#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2guz s THR 54 N 0.00 4.48 0.09 3.17 -4.23 -1.26 -4.93 115.64 112.96 2guz s THR 54 Ca 0.00 0.80 -0.22 0.00 -1.18 0.00 0.00 61.69 61.09 2guz s THR 54 Cb 0.00 -3.72 -0.13 0.00 1.34 0.00 0.00 72.50 70.00 2guz s THR 54 CO 0.00 -1.05 1.73 0.25 -0.54 0.00 0.00 174.62 175.00 2guz h LEU 55 N -0.45 0.08 -0.11 4.79 7.12 -1.98 -1.54 115.31 123.21 2guz h LEU 55 Ca -0.44 -0.03 0.03 0.00 0.13 0.00 0.00 57.88 57.57 2guz h LEU 55 Cb 1.20 -0.02 -0.03 0.00 -0.53 0.00 0.00 40.66 41.28 2guz h LEU 55 CO 0.60 0.09 -0.05 0.44 -0.13 0.00 0.00 178.44 179.39 2guz h ASP 56 N 0.07 -0.16 -0.15 1.25 3.45 -1.99 -0.30 116.42 118.58 2guz h ASP 56 Ca 0.02 0.04 -0.05 0.00 0.43 0.00 0.00 57.03 57.48 2guz h ASP 56 Cb 0.02 0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 38.87 2guz h ASP 56 CO -0.00 -0.07 -0.04 -0.08 -1.57 0.00 0.00 179.24 177.47 2guz h GLU 57 N -0.04 0.43 -0.63 3.56 4.81 -1.95 -1.85 114.58 118.92 2guz h GLU 57 Ca 0.06 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 59.11 2guz h GLU 57 Cb 0.13 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2guz h GLU 57 CO -0.13 0.50 0.04 0.77 -0.73 0.00 0.00 179.01 179.46 2guz h SER 58 N 0.41 1.04 -0.51 1.04 0.02 -0.52 0.68 113.55 115.71 2guz h SER 58 Ca 0.09 -0.28 -0.11 0.00 -0.84 0.00 0.00 61.79 60.65 2guz h SER 58 Cb 0.35 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 2guz h SER 58 CO 0.01 1.07 -0.12 0.00 -1.14 0.00 0.00 176.83 176.66 2guz h LYS 60 N 0.85 0.92 -0.61 0.00 3.64 -0.88 0.61 116.57 121.11 2guz h LYS 60 Ca 0.13 -0.38 -0.01 0.00 -1.27 0.00 0.00 60.65 59.12 2guz h LYS 60 Cb 0.68 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.44 2guz h LYS 60 CO 0.05 1.04 0.35 0.82 -2.27 0.00 0.00 179.45 179.44 2guz h ILE 61 N 0.76 1.19 -0.11 2.00 2.04 -0.81 -2.53 117.51 120.05 2guz h ILE 61 Ca 0.11 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.53 2guz h ILE 61 Cb 0.73 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2guz h ILE 61 CO 0.06 0.19 0.00 0.18 0.00 0.00 0.00 178.15 178.58 2guz n LEU 62 N -4.60 1.35 -3.49 1.44 4.77 -0.90 -4.91 117.00 110.66 2guz n LEU 62 Ca 0.04 -0.54 -0.18 0.00 -0.03 0.00 0.00 56.01 55.30 2guz n LEU 62 Cb 0.07 -0.06 0.07 0.00 -2.33 0.00 0.00 43.42 41.17 2guz n LEU 62 CO 0.36 0.27 0.06 -3.20 -1.33 0.00 0.00 177.39 173.55 2guz n ASN 63 N 0.10 -2.01 -4.30 -1.43 4.05 -0.19 -4.93 115.26 106.55 2guz n ASN 63 Ca 0.17 -0.68 -0.33 0.00 0.45 0.00 0.00 54.58 54.20 2guz n ASN 63 Cb 0.29 -4.85 -0.16 0.00 1.23 0.00 0.00 39.78 36.30 2guz n ASN 63 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2guz s ILE 64 N -3.44 2.59 -0.35 -1.44 1.01 0.20 -5.02 121.20 114.74 2guz s ILE 64 Ca 0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 2guz s ILE 64 Cb -0.00 -2.05 0.09 0.00 0.01 0.00 0.00 42.46 40.50 2guz s ILE 64 CO 0.75 0.54 0.09 -0.70 0.00 0.00 0.00 174.94 175.62 2guz s GLU 65 N 0.39 2.03 0.31 2.79 2.12 -1.26 -4.37 118.70 120.71 2guz s GLU 65 Ca -0.14 -1.64 0.09 0.00 0.36 0.00 0.00 54.97 53.64 2guz s GLU 65 Cb -0.17 -3.34 0.85 0.00 0.26 0.00 0.00 34.13 31.74 2guz s GLU 65 CO 0.06 -0.88 1.74 1.49 -0.54 0.00 0.00 175.26 177.13 2guz h GLU 66 N 7.92 0.59 0.00 4.30 4.81 -1.95 -0.32 114.58 129.94 2guz h GLU 66 Ca -0.14 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 2guz h GLU 66 Cb 1.05 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 2guz h GLU 66 CO 0.59 0.39 -0.04 0.66 -0.73 0.00 0.00 179.01 179.89 2guz h SER 67 N 0.61 0.00 -0.23 1.04 4.64 -2.01 -1.42 113.55 116.17 2guz h SER 67 Ca 0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.95 2guz h SER 67 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2guz h SER 67 CO -0.46 0.04 0.00 0.29 -0.87 0.00 0.00 176.83 175.82 2guz n LYS 68 N -3.20 1.80 -0.79 4.77 5.02 -0.14 -4.93 118.16 120.68 2guz n LYS 68 Ca -0.01 -1.21 0.00 0.00 -2.02 0.00 0.00 58.31 55.07 2guz n LYS 68 Cb 0.24 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 2guz n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2guz n GLY 69 N 1.13 0.82 0.10 0.72 0.00 -0.54 -4.95 105.19 102.48 2guz n GLY 69 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.27 2guz n GLY 69 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2guz n ASP 70 N 0.00 0.48 -4.39 1.61 10.43 -1.15 -4.30 116.55 119.24 2guz n ASP 70 Ca 0.00 0.63 -0.43 0.00 2.57 0.00 0.00 54.79 57.56 2guz n ASP 70 Cb 0.00 -0.73 0.00 0.00 1.84 0.00 0.00 41.12 42.23 2guz n ASP 70 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 2guz n LEU 71 N -2.05 5.39 -3.70 0.64 0.00 -1.26 -4.46 117.00 111.56 2guz n LEU 71 Ca 0.02 -4.33 -0.13 0.00 0.00 0.00 0.00 56.01 51.57 2guz n LEU 71 Cb 0.18 -1.64 -0.07 0.00 0.00 0.00 0.00 43.42 41.89 2guz n LEU 71 CO 0.16 0.67 0.10 0.54 0.00 0.00 0.00 177.39 178.87 2guz s ASN 72 N 2.97 -0.24 0.18 1.96 2.20 -1.26 -5.06 114.94 115.68 2guz s ASN 72 Ca 0.46 0.01 -0.12 0.00 -0.94 0.00 0.00 52.86 52.27 2guz s ASN 72 Cb 0.01 0.38 0.09 0.00 -2.00 0.00 0.00 41.25 39.74 2guz s ASN 72 CO 0.02 -0.59 1.76 -0.03 -2.94 0.00 0.00 177.10 175.32 2guz h MET 73 N 3.28 0.90 -0.20 3.55 1.85 -1.96 0.65 114.93 123.00 2guz h MET 73 Ca -0.31 -0.14 -0.01 0.00 -0.61 0.00 0.00 59.70 58.63 2guz h MET 73 Cb 1.19 -0.16 -0.01 0.00 0.43 0.00 0.00 31.60 33.05 2guz h MET 73 CO 0.43 0.73 0.06 0.22 -0.40 0.00 0.00 176.91 177.95 2guz h ASP 74 N 0.86 0.28 -0.32 1.39 -0.00 -1.97 0.14 116.42 116.80 2guz h ASP 74 Ca 0.21 -0.20 -0.05 0.00 -0.00 0.00 0.00 57.03 57.00 2guz h ASP 74 Cb 0.13 -0.07 -0.01 0.00 -0.00 0.00 0.00 39.33 39.37 2guz h ASP 74 CO -0.03 0.40 0.01 0.50 -0.00 0.00 0.00 179.24 180.13 2guz h LYS 75 N 0.15 0.56 -0.69 0.28 3.64 -1.78 -1.36 116.57 117.36 2guz h LYS 75 Ca 0.06 -0.17 0.05 0.00 -1.27 0.00 0.00 60.65 59.32 2guz h LYS 75 Cb 0.22 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.93 2guz h LYS 75 CO -0.00 0.68 0.40 0.82 -2.27 0.00 0.00 179.45 179.08 2guz h ILE 76 N 0.36 1.01 -0.52 2.00 2.04 -0.72 0.13 117.51 121.81 2guz h ILE 76 Ca 0.09 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 2guz h ILE 76 Cb 0.43 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2guz h ILE 76 CO 0.01 0.14 0.25 0.78 0.00 0.00 0.00 178.15 179.34 2guz h ASN 77 N 0.76 0.68 -0.22 1.72 2.35 -0.29 0.21 115.58 120.78 2guz h ASN 77 Ca 0.30 -0.13 -0.14 0.00 -0.55 0.00 0.00 56.30 55.78 2guz h ASN 77 Cb 0.15 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.34 2guz h ASN 77 CO -0.16 0.61 -0.42 0.78 -1.65 0.00 0.00 177.43 176.58 2guz h ASN 78 N 0.69 0.76 -0.49 5.81 -0.26 -1.08 -0.46 115.58 120.55 2guz h ASN 78 Ca 0.18 -0.54 -0.01 0.00 -0.56 0.00 0.00 56.30 55.36 2guz h ASN 78 Cb 0.11 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.13 2guz h ASN 78 CO -0.02 1.16 0.26 0.03 -1.06 0.00 0.00 177.43 177.79 2guz h ARG 79 N 0.39 0.70 0.16 0.81 2.47 -0.74 -2.75 114.38 115.42 2guz h ARG 79 Ca 0.01 -0.09 0.01 0.00 -1.26 0.00 0.00 59.98 58.65 2guz h ARG 79 Cb 1.03 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 29.19 2guz h ARG 79 CO 0.09 0.56 -0.19 0.35 0.56 0.00 0.00 179.97 181.35 2guz h PHE 80 N 0.65 -0.50 -0.98 3.04 3.57 -0.97 -1.72 116.94 120.02 2guz h PHE 80 Ca 0.17 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.77 2guz h PHE 80 Cb 0.08 0.20 -0.07 0.00 2.79 0.00 0.00 35.95 38.95 2guz h PHE 80 CO -0.01 -0.29 0.63 -0.91 -2.23 0.00 0.00 178.31 175.50 2guz h ASN 81 N -0.40 0.96 0.15 0.41 2.35 -0.96 0.17 115.58 118.26 2guz h ASN 81 Ca 0.01 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2guz h ASN 81 Cb 0.39 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2guz h ASN 81 CO -0.07 0.57 -0.07 0.22 -1.65 0.00 0.00 177.43 176.43 2guz h TYR 82 N 1.06 -0.19 0.00 1.19 3.20 -1.42 -2.57 116.97 118.24 2guz h TYR 82 Ca 0.45 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.23 2guz h TYR 82 Cb 0.32 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 2guz h TYR 82 CO -0.00 0.26 -0.40 -0.07 -1.64 0.00 0.00 178.16 176.31 2guz h LEU 83 N -0.84 0.00 -0.34 2.82 3.38 -1.08 -2.08 115.31 117.16 2guz h LEU 83 Ca -0.02 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2guz h LEU 83 Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2guz h LEU 83 CO 0.03 0.40 -0.11 0.15 0.09 0.00 0.00 178.44 179.01 2guz h PHE 84 N 0.00 0.76 -0.23 1.13 3.57 -0.75 -2.28 116.94 119.15 2guz h PHE 84 Ca -0.00 -0.17 -0.17 0.00 3.53 0.00 0.00 57.97 61.15 2guz h PHE 84 Cb 0.88 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.44 2guz h PHE 84 CO 0.00 0.85 -0.53 1.49 -2.23 0.00 0.00 178.31 177.90 2guz h GLU 85 N 0.46 0.76 0.00 1.11 4.81 -1.31 -2.89 114.58 117.52 2guz h GLU 85 Ca 0.08 -0.51 -0.03 0.00 -0.13 0.00 0.00 59.36 58.77 2guz h GLU 85 Cb 0.62 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.07 2guz h GLU 85 CO 0.04 1.13 -0.15 0.28 -0.73 0.00 0.00 179.01 179.58 2guz h VAL 86 N 0.49 0.75 -0.59 0.32 2.07 -1.38 -1.94 116.25 115.96 2guz h VAL 86 Ca -0.00 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.91 2guz h VAL 86 Cb 1.14 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 2guz h VAL 86 CO 0.12 0.15 0.00 0.59 0.02 0.00 0.00 177.57 178.44 2guz n ASN 87 N -3.83 3.65 -4.77 0.57 4.13 -0.86 -4.81 115.26 109.34 2guz n ASN 87 Ca -0.02 -1.99 -0.39 0.00 1.68 0.00 0.00 54.58 53.86 2guz n ASN 87 Cb 0.25 -0.39 -0.03 0.00 -1.54 0.00 0.00 39.78 38.07 2guz n ASN 87 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2guz s ASP 88 N -1.08 6.82 0.34 6.41 -1.08 -0.73 -3.19 116.67 124.15 2guz s ASP 88 Ca 0.42 2.33 0.26 0.00 -0.52 0.00 0.00 52.55 55.04 2guz s ASP 88 Cb 0.22 -2.62 0.79 0.00 -1.46 0.00 0.00 42.92 39.85 2guz s ASP 88 CO 0.30 -0.47 1.75 0.07 0.52 0.00 0.00 175.17 177.34 2guz h LYS 89 N 3.09 0.00 -0.71 4.34 2.10 -1.87 -2.33 116.57 121.20 2guz h LYS 89 Ca -0.48 0.00 0.08 0.00 -2.00 0.00 0.00 60.65 58.25 2guz h LYS 89 Cb 1.22 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.49 2guz h LYS 89 CO 0.64 0.00 0.37 1.49 -2.00 0.00 0.00 179.45 179.95 2guz h GLU 90 N 0.00 0.63 -1.73 0.07 4.57 -1.91 -2.78 114.58 113.42 2guz h GLU 90 Ca 0.00 -0.04 -0.67 0.00 -1.18 0.00 0.00 59.36 57.47 2guz h GLU 90 Cb 0.71 -0.14 -0.35 0.00 -0.16 0.00 0.00 28.75 28.81 2guz h GLU 90 CO 0.00 0.42 0.08 1.63 -1.18 0.00 0.00 179.01 179.96 2guz n LYS 91 N -4.83 3.12 -0.63 1.92 4.76 -1.25 -4.91 118.16 116.35 2guz n LYS 91 Ca 0.10 -4.06 0.00 0.00 -2.87 0.00 0.00 58.31 51.48 2guz n LYS 91 Cb 0.24 -2.26 0.00 0.00 -1.84 0.00 0.00 35.03 31.17 2guz n LYS 91 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2guz n GLY 92 N -0.51 0.74 3.84 0.72 0.00 -1.05 -5.01 105.19 103.93 2guz n GLY 92 Ca 0.46 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.16 2guz n GLY 92 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2guz s GLY 93 N -1.84 1.85 -0.26 -0.02 0.00 -0.87 -4.96 107.32 101.22 2guz s GLY 93 Ca 0.00 0.09 -0.29 0.00 0.00 0.00 0.00 44.72 44.52 2guz s GLY 93 CO 0.00 0.38 1.16 -0.45 0.00 0.00 0.00 173.10 174.19 2guz s SER 94 N -3.57 6.92 0.33 1.64 0.15 -1.19 -3.84 113.70 114.15 2guz s SER 94 Ca 0.58 1.32 0.05 0.00 0.70 0.00 0.00 55.95 58.61 2guz s SER 94 Cb -0.12 -2.54 0.60 0.00 -1.71 0.00 0.00 66.02 62.25 2guz s SER 94 CO 0.45 -0.84 1.84 0.15 1.20 0.00 0.00 173.24 176.03 2guz h PHE 95 N 8.20 0.44 0.28 3.44 3.57 -1.94 0.13 116.94 131.06 2guz h PHE 95 Ca -0.23 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.21 2guz h PHE 95 Cb 1.08 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 2guz h PHE 95 CO 0.81 0.53 -0.21 -0.92 -2.23 0.00 0.00 178.31 176.30 2guz h TYR 96 N 0.39 -0.55 -0.86 0.41 3.20 -1.93 0.13 116.97 117.76 2guz h TYR 96 Ca 0.07 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 2guz h TYR 96 Cb 0.46 0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 2guz h TYR 96 CO 0.01 -0.32 0.48 -0.07 -1.64 0.00 0.00 178.16 176.62 2guz h LEU 97 N -0.49 1.06 -0.92 2.82 3.38 -1.81 -1.95 115.31 117.39 2guz h LEU 97 Ca -0.02 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2guz h LEU 97 Cb 0.43 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2guz h LEU 97 CO -0.01 0.84 0.09 -0.61 0.09 0.00 0.00 178.44 178.85 2guz h GLN 98 N 1.20 0.88 -0.75 1.13 4.15 -0.53 -2.34 115.11 118.85 2guz h GLN 98 Ca 0.30 -0.21 -0.02 0.00 0.77 0.00 0.00 58.65 59.49 2guz h GLN 98 Cb 0.01 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.55 2guz h GLN 98 CO -0.05 0.82 0.38 0.77 -1.93 0.00 0.00 178.83 178.82 2guz h SER 99 N 0.83 0.96 -0.94 -0.69 0.02 -0.45 0.34 113.55 113.63 2guz h SER 99 Ca 0.17 -0.12 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2guz h SER 99 Cb 0.37 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.62 2guz h SER 99 CO 0.01 0.80 0.62 0.11 -1.14 0.00 0.00 176.83 177.23 2guz h LYS 100 N 1.04 1.22 -0.16 3.45 1.79 -0.97 0.16 116.57 123.09 2guz h LYS 100 Ca 0.26 -0.07 -0.09 0.00 -2.18 0.00 0.00 60.65 58.57 2guz h LYS 100 Cb 0.08 -0.27 -0.00 0.00 -1.58 0.00 0.00 32.23 30.45 2guz h LYS 100 CO -0.04 0.81 -0.25 0.28 -1.08 0.00 0.00 179.45 179.17 2guz h VAL 101 N 1.25 1.35 -0.43 0.50 2.07 -1.00 0.13 116.25 120.13 2guz h VAL 101 Ca 0.35 -1.48 0.05 0.00 0.82 0.00 0.00 66.70 66.44 2guz h VAL 101 Cb -0.12 1.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 2guz h VAL 101 CO -0.08 0.44 0.17 0.22 0.02 0.00 0.00 177.57 178.34 2guz h TYR 102 N 0.07 0.30 -0.42 1.57 3.20 -0.47 -1.05 116.97 120.17 2guz h TYR 102 Ca 0.01 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.77 2guz h TYR 102 Cb 0.83 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 2guz h TYR 102 CO 0.09 0.13 -0.25 0.00 -1.64 0.00 0.00 178.16 176.49 2guz h ARG 103 N 0.35 0.88 -0.54 1.82 2.47 -0.54 0.23 114.38 119.06 2guz h ARG 103 Ca 0.20 -0.38 0.00 0.00 -1.26 0.00 0.00 59.98 58.54 2guz h ARG 103 Cb 0.17 -0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.43 2guz h ARG 103 CO -0.18 1.03 0.35 0.00 0.56 0.00 0.00 179.97 181.73 2guz h ALA 104 N 0.95 0.68 -0.38 0.04 0.00 -0.59 -1.46 119.26 118.50 2guz h ALA 104 Ca 0.09 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2guz h ALA 104 Cb 0.80 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2guz h ALA 104 CO 0.07 0.12 -0.31 0.00 0.00 0.00 0.00 179.25 179.13 2guz h ALA 105 N 1.19 0.72 -0.49 0.00 0.00 -0.93 -1.38 119.26 118.38 2guz h ALA 105 Ca 0.20 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2guz h ALA 105 Cb -0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2guz h ALA 105 CO -0.04 0.66 0.27 1.49 0.00 0.00 0.00 179.25 181.63 2guz h GLU 106 N 0.71 0.68 -0.17 0.00 4.81 -0.82 0.21 114.58 120.00 2guz h GLU 106 Ca 0.08 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2guz h GLU 106 Cb 0.87 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 2guz h GLU 106 CO 0.08 0.52 -0.01 -0.09 -0.73 0.00 0.00 179.01 178.78 2guz h ARG 107 N 0.65 0.31 -0.24 1.92 9.65 -1.06 -0.25 114.38 125.36 2guz h ARG 107 Ca 0.17 -0.10 -0.09 0.00 -1.10 0.00 0.00 59.98 58.86 2guz h ARG 107 Cb 0.04 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 2guz h ARG 107 CO -0.03 0.54 -0.26 -0.07 2.80 0.00 0.00 179.97 182.95 2guz h LEU 108 N 0.04 0.46 -0.49 3.80 3.38 -0.84 -1.12 115.31 120.54 2guz h LEU 108 Ca 0.05 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 2guz h LEU 108 Cb 0.41 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2guz h LEU 108 CO 0.01 0.71 -0.42 0.11 0.09 0.00 0.00 178.44 178.94 2guz h LYS 109 N 0.40 0.78 0.06 1.13 1.57 -0.51 -0.31 116.57 119.69 2guz h LYS 109 Ca 0.06 -0.42 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2guz h LYS 109 Cb 0.66 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2guz h LYS 109 CO 0.05 1.05 -0.07 2.35 -0.57 0.00 0.00 179.45 182.26 2guz h TRP 110 N 0.63 -0.17 -0.53 -1.35 2.91 -0.90 -0.43 115.95 116.10 2guz h TRP 110 Ca 0.05 0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.10 2guz h TRP 110 Cb 0.98 0.07 -0.04 0.00 -0.51 0.00 0.00 29.16 29.66 2guz h TRP 110 CO 0.05 -0.10 0.31 1.49 -1.03 0.00 0.00 178.44 179.16 2guz h GLU 111 N -0.15 0.59 -0.39 2.65 4.57 -0.97 -0.68 114.58 120.21 2guz h GLU 111 Ca 0.01 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.07 2guz h GLU 111 Cb 0.15 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 2guz h GLU 111 CO -0.02 0.39 -0.09 -0.07 -1.18 0.00 0.00 179.01 178.03 2guz h LEU 112 N 0.60 0.65 -1.77 1.64 4.07 -0.88 -0.86 115.31 118.76 2guz h LEU 112 Ca 0.22 -0.18 -0.03 0.00 0.08 0.00 0.00 57.88 57.97 2guz h LEU 112 Cb 0.06 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 41.62 2guz h LEU 112 CO -0.11 0.78 -0.16 0.00 -1.08 0.00 0.00 178.44 177.87 2guz h ALA 113 N 1.28 1.52 0.04 1.53 0.00 -0.32 -2.49 119.26 120.81 2guz h ALA 113 Ca 0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2guz h ALA 113 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2guz h ALA 113 CO 0.03 0.20 -0.02 1.96 0.00 0.00 0.00 179.25 181.42 2guz h GLN 114 N 0.00 -0.05 -0.85 0.00 1.08 -0.28 -3.19 115.11 111.82 2guz h GLN 114 Ca -0.00 0.00 0.15 0.00 -1.45 0.00 0.00 58.65 57.35 2guz h GLN 114 Cb 0.32 0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 27.70 2guz h GLN 114 CO 0.02 0.63 0.56 0.00 -0.95 0.00 0.00 178.83 179.08 2guz h ARG 115 N -0.85 0.58 -0.67 1.46 3.08 -1.16 0.35 114.38 117.16 2guz h ARG 115 Ca -0.00 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2guz h ARG 115 Cb 0.70 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 2guz h ARG 115 CO 0.01 0.38 0.34 1.49 -1.07 0.00 0.00 179.97 181.12 2guz h GLU 116 N 0.59 0.95 0.00 0.04 4.81 -1.53 -3.51 114.58 115.93 2guz h GLU 116 Ca 0.43 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 2guz h GLU 116 Cb 0.79 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.99 2guz h GLU 116 CO -0.18 0.74 0.00 1.17 -0.73 0.00 0.00 179.01 180.01