#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2z31 s VAL 4 N 0.00 1.57 0.01 0.00 1.01 -1.26 -1.07 120.40 120.65 2z31 s VAL 4 Ca 0.00 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2z31 s VAL 4 Cb 0.00 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.06 2z31 s VAL 4 CO 0.00 0.44 -0.07 0.42 0.00 0.00 0.00 175.10 175.89 2z31 s THR 5 N -0.33 0.58 0.33 3.92 -4.23 0.61 -4.62 115.64 111.90 2z31 s THR 5 Ca 0.04 -0.48 0.09 0.00 -1.18 0.00 0.00 61.69 60.17 2z31 s THR 5 Cb -0.09 -0.52 -0.06 0.00 1.34 0.00 0.00 72.50 73.18 2z31 s THR 5 CO 0.00 0.05 -0.02 -1.10 -0.54 0.00 0.00 174.62 173.01 2z31 s GLN 6 N -0.47 2.02 -0.28 3.99 -0.21 -1.26 -0.48 119.66 122.97 2z31 s GLN 6 Ca 0.00 -1.77 -0.16 0.00 0.02 0.00 0.00 55.36 53.45 2z31 s GLN 6 Cb -0.04 -1.89 0.09 0.00 1.00 0.00 0.00 33.01 32.17 2z31 s GLN 6 CO -0.00 0.16 0.76 0.45 -2.12 0.00 0.00 175.29 174.53 2z31 s SER 7 N -3.68 -0.84 0.96 5.90 0.15 -0.04 -4.60 113.70 111.54 2z31 s SER 7 Ca 0.34 1.36 -0.15 0.00 0.70 0.00 0.00 55.95 58.19 2z31 s SER 7 Cb -0.00 1.35 0.20 0.00 -1.71 0.00 0.00 66.02 65.86 2z31 s SER 7 CO 0.19 -0.21 1.31 -2.16 1.20 0.00 0.00 173.24 173.57 2z31 s PRO 8 N 1.52 0.64 0.00 5.44 0.04 -1.26 -0.95 135.00 140.43 2z31 s PRO 8 Ca -0.09 -0.46 0.23 0.00 0.04 0.00 0.00 61.00 60.71 2z31 s PRO 8 Cb -0.05 -1.86 0.49 0.00 0.04 0.00 0.00 34.50 33.12 2z31 s PRO 8 CO -0.18 -2.40 1.44 0.54 0.04 0.00 0.00 177.00 176.44 2z31 n ARG 9 N -3.74 2.58 -3.15 4.56 1.74 -1.26 -4.62 116.66 112.77 2z31 n ARG 9 Ca 0.15 -2.41 0.05 0.00 -0.77 0.00 0.00 57.85 54.87 2z31 n ARG 9 Cb 0.59 -1.53 -0.01 0.00 -1.02 0.00 0.00 32.46 30.49 2z31 n ARG 9 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2z31 s ASN 10 N -1.33 -0.73 -0.20 0.55 0.01 -1.26 -3.68 114.94 108.29 2z31 s ASN 10 Ca 0.42 0.40 0.01 0.00 -0.71 0.00 0.00 52.86 52.98 2z31 s ASN 10 Cb 0.24 1.59 0.05 0.00 0.41 0.00 0.00 41.25 43.53 2z31 s ASN 10 CO 0.32 -0.14 -0.09 -0.75 -1.51 0.00 0.00 177.10 174.94 2z31 s LYS 11 N 2.93 1.90 -0.17 -0.60 2.47 -0.48 -4.99 119.74 120.79 2z31 s LYS 11 Ca 0.07 -0.85 -0.13 0.00 -1.56 0.00 0.00 55.97 53.50 2z31 s LYS 11 Cb -0.11 -2.42 -0.05 0.00 -1.46 0.00 0.00 37.83 33.79 2z31 s LYS 11 CO -0.15 -0.47 0.25 0.08 0.16 0.00 0.00 175.35 175.22 2z31 s VAL 12 N 1.41 5.33 0.22 4.02 1.01 -1.26 -2.23 120.40 128.90 2z31 s VAL 12 Ca -0.02 0.46 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 2z31 s VAL 12 Cb -0.17 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2z31 s VAL 12 CO -0.08 0.40 0.16 0.00 0.00 0.00 0.00 175.10 175.59 2z31 s ALA 13 N 0.46 1.18 0.03 5.51 0.00 -0.68 -4.99 121.76 123.27 2z31 s ALA 13 Ca 0.14 -1.70 0.06 0.00 0.00 0.00 0.00 51.96 50.46 2z31 s ALA 13 Cb -0.12 1.38 -0.03 0.00 0.00 0.00 0.00 23.12 24.35 2z31 s ALA 13 CO 0.02 -0.61 -0.14 0.14 0.00 0.00 0.00 175.76 175.17 2z31 s VAL 14 N -4.07 3.10 0.29 0.00 -7.23 -1.26 -2.00 120.40 109.23 2z31 s VAL 14 Ca 0.38 -1.06 -0.27 0.00 -1.81 0.00 0.00 61.98 59.22 2z31 s VAL 14 Cb 0.06 -2.33 -0.14 0.00 0.56 0.00 0.00 36.38 34.53 2z31 s VAL 14 CO 0.14 0.34 0.83 0.41 -0.31 0.00 0.00 175.10 176.51 2z31 n THR 15 N 1.50 1.98 0.00 5.32 -1.04 -1.25 -1.25 114.28 119.54 2z31 n THR 15 Ca -0.16 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.35 2z31 n THR 15 Cb 0.52 -0.71 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 2z31 n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2z31 n GLY 16 N 1.47 2.23 3.34 3.41 0.00 0.27 -4.94 105.19 110.97 2z31 n GLY 16 Ca 0.12 -0.39 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 2z31 n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2z31 n GLU 17 N 0.00 0.20 -3.36 1.61 2.13 -0.38 -3.30 120.64 117.53 2z31 n GLU 17 Ca 0.00 0.08 -0.41 0.00 0.66 0.00 0.00 57.16 57.49 2z31 n GLU 17 Cb 0.00 -1.25 -0.09 0.00 0.27 0.00 0.00 31.44 30.37 2z31 n GLU 17 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2z31 s LYS 18 N -1.37 3.64 0.05 5.31 2.20 -1.20 -0.45 119.74 127.92 2z31 s LYS 18 Ca 0.61 -0.30 0.05 0.00 -0.36 0.00 0.00 55.97 55.98 2z31 s LYS 18 Cb -0.51 -3.78 -0.04 0.00 -1.51 0.00 0.00 37.83 31.99 2z31 s LYS 18 CO 0.62 -0.52 -0.09 0.08 -0.36 0.00 0.00 175.35 175.08 2z31 s VAL 19 N 2.11 3.47 -0.03 4.02 1.01 -0.30 -4.98 120.40 125.70 2z31 s VAL 19 Ca 0.14 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.11 2z31 s VAL 19 Cb -0.16 -2.55 0.03 0.00 0.00 0.00 0.00 36.38 33.69 2z31 s VAL 19 CO 0.12 0.27 0.01 -0.89 0.00 0.00 0.00 175.10 174.61 2z31 s THR 20 N -1.08 0.09 -0.02 3.92 2.01 -1.26 0.36 115.64 119.65 2z31 s THR 20 Ca 0.19 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.35 2z31 s THR 20 Cb -0.11 -0.21 -0.03 0.00 0.01 0.00 0.00 72.50 72.16 2z31 s THR 20 CO 0.10 0.13 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.39 2z31 s LEU 21 N 1.13 3.46 -0.00 4.42 2.01 0.60 -4.72 118.68 125.58 2z31 s LEU 21 Ca -0.08 -0.00 0.08 0.00 0.01 0.00 0.00 54.13 54.14 2z31 s LEU 21 Cb -0.13 -1.95 -0.02 0.00 0.01 0.00 0.00 46.19 44.10 2z31 s LEU 21 CO -0.02 0.30 -0.25 -0.44 1.01 0.00 0.00 176.35 176.94 2z31 s SER 22 N -1.40 3.15 -0.04 2.29 0.01 -0.13 -1.60 113.70 115.98 2z31 s SER 22 Ca 0.18 -0.49 0.02 0.00 1.31 0.00 0.00 55.95 56.97 2z31 s SER 22 Cb -0.11 -0.36 0.01 0.00 0.21 0.00 0.00 66.02 65.77 2z31 s SER 22 CO 0.08 0.30 -0.07 0.00 0.41 0.00 0.00 173.24 173.97 2z31 s ASN 24 N 0.55 2.54 -0.08 0.00 2.47 0.37 -2.28 114.94 118.51 2z31 s ASN 24 Ca -0.08 -0.66 -0.07 0.00 0.42 0.00 0.00 52.86 52.46 2z31 s ASN 24 Cb -0.12 -0.15 0.02 0.00 -1.45 0.00 0.00 41.25 39.56 2z31 s ASN 24 CO 0.01 0.07 0.21 0.00 -3.72 0.00 0.00 177.10 173.67 2z31 s GLN 25 N -1.81 0.24 -0.18 0.43 -2.07 0.18 -0.28 119.66 116.17 2z31 s GLN 25 Ca 0.07 0.31 0.17 0.00 -1.82 0.00 0.00 55.36 54.08 2z31 s GLN 25 Cb -0.10 0.10 0.52 0.00 -1.09 0.00 0.00 33.01 32.45 2z31 s GLN 25 CO 0.04 -0.04 1.42 0.25 -1.32 0.00 0.00 175.29 175.64 2z31 n THR 26 N 3.04 2.28 0.14 3.63 -2.24 -0.23 -4.37 114.28 116.53 2z31 n THR 26 Ca -0.13 -1.90 0.05 0.00 -2.27 0.00 0.00 64.05 59.79 2z31 n THR 26 Cb 0.58 -0.26 0.04 0.00 -2.10 0.00 0.00 70.33 68.59 2z31 n THR 26 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2z31 h ASN 27 N 1.75 0.00 -0.22 3.42 -0.26 -1.95 -3.41 115.58 114.90 2z31 h ASN 27 Ca 0.00 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.65 2z31 h ASN 27 Cb 1.44 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 38.66 2z31 h ASN 27 CO 0.22 0.36 -0.09 -3.20 -1.06 0.00 0.00 177.43 173.66 2z31 n ASN 28 N -3.10 -4.08 -4.78 5.81 4.05 -1.26 -5.01 115.26 106.90 2z31 n ASN 28 Ca 0.00 0.12 -0.35 0.00 0.45 0.00 0.00 54.58 54.81 2z31 n ASN 28 Cb 0.69 -1.99 -0.00 0.00 1.23 0.00 0.00 39.78 39.71 2z31 n ASN 28 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 2z31 s HIS 29 N -2.00 2.74 -0.56 1.20 3.76 -1.26 -4.96 115.29 114.20 2z31 s HIS 29 Ca 0.00 1.55 0.24 0.00 -0.15 0.00 0.00 55.06 56.70 2z31 s HIS 29 Cb 0.00 -3.23 0.29 0.00 1.11 0.00 0.00 32.58 30.75 2z31 s HIS 29 CO 0.00 -1.42 1.29 -0.91 -0.85 0.00 0.00 174.74 172.85 2z31 h ASN 30 N 1.17 0.00 -3.00 1.40 2.35 -1.79 -3.46 115.58 112.24 2z31 h ASN 30 Ca -0.50 -0.17 -0.64 0.00 -0.55 0.00 0.00 56.30 54.45 2z31 h ASN 30 Cb 1.25 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 39.52 2z31 h ASN 30 CO 0.57 0.08 -0.51 0.20 -1.65 0.00 0.00 177.43 176.13 2z31 s ASN 31 N -4.50 6.13 -0.03 5.81 0.01 0.24 -2.76 114.94 119.84 2z31 s ASN 31 Ca 0.05 0.31 -0.02 0.00 -0.71 0.00 0.00 52.86 52.49 2z31 s ASN 31 Cb 0.12 -2.01 0.02 0.00 0.41 0.00 0.00 41.25 39.79 2z31 s ASN 31 CO 0.73 0.30 0.07 -0.04 -1.51 0.00 0.00 177.10 176.65 2z31 s MET 32 N -0.35 0.05 0.18 -0.60 -1.94 -0.92 0.82 119.30 116.53 2z31 s MET 32 Ca 0.11 0.18 0.07 0.00 -1.71 0.00 0.00 55.69 54.34 2z31 s MET 32 Cb -0.12 -0.09 -0.04 0.00 2.01 0.00 0.00 34.83 36.59 2z31 s MET 32 CO 0.01 -0.09 -0.14 0.71 -0.01 0.00 0.00 175.02 175.50 2z31 s TYR 33 N 0.56 1.61 -0.26 -0.03 1.51 0.30 0.16 117.35 121.20 2z31 s TYR 33 Ca -0.04 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.46 2z31 s TYR 33 Cb -0.06 -0.78 0.06 0.00 -0.11 0.00 0.00 41.96 41.07 2z31 s TYR 33 CO -0.02 0.28 -0.09 -1.58 -1.11 0.00 0.00 175.55 173.03 2z31 s TRP 34 N -2.74 3.10 0.34 2.71 0.23 0.21 -1.12 118.94 121.68 2z31 s TRP 34 Ca 0.18 -2.24 0.08 0.00 -2.03 0.00 0.00 56.10 52.10 2z31 s TRP 34 Cb -0.02 -1.90 -0.04 0.00 0.03 0.00 0.00 33.47 31.54 2z31 s TRP 34 CO 0.05 -0.86 0.11 0.71 0.96 0.00 0.00 176.95 177.92 2z31 s TYR 35 N 1.15 2.67 -0.01 -1.98 1.51 0.23 -1.39 117.35 119.54 2z31 s TYR 35 Ca -0.07 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.61 2z31 s TYR 35 Cb -0.20 -1.60 0.00 0.00 -0.11 0.00 0.00 41.96 40.05 2z31 s TYR 35 CO -0.05 0.37 -0.06 -0.98 -1.11 0.00 0.00 175.55 173.72 2z31 s ARG 36 N -3.82 0.55 -0.25 -0.62 1.70 -0.83 -0.98 118.95 114.70 2z31 s ARG 36 Ca 0.37 -0.18 -0.07 0.00 -0.47 0.00 0.00 55.73 55.37 2z31 s ARG 36 Cb -0.02 -0.55 -0.03 0.00 -0.57 0.00 0.00 34.95 33.79 2z31 s ARG 36 CO 0.22 0.08 0.07 -1.14 -1.08 0.00 0.00 175.30 173.45 2z31 s GLN 37 N 0.11 3.61 0.03 3.89 0.74 0.41 -1.45 119.66 127.01 2z31 s GLN 37 Ca -0.01 -0.51 0.04 0.00 0.05 0.00 0.00 55.36 54.94 2z31 s GLN 37 Cb -0.05 -3.33 -0.02 0.00 1.10 0.00 0.00 33.01 30.70 2z31 s GLN 37 CO -0.00 -0.21 -0.13 -0.51 -0.55 0.00 0.00 175.29 173.89 2z31 s ASP 38 N 1.61 1.55 0.31 6.67 1.01 -0.49 -3.50 116.67 123.83 2z31 s ASP 38 Ca 0.06 -0.42 -0.29 0.00 0.71 0.00 0.00 52.55 52.61 2z31 s ASP 38 Cb -0.15 -0.11 -0.10 0.00 1.01 0.00 0.00 42.92 43.57 2z31 s ASP 38 CO 0.04 0.04 1.43 -0.89 0.21 0.00 0.00 175.17 176.00 2z31 s THR 39 N -0.77 2.47 0.00 -1.27 2.01 -1.26 0.41 115.64 117.22 2z31 s THR 39 Ca 0.01 0.43 0.00 0.00 0.31 0.00 0.00 61.69 62.44 2z31 s THR 39 Cb -0.07 -3.27 0.00 0.00 0.01 0.00 0.00 72.50 69.16 2z31 s THR 39 CO 0.01 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 2z31 n GLY 40 N 1.42 2.94 0.00 4.40 0.00 -1.26 -4.68 105.19 108.02 2z31 n GLY 40 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2z31 n GLY 40 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2z31 n HIS 41 N -2.00 0.00 -4.66 1.61 -0.00 -0.45 -5.11 115.22 104.61 2z31 n HIS 41 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2z31 n HIS 41 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 29.99 29.97 2z31 n HIS 41 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2z31 n GLY 42 N 2.69 1.74 3.82 -1.41 0.00 0.17 -4.62 105.19 107.58 2z31 n GLY 42 Ca -0.01 -0.61 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 2z31 n GLY 42 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2z31 s LEU 43 N 0.00 4.49 -0.02 0.99 1.43 -1.26 -1.39 118.68 122.91 2z31 s LEU 43 Ca 0.00 1.17 0.01 0.00 -1.03 0.00 0.00 54.13 54.28 2z31 s LEU 43 Cb 0.00 -2.90 0.02 0.00 0.03 0.00 0.00 46.19 43.34 2z31 s LEU 43 CO 0.00 0.26 -0.03 -0.13 0.23 0.00 0.00 176.35 176.68 2z31 s ARG 44 N -1.24 0.49 -0.09 1.70 0.52 -0.52 -4.94 118.95 114.86 2z31 s ARG 44 Ca 0.29 -0.06 -0.29 0.00 -0.52 0.00 0.00 55.73 55.15 2z31 s ARG 44 Cb -0.18 -0.55 -0.02 0.00 0.52 0.00 0.00 34.95 34.72 2z31 s ARG 44 CO 0.18 -0.04 0.97 -1.17 0.02 0.00 0.00 175.30 175.26 2z31 s LEU 45 N 0.60 4.26 -0.24 2.53 2.96 -1.26 -1.97 118.68 125.57 2z31 s LEU 45 Ca -0.07 1.49 -0.15 0.00 -0.22 0.00 0.00 54.13 55.18 2z31 s LEU 45 Cb -0.10 -3.49 -0.10 0.00 0.50 0.00 0.00 46.19 43.00 2z31 s LEU 45 CO -0.01 -0.39 -0.35 -0.38 -1.32 0.00 0.00 176.35 173.90 2z31 n ILE 46 N 4.42 1.50 -3.86 6.68 5.41 -0.48 -0.28 119.36 132.75 2z31 n ILE 46 Ca 0.07 -0.18 -0.09 0.00 1.00 0.00 0.00 62.75 63.55 2z31 n ILE 46 Cb 0.49 -2.05 -0.07 0.00 -0.71 0.00 0.00 39.64 37.31 2z31 n ILE 46 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2z31 s TYR 47 N -2.65 0.18 0.16 1.39 1.51 -1.18 -0.32 117.35 116.44 2z31 s TYR 47 Ca -0.35 -0.56 -0.24 0.00 -1.01 0.00 0.00 57.07 54.91 2z31 s TYR 47 Cb 0.11 0.01 0.06 0.00 -0.11 0.00 0.00 41.96 42.03 2z31 s TYR 47 CO 0.46 -0.65 0.82 1.52 -1.11 0.00 0.00 175.55 176.58 2z31 s TYR 48 N -3.89 -0.25 -0.00 2.71 1.13 -1.02 0.67 117.35 116.69 2z31 s TYR 48 Ca 0.09 -0.05 -0.01 0.00 -1.41 0.00 0.00 57.07 55.69 2z31 s TYR 48 Cb 0.04 0.63 -0.00 0.00 -1.10 0.00 0.00 41.96 41.52 2z31 s TYR 48 CO -0.07 -0.90 0.01 -1.54 -2.51 0.00 0.00 175.55 170.54 2z31 s SER 49 N -2.82 0.05 0.00 -0.18 1.04 0.12 -1.26 113.70 110.65 2z31 s SER 49 Ca 0.09 -0.12 0.28 0.00 0.48 0.00 0.00 55.95 56.68 2z31 s SER 49 Cb -0.03 0.07 1.03 0.00 0.10 0.00 0.00 66.02 67.20 2z31 s SER 49 CO -0.01 -0.11 1.77 -1.22 0.98 0.00 0.00 173.24 174.66 2z31 n TYR 50 N 2.59 0.00 0.00 5.02 4.01 -1.26 -2.17 117.16 125.34 2z31 n TYR 50 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 2z31 n TYR 50 Cb 0.58 -0.37 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 2z31 n TYR 50 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2z31 n GLY 51 N 1.45 0.52 3.68 2.72 0.00 -1.11 -4.53 105.19 107.92 2z31 n GLY 51 Ca 0.08 -1.21 -0.54 0.00 0.00 0.00 0.00 46.02 44.35 2z31 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2z31 n ALA 52 N -0.98 -0.06 -0.32 4.61 0.00 -1.26 -0.12 120.51 122.39 2z31 n ALA 52 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2z31 n ALA 52 Cb 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.20 2z31 n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2z31 n GLY 53 N 3.83 0.74 3.69 0.00 0.00 -0.95 -5.02 105.19 107.48 2z31 n GLY 53 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 2z31 n GLY 53 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2z31 s SER 54 N -2.55 6.17 -0.32 1.61 0.15 0.83 -4.97 113.70 114.62 2z31 s SER 54 Ca 0.00 0.18 -0.02 0.00 0.70 0.00 0.00 55.95 56.81 2z31 s SER 54 Cb 0.00 -2.11 0.12 0.00 -1.71 0.00 0.00 66.02 62.32 2z31 s SER 54 CO 0.00 0.10 0.17 -0.89 1.20 0.00 0.00 173.24 173.82 2z31 s THR 55 N 0.79 0.07 -0.22 6.45 2.01 -1.26 -4.42 115.64 119.07 2z31 s THR 55 Ca 0.08 -1.23 -0.09 0.00 0.31 0.00 0.00 61.69 60.77 2z31 s THR 55 Cb -0.13 -1.08 -0.04 0.00 0.01 0.00 0.00 72.50 71.27 2z31 s THR 55 CO 0.02 -0.85 0.10 -1.61 -0.69 0.00 0.00 174.62 171.60 2z31 s GLU 56 N 1.60 3.95 -0.03 4.92 0.41 -0.39 -5.02 118.70 124.13 2z31 s GLU 56 Ca 0.13 -0.34 -0.30 0.00 -0.41 0.00 0.00 54.97 54.05 2z31 s GLU 56 Cb -0.19 -3.37 -0.05 0.00 -1.78 0.00 0.00 34.13 28.73 2z31 s GLU 56 CO -0.19 0.09 1.47 0.15 -0.49 0.00 0.00 175.26 176.29 2z31 s LYS 57 N 0.92 4.24 0.00 1.61 1.02 -1.26 -2.45 119.74 123.82 2z31 s LYS 57 Ca 0.05 2.02 0.00 0.00 0.02 0.00 0.00 55.97 58.06 2z31 s LYS 57 Cb -0.13 -3.71 0.00 0.00 -0.52 0.00 0.00 37.83 33.46 2z31 s LYS 57 CO 0.03 -0.68 0.00 0.41 -0.92 0.00 0.00 175.35 174.19 2z31 n GLY 58 N 3.80 0.66 0.19 -3.33 0.00 0.57 -4.95 105.19 102.14 2z31 n GLY 58 Ca 0.15 -1.52 -0.16 0.00 0.00 0.00 0.00 46.02 44.48 2z31 n GLY 58 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2z31 h ASP 59 N 0.00 0.75 -2.46 1.61 3.32 -0.83 -3.39 116.42 115.43 2z31 h ASP 59 Ca 0.00 -0.55 -0.60 0.00 0.02 0.00 0.00 57.03 55.90 2z31 h ASP 59 Cb 0.00 -0.23 -0.41 0.00 0.22 0.00 0.00 39.33 38.91 2z31 h ASP 59 CO 0.00 1.34 -0.67 2.30 -1.72 0.00 0.00 179.24 180.49 2z31 n ILE 60 N -3.85 1.59 0.05 0.35 -5.35 -0.48 -4.94 119.36 106.73 2z31 n ILE 60 Ca -0.08 -4.87 -0.20 0.00 -0.27 0.00 0.00 62.75 57.33 2z31 n ILE 60 Cb 0.80 -2.08 -0.13 0.00 -1.74 0.00 0.00 39.64 36.48 2z31 n ILE 60 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2z31 h PRO 61 N 4.62 0.41 -3.99 6.28 0.13 -1.76 -3.41 132.00 134.28 2z31 h PRO 61 Ca 0.17 -0.59 -0.53 0.00 -0.87 0.00 0.00 66.00 64.19 2z31 h PRO 61 Cb 0.73 0.20 0.03 0.00 0.13 0.00 0.00 31.00 32.09 2z31 h PRO 61 CO 0.73 1.25 0.06 -0.25 -0.23 0.00 0.00 178.00 179.56 2z31 n ASP 62 N -4.06 0.03 0.00 1.44 10.43 -1.26 -0.63 116.55 122.50 2z31 n ASP 62 Ca -0.13 0.77 0.00 0.00 2.57 0.00 0.00 54.79 58.00 2z31 n ASP 62 Cb 0.83 -0.61 0.00 0.00 1.84 0.00 0.00 41.12 43.18 2z31 n ASP 62 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2z31 n GLY 63 N 1.08 0.74 3.43 0.44 0.00 -1.26 -5.03 105.19 104.59 2z31 n GLY 63 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 2z31 n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2z31 s TYR 65 N -2.74 1.91 -0.05 1.61 1.51 0.20 -4.21 117.35 115.58 2z31 s TYR 65 Ca 0.00 -0.98 -0.29 0.00 -1.01 0.00 0.00 57.07 54.79 2z31 s TYR 65 Cb 0.00 -1.23 0.06 0.00 -0.11 0.00 0.00 41.96 40.68 2z31 s TYR 65 CO 0.00 -0.02 0.64 0.21 -1.11 0.00 0.00 175.55 175.27 2z31 s LYS 66 N -3.90 1.01 0.20 -0.62 2.20 -0.91 -4.98 119.74 112.74 2z31 s LYS 66 Ca 0.36 0.24 -0.04 0.00 -0.36 0.00 0.00 55.97 56.17 2z31 s LYS 66 Cb 0.09 0.47 -0.03 0.00 -1.51 0.00 0.00 37.83 36.85 2z31 s LYS 66 CO 0.15 -0.31 0.20 0.00 -0.36 0.00 0.00 175.35 175.04 2z31 s ALA 67 N -1.15 0.79 -0.18 3.13 0.00 -1.26 -0.29 121.76 122.79 2z31 s ALA 67 Ca -0.11 -1.46 -0.15 0.00 0.00 0.00 0.00 51.96 50.24 2z31 s ALA 67 Cb -0.01 1.24 0.05 0.00 0.00 0.00 0.00 23.12 24.41 2z31 s ALA 67 CO 0.09 -0.64 0.47 -1.12 0.00 0.00 0.00 175.76 174.57 2z31 s SER 68 N -3.11 -0.53 -0.62 0.00 0.01 -0.93 -4.97 113.70 103.55 2z31 s SER 68 Ca 0.33 0.97 0.04 0.00 1.31 0.00 0.00 55.95 58.61 2z31 s SER 68 Cb 0.05 0.95 0.34 0.00 0.21 0.00 0.00 66.02 67.57 2z31 s SER 68 CO 0.10 -0.18 1.04 -1.14 0.41 0.00 0.00 173.24 173.47 2z31 n ARG 69 N 3.27 3.47 -0.44 12.44 3.00 -1.26 -1.50 116.66 135.63 2z31 n ARG 69 Ca -0.16 -4.84 0.37 0.00 -0.00 0.00 0.00 57.85 53.22 2z31 n ARG 69 Cb 0.56 -2.26 0.68 0.00 0.00 0.00 0.00 32.46 31.44 2z31 n ARG 69 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 2z31 h PRO 70 N 3.09 0.11 0.00 -0.14 0.13 -1.96 -2.51 132.00 130.72 2z31 h PRO 70 Ca 0.18 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2z31 h PRO 70 Cb 0.49 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.60 2z31 h PRO 70 CO 0.86 0.07 0.00 -1.13 -0.23 0.00 0.00 178.00 177.57 2z31 n SER 71 N -4.42 0.01 -0.10 1.44 3.41 -1.25 -4.77 113.62 107.94 2z31 n SER 71 Ca 0.33 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.71 2z31 n SER 71 Cb 1.39 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 65.22 2z31 n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2z31 n GLN 72 N 0.00 0.60 0.00 4.33 1.13 -1.26 -4.02 117.38 118.15 2z31 n GLN 72 Ca 0.00 0.46 0.13 0.00 -1.94 0.00 0.00 57.00 55.65 2z31 n GLN 72 Cb 0.00 -1.69 0.56 0.00 0.11 0.00 0.00 30.24 29.22 2z31 n GLN 72 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2z31 n GLU 73 N -4.25 0.01 -4.63 -1.09 1.02 -1.26 -4.82 120.64 105.63 2z31 n GLU 73 Ca -0.37 0.05 -0.29 0.00 -0.02 0.00 0.00 57.16 56.53 2z31 n GLU 73 Cb 0.78 -1.50 -0.17 0.00 -0.02 0.00 0.00 31.44 30.53 2z31 n GLU 73 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2z31 s ASN 74 N -2.99 2.55 -0.09 1.62 -0.87 -1.26 -0.65 114.94 113.25 2z31 s ASN 74 Ca 0.13 -0.46 -0.02 0.00 -1.57 0.00 0.00 52.86 50.94 2z31 s ASN 74 Cb 0.17 -1.15 0.03 0.00 -0.02 0.00 0.00 41.25 40.28 2z31 s ASN 74 CO 0.47 0.05 0.02 0.12 -2.57 0.00 0.00 177.10 175.19 2z31 s PHE 75 N 0.82 0.57 0.16 2.20 5.36 -0.97 -3.78 117.98 122.35 2z31 s PHE 75 Ca -0.10 -0.19 0.09 0.00 -0.96 0.00 0.00 56.93 55.78 2z31 s PHE 75 Cb -0.16 -0.77 -0.04 0.00 -0.34 0.00 0.00 43.02 41.72 2z31 s PHE 75 CO 0.01 -0.35 -0.16 -1.54 -1.46 0.00 0.00 175.22 171.71 2z31 s SER 76 N 2.00 3.91 -0.05 6.13 1.04 -0.56 -2.72 113.70 123.46 2z31 s SER 76 Ca 0.04 -0.64 0.06 0.00 0.48 0.00 0.00 55.95 55.89 2z31 s SER 76 Cb -0.13 -0.54 -0.02 0.00 0.10 0.00 0.00 66.02 65.43 2z31 s SER 76 CO -0.05 0.14 -0.22 -0.22 0.98 0.00 0.00 173.24 173.87 2z31 s LEU 77 N -2.52 2.29 -0.08 2.42 2.96 -0.63 -2.20 118.68 120.93 2z31 s LEU 77 Ca 0.21 -0.40 -0.00 0.00 -0.22 0.00 0.00 54.13 53.72 2z31 s LEU 77 Cb -0.09 -1.43 0.02 0.00 0.50 0.00 0.00 46.19 45.19 2z31 s LEU 77 CO 0.12 0.29 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.49 2z31 s THR 78 N -0.42 0.77 -0.55 3.68 2.01 0.60 -0.29 115.64 121.44 2z31 s THR 78 Ca 0.04 -0.16 -0.18 0.00 0.31 0.00 0.00 61.69 61.70 2z31 s THR 78 Cb -0.12 -0.82 0.09 0.00 0.01 0.00 0.00 72.50 71.66 2z31 s THR 78 CO 0.01 0.31 0.64 -0.76 -0.69 0.00 0.00 174.62 174.14 2z31 s LEU 79 N 1.54 5.33 0.04 4.42 1.02 0.16 -2.13 118.68 129.06 2z31 s LEU 79 Ca 0.00 -1.28 -0.13 0.00 0.02 0.00 0.00 54.13 52.74 2z31 s LEU 79 Cb -0.13 -2.33 -0.06 0.00 0.02 0.00 0.00 46.19 43.69 2z31 s LEU 79 CO -0.05 -0.99 1.21 -0.08 0.02 0.00 0.00 176.35 176.46 2z31 h GLU 80 N 9.07 -0.29 -3.19 1.70 4.57 -1.81 -0.77 114.58 123.86 2z31 h GLU 80 Ca -0.29 0.02 -0.66 0.00 -1.18 0.00 0.00 59.36 57.26 2z31 h GLU 80 Cb 1.09 0.07 -0.39 0.00 -0.16 0.00 0.00 28.75 29.35 2z31 h GLU 80 CO 1.04 -0.19 -0.38 0.45 -1.18 0.00 0.00 179.01 178.74 2z31 s SER 81 N -3.24 5.28 0.52 1.04 0.15 -1.26 -3.24 113.70 112.95 2z31 s SER 81 Ca -0.06 -3.76 -0.18 0.00 0.70 0.00 0.00 55.95 52.64 2z31 s SER 81 Cb 0.02 -1.75 -0.14 0.00 -1.71 0.00 0.00 66.02 62.44 2z31 s SER 81 CO 0.23 -0.13 -0.08 0.00 1.20 0.00 0.00 173.24 174.46 2z31 n ALA 82 N 2.17 -2.95 -2.58 5.45 0.00 0.40 -4.50 120.51 118.50 2z31 n ALA 82 Ca 0.20 -0.05 -0.09 0.00 0.00 0.00 0.00 53.44 53.49 2z31 n ALA 82 Cb 0.36 -1.44 -0.07 0.00 0.00 0.00 0.00 19.45 18.29 2z31 n ALA 82 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2z31 s THR 83 N -1.98 0.12 0.30 0.00 -4.23 -1.26 -0.56 115.64 108.03 2z31 s THR 83 Ca 0.58 -1.26 -0.01 0.00 -1.18 0.00 0.00 61.69 59.82 2z31 s THR 83 Cb -0.49 -1.48 0.27 0.00 1.34 0.00 0.00 72.50 72.14 2z31 s THR 83 CO 0.65 -0.56 1.94 -0.65 -0.54 0.00 0.00 174.62 175.46 2z31 h PRO 84 N 2.70 1.06 0.00 3.99 0.11 -1.95 -1.55 132.00 136.36 2z31 h PRO 84 Ca -0.33 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2z31 h PRO 84 Cb 1.21 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2z31 h PRO 84 CO 0.54 0.70 0.00 -1.13 -0.21 0.00 0.00 178.00 177.91 2z31 n SER 85 N -4.44 0.15 -1.55 -2.05 3.41 -1.26 -1.23 113.62 106.64 2z31 n SER 85 Ca 0.12 0.55 0.10 0.00 -0.26 0.00 0.00 58.87 59.38 2z31 n SER 85 Cb 0.11 -0.58 0.35 0.00 -0.26 0.00 0.00 64.21 63.83 2z31 n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2z31 n GLN 86 N -1.68 3.52 -2.62 4.33 6.02 -0.58 -4.89 117.38 121.48 2z31 n GLN 86 Ca 0.01 -2.82 -0.42 0.00 -0.01 0.00 0.00 57.00 53.76 2z31 n GLN 86 Cb 0.08 -1.83 -0.03 0.00 1.02 0.00 0.00 30.24 29.48 2z31 n GLN 86 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2z31 s THR 87 N -1.68 4.62 0.00 5.09 2.01 -0.36 -4.88 115.64 120.44 2z31 s THR 87 Ca 0.51 1.90 0.00 0.00 0.31 0.00 0.00 61.69 64.41 2z31 s THR 87 Cb 0.31 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.60 2z31 s THR 87 CO 0.27 0.01 0.00 -0.24 -0.69 0.00 0.00 174.62 173.97 2z31 n SER 88 N 4.99 0.00 -4.72 3.53 2.88 0.85 -4.98 113.62 116.17 2z31 n SER 88 Ca 0.09 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.27 2z31 n SER 88 Cb 0.48 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.87 2z31 n SER 88 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2z31 s VAL 89 N -2.00 5.28 -0.10 2.46 1.01 -1.23 -1.39 120.40 124.42 2z31 s VAL 89 Ca 0.00 0.63 -0.01 0.00 0.00 0.00 0.00 61.98 62.59 2z31 s VAL 89 Cb 0.00 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 2z31 s VAL 89 CO 0.00 0.36 -0.04 -0.31 0.00 0.00 0.00 175.10 175.11 2z31 s TYR 90 N 0.59 3.02 -0.01 5.22 1.51 -0.62 -0.44 117.35 126.62 2z31 s TYR 90 Ca 0.18 -0.05 0.07 0.00 -1.01 0.00 0.00 57.07 56.26 2z31 s TYR 90 Cb -0.13 -1.82 -0.02 0.00 -0.11 0.00 0.00 41.96 39.88 2z31 s TYR 90 CO 0.05 0.24 -0.21 -0.06 -1.11 0.00 0.00 175.55 174.46 2z31 s PHE 91 N -0.42 1.87 0.19 2.71 0.08 -0.15 -0.23 117.98 122.03 2z31 s PHE 91 Ca 0.07 -0.36 0.08 0.00 0.12 0.00 0.00 56.93 56.84 2z31 s PHE 91 Cb -0.12 -1.19 -0.04 0.00 -0.57 0.00 0.00 43.02 41.10 2z31 s PHE 91 CO 0.02 -0.01 -0.02 0.00 -0.10 0.00 0.00 175.22 175.11 2z31 s ALA 93 N -1.81 -0.87 0.09 0.00 0.00 -0.27 -0.70 121.76 118.20 2z31 s ALA 93 Ca 0.27 0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.44 2z31 s ALA 93 Cb -0.09 0.38 -0.03 0.00 0.00 0.00 0.00 23.12 23.38 2z31 s ALA 93 CO 0.18 -0.46 -0.16 -1.54 0.00 0.00 0.00 175.76 173.78 2z31 s SER 94 N -2.12 1.97 -0.01 0.00 1.04 -0.60 0.11 113.70 114.08 2z31 s SER 94 Ca -0.04 -0.67 -0.07 0.00 0.48 0.00 0.00 55.95 55.65 2z31 s SER 94 Cb -0.00 -0.08 0.01 0.00 0.10 0.00 0.00 66.02 66.04 2z31 s SER 94 CO -0.04 -0.05 0.16 -0.83 0.98 0.00 0.00 173.24 173.46 2z31 s GLY 95 N -1.90 -0.01 0.00 7.32 0.00 0.24 -1.87 107.32 111.10 2z31 s GLY 95 Ca 0.02 0.04 0.24 0.00 0.00 0.00 0.00 44.72 45.02 2z31 s GLY 95 CO 0.03 -0.09 1.80 2.09 0.00 0.00 0.00 173.10 176.93 2z31 n ASP 96 N 1.79 0.00 -1.73 1.64 3.85 -1.26 -0.59 116.55 120.25 2z31 n ASP 96 Ca -0.20 -0.44 -0.12 0.00 -0.71 0.00 0.00 54.79 53.32 2z31 n ASP 96 Cb 0.56 -0.13 0.02 0.00 -1.35 0.00 0.00 41.12 40.23 2z31 n ASP 96 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2z31 n ALA 97 N -1.13 -0.52 -3.63 2.12 0.00 -1.26 -4.61 120.51 111.48 2z31 n ALA 97 Ca 0.15 0.16 -0.38 0.00 0.00 0.00 0.00 53.44 53.37 2z31 n ALA 97 Cb 0.13 -2.38 -0.07 0.00 0.00 0.00 0.00 19.45 17.12 2z31 n ALA 97 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2z31 s SER 98 N -2.90 5.69 0.00 0.00 1.04 -1.26 -4.94 113.70 111.32 2z31 s SER 98 Ca 0.18 -3.04 0.00 0.00 0.48 0.00 0.00 55.95 53.57 2z31 s SER 98 Cb -0.08 -1.93 0.00 0.00 0.10 0.00 0.00 66.02 64.11 2z31 s SER 98 CO 0.22 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.69 2z31 n GLY 99 N 3.29 0.00 3.31 7.32 0.00 -1.26 -2.78 105.19 115.07 2z31 n GLY 99 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 2z31 n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2z31 n GLY 100 N 1.52 -0.35 3.68 -0.02 0.00 -1.26 -4.85 105.19 103.91 2z31 n GLY 100 Ca 0.00 0.11 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 2z31 n GLY 100 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2z31 n ASN 104 N -2.80 3.29 -4.76 1.61 0.23 -1.12 -4.90 115.26 106.82 2z31 n ASN 104 Ca -0.14 1.09 -0.38 0.00 -0.53 0.00 0.00 54.58 54.62 2z31 n ASN 104 Cb 0.61 -1.47 0.02 0.00 -2.08 0.00 0.00 39.78 36.86 2z31 n ASN 104 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2z31 s THR 105 N 0.79 2.46 -0.11 5.53 -1.32 -1.26 -4.95 115.64 116.78 2z31 s THR 105 Ca 0.76 0.34 -0.03 0.00 -1.21 0.00 0.00 61.69 61.55 2z31 s THR 105 Cb -0.63 -3.17 -0.03 0.00 -1.51 0.00 0.00 72.50 67.16 2z31 s THR 105 CO 0.39 -0.01 0.01 -0.76 -2.21 0.00 0.00 174.62 172.04 2z31 s LEU 106 N -3.38 3.61 -0.23 9.08 1.43 -1.26 -4.56 118.68 123.37 2z31 s LEU 106 Ca 0.69 0.12 -0.07 0.00 -1.03 0.00 0.00 54.13 53.84 2z31 s LEU 106 Cb -0.36 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 2z31 s LEU 106 CO 0.42 0.32 0.05 -0.31 0.23 0.00 0.00 176.35 177.07 2z31 s TYR 107 N -0.56 3.09 0.02 0.29 1.51 -0.78 -4.96 117.35 115.97 2z31 s TYR 107 Ca 0.10 -0.36 -0.01 0.00 -1.01 0.00 0.00 57.07 55.79 2z31 s TYR 107 Cb -0.12 -2.17 -0.04 0.00 -0.11 0.00 0.00 41.96 39.52 2z31 s TYR 107 CO 0.02 -0.26 0.14 -0.06 -1.11 0.00 0.00 175.55 174.29 2z31 s PHE 108 N 1.27 3.41 0.79 2.71 0.08 -1.26 -1.55 117.98 123.44 2z31 s PHE 108 Ca 0.04 0.25 -0.08 0.00 0.12 0.00 0.00 56.93 57.27 2z31 s PHE 108 Cb -0.15 -1.76 0.13 0.00 -0.57 0.00 0.00 43.02 40.67 2z31 s PHE 108 CO 0.03 0.59 1.11 0.20 -0.10 0.00 0.00 175.22 177.05 2z31 s GLY 109 N -2.06 1.74 0.00 4.36 0.00 0.13 -4.79 107.32 106.70 2z31 s GLY 109 Ca 0.28 -1.27 0.22 0.00 0.00 0.00 0.00 44.72 43.95 2z31 s GLY 109 CO 0.20 -0.69 1.81 0.00 0.00 0.00 0.00 173.10 174.42 2z31 n ALA 110 N -3.17 2.57 0.00 3.20 0.00 -1.26 -4.66 120.51 117.18 2z31 n ALA 110 Ca 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2z31 n ALA 110 Cb 0.60 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.69 2z31 n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2z31 n GLY 111 N 0.76 -0.63 2.68 0.00 0.00 -1.26 -4.96 105.19 101.78 2z31 n GLY 111 Ca 0.17 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 44.22 2z31 n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2z31 s THR 112 N -2.21 0.37 -0.41 2.61 2.01 0.69 -4.70 115.64 113.99 2z31 s THR 112 Ca 0.00 -0.67 -0.29 0.00 0.31 0.00 0.00 61.69 61.04 2z31 s THR 112 Cb 0.00 -1.05 0.02 0.00 0.01 0.00 0.00 72.50 71.47 2z31 s THR 112 CO 0.00 -0.40 1.29 -0.60 -0.69 0.00 0.00 174.62 174.22 2z31 s ARG 113 N 1.91 3.70 -0.08 4.92 3.52 -1.24 -1.59 118.95 130.08 2z31 s ARG 113 Ca 0.03 0.86 0.05 0.00 -0.13 0.00 0.00 55.73 56.54 2z31 s ARG 113 Cb -0.17 -3.95 -0.00 0.00 -1.56 0.00 0.00 34.95 29.27 2z31 s ARG 113 CO -0.16 -1.41 -0.23 -1.17 -0.81 0.00 0.00 175.30 171.52 2z31 s LEU 114 N 4.87 2.04 -0.01 -0.88 2.96 -0.49 -1.38 118.68 125.80 2z31 s LEU 114 Ca 0.55 -0.51 0.04 0.00 -0.22 0.00 0.00 54.13 53.99 2z31 s LEU 114 Cb -0.12 -1.32 -0.01 0.00 0.50 0.00 0.00 46.19 45.24 2z31 s LEU 114 CO 0.30 0.17 -0.14 -0.94 -1.32 0.00 0.00 176.35 174.43 2z31 s SER 115 N 0.20 1.62 -0.36 3.68 1.04 -0.94 -0.11 113.70 118.83 2z31 s SER 115 Ca -0.13 -0.27 -0.03 0.00 0.48 0.00 0.00 55.95 56.01 2z31 s SER 115 Cb -0.16 -0.17 0.08 0.00 0.10 0.00 0.00 66.02 65.86 2z31 s SER 115 CO 0.07 0.16 0.11 -0.69 0.98 0.00 0.00 173.24 173.87 2z31 s VAL 116 N -0.36 3.22 -2.67 5.02 1.01 -1.26 -1.69 120.40 123.66 2z31 s VAL 116 Ca 0.05 -1.69 0.27 0.00 0.00 0.00 0.00 61.98 60.60 2z31 s VAL 116 Cb -0.05 -3.03 0.43 0.00 0.00 0.00 0.00 36.38 33.72 2z31 s VAL 116 CO -0.00 -0.41 1.58 0.18 0.00 0.00 0.00 175.10 176.45