#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zae n MET 62 N 0.00 3.07 -3.75 -0.41 2.81 -1.26 -4.84 117.12 112.74 1zae n MET 62 Ca 0.00 -1.84 -0.10 0.00 -1.81 0.00 0.00 57.70 53.95 1zae n MET 62 Cb 0.00 -2.59 -0.06 0.00 -0.71 0.00 0.00 33.22 29.86 1zae n MET 62 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1zae s ASP 63 N 2.42 -0.10 -0.90 7.83 2.15 -1.26 -5.10 116.67 121.71 1zae s ASP 63 Ca 0.62 -0.50 -0.18 0.00 0.43 0.00 0.00 52.55 52.92 1zae s ASP 63 Cb 0.18 0.44 -0.24 0.00 -0.30 0.00 0.00 42.92 43.00 1zae s ASP 63 CO -0.05 -0.85 2.30 2.29 -0.17 0.00 0.00 175.17 178.69 1zae n LYS 64 N -0.19 0.26 -0.10 4.34 2.85 -1.26 -4.80 118.16 119.25 1zae n LYS 64 Ca -0.14 -0.33 0.00 0.00 -1.05 0.00 0.00 58.31 56.80 1zae n LYS 64 Cb 0.63 -2.17 0.00 0.00 -0.65 0.00 0.00 35.03 32.85 1zae n LYS 64 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1zae n THR 65 N 6.99 1.05 -2.21 0.58 -1.04 -1.26 -4.84 114.28 113.54 1zae n THR 65 Ca 0.59 -0.10 -0.32 0.00 -2.04 0.00 0.00 64.05 62.18 1zae n THR 65 Cb 0.26 -1.04 -0.02 0.00 -1.82 0.00 0.00 70.33 67.71 1zae n THR 65 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1zae s VAL 66 N 0.19 4.44 0.20 12.58 0.11 -1.26 -4.77 120.40 131.88 1zae s VAL 66 Ca 0.00 1.08 -0.32 0.00 -2.93 0.00 0.00 61.98 59.81 1zae s VAL 66 Cb 0.00 -3.68 -0.15 0.00 -1.53 0.00 0.00 36.38 31.02 1zae s VAL 66 CO 0.00 -0.75 1.24 -0.46 -3.33 0.00 0.00 175.10 171.79 1zae n ASN 67 N -1.93 1.81 -3.47 3.54 6.94 -1.26 -4.04 115.26 116.85 1zae n ASN 67 Ca 0.07 1.14 -0.14 0.00 -0.02 0.00 0.00 54.58 55.64 1zae n ASN 67 Cb 0.54 -1.29 0.00 0.00 -2.36 0.00 0.00 39.78 36.67 1zae n ASN 67 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1zae n LEU 68 N 2.04 -4.09 -4.95 -4.53 4.32 -1.26 -5.03 117.00 103.50 1zae n LEU 68 Ca 0.14 -0.57 -0.28 0.00 -0.02 0.00 0.00 56.01 55.28 1zae n LEU 68 Cb 0.27 -2.39 0.15 0.00 -1.62 0.00 0.00 43.42 39.84 1zae n LEU 68 CO 0.61 -0.29 0.77 -0.55 -1.22 0.00 0.00 177.39 176.71 1zae s SER 69 N -2.99 3.62 0.17 -1.43 0.15 -1.26 -4.76 113.70 107.20 1zae s SER 69 Ca 0.00 0.15 -0.26 0.00 0.70 0.00 0.00 55.95 56.54 1zae s SER 69 Cb -0.00 -0.34 0.03 0.00 -1.71 0.00 0.00 66.02 64.00 1zae s SER 69 CO 0.83 -2.39 1.56 0.00 1.20 0.00 0.00 173.24 174.44 1zae h ALA 70 N -1.26 -0.34 0.63 5.45 0.00 -1.97 -0.84 119.26 120.93 1zae h ALA 70 Ca -0.42 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1zae h ALA 70 Cb 1.25 1.04 -0.00 0.00 0.00 0.00 0.00 17.79 20.08 1zae h ALA 70 CO 0.42 -0.84 -0.41 0.00 0.00 0.00 0.00 179.25 178.42 1zae h GLU 72 N -0.97 0.10 -0.23 0.00 9.09 -1.88 0.53 114.58 121.21 1zae h GLU 72 Ca -0.08 -0.02 -0.02 0.00 0.05 0.00 0.00 59.36 59.29 1zae h GLU 72 Cb 0.79 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.86 1zae h GLU 72 CO 0.07 0.22 0.06 0.28 0.05 0.00 0.00 179.01 179.70 1zae h VAL 73 N 0.10 1.20 -0.72 -1.06 2.07 -1.08 0.15 116.25 116.91 1zae h VAL 73 Ca 0.02 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 1zae h VAL 73 Cb 0.27 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1zae h VAL 73 CO 0.02 0.21 0.37 0.00 0.02 0.00 0.00 177.57 178.19 1zae h ALA 74 N 0.88 1.30 -0.36 1.67 0.00 -0.14 -0.95 119.26 121.66 1zae h ALA 74 Ca 0.07 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1zae h ALA 74 Cb 0.26 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1zae h ALA 74 CO -0.00 0.56 -0.19 0.28 0.00 0.00 0.00 179.25 179.90 1zae h VAL 75 N 1.01 1.26 -0.18 0.00 2.07 -0.75 -1.57 116.25 118.10 1zae h VAL 75 Ca 0.25 -1.25 0.04 0.00 0.82 0.00 0.00 66.70 66.57 1zae h VAL 75 Cb 0.06 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1zae h VAL 75 CO -0.04 0.41 0.12 -0.07 0.02 0.00 0.00 177.57 178.02 1zae h LEU 76 N 0.60 0.04 -0.16 2.57 3.38 0.08 0.51 115.31 122.33 1zae h LEU 76 Ca 0.09 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1zae h LEU 76 Cb 0.66 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1zae h LEU 76 CO 0.05 0.03 -0.03 -2.24 0.09 0.00 0.00 178.44 176.33 1zae h ASP 77 N 0.05 0.31 -0.60 -0.43 3.04 -0.21 -0.66 116.42 117.91 1zae h ASP 77 Ca 0.08 -0.36 -0.05 0.00 -3.24 0.00 0.00 57.03 53.46 1zae h ASP 77 Cb 0.27 -0.08 -0.03 0.00 -1.04 0.00 0.00 39.33 38.44 1zae h ASP 77 CO -0.01 0.59 0.20 -0.07 -2.04 0.00 0.00 179.24 177.92 1zae h LEU 78 N 0.02 0.90 0.65 0.15 3.38 -1.11 -0.08 115.31 119.22 1zae h LEU 78 Ca 0.04 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1zae h LEU 78 Cb 0.46 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1zae h LEU 78 CO 0.01 0.85 -0.46 1.88 0.09 0.00 0.00 178.44 180.81 1zae h TYR 79 N 0.94 -1.25 0.00 1.13 0.05 -0.70 0.14 116.97 117.27 1zae h TYR 79 Ca 0.21 -0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.90 1zae h TYR 79 Cb 0.27 0.46 -0.01 0.00 1.01 0.00 0.00 36.73 38.46 1zae h TYR 79 CO 0.02 -0.67 -0.40 0.93 -1.05 0.00 0.00 178.16 176.99 1zae h GLU 80 N -1.07 0.00 -0.63 4.88 4.39 -0.93 0.26 114.58 121.49 1zae h GLU 80 Ca -0.08 0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.72 1zae h GLU 80 Cb 0.88 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.45 1zae h GLU 80 CO 0.04 0.40 0.21 0.37 -1.16 0.00 0.00 179.01 178.88 1zae h GLN 81 N 0.00 0.37 -0.03 2.33 -0.00 -0.98 -0.21 115.11 116.59 1zae h GLN 81 Ca -0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1zae h GLN 81 Cb 0.78 -0.08 0.00 0.00 0.00 0.00 0.00 27.48 28.18 1zae h GLN 81 CO 0.05 0.24 0.00 -1.13 0.00 0.00 0.00 178.83 178.00 1zae n SER 82 N -5.03 0.27 -3.74 -0.69 3.41 0.26 -4.95 113.62 103.15 1zae n SER 82 Ca 0.10 -1.56 -0.27 0.00 -0.26 0.00 0.00 58.87 56.87 1zae n SER 82 Cb 0.31 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.24 1zae n SER 82 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1zae n ASN 83 N -0.56 -3.51 -4.23 4.04 2.85 0.55 -4.99 115.26 109.40 1zae n ASN 83 Ca 0.12 -0.88 -0.38 0.00 -0.11 0.00 0.00 54.58 53.33 1zae n ASN 83 Cb 0.09 -1.24 -0.12 0.00 1.24 0.00 0.00 39.78 39.75 1zae n ASN 83 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1zae s ILE 84 N -3.23 3.66 0.20 -1.44 1.01 0.60 -4.94 121.20 117.05 1zae s ILE 84 Ca 0.17 -1.39 -0.27 0.00 0.00 0.00 0.00 60.65 59.16 1zae s ILE 84 Cb -0.09 -3.18 -0.08 0.00 0.01 0.00 0.00 42.46 39.11 1zae s ILE 84 CO 0.73 -0.32 0.84 -0.60 0.00 0.00 0.00 174.94 175.59 1zae s ARG 85 N 1.34 4.69 -0.21 2.79 3.52 -1.26 -4.50 118.95 125.31 1zae s ARG 85 Ca 0.00 1.29 -0.05 0.00 -0.13 0.00 0.00 55.73 56.84 1zae s ARG 85 Cb -0.21 -3.27 -0.02 0.00 -1.56 0.00 0.00 34.95 29.89 1zae s ARG 85 CO 0.01 0.55 0.01 0.42 -0.81 0.00 0.00 175.30 175.48 1zae s ILE 86 N -1.16 3.95 0.50 4.11 -1.09 -1.26 -5.10 121.20 121.14 1zae s ILE 86 Ca 0.38 -0.31 -0.22 0.00 -2.23 0.00 0.00 60.65 58.27 1zae s ILE 86 Cb -0.24 -2.80 -0.08 0.00 -1.58 0.00 0.00 42.46 37.76 1zae s ILE 86 CO 0.29 0.41 1.03 -2.65 -1.23 0.00 0.00 174.94 172.79 1zae n PRO 87 N 4.40 1.26 0.05 2.79 -0.02 -1.26 -4.93 135.00 137.29 1zae n PRO 87 Ca -0.17 0.46 -0.11 0.00 -2.02 0.00 0.00 63.50 61.66 1zae n PRO 87 Cb 0.52 -2.16 -0.05 0.00 -0.02 0.00 0.00 33.50 31.79 1zae n PRO 87 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1zae h SER 88 N 1.17 -0.79 -0.63 2.55 4.64 -2.00 -2.71 113.55 115.78 1zae h SER 88 Ca -0.47 0.11 0.10 0.00 -0.47 0.00 0.00 61.79 61.06 1zae h SER 88 Cb 1.34 0.33 -0.10 0.00 -0.31 0.00 0.00 62.40 63.66 1zae h SER 88 CO 0.55 -0.33 -0.25 -0.67 -0.87 0.00 0.00 176.83 175.25 1zae n ASP 89 N -5.38 -0.43 -0.05 4.97 -0.08 -1.26 0.59 116.55 114.92 1zae n ASP 89 Ca -0.05 1.10 -0.10 0.00 -1.51 0.00 0.00 54.79 54.23 1zae n ASP 89 Cb 0.29 -0.25 -0.04 0.00 2.34 0.00 0.00 41.12 43.47 1zae n ASP 89 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1zae h ILE 90 N 0.00 0.19 -0.30 5.18 1.08 -1.86 -1.40 117.51 120.40 1zae h ILE 90 Ca 0.21 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.67 1zae h ILE 90 Cb 0.37 0.19 -0.01 0.00 -3.07 0.00 0.00 36.82 34.30 1zae h ILE 90 CO -0.62 0.00 0.16 0.40 -0.69 0.00 0.00 178.15 177.39 1zae h ILE 91 N -0.38 1.14 -0.39 -0.67 2.04 0.17 0.20 117.51 119.60 1zae h ILE 91 Ca 0.11 -0.38 0.08 0.00 1.00 0.00 0.00 64.86 65.68 1zae h ILE 91 Cb 0.58 0.84 -0.09 0.00 -0.74 0.00 0.00 36.82 37.41 1zae h ILE 91 CO -0.45 0.14 -0.33 -0.33 0.00 0.00 0.00 178.15 177.18 1zae h GLU 92 N 0.36 -0.25 0.60 2.37 5.08 -0.35 0.02 114.58 122.40 1zae h GLU 92 Ca 0.10 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1zae h GLU 92 Cb 0.08 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.40 1zae h GLU 92 CO -0.02 -0.17 -0.29 0.22 -1.00 0.00 0.00 179.01 177.76 1zae h ASP 93 N -0.26 -0.68 -0.88 1.42 3.58 -1.25 -3.34 116.42 115.01 1zae h ASP 93 Ca 0.17 -0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.61 1zae h ASP 93 Cb 0.54 0.18 -0.05 0.00 1.72 0.00 0.00 39.33 41.72 1zae h ASP 93 CO -0.54 -0.32 0.58 0.25 -2.88 0.00 0.00 179.24 176.33 1zae h LEU 94 N -1.08 0.99 -0.72 2.28 7.12 -0.16 0.31 115.31 124.05 1zae h LEU 94 Ca -0.08 -0.02 0.16 0.00 0.13 0.00 0.00 57.88 58.07 1zae h LEU 94 Cb 0.67 -0.24 -0.13 0.00 -0.53 0.00 0.00 40.66 40.43 1zae h LEU 94 CO 0.13 0.70 -0.01 0.58 -0.13 0.00 0.00 178.44 179.71 1zae h VAL 95 N 1.16 0.37 -0.26 1.05 2.07 -1.19 0.16 116.25 119.60 1zae h VAL 95 Ca 0.33 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.79 1zae h VAL 95 Cb -0.09 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 1zae h VAL 95 CO -0.09 0.02 0.06 -1.13 0.02 0.00 0.00 177.57 176.45 1zae h ASN 96 N 0.10 0.40 -0.53 0.57 -1.24 -0.60 -3.27 115.58 111.01 1zae h ASN 96 Ca 0.39 -0.24 -0.00 0.00 0.71 0.00 0.00 56.30 57.16 1zae h ASN 96 Cb 0.66 -0.11 -0.03 0.00 0.73 0.00 0.00 38.32 39.58 1zae h ASN 96 CO -0.64 0.54 0.33 1.56 -1.29 0.00 0.00 177.43 177.93 1zae h GLN 97 N 0.25 0.72 -6.71 6.67 1.08 -0.21 -3.48 115.11 113.43 1zae h GLN 97 Ca 0.08 -0.06 -0.48 0.00 -1.45 0.00 0.00 58.65 56.75 1zae h GLN 97 Cb 0.29 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1zae h GLN 97 CO 0.00 0.51 -1.11 -2.13 -0.95 0.00 0.00 178.83 175.15 1zae n ARG 98 N -4.68 -1.56 -0.78 1.46 3.00 0.48 -3.69 116.66 110.90 1zae n ARG 98 Ca 0.03 0.80 -0.29 0.00 -0.00 0.00 0.00 57.85 58.38 1zae n ARG 98 Cb 0.04 -2.14 0.20 0.00 0.00 0.00 0.00 32.46 30.57 1zae n ARG 98 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1zae s LEU 99 N -4.65 1.69 0.15 6.15 1.43 -1.26 -0.44 118.68 121.75 1zae s LEU 99 Ca 0.04 1.65 0.26 0.00 -1.03 0.00 0.00 54.13 55.06 1zae s LEU 99 Cb -0.00 -3.81 0.83 0.00 0.03 0.00 0.00 46.19 43.23 1zae s LEU 99 CO 0.88 -3.52 1.74 0.00 0.23 0.00 0.00 176.35 175.68 1zae n GLN 100 N -4.47 0.20 -4.02 1.70 3.00 -1.26 -4.63 117.38 107.90 1zae n GLN 100 Ca 0.06 0.15 -0.10 0.00 -0.01 0.00 0.00 57.00 57.10 1zae n GLN 100 Cb 0.54 -1.71 -0.08 0.00 0.00 0.00 0.00 30.24 28.99 1zae n GLN 100 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1zae s SER 101 N -4.11 0.08 0.18 1.08 1.04 -1.26 -5.04 113.70 105.67 1zae s SER 101 Ca 0.11 -0.98 -0.18 0.00 0.48 0.00 0.00 55.95 55.38 1zae s SER 101 Cb 0.14 0.42 0.12 0.00 0.10 0.00 0.00 66.02 66.80 1zae s SER 101 CO 0.60 -0.89 1.64 -0.08 0.98 0.00 0.00 173.24 175.50 1zae h GLU 102 N 2.57 -0.07 -0.97 4.02 4.22 -1.87 -1.95 114.58 120.52 1zae h GLU 102 Ca -0.32 0.01 0.06 0.00 0.08 0.00 0.00 59.36 59.19 1zae h GLU 102 Cb 1.23 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 30.43 1zae h GLU 102 CO 0.49 -0.05 0.62 0.37 -2.18 0.00 0.00 179.01 178.27 1zae h GLN 103 N -0.08 1.10 -0.13 1.92 5.75 -1.97 -1.65 115.11 120.05 1zae h GLN 103 Ca 0.21 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.63 1zae h GLN 103 Cb 0.40 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1zae h GLN 103 CO -0.49 0.73 0.03 0.93 -2.65 0.00 0.00 178.83 177.37 1zae h GLU 104 N 1.13 0.22 -0.83 1.69 5.08 -1.76 -0.36 114.58 119.75 1zae h GLU 104 Ca 0.42 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.69 1zae h GLU 104 Cb 0.17 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 1zae h GLU 104 CO -0.17 0.40 0.39 -0.39 -1.00 0.00 0.00 179.01 178.24 1zae h VAL 105 N 0.00 1.26 -0.32 3.13 -1.51 -0.89 0.18 116.25 118.11 1zae h VAL 105 Ca 0.04 -0.72 -0.09 0.00 -1.23 0.00 0.00 66.70 64.70 1zae h VAL 105 Cb 0.28 0.20 -0.02 0.00 -2.13 0.00 0.00 31.29 29.62 1zae h VAL 105 CO 0.00 0.31 -0.17 0.17 -1.23 0.00 0.00 177.57 176.65 1zae h LEU 106 N 1.18 0.56 0.68 4.19 8.10 -1.19 0.72 115.31 129.55 1zae h LEU 106 Ca 0.28 -0.17 -0.03 0.00 0.11 0.00 0.00 57.88 58.08 1zae h LEU 106 Cb 0.12 -0.15 0.00 0.00 -0.44 0.00 0.00 40.66 40.19 1zae h LEU 106 CO -0.04 0.74 -0.35 0.78 -4.11 0.00 0.00 178.44 175.47 1zae h ASN 107 N 0.51 -0.83 0.14 0.17 2.35 -0.49 -0.93 115.58 116.50 1zae h ASN 107 Ca 0.09 0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.89 1zae h ASN 107 Cb 0.58 0.22 -0.04 0.00 0.05 0.00 0.00 38.32 39.14 1zae h ASN 107 CO 0.04 -0.58 -0.32 0.22 -1.65 0.00 0.00 177.43 175.14 1zae h TYR 108 N -0.94 -0.87 0.02 1.19 3.20 -0.90 -1.95 116.97 116.72 1zae h TYR 108 Ca -0.09 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.81 1zae h TYR 108 Cb 0.73 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.34 1zae h TYR 108 CO -0.04 -0.43 -0.12 0.82 -1.64 0.00 0.00 178.16 176.75 1zae h ILE 109 N -0.56 0.71 -0.70 1.81 2.04 -0.89 0.41 117.51 120.33 1zae h ILE 109 Ca 0.03 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.04 1zae h ILE 109 Cb 0.58 0.71 -0.11 0.00 -0.74 0.00 0.00 36.82 37.25 1zae h ILE 109 CO -0.17 0.00 0.10 -0.33 0.00 0.00 0.00 178.15 177.75 1zae h GLU 110 N -0.21 0.20 0.26 2.37 5.08 -1.07 0.22 114.58 121.43 1zae h GLU 110 Ca 0.04 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1zae h GLU 110 Cb 0.26 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1zae h GLU 110 CO -0.10 0.13 -0.22 1.15 -1.00 0.00 0.00 179.01 178.97 1zae h THR 111 N 0.20 0.53 -0.38 1.13 2.02 -0.73 -2.27 112.91 113.41 1zae h THR 111 Ca 0.38 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.52 1zae h THR 111 Cb 0.65 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 1zae h THR 111 CO -0.53 0.00 0.05 1.56 0.37 0.00 0.00 175.52 176.97 1zae h GLN 112 N -0.50 0.58 -0.96 6.66 1.08 -0.10 0.12 115.11 121.99 1zae h GLN 112 Ca -0.01 -0.11 0.12 0.00 -1.45 0.00 0.00 58.65 57.19 1zae h GLN 112 Cb 0.44 -0.09 -0.08 0.00 -0.05 0.00 0.00 27.48 27.70 1zae h GLN 112 CO -0.02 0.57 0.59 0.00 -0.95 0.00 0.00 178.83 179.01 1zae h ARG 113 N 0.56 0.91 -0.37 1.46 3.08 -0.51 0.32 114.38 119.83 1zae h ARG 113 Ca 0.13 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.02 1zae h ARG 113 Cb 0.28 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1zae h ARG 113 CO 0.00 0.60 -0.19 1.15 -1.07 0.00 0.00 179.97 180.47 1zae h THR 114 N 0.94 1.26 -0.22 2.04 2.02 -0.21 0.22 112.91 118.95 1zae h THR 114 Ca 0.47 -1.25 0.06 0.00 0.77 0.00 0.00 66.41 66.46 1zae h THR 114 Cb 0.47 1.18 -0.07 0.00 -1.74 0.00 0.00 68.15 67.99 1zae h THR 114 CO -0.27 0.42 -0.28 0.22 0.37 0.00 0.00 175.52 175.98 1zae h TYR 115 N 0.62 -0.77 -0.81 3.16 3.20 -0.28 -0.92 116.97 121.18 1zae h TYR 115 Ca 0.10 0.04 0.07 0.00 3.14 0.00 0.00 58.73 62.08 1zae h TYR 115 Cb 0.66 0.37 -0.06 0.00 1.54 0.00 0.00 36.73 39.24 1zae h TYR 115 CO 0.03 -0.36 0.48 -1.49 -1.64 0.00 0.00 178.16 175.19 1zae h TRP 116 N -0.31 0.89 -0.54 -3.82 4.06 -0.68 -0.03 115.95 115.53 1zae h TRP 116 Ca 0.12 0.03 0.11 0.00 2.06 0.00 0.00 58.89 61.21 1zae h TRP 116 Cb 0.50 -0.28 -0.10 0.00 -1.00 0.00 0.00 29.16 28.28 1zae h TRP 116 CO -0.42 0.43 -0.07 -0.22 -3.56 0.00 0.00 178.44 174.60 1zae h LYS 117 N 0.87 0.05 -0.01 0.49 3.64 -0.17 0.21 116.57 121.64 1zae h LYS 117 Ca 0.37 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 1zae h LYS 117 Cb 0.22 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1zae h LYS 117 CO -0.19 0.04 0.00 -0.07 -2.27 0.00 0.00 179.45 176.96 1zae h LEU 118 N 0.05 0.00 -1.15 5.20 3.38 0.27 -1.04 115.31 122.03 1zae h LEU 118 Ca 0.27 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.45 1zae h LEU 118 Cb 0.42 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.07 1zae h LEU 118 CO -0.51 0.01 0.62 -0.33 0.09 0.00 0.00 178.44 178.32 1zae h GLU 119 N 0.01 0.61 0.00 1.13 4.39 -0.45 0.15 114.58 120.42 1zae h GLU 119 Ca 0.01 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1zae h GLU 119 Cb 0.00 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 1zae h GLU 119 CO -0.01 0.41 0.00 0.09 -1.16 0.00 0.00 179.01 178.34 1zae n ASN 120 N -4.70 0.14 -0.11 1.42 5.03 0.67 -3.86 115.26 113.85 1zae n ASN 120 Ca 0.23 0.52 -0.14 0.00 0.87 0.00 0.00 54.58 56.06 1zae n ASN 120 Cb 0.65 -0.56 -0.10 0.00 -1.02 0.00 0.00 39.78 38.75 1zae n ASN 120 CO 0.00 0.00 0.00 1.67 -1.83 0.00 0.00 177.26 177.10 1zae n GLN 121 N -1.64 0.63 -1.36 3.52 7.27 0.33 -5.04 117.38 121.08 1zae n GLN 121 Ca 0.05 0.11 -0.40 0.00 0.07 0.00 0.00 57.00 56.84 1zae n GLN 121 Cb 0.29 -1.44 0.01 0.00 2.41 0.00 0.00 30.24 31.51 1zae n GLN 121 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1zae n LYS 122 N -3.08 0.26 -2.18 3.69 5.02 -0.17 -4.94 118.16 116.77 1zae n LYS 122 Ca -0.37 0.10 -0.42 0.00 -2.02 0.00 0.00 58.31 55.60 1zae n LYS 122 Cb 0.93 -1.30 -0.03 0.00 -0.02 0.00 0.00 35.03 34.61 1zae n LYS 122 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1zae s LYS 123 N -1.43 4.29 -0.34 1.97 0.00 -1.26 -5.03 119.74 117.94 1zae s LYS 123 Ca 0.62 2.04 -0.16 0.00 0.00 0.00 0.00 55.97 58.47 1zae s LYS 123 Cb -0.53 -3.44 -0.01 0.00 0.00 0.00 0.00 37.83 33.85 1zae s LYS 123 CO 0.60 -0.53 0.40 -1.17 0.00 0.00 0.00 175.35 174.66 1zae s LEU 124 N 1.86 4.39 0.00 2.77 2.96 -1.26 -5.00 118.68 124.41 1zae s LEU 124 Ca 0.65 -0.15 0.00 0.00 -0.22 0.00 0.00 54.13 54.41 1zae s LEU 124 Cb -0.34 -2.40 0.00 0.00 0.50 0.00 0.00 46.19 43.94 1zae s LEU 124 CO 0.29 -0.36 0.61 0.00 -1.32 0.00 0.00 176.35 175.57 1zae n TYR 125 N 5.46 0.00 0.00 5.38 0.18 -1.26 -4.88 117.16 122.04 1zae n TYR 125 Ca -0.08 -0.31 0.00 0.00 1.88 0.00 0.00 57.90 59.39 1zae n TYR 125 Cb 0.49 -0.21 0.00 0.00 -0.38 0.00 0.00 39.34 39.24 1zae n TYR 125 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1zae n ARG 126 N 0.92 0.00 0.00 -3.48 5.12 -1.26 -4.87 116.66 113.08 1zae n ARG 126 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1zae n ARG 126 Cb 0.26 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.56 1zae n ARG 126 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1zae n GLY 127 N 0.00 0.87 2.76 -0.13 0.00 -1.26 -4.49 105.19 102.94 1zae n GLY 127 Ca 0.00 0.51 -0.38 0.00 0.00 0.00 0.00 46.02 46.16 1zae n GLY 127 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1zae n SER 128 N 2.06 4.43 -3.40 1.61 3.41 -1.26 -4.82 113.62 115.64 1zae n SER 128 Ca 0.00 -2.63 -0.33 0.00 -0.26 0.00 0.00 58.87 55.65 1zae n SER 128 Cb 0.00 -1.34 -0.03 0.00 -0.26 0.00 0.00 64.21 62.58 1zae n SER 128 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1zae n LEU 129 N 5.75 5.15 -0.24 1.04 7.94 -1.26 -5.26 117.00 130.11 1zae n LEU 129 Ca 0.54 -3.14 0.15 0.00 -1.11 0.00 0.00 56.01 52.44 1zae n LEU 129 Cb 0.31 -1.20 0.73 0.00 0.53 0.00 0.00 43.42 43.80 1zae n LEU 129 CO 0.90 0.44 0.99 1.17 -1.11 0.00 0.00 177.39 179.77