01 0.00 1.34 0.00 0.00 72.50 69.97 2gr8 s THR 1088CO 0.09 -0.18 0.05 -0.83 -0.54 0.00 0.00 174.62 173.20 2gr8 s GLY 1089N -3.02 0.17 0.02 3.99 0.00 -0.21 -4.97 107.32 103.30 2gr8 s GLY 1089Ca 0.41 -0.45 0.06 0.00 0.00 0.00 0.00 44.72 44.73 2gr8 s GLY 1089CO 0.28 -0.56 -0.18 -1.34 0.00 0.00 0.00 173.10 171.31 2gr8 s VAL 1090N -1.73 1.40 -0.06 1.40 -7.23 -1.26 -0.13 120.40 112.79 2gr8 s VAL 1090Ca -0.13 -0.94 -0.12 0.00 -1.81 0.00 0.00 61.98 58.98 2gr8 s VAL 1090Cb -0.07 -1.20 0.02 0.00 0.56 0.00 0.00 36.38 35.69 2gr8 s VAL 1090CO -0.01 0.24 0.30 0.00 -0.31 0.00 0.00 175.10 175.32 2gr8 s ALA 1091N -0.62 -0.74 -0.04 1.32 0.00 -0.67 -5.03 121.76 115.98 2gr8 s ALA 1091Ca 0.06 0.54 -0.11 0.00 0.00 0.00 0.00 51.96 52.45 2gr8 s ALA 1091Cb -0.08 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.87 2gr8 s ALA 1091CO 0.01 -0.20 0.24 0.00 0.00 0.00 0.00 175.76 175.81 2gr8 s ALA 1092N -0.65 -0.61 0.05 0.00 0.00 -1.26 -0.48 121.76 118.82 2gr8 s ALA 1092Ca -0.07 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.18 2gr8 s ALA 1092Cb -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 2gr8 s ALA 1092CO 0.02 -0.20 0.04 0.20 0.00 0.00 0.00 175.76 175.83 2gr8 s GLY 1093N -0.86 0.31 -0.00 0.00 0.00 0.59 -4.99 107.32 102.37 2gr8 s GLY 1093Ca -0.09 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.71 2gr8 s GLY 1093CO 0.02 -1.04 -0.01 0.54 0.00 0.00 0.00 173.10 172.61 2gr8 s VAL 1094N -3.52 0.08 0.05 1.40 0.11 -1.26 -1.04 120.40 116.21 2gr8 s VAL 1094Ca 0.03 -0.04 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 2gr8 s VAL 1094Cb 0.05 -0.07 -0.03 0.00 -1.53 0.00 0.00 36.38 34.80 2gr8 s VAL 1094CO -0.09 0.02 -0.07 -0.83 -3.33 0.00 0.00 175.10 170.81 2gr8 s GLY 1095N -0.02 0.52 -0.05 6.54 0.00 0.29 -5.01 107.32 109.60 2gr8 s GLY 1095Ca 0.00 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 43.87 2gr8 s GLY 1095CO -0.00 -0.94 -0.07 -0.47 0.00 0.00 0.00 173.10 171.62 2gr8 s TYR 1096N -1.90 0.93 -0.09 1.90 5.04 -1.26 -1.46 117.35 120.51 2gr8 s TYR 1096Ca -0.06 -0.29 0.03 0.00 -2.44 0.00 0.00 57.07 54.31 2gr8 s TYR 1096Cb -0.06 -0.76 0.01 0.00 0.35 0.00 0.00 41.96 41.49 2gr8 s TYR 1096CO -0.01 -0.20 -0.18 1.14 -1.34 0.00 0.00 175.55 174.96 2gr8 s GLN 1097N 0.79 2.39 0.00 4.97 -2.07 0.18 -5.03 119.66 120.88 2gr8 s GLN 1097Ca -0.12 -0.64 0.25 0.00 -1.82 0.00 0.00 55.36 53.03 2gr8 s GLN 1097Cb -0.14 -1.91 0.45 0.00 -1.09 0.00 0.00 33.01 30.32 2gr8 s GLN 1097CO 0.01 0.06 1.41 0.91 -1.32 0.00 0.00 175.29 176.36