#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 4.46 0.21 3.17 -4.23 -1.26 -4.93 115.64 113.07 2guz s THR 54 Ca 0.00 1.13 -0.09 0.00 -1.18 0.00 0.00 61.69 61.55 2guz s THR 54 Cb 0.00 -3.70 0.15 0.00 1.34 0.00 0.00 72.50 70.29 2guz s THR 54 CO 0.00 -0.73 1.82 0.25 -0.54 0.00 0.00 174.62 175.42 2guz h LEU 55 N 0.69 0.61 -0.44 4.79 7.12 -1.98 -0.29 115.31 125.81 2guz h LEU 55 Ca -0.46 0.02 -0.04 0.00 0.13 0.00 0.00 57.88 57.53 2guz h LEU 55 Cb 1.19 -0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 41.20 2guz h LEU 55 CO 0.61 0.40 0.12 0.44 -0.13 0.00 0.00 178.44 179.88 2guz h ASP 56 N 0.75 0.66 -0.36 1.25 3.45 -2.00 -0.25 116.42 119.93 2guz h ASP 56 Ca 0.30 -0.23 -0.10 0.00 0.43 0.00 0.00 57.03 57.44 2guz h ASP 56 Cb 0.14 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 38.72 2guz h ASP 56 CO -0.16 0.71 -0.12 -0.08 -1.57 0.00 0.00 179.24 178.02 2guz h GLU 57 N 0.58 0.80 -0.49 3.56 4.81 -1.88 -2.35 114.58 119.61 2guz h GLU 57 Ca 0.14 -0.28 -0.02 0.00 -0.13 0.00 0.00 59.36 59.07 2guz h GLU 57 Cb 0.30 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2guz h GLU 57 CO -0.00 0.89 0.23 0.77 -0.73 0.00 0.00 179.01 180.17 2guz h SER 58 N 0.72 0.64 -0.45 1.04 0.02 -0.73 -0.24 113.55 114.55 2guz h SER 58 Ca 0.12 -0.13 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 2guz h SER 58 Cb 0.62 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 2guz h SER 58 CO 0.04 0.59 0.05 0.00 -1.14 0.00 0.00 176.83 176.37 2guz h LYS 60 N 0.78 0.53 -0.66 0.00 3.64 -0.85 0.35 116.57 120.36 2guz h LYS 60 Ca 0.16 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2guz h LYS 60 Cb 0.40 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 2guz h LYS 60 CO 0.01 0.62 0.42 0.82 -2.27 0.00 0.00 179.45 179.05 2guz h ILE 61 N 0.35 1.12 -0.01 2.00 2.04 -0.95 -2.96 117.51 119.10 2guz h ILE 61 Ca 0.10 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2guz h ILE 61 Cb 0.35 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 2guz h ILE 61 CO 0.01 0.15 -0.12 0.18 0.00 0.00 0.00 178.15 178.37 2guz n LEU 62 N -4.67 0.86 -3.18 1.44 4.77 -0.84 -4.93 117.00 110.45 2guz n LEU 62 Ca 0.06 -0.20 -0.16 0.00 -0.03 0.00 0.00 56.01 55.68 2guz n LEU 62 Cb 0.06 -0.10 0.08 0.00 -2.33 0.00 0.00 43.42 41.12 2guz n LEU 62 CO 0.34 0.15 0.11 -3.20 -1.33 0.00 0.00 177.39 173.46 2guz n ASN 63 N -0.59 -2.45 -4.35 -1.43 4.05 0.87 -4.96 115.26 106.40 2guz n ASN 63 Ca 0.16 -0.55 -0.32 0.00 0.45 0.00 0.00 54.58 54.32 2guz n ASN 63 Cb 0.31 -4.62 -0.15 0.00 1.23 0.00 0.00 39.78 36.54 2guz n ASN 63 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 2guz s ILE 64 N -3.32 2.40 -0.27 -1.44 -5.25 0.84 -5.02 121.20 109.14 2guz s ILE 64 Ca 0.06 -0.97 0.03 0.00 -0.99 0.00 0.00 60.65 58.78 2guz s ILE 64 Cb -0.02 -1.88 0.07 0.00 2.95 0.00 0.00 42.46 43.57 2guz s ILE 64 CO 0.65 0.58 -0.08 -0.70 -1.79 0.00 0.00 174.94 173.60 2guz s GLU 65 N -0.51 2.10 0.37 0.37 2.12 -1.26 -4.45 118.70 117.44 2guz s GLU 65 Ca 0.07 -1.42 0.11 0.00 0.36 0.00 0.00 54.97 54.09 2guz s GLU 65 Cb -0.11 -2.93 0.89 0.00 0.26 0.00 0.00 34.13 32.24 2guz s GLU 65 CO 0.01 -0.63 1.86 1.49 -0.54 0.00 0.00 175.26 177.45 2guz h GLU 66 N 7.75 0.60 0.00 4.30 4.81 -1.95 -1.65 114.58 128.43 2guz h GLU 66 Ca -0.17 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.98 2guz h GLU 66 Cb 1.04 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 2guz h GLU 66 CO 0.47 0.39 -0.23 0.66 -0.73 0.00 0.00 179.01 179.57 2guz h SER 67 N 0.61 0.00 -0.15 1.04 4.64 -2.01 -1.55 113.55 116.13 2guz h SER 67 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 2guz h SER 67 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2guz h SER 67 CO -0.21 0.23 0.00 0.29 -0.87 0.00 0.00 176.83 176.27 2guz n LYS 68 N -3.65 1.71 -0.96 4.77 5.02 -0.64 -4.93 118.16 119.49 2guz n LYS 68 Ca -0.01 -1.07 0.00 0.00 -2.02 0.00 0.00 58.31 55.21 2guz n LYS 68 Cb 0.36 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 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 0.48 0.16 0.72 0.00 -0.58 -4.93 105.19 102.16 2guz n GLY 69 Ca 0.16 -0.39 0.13 0.00 0.00 0.00 0.00 46.02 45.93 2guz n GLY 69 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2guz h ASP 70 N 0.00 0.00 -0.40 1.61 3.45 -1.69 -3.38 116.42 116.01 2guz h ASP 70 Ca 0.00 0.00 -0.72 0.00 0.43 0.00 0.00 57.03 56.74 2guz h ASP 70 Cb 0.00 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 38.70 2guz h ASP 70 CO 0.00 0.00 2.78 0.18 -1.57 0.00 0.00 179.24 180.63 2guz n LEU 71 N -2.48 6.55 -4.06 1.55 4.77 -1.26 -4.46 117.00 117.61 2guz n LEU 71 Ca 0.03 -4.21 -0.08 0.00 -0.03 0.00 0.00 56.01 51.72 2guz n LEU 71 Cb 0.31 -1.64 -0.09 0.00 -2.33 0.00 0.00 43.42 39.67 2guz n LEU 71 CO 0.25 1.03 -0.28 0.54 -1.33 0.00 0.00 177.39 177.60 2guz s ASN 72 N 2.91 0.35 0.17 -1.43 4.22 -1.26 -5.06 114.94 114.85 2guz s ASN 72 Ca 0.46 -0.99 -0.12 0.00 -2.14 0.00 0.00 52.86 50.07 2guz s ASN 72 Cb 0.12 0.27 0.07 0.00 1.28 0.00 0.00 41.25 42.98 2guz s ASN 72 CO -0.05 -0.68 1.72 -0.03 -2.04 0.00 0.00 177.10 176.02 2guz h MET 73 N 2.96 0.91 -0.24 3.55 1.85 -1.97 -0.93 114.93 121.07 2guz h MET 73 Ca -0.34 -0.18 -0.14 0.00 -0.61 0.00 0.00 59.70 58.43 2guz h MET 73 Cb 1.17 -0.14 -0.00 0.00 0.43 0.00 0.00 31.60 33.06 2guz h MET 73 CO 0.61 0.79 -0.40 0.22 -0.40 0.00 0.00 176.91 177.73 2guz h ASP 74 N 0.83 0.76 -0.27 1.39 -0.00 -1.97 -0.60 116.42 116.57 2guz h ASP 74 Ca 0.20 -0.53 -0.02 0.00 -0.00 0.00 0.00 57.03 56.68 2guz h ASP 74 Cb 0.24 -0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 39.34 2guz h ASP 74 CO -0.01 1.14 0.11 0.50 -0.00 0.00 0.00 179.24 180.98 2guz h LYS 75 N 0.41 0.41 -0.67 0.28 3.64 -1.80 -1.48 116.57 117.35 2guz h LYS 75 Ca 0.02 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.36 2guz h LYS 75 Cb 0.99 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.70 2guz h LYS 75 CO 0.09 0.43 0.41 0.82 -2.27 0.00 0.00 179.45 178.93 2guz h ILE 76 N 0.29 1.06 0.15 2.00 2.04 -1.10 -0.71 117.51 121.24 2guz h ILE 76 Ca 0.09 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.68 2guz h ILE 76 Cb 0.17 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2guz h ILE 76 CO -0.01 0.14 -0.14 0.78 0.00 0.00 0.00 178.15 178.93 2guz h ASN 77 N 0.79 -0.37 -0.77 1.72 -0.26 -0.82 0.02 115.58 115.88 2guz h ASN 77 Ca 0.28 0.03 -0.03 0.00 -0.56 0.00 0.00 56.30 56.02 2guz h ASN 77 Cb 0.06 0.13 -0.04 0.00 -1.06 0.00 0.00 38.32 37.41 2guz h ASN 77 CO -0.12 -0.22 0.37 0.78 -1.06 0.00 0.00 177.43 177.18 2guz h ASN 78 N -0.31 1.02 -0.24 5.81 2.35 -1.14 -0.42 115.58 122.65 2guz h ASN 78 Ca 0.00 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.58 2guz h ASN 78 Cb 0.29 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2guz h ASN 78 CO -0.03 0.87 0.01 0.03 -1.65 0.00 0.00 177.43 176.66 2guz h ARG 79 N 1.09 0.41 0.28 0.81 2.47 -0.83 -1.71 114.38 116.90 2guz h ARG 79 Ca 0.27 -0.12 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2guz h ARG 79 Cb 0.13 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.39 2guz h ARG 79 CO -0.03 0.57 -0.27 0.35 0.56 0.00 0.00 179.97 181.15 2guz h PHE 80 N 0.19 -0.73 -0.84 3.04 3.57 -0.94 -1.17 116.94 120.06 2guz h PHE 80 Ca 0.07 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.64 2guz h PHE 80 Cb 0.38 0.28 -0.06 0.00 2.79 0.00 0.00 35.95 39.34 2guz h PHE 80 CO 0.03 -0.40 0.51 -0.91 -2.23 0.00 0.00 178.31 175.31 2guz h ASN 81 N -0.58 0.78 0.73 0.41 -0.26 -0.88 0.20 115.58 115.97 2guz h ASN 81 Ca -0.01 0.03 -0.04 0.00 -0.56 0.00 0.00 56.30 55.72 2guz h ASN 81 Cb 0.54 -0.13 0.01 0.00 -1.06 0.00 0.00 38.32 37.67 2guz h ASN 81 CO -0.05 0.48 -0.35 0.22 -1.06 0.00 0.00 177.43 176.67 2guz h TYR 82 N 0.91 -0.90 0.00 1.19 3.20 -1.24 -2.01 116.97 118.11 2guz h TYR 82 Ca 0.38 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.16 2guz h TYR 82 Cb 0.23 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 2guz h TYR 82 CO -0.04 -0.54 -0.31 -0.07 -1.64 0.00 0.00 178.16 175.55 2guz h LEU 83 N -1.21 0.00 -0.23 2.82 3.38 -1.00 -0.66 115.31 118.42 2guz h LEU 83 Ca -0.10 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.66 2guz h LEU 83 Cb 0.76 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.52 2guz h LEU 83 CO 0.16 0.31 -0.71 0.15 0.09 0.00 0.00 178.44 178.45 2guz h PHE 84 N 0.00 1.03 -0.15 1.13 3.57 -0.64 -2.57 116.94 119.32 2guz h PHE 84 Ca -0.00 -0.43 -0.20 0.00 3.53 0.00 0.00 57.97 60.87 2guz h PHE 84 Cb 0.59 -0.17 0.01 0.00 2.79 0.00 0.00 35.95 39.17 2guz h PHE 84 CO 0.00 1.25 -0.67 1.49 -2.23 0.00 0.00 178.31 178.15 2guz h GLU 85 N 0.56 0.72 0.00 1.11 4.81 -1.07 -2.41 114.58 118.29 2guz h GLU 85 Ca -0.03 -0.57 -0.02 0.00 -0.13 0.00 0.00 59.36 58.61 2guz h GLU 85 Cb 1.32 0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.82 2guz h GLU 85 CO 0.15 1.19 -0.09 0.28 -0.73 0.00 0.00 179.01 179.80 2guz h VAL 86 N 0.42 0.98 -0.59 0.32 2.07 -1.12 -1.60 116.25 116.73 2guz h VAL 86 Ca -0.04 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2guz h VAL 86 Cb 1.31 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 2guz h VAL 86 CO 0.14 0.09 0.00 0.59 0.02 0.00 0.00 177.57 178.41 2guz n ASN 87 N -4.31 3.74 -4.77 0.57 4.13 -0.97 -4.81 115.26 108.84 2guz n ASN 87 Ca -0.03 -2.09 -0.41 0.00 1.68 0.00 0.00 54.58 53.74 2guz n ASN 87 Cb 0.17 -0.42 -0.01 0.00 -1.54 0.00 0.00 39.78 37.97 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 -1.02 6.59 0.47 6.41 -1.08 -0.60 -3.00 116.67 124.43 2guz s ASP 88 Ca 0.41 2.83 0.27 0.00 -0.52 0.00 0.00 52.55 55.54 2guz s ASP 88 Cb 0.23 -2.65 0.90 0.00 -1.46 0.00 0.00 42.92 39.93 2guz s ASP 88 CO 0.26 -0.69 1.81 0.07 0.52 0.00 0.00 175.17 177.14 2guz h LYS 89 N 3.49 0.00 -0.48 4.34 2.10 -1.87 -0.38 116.57 123.77 2guz h LYS 89 Ca -0.49 0.00 0.07 0.00 -2.00 0.00 0.00 60.65 58.23 2guz h LYS 89 Cb 1.23 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.50 2guz h LYS 89 CO 0.67 0.10 0.15 1.49 -2.00 0.00 0.00 179.45 179.85 2guz h GLU 90 N 0.00 0.30 -0.87 0.07 4.57 -1.91 -2.35 114.58 114.39 2guz h GLU 90 Ca -0.00 -0.02 -0.56 0.00 -1.18 0.00 0.00 59.36 57.61 2guz h GLU 90 Cb 0.76 -0.07 -0.29 0.00 -0.16 0.00 0.00 28.75 28.99 2guz h GLU 90 CO 0.01 0.20 0.40 1.63 -1.18 0.00 0.00 179.01 180.07 2guz n LYS 91 N -5.04 2.64 -0.37 1.92 4.76 -1.25 -4.90 118.16 115.92 2guz n LYS 91 Ca 0.05 -3.37 0.00 0.00 -2.87 0.00 0.00 58.31 52.11 2guz n LYS 91 Cb 0.21 -2.20 0.00 0.00 -1.84 0.00 0.00 35.03 31.20 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 -0.96 0.81 3.81 0.72 0.00 -0.88 -5.07 105.19 103.61 2guz n GLY 92 Ca 0.55 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 46.23 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 -2.03 1.62 -0.28 -0.02 0.00 -0.15 -4.95 107.32 101.50 2guz s GLY 93 Ca 0.00 -0.23 -0.24 0.00 0.00 0.00 0.00 44.72 44.26 2guz s GLY 93 CO 0.00 0.20 0.79 -0.45 0.00 0.00 0.00 173.10 173.64 2guz s SER 94 N -3.93 6.72 0.41 1.64 0.15 -1.16 -3.95 113.70 113.56 2guz s SER 94 Ca 0.61 0.81 0.18 0.00 0.70 0.00 0.00 55.95 58.25 2guz s SER 94 Cb -0.14 -2.41 0.89 0.00 -1.71 0.00 0.00 66.02 62.65 2guz s SER 94 CO 0.54 -0.55 1.86 0.15 1.20 0.00 0.00 173.24 176.44 2guz h PHE 95 N 7.93 0.00 0.10 3.44 3.57 -1.94 -0.68 116.94 129.36 2guz h PHE 95 Ca -0.24 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.25 2guz h PHE 95 Cb 1.10 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.84 2guz h PHE 95 CO 0.77 0.31 -0.05 -0.92 -2.23 0.00 0.00 178.31 176.19 2guz h TYR 96 N 0.00 -0.12 -0.59 0.41 3.20 -1.93 0.99 116.97 118.93 2guz h TYR 96 Ca -0.00 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 2guz h TYR 96 Cb 0.65 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.93 2guz h TYR 96 CO 0.00 0.13 0.11 -0.07 -1.64 0.00 0.00 178.16 176.69 2guz h LEU 97 N -0.37 0.89 -1.07 2.82 3.38 -1.80 -2.50 115.31 116.65 2guz h LEU 97 Ca -0.01 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.69 2guz h LEU 97 Cb 0.31 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2guz h LEU 97 CO 0.02 0.89 -0.15 -0.61 0.09 0.00 0.00 178.44 178.68 2guz h GLN 98 N 0.89 0.49 -0.41 1.13 4.15 -1.01 -2.10 115.11 118.25 2guz h GLN 98 Ca 0.19 -0.15 -0.09 0.00 0.77 0.00 0.00 58.65 59.37 2guz h GLN 98 Cb 0.37 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 2guz h GLN 98 CO 0.01 0.63 -0.09 0.77 -1.93 0.00 0.00 178.83 178.21 2guz h SER 99 N 0.45 0.78 -0.45 -0.69 0.02 -0.58 -0.40 113.55 112.68 2guz h SER 99 Ca 0.08 -0.36 0.07 0.00 -0.84 0.00 0.00 61.79 60.74 2guz h SER 99 Cb 0.52 -0.21 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 2guz h SER 99 CO 0.03 0.96 0.10 0.11 -1.14 0.00 0.00 176.83 176.89 2guz h LYS 100 N 0.60 0.23 -0.71 3.45 1.79 -1.28 0.19 116.57 120.84 2guz h LYS 100 Ca 0.10 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.54 2guz h LYS 100 Cb 0.61 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 2guz h LYS 100 CO 0.04 0.15 0.37 0.28 -1.08 0.00 0.00 179.45 179.21 2guz h VAL 101 N 0.24 1.23 -0.40 0.50 2.07 -1.28 0.18 116.25 118.78 2guz h VAL 101 Ca 0.22 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 2guz h VAL 101 Cb 0.27 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 2guz h VAL 101 CO -0.28 0.26 0.15 0.22 0.02 0.00 0.00 177.57 177.93 2guz h TYR 102 N 0.98 0.62 -0.20 1.57 3.20 -0.31 -1.58 116.97 121.25 2guz h TYR 102 Ca 0.25 -0.05 -0.16 0.00 3.14 0.00 0.00 58.73 61.90 2guz h TYR 102 Cb 0.08 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 2guz h TYR 102 CO 0.00 0.57 -0.53 0.00 -1.64 0.00 0.00 178.16 176.55 2guz h ARG 103 N 0.50 0.58 0.00 1.82 2.47 -0.46 0.31 114.38 119.59 2guz h ARG 103 Ca 0.13 -0.35 0.01 0.00 -1.26 0.00 0.00 59.98 58.51 2guz h ARG 103 Cb 0.22 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.56 2guz h ARG 103 CO -0.01 0.96 -0.08 0.00 0.56 0.00 0.00 179.97 181.40 2guz h ALA 104 N 0.97 -0.09 -0.56 0.04 0.00 -0.59 -0.94 119.26 118.09 2guz h ALA 104 Ca 0.01 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2guz h ALA 104 Cb 1.08 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2guz h ALA 104 CO 0.10 -0.57 0.04 0.00 0.00 0.00 0.00 179.25 178.82 2guz h ALA 105 N 0.84 1.01 -0.46 0.00 0.00 -1.14 -2.27 119.26 117.25 2guz h ALA 105 Ca 0.03 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.68 2guz h ALA 105 Cb 0.18 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2guz h ALA 105 CO -0.08 0.62 0.29 1.49 0.00 0.00 0.00 179.25 181.56 2guz h GLU 106 N 0.87 0.57 -0.03 0.00 4.81 -0.68 0.17 114.58 120.29 2guz h GLU 106 Ca 0.17 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2guz h GLU 106 Cb 0.46 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 2guz h GLU 106 CO 0.02 0.38 0.01 -0.09 -0.73 0.00 0.00 179.01 178.60 2guz h ARG 107 N 0.59 0.05 -0.47 1.92 9.65 -0.93 -0.96 114.38 124.22 2guz h ARG 107 Ca 0.18 -0.01 -0.11 0.00 -1.10 0.00 0.00 59.98 58.94 2guz h ARG 107 Cb -0.03 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 2guz h ARG 107 CO -0.06 0.19 -0.15 -0.07 2.80 0.00 0.00 179.97 182.67 2guz h LEU 108 N -0.10 0.90 -0.80 3.80 3.38 -1.25 -0.36 115.31 120.88 2guz h LEU 108 Ca 0.01 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.58 2guz h LEU 108 Cb 0.16 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2guz h LEU 108 CO -0.00 1.05 -0.11 0.11 0.09 0.00 0.00 178.44 179.58 2guz h LYS 109 N 0.80 0.79 0.09 1.13 1.57 -0.61 -0.54 116.57 119.80 2guz h LYS 109 Ca 0.12 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2guz h LYS 109 Cb 0.69 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2guz h LYS 109 CO 0.05 0.87 -0.04 2.35 -0.57 0.00 0.00 179.45 182.11 2guz h TRP 110 N 0.72 -0.11 -0.56 -1.35 2.91 -0.93 -1.41 115.95 115.22 2guz h TRP 110 Ca 0.12 -0.00 0.11 0.00 1.13 0.00 0.00 58.89 60.25 2guz h TRP 110 Cb 0.59 0.04 -0.09 0.00 -0.51 0.00 0.00 29.16 29.19 2guz h TRP 110 CO 0.03 -0.02 0.05 1.49 -1.03 0.00 0.00 178.44 178.95 2guz h GLU 111 N -0.17 0.16 -0.61 2.65 4.57 -0.91 0.14 114.58 120.41 2guz h GLU 111 Ca -0.01 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.18 2guz h GLU 111 Cb 0.14 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.65 2guz h GLU 111 CO 0.02 0.11 0.38 -0.07 -1.18 0.00 0.00 179.01 178.26 2guz h LEU 112 N 0.17 0.62 -0.74 1.64 4.07 -0.95 -0.17 115.31 119.94 2guz h LEU 112 Ca 0.29 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.20 2guz h LEU 112 Cb 0.44 -0.13 -0.03 0.00 1.08 0.00 0.00 40.66 42.01 2guz h LEU 112 CO -0.43 0.43 0.27 0.00 -1.08 0.00 0.00 178.44 177.63 2guz h ALA 113 N 1.26 0.97 -0.36 1.53 0.00 -0.40 -1.40 119.26 120.85 2guz h ALA 113 Ca 0.24 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2guz h ALA 113 Cb 0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2guz h ALA 113 CO -0.10 0.62 -0.21 1.96 0.00 0.00 0.00 179.25 181.52 2guz h GLN 114 N 1.08 0.78 -0.38 0.00 1.08 -0.06 -2.43 115.11 115.17 2guz h GLN 114 Ca 0.24 -0.35 0.05 0.00 -1.45 0.00 0.00 58.65 57.14 2guz h GLN 114 Cb 0.25 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.62 2guz h GLN 114 CO -0.02 0.98 0.12 0.00 -0.95 0.00 0.00 178.83 178.96 2guz h ARG 115 N 0.57 0.27 0.00 1.46 3.08 -1.01 -1.63 114.38 117.11 2guz h ARG 115 Ca 0.08 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2guz h ARG 115 Cb 0.76 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.75 2guz h ARG 115 CO 0.06 0.18 0.00 1.49 -1.07 0.00 0.00 179.97 180.62 2guz h GLU 116 N 0.27 0.00 -0.01 0.04 4.81 -0.98 -3.51 114.58 115.20 2guz h GLU 116 Ca 0.18 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2guz h GLU 116 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2guz h GLU 116 CO -0.19 0.00 0.00 1.17 -0.73 0.00 0.00 179.01 179.26