#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 -0.55 -2.40 -0.41 2.81 0.40 -5.03 117.12 111.94 1zae n MET 62 Ca 0.00 -0.43 -0.30 0.00 -1.81 0.00 0.00 57.70 55.16 1zae n MET 62 Cb 0.00 -0.31 0.01 0.00 -0.71 0.00 0.00 33.22 32.21 1zae n MET 62 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1zae n ASP 63 N -3.24 5.33 -3.62 7.83 5.75 -1.25 -4.37 116.55 122.98 1zae n ASP 63 Ca 0.04 -3.74 -0.41 0.00 -0.01 0.00 0.00 54.79 50.66 1zae n ASP 63 Cb 0.13 -0.61 -0.02 0.00 -1.03 0.00 0.00 41.12 39.59 1zae n ASP 63 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1zae n LYS 64 N -0.47 2.42 0.28 0.11 4.81 -0.38 -4.65 118.16 120.29 1zae n LYS 64 Ca 0.42 -2.24 0.18 0.00 -0.87 0.00 0.00 58.31 55.80 1zae n LYS 64 Cb 0.54 -3.07 0.73 0.00 0.02 0.00 0.00 35.03 33.26 1zae n LYS 64 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1zae h THR 65 N 4.03 0.00 -0.19 3.15 1.35 -1.84 -3.37 112.91 116.05 1zae h THR 65 Ca 0.54 -0.47 -0.36 0.00 -0.55 0.00 0.00 66.41 65.57 1zae h THR 65 Cb 0.59 1.47 0.02 0.00 -1.73 0.00 0.00 68.15 68.50 1zae h THR 65 CO 1.88 0.00 1.12 0.52 -0.25 0.00 0.00 175.52 178.79 1zae n VAL 66 N -3.09 1.09 -2.73 6.82 0.31 -1.26 -4.92 118.33 114.55 1zae n VAL 66 Ca 0.00 -1.07 -0.42 0.00 -0.01 0.00 0.00 64.34 62.85 1zae n VAL 66 Cb 0.29 -2.13 -0.04 0.00 -0.91 0.00 0.00 33.84 31.05 1zae n VAL 66 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1zae s ASN 67 N 6.77 7.41 -1.13 4.52 2.20 -1.26 -3.23 114.94 130.23 1zae s ASN 67 Ca 0.70 1.70 -0.10 0.00 -0.94 0.00 0.00 52.86 54.21 1zae s ASN 67 Cb 0.04 -2.57 -0.03 0.00 -2.00 0.00 0.00 41.25 36.68 1zae s ASN 67 CO 0.18 -0.18 0.85 0.18 -2.94 0.00 0.00 177.10 175.19 1zae n LEU 68 N 3.46 -4.20 -4.61 3.54 4.32 -1.26 -5.03 117.00 113.22 1zae n LEU 68 Ca 0.04 -0.83 -0.29 0.00 -0.02 0.00 0.00 56.01 54.92 1zae n LEU 68 Cb 0.50 -2.84 0.20 0.00 -1.62 0.00 0.00 43.42 39.66 1zae n LEU 68 CO 0.52 0.29 0.60 -0.55 -1.22 0.00 0.00 177.39 177.03 1zae s SER 69 N -3.61 2.10 0.20 -1.43 0.15 -1.20 -4.56 113.70 105.36 1zae s SER 69 Ca 0.38 1.36 -0.18 0.00 0.70 0.00 0.00 55.95 58.20 1zae s SER 69 Cb -0.09 -2.06 0.17 0.00 -1.71 0.00 0.00 66.02 62.34 1zae s SER 69 CO 0.79 -3.48 1.59 0.00 1.20 0.00 0.00 173.24 173.35 1zae h ALA 70 N -2.13 0.11 -0.71 5.45 0.00 -1.95 0.55 119.26 120.58 1zae h ALA 70 Ca -0.56 0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.55 1zae h ALA 70 Cb 1.33 0.72 -0.04 0.00 0.00 0.00 0.00 17.79 19.80 1zae h ALA 70 CO 0.54 -0.60 0.47 0.00 0.00 0.00 0.00 179.25 179.66 1zae h GLU 72 N 0.95 0.50 -0.33 0.00 5.08 -1.46 -0.34 114.58 118.99 1zae h GLU 72 Ca 0.26 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1zae h GLU 72 Cb -0.10 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1zae h GLU 72 CO -0.06 0.66 0.09 0.28 -1.00 0.00 0.00 179.01 178.98 1zae h VAL 73 N 0.29 1.21 -0.76 3.13 2.07 -0.89 -0.49 116.25 120.81 1zae h VAL 73 Ca 0.08 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1zae h VAL 73 Cb 0.43 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 1zae h VAL 73 CO 0.02 0.23 0.47 0.00 0.02 0.00 0.00 177.57 178.31 1zae h ALA 74 N 0.93 0.96 -0.46 1.67 0.00 -0.73 0.20 119.26 121.83 1zae h ALA 74 Ca 0.10 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1zae h ALA 74 Cb 0.27 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1zae h ALA 74 CO -0.00 0.42 -0.13 -0.24 0.00 0.00 0.00 179.25 179.30 1zae h VAL 75 N 1.03 1.27 -0.76 0.00 3.04 -0.95 -1.43 116.25 118.45 1zae h VAL 75 Ca 0.27 -1.26 0.08 0.00 -1.01 0.00 0.00 66.70 64.78 1zae h VAL 75 Cb -0.05 1.13 -0.05 0.00 -2.01 0.00 0.00 31.29 30.31 1zae h VAL 75 CO -0.05 0.43 0.50 -0.07 -1.01 0.00 0.00 177.57 177.37 1zae h LEU 76 N 0.74 0.68 0.08 3.16 3.38 -0.62 0.29 115.31 123.02 1zae h LEU 76 Ca 0.11 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1zae h LEU 76 Cb 0.68 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1zae h LEU 76 CO 0.05 0.43 -0.04 -0.78 0.09 0.00 0.00 178.44 178.18 1zae h ASP 77 N 0.76 -0.10 -0.69 -0.43 1.82 -0.38 -2.48 116.42 114.93 1zae h ASP 77 Ca 0.34 -0.36 0.14 0.00 -0.39 0.00 0.00 57.03 56.75 1zae h ASP 77 Cb 0.32 0.02 -0.13 0.00 0.68 0.00 0.00 39.33 40.23 1zae h ASP 77 CO -0.12 0.33 -0.17 -0.07 -1.61 0.00 0.00 179.24 177.60 1zae h LEU 78 N -0.54 -0.63 -0.39 2.28 3.38 -1.01 0.16 115.31 118.55 1zae h LEU 78 Ca -0.01 0.20 0.08 0.00 0.09 0.00 0.00 57.88 58.25 1zae h LEU 78 Cb 0.45 0.42 -0.09 0.00 0.09 0.00 0.00 40.66 41.54 1zae h LEU 78 CO 0.02 -0.22 -0.26 1.88 0.09 0.00 0.00 178.44 179.94 1zae h TYR 79 N 0.00 -0.70 0.00 1.13 0.05 -0.81 -1.30 116.97 115.34 1zae h TYR 79 Ca 0.33 0.05 -0.12 0.00 0.05 0.00 0.00 58.73 59.04 1zae h TYR 79 Cb 0.51 0.37 -0.02 0.00 1.01 0.00 0.00 36.73 38.60 1zae h TYR 79 CO -0.55 -0.34 -0.92 0.93 -1.05 0.00 0.00 178.16 176.24 1zae h GLU 80 N -0.20 0.00 -0.77 4.88 4.39 -0.74 0.26 114.58 122.41 1zae h GLU 80 Ca 0.19 0.00 0.17 0.00 0.34 0.00 0.00 59.36 60.06 1zae h GLU 80 Cb 0.49 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 29.03 1zae h GLU 80 CO -0.51 0.36 0.22 1.96 -1.16 0.00 0.00 179.01 179.88 1zae h GLN 81 N 0.00 0.29 0.00 2.33 4.20 -0.74 0.30 115.11 121.49 1zae h GLN 81 Ca -0.07 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1zae h GLN 81 Cb 1.43 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.14 1zae h GLN 81 CO 0.05 0.19 0.00 0.43 -0.67 0.00 0.00 178.83 178.83 1zae n SER 82 N -5.13 0.00 -3.23 1.46 7.64 -0.50 -4.98 113.62 108.89 1zae n SER 82 Ca 0.16 0.13 -0.12 0.00 1.01 0.00 0.00 58.87 60.04 1zae n SER 82 Cb 0.50 -0.35 0.01 0.00 -1.01 0.00 0.00 64.21 63.35 1zae n SER 82 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1zae n ASN 83 N -1.35 -6.90 -3.76 6.43 4.05 0.09 -5.05 115.26 108.77 1zae n ASN 83 Ca 0.09 -0.13 -0.28 0.00 0.45 0.00 0.00 54.58 54.71 1zae n ASN 83 Cb 0.21 -4.07 -0.16 0.00 1.23 0.00 0.00 39.78 36.99 1zae n ASN 83 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1zae s ILE 84 N -2.71 0.63 0.15 -1.44 1.01 -0.63 -4.93 121.20 113.27 1zae s ILE 84 Ca 0.11 -0.62 -0.31 0.00 0.00 0.00 0.00 60.65 59.82 1zae s ILE 84 Cb -0.02 -1.11 -0.10 0.00 0.01 0.00 0.00 42.46 41.24 1zae s ILE 84 CO 0.80 -0.20 1.53 -0.60 0.00 0.00 0.00 174.94 176.48 1zae s ARG 85 N 1.81 4.24 -0.21 2.79 3.52 -1.26 -4.43 118.95 125.41 1zae s ARG 85 Ca -0.01 2.30 -0.14 0.00 -0.13 0.00 0.00 55.73 57.75 1zae s ARG 85 Cb -0.17 -3.20 -0.04 0.00 -1.56 0.00 0.00 34.95 29.98 1zae s ARG 85 CO -0.08 -0.58 0.30 0.42 -0.81 0.00 0.00 175.30 174.56 1zae s ILE 86 N 1.21 5.27 0.34 4.11 -1.09 -1.26 -5.07 121.20 124.70 1zae s ILE 86 Ca 0.69 0.50 -0.27 0.00 -2.23 0.00 0.00 60.65 59.34 1zae s ILE 86 Cb -0.42 -3.64 -0.12 0.00 -1.58 0.00 0.00 42.46 36.70 1zae s ILE 86 CO 0.31 0.30 1.19 -2.65 -1.23 0.00 0.00 174.94 172.86 1zae n PRO 87 N 4.31 1.83 -0.31 2.79 -0.02 -1.26 -4.88 135.00 137.46 1zae n PRO 87 Ca -0.11 0.64 0.20 0.00 -2.02 0.00 0.00 63.50 62.22 1zae n PRO 87 Cb 0.51 -2.18 0.48 0.00 -0.02 0.00 0.00 33.50 32.30 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 2.27 0.48 0.28 2.55 4.64 -1.99 -0.19 113.55 121.60 1zae h SER 88 Ca -0.44 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 60.94 1zae h SER 88 Cb 1.30 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1zae h SER 88 CO 0.61 0.14 -0.03 0.44 -0.87 0.00 0.00 176.83 177.12 1zae h ASP 89 N 0.45 0.00 0.14 4.97 5.19 -2.00 0.14 116.42 125.31 1zae h ASP 89 Ca 0.56 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.96 1zae h ASP 89 Cb 1.33 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.84 1zae h ASP 89 CO -0.27 0.03 -0.07 0.40 -3.12 0.00 0.00 179.24 176.21 1zae h ILE 90 N 0.00 0.97 -0.96 0.35 1.08 -1.39 -3.38 117.51 114.19 1zae h ILE 90 Ca -0.00 -1.10 0.04 0.00 -0.39 0.00 0.00 64.86 63.41 1zae h ILE 90 Cb 0.18 1.59 -0.06 0.00 -3.07 0.00 0.00 36.82 35.46 1zae h ILE 90 CO 0.00 0.24 0.62 0.40 -0.69 0.00 0.00 178.15 178.72 1zae h ILE 91 N -0.77 1.16 0.00 -0.67 2.04 -0.81 0.01 117.51 118.47 1zae h ILE 91 Ca -0.02 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1zae h ILE 91 Cb 0.53 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1zae h ILE 91 CO 0.03 0.22 0.00 1.21 0.00 0.00 0.00 178.15 179.61 1zae n GLU 92 N -4.48 0.00 0.03 2.37 2.13 0.34 -1.14 120.64 119.89 1zae n GLU 92 Ca 0.13 0.44 -0.10 0.00 0.66 0.00 0.00 57.16 58.28 1zae n GLU 92 Cb 0.10 -0.68 -0.07 0.00 0.27 0.00 0.00 31.44 31.06 1zae n GLU 92 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 1zae h ASP 93 N 0.00 -0.14 -0.93 4.31 3.58 -1.59 -3.31 116.42 118.33 1zae h ASP 93 Ca 0.00 -0.39 0.10 0.00 0.42 0.00 0.00 57.03 57.16 1zae h ASP 93 Cb 0.00 0.04 -0.12 0.00 1.72 0.00 0.00 39.33 40.96 1zae h ASP 93 CO 0.00 0.46 -0.48 -0.11 -2.88 0.00 0.00 179.24 176.23 1zae n LEU 94 N -4.87 -0.85 0.16 2.28 0.00 -0.06 -0.69 117.00 112.97 1zae n LEU 94 Ca -0.07 1.64 -0.11 0.00 0.00 0.00 0.00 56.01 57.47 1zae n LEU 94 Cb 0.26 -0.27 -0.06 0.00 0.00 0.00 0.00 43.42 43.35 1zae n LEU 94 CO 0.24 -1.38 0.51 0.58 0.00 0.00 0.00 177.39 177.34 1zae h VAL 95 N 0.00 0.00 -0.23 1.96 2.07 -1.29 -3.32 116.25 115.43 1zae h VAL 95 Ca 0.21 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.65 1zae h VAL 95 Cb 0.44 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1zae h VAL 95 CO -0.89 0.00 -0.16 -0.55 0.02 0.00 0.00 177.57 175.99 1zae h ASN 96 N -0.58 0.54 -0.42 0.57 7.08 -1.48 -3.40 115.58 117.89 1zae h ASN 96 Ca -0.03 -0.44 -0.07 0.00 -3.08 0.00 0.00 56.30 52.67 1zae h ASN 96 Cb 0.51 -0.15 -0.01 0.00 -2.08 0.00 0.00 38.32 36.58 1zae h ASN 96 CO -0.05 0.86 -0.02 0.06 -2.08 0.00 0.00 177.43 176.20 1zae h GLN 97 N 0.22 0.75 0.00 4.14 -0.00 -1.01 -1.00 115.11 118.22 1zae h GLN 97 Ca 0.05 -0.25 0.00 0.00 -0.00 0.00 0.00 58.65 58.44 1zae h GLN 97 Cb 0.69 -0.06 0.00 0.00 -0.00 0.00 0.00 27.48 28.10 1zae h GLN 97 CO 0.04 0.84 0.00 -2.13 -0.00 0.00 0.00 178.83 177.59 1zae n ARG 98 N -4.40 0.00 -0.04 0.06 0.63 -1.26 -0.45 116.66 111.20 1zae n ARG 98 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1zae n ARG 98 Cb 0.31 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.22 1zae n ARG 98 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1zae n LEU 99 N 0.00 -1.05 0.00 6.15 4.77 -1.26 -4.85 117.00 120.76 1zae n LEU 99 Ca 0.00 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1zae n LEU 99 Cb 0.00 0.89 0.00 0.00 -2.33 0.00 0.00 43.42 41.98 1zae n LEU 99 CO 0.00 0.01 -0.11 0.00 -1.33 0.00 0.00 177.39 175.96 1zae n GLN 100 N -0.99 0.00 -3.64 3.23 3.00 -1.26 -5.02 117.38 112.70 1zae n GLN 100 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.66 1zae n GLN 100 Cb 0.00 -0.57 -0.05 0.00 0.00 0.00 0.00 30.24 29.62 1zae n GLN 100 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1zae s SER 101 N -3.40 6.56 0.23 1.08 0.15 -1.26 -4.75 113.70 112.30 1zae s SER 101 Ca 0.00 0.67 -0.00 0.00 0.70 0.00 0.00 55.95 57.32 1zae s SER 101 Cb 0.00 -2.13 0.51 0.00 -1.71 0.00 0.00 66.02 62.70 1zae s SER 101 CO 0.00 0.14 1.16 -0.62 1.20 0.00 0.00 173.24 175.12 1zae n GLU 102 N 0.64 -0.06 -0.15 5.44 4.71 -1.26 -0.63 120.64 129.33 1zae n GLU 102 Ca -0.07 1.12 -0.09 0.00 -0.01 0.00 0.00 57.16 58.12 1zae n GLU 102 Cb 0.52 -1.76 -0.00 0.00 -1.01 0.00 0.00 31.44 29.20 1zae n GLU 102 CO 0.00 0.00 0.00 0.37 0.09 0.00 0.00 177.13 177.59 1zae h GLN 103 N 0.00 0.64 -0.03 3.49 5.75 -1.94 0.73 115.11 123.74 1zae h GLN 103 Ca 0.43 -0.11 -0.00 0.00 -0.15 0.00 0.00 58.65 58.82 1zae h GLN 103 Cb 0.84 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.28 1zae h GLN 103 CO -0.71 0.57 0.00 0.93 -2.65 0.00 0.00 178.83 176.97 1zae h GLU 104 N 0.56 0.06 -0.80 1.69 5.08 -1.27 -1.13 114.58 118.76 1zae h GLU 104 Ca 0.15 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1zae h GLU 104 Cb 0.16 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 1zae h GLU 104 CO -0.02 0.33 0.40 -0.39 -1.00 0.00 0.00 179.01 178.34 1zae h VAL 105 N -0.23 1.25 -0.63 3.13 -1.51 -1.00 0.54 116.25 117.79 1zae h VAL 105 Ca 0.01 -0.67 -0.09 0.00 -1.23 0.00 0.00 66.70 64.72 1zae h VAL 105 Cb 0.31 0.21 -0.02 0.00 -2.13 0.00 0.00 31.29 29.66 1zae h VAL 105 CO 0.00 0.29 0.06 0.17 -1.23 0.00 0.00 177.57 176.86 1zae h LEU 106 N 1.13 1.05 0.67 4.19 8.10 -0.83 0.18 115.31 129.79 1zae h LEU 106 Ca 0.28 -0.28 -0.03 0.00 0.11 0.00 0.00 57.88 57.96 1zae h LEU 106 Cb 0.09 -0.28 0.00 0.00 -0.44 0.00 0.00 40.66 40.03 1zae h LEU 106 CO -0.04 1.07 -0.36 0.78 -4.11 0.00 0.00 178.44 175.77 1zae h ASN 107 N 0.99 -0.89 0.18 0.17 2.35 -0.67 -1.17 115.58 116.53 1zae h ASN 107 Ca 0.19 0.04 0.01 0.00 -0.55 0.00 0.00 56.30 55.99 1zae h ASN 107 Cb 0.49 0.25 -0.04 0.00 0.05 0.00 0.00 38.32 39.07 1zae h ASN 107 CO 0.02 -0.59 -0.41 0.22 -1.65 0.00 0.00 177.43 175.02 1zae h TYR 108 N -0.96 -1.14 -0.04 1.19 3.20 -0.84 -0.85 116.97 117.53 1zae h TYR 108 Ca -0.09 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.84 1zae h TYR 108 Cb 0.76 0.48 -0.04 0.00 1.54 0.00 0.00 36.73 39.46 1zae h TYR 108 CO -0.06 -0.52 -0.21 0.82 -1.64 0.00 0.00 178.16 176.55 1zae h ILE 109 N -0.68 0.50 -0.90 1.81 2.04 -0.68 0.72 117.51 120.33 1zae h ILE 109 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1zae h ILE 109 Cb 0.68 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 1zae h ILE 109 CO -0.20 0.00 0.57 -0.33 0.00 0.00 0.00 178.15 178.19 1zae h GLU 110 N -0.31 1.19 0.29 2.37 4.39 -1.12 0.33 114.58 121.73 1zae h GLU 110 Ca 0.07 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 1zae h GLU 110 Cb 0.41 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1zae h GLU 110 CO -0.22 0.81 -0.22 1.15 -1.16 0.00 0.00 179.01 179.37 1zae h THR 111 N 1.22 0.54 -0.19 1.13 2.02 -0.75 -0.74 112.91 116.14 1zae h THR 111 Ca 0.33 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.45 1zae h THR 111 Cb -0.11 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1zae h THR 111 CO -0.07 0.00 -0.12 1.56 0.37 0.00 0.00 175.52 177.26 1zae h GLN 112 N -0.51 0.30 0.00 6.66 1.08 -0.45 0.98 115.11 123.18 1zae h GLN 112 Ca -0.02 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.10 1zae h GLN 112 Cb 0.44 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1zae h GLN 112 CO -0.00 0.43 -0.03 -0.09 -0.95 0.00 0.00 178.83 178.19 1zae h ARG 113 N 0.28 0.00 -0.05 1.46 2.43 -0.21 0.19 114.38 118.49 1zae h ARG 113 Ca 0.06 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 1zae h ARG 113 Cb 0.40 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1zae h ARG 113 CO 0.02 0.03 -0.52 1.15 -1.51 0.00 0.00 179.97 179.14 1zae h THR 114 N 0.00 1.41 -0.31 0.20 2.02 0.71 -2.61 112.91 114.33 1zae h THR 114 Ca -0.00 -1.94 0.05 0.00 0.77 0.00 0.00 66.41 65.29 1zae h THR 114 Cb 0.38 2.42 -0.08 0.00 -1.74 0.00 0.00 68.15 69.12 1zae h THR 114 CO 0.00 0.57 -0.52 0.22 0.37 0.00 0.00 175.52 176.16 1zae h TYR 115 N -0.04 -1.55 -0.50 3.16 3.20 -0.47 -2.55 116.97 118.22 1zae h TYR 115 Ca -0.05 0.07 0.10 0.00 3.14 0.00 0.00 58.73 61.99 1zae h TYR 115 Cb 1.20 0.72 -0.08 0.00 1.54 0.00 0.00 36.73 40.11 1zae h TYR 115 CO 0.13 -0.50 0.01 -1.49 -1.64 0.00 0.00 178.16 174.67 1zae h TRP 116 N -0.45 -0.02 -0.81 -3.82 4.06 -0.73 0.89 115.95 115.07 1zae h TRP 116 Ca 0.08 0.04 0.05 0.00 2.06 0.00 0.00 58.89 61.12 1zae h TRP 116 Cb 0.62 0.08 -0.05 0.00 -1.00 0.00 0.00 29.16 28.82 1zae h TRP 116 CO -0.65 -0.11 0.53 1.57 -3.56 0.00 0.00 178.44 176.23 1zae h LYS 117 N 0.12 0.91 -0.07 0.49 2.10 -1.33 0.34 116.57 119.13 1zae h LYS 117 Ca 0.25 -0.05 -0.01 0.00 -2.00 0.00 0.00 60.65 58.84 1zae h LYS 117 Cb 0.38 -0.20 -0.00 0.00 -0.90 0.00 0.00 32.23 31.50 1zae h LYS 117 CO -0.41 0.60 0.02 -0.07 -2.00 0.00 0.00 179.45 177.59 1zae h LEU 118 N 0.93 0.10 -2.28 7.07 3.38 -0.50 -1.30 115.31 122.71 1zae h LEU 118 Ca 0.34 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1zae h LEU 118 Cb 0.16 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1zae h LEU 118 CO -0.11 0.29 -0.04 -0.33 0.09 0.00 0.00 178.44 178.33 1zae h GLU 119 N -0.09 0.00 -0.06 1.13 4.39 -0.46 0.12 114.58 119.60 1zae h GLU 119 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1zae h GLU 119 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1zae h GLU 119 CO -0.00 0.04 0.00 0.09 -1.16 0.00 0.00 179.01 177.98 1zae n ASN 120 N -3.81 1.36 -0.05 1.42 3.02 0.11 -4.23 115.26 113.09 1zae n ASN 120 Ca -0.03 -1.52 -0.06 0.00 -0.03 0.00 0.00 54.58 52.94 1zae n ASN 120 Cb 0.13 -0.04 -0.02 0.00 -0.61 0.00 0.00 39.78 39.25 1zae n ASN 120 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1zae n GLN 121 N 0.08 0.36 -1.04 3.52 7.27 0.08 -5.03 117.38 122.61 1zae n GLN 121 Ca 0.18 0.14 -0.33 0.00 0.07 0.00 0.00 57.00 57.06 1zae n GLN 121 Cb 0.31 -1.12 -0.00 0.00 2.41 0.00 0.00 30.24 31.84 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 -4.12 0.00 -1.72 3.69 5.02 0.18 -4.74 118.16 116.47 1zae n LYS 122 Ca -0.09 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.01 1zae n LYS 122 Cb 0.35 -0.81 -0.06 0.00 -0.02 0.00 0.00 35.03 34.49 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 -0.81 1.93 -0.49 1.97 0.00 -1.26 -4.96 119.74 116.13 1zae s LYS 123 Ca 0.48 0.30 -0.28 0.00 0.00 0.00 0.00 55.97 56.46 1zae s LYS 123 Cb -0.49 -4.85 0.01 0.00 0.00 0.00 0.00 37.83 32.50 1zae s LYS 123 CO 0.51 -4.04 1.37 -1.17 0.00 0.00 0.00 175.35 172.02 1zae s LEU 124 N 13.16 3.51 0.00 2.77 2.96 -1.26 -4.94 118.68 134.88 1zae s LEU 124 Ca 0.85 0.54 0.00 0.00 -0.22 0.00 0.00 54.13 55.30 1zae s LEU 124 Cb -0.11 -3.34 0.00 0.00 0.50 0.00 0.00 46.19 43.24 1zae s LEU 124 CO 0.06 -1.53 0.40 0.00 -1.32 0.00 0.00 176.35 173.96 1zae n TYR 125 N 9.00 0.00 0.00 5.38 0.18 -1.26 -4.87 117.16 125.59 1zae n TYR 125 Ca 0.14 -0.17 0.00 0.00 1.88 0.00 0.00 57.90 59.75 1zae n TYR 125 Cb 0.49 -0.14 0.00 0.00 -0.38 0.00 0.00 39.34 39.31 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 0.66 0.00 0.00 -3.48 5.12 -1.26 -4.87 116.66 112.83 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 0.20 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.50 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 1.34 2.07 -0.13 0.00 -1.26 -4.65 105.19 102.56 1zae n GLY 127 Ca 0.00 0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 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 2.78 5.04 -3.46 1.61 3.41 -1.26 -4.86 113.62 116.88 1zae n SER 128 Ca 0.00 -2.41 -0.36 0.00 -0.26 0.00 0.00 58.87 55.85 1zae n SER 128 Cb 0.00 -1.31 -0.04 0.00 -0.26 0.00 0.00 64.21 62.60 1zae n SER 128 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1zae n LEU 129 N 2.63 4.89 0.00 1.04 4.77 -1.26 -5.31 117.00 123.77 1zae n LEU 129 Ca 0.42 -3.09 0.10 0.00 -0.03 0.00 0.00 56.01 53.40 1zae n LEU 129 Cb 0.79 -1.19 0.57 0.00 -2.33 0.00 0.00 43.42 41.27 1zae n LEU 129 CO 0.18 0.25 0.77 0.29 -1.33 0.00 0.00 177.39 177.55