#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ry3 s ASN -17 N 0.00 6.39 -0.53 7.83 3.04 -1.26 -4.99 114.94 125.42 1ry3 s ASN -17 Ca 0.00 -0.18 -0.27 0.00 0.04 0.00 0.00 52.86 52.45 1ry3 s ASN -17 Cb 0.00 -2.38 -0.03 0.00 -1.54 0.00 0.00 41.25 37.29 1ry3 s ASN -17 CO 0.00 -0.94 1.97 -0.94 -3.04 0.00 0.00 177.10 174.15 1ry3 s SER -16 N 2.23 5.20 -0.04 -4.21 1.04 -1.26 -4.77 113.70 111.89 1ry3 s SER -16 Ca 0.29 0.69 0.19 0.00 0.48 0.00 0.00 55.95 57.60 1ry3 s SER -16 Cb -0.12 -2.52 -0.22 0.00 0.10 0.00 0.00 66.02 63.25 1ry3 s SER -16 CO 0.22 -2.36 0.51 0.52 0.98 0.00 0.00 173.24 173.11 1ry3 n VAL -15 N 7.42 0.92 0.05 5.02 0.31 -1.26 -2.34 118.33 128.46 1ry3 n VAL -15 Ca 0.24 -0.69 -0.14 0.00 -0.01 0.00 0.00 64.34 63.75 1ry3 n VAL -15 Cb 0.52 -0.45 -0.14 0.00 -0.91 0.00 0.00 33.84 32.86 1ry3 n VAL -15 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1ry3 h LYS -14 N 0.00 0.17 0.11 5.55 1.63 -1.98 -2.00 116.57 120.04 1ry3 h LYS -14 Ca -0.23 -0.28 -0.27 0.00 -0.85 0.00 0.00 60.65 59.02 1ry3 h LYS -14 Cb 1.61 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 33.35 1ry3 h LYS -14 CO 0.03 1.00 -1.20 1.49 -3.45 0.00 0.00 179.45 177.32 1ry3 h GLU -13 N 0.05 0.27 0.00 1.90 4.81 -1.96 -2.67 114.58 116.98 1ry3 h GLU -13 Ca -0.20 -0.44 -0.08 0.00 -0.13 0.00 0.00 59.36 58.51 1ry3 h GLU -13 Cb 1.97 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 31.49 1ry3 h GLU -13 CO 0.14 1.20 -0.38 1.25 -0.73 0.00 0.00 179.01 180.49 1ry3 h LEU -12 N 0.08 0.00 0.21 1.64 5.85 -1.56 -2.30 115.31 119.23 1ry3 h LEU -12 Ca -0.12 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.28 1ry3 h LEU -12 Cb 1.92 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.99 1ry3 h LEU -12 CO 0.20 0.38 -1.37 0.78 -0.34 0.00 0.00 178.44 178.08 1ry3 h ASN -11 N 0.00 0.84 0.94 1.25 -0.26 -1.38 -3.30 115.58 113.68 1ry3 h ASN -11 Ca -0.00 -0.89 -0.11 0.00 -0.56 0.00 0.00 56.30 54.74 1ry3 h ASN -11 Cb 1.11 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 38.08 1ry3 h ASN -11 CO 0.05 1.67 -0.50 1.62 -1.06 0.00 0.00 177.43 179.20 1ry3 h VAL -10 N 0.16 1.06 -0.05 2.81 3.04 -1.50 -3.08 116.25 118.69 1ry3 h VAL -10 Ca -0.23 -1.95 0.01 0.00 -1.01 0.00 0.00 66.70 63.53 1ry3 h VAL -10 Cb 2.07 2.15 -0.00 0.00 -2.01 0.00 0.00 31.29 33.49 1ry3 h VAL -10 CO 0.26 0.49 0.07 0.50 -1.01 0.00 0.00 177.57 177.88 1ry3 h LYS -9 N 0.00 0.00 0.00 4.17 1.63 -1.48 -2.79 116.57 118.10 1ry3 h LYS -9 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1ry3 h LYS -9 Cb 1.11 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.74 1ry3 h LYS -9 CO 0.07 0.00 0.00 0.39 -3.45 0.00 0.00 179.45 176.46 1ry3 n GLU -8 N -3.65 0.00 -0.26 1.90 1.02 -1.16 -1.56 120.64 116.92 1ry3 n GLU -8 Ca -0.02 0.20 0.19 0.00 -0.02 0.00 0.00 57.16 57.52 1ry3 n GLU -8 Cb 0.16 -1.10 0.50 0.00 -0.02 0.00 0.00 31.44 30.98 1ry3 n GLU -8 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ry3 h MET -7 N 0.00 0.41 0.38 3.49 -0.00 -1.78 -1.17 114.93 116.26 1ry3 h MET -7 Ca 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 59.70 59.67 1ry3 h MET -7 Cb 0.00 -0.09 -0.03 0.00 -0.00 0.00 0.00 31.60 31.48 1ry3 h MET -7 CO 0.00 0.27 -0.48 -0.22 -0.00 0.00 0.00 176.91 176.49 1ry3 h LYS -6 N 0.43 -0.85 -0.68 -0.10 1.63 -1.40 -1.41 116.57 114.19 1ry3 h LYS -6 Ca 0.49 0.06 0.00 0.00 -0.85 0.00 0.00 60.65 60.35 1ry3 h LYS -6 Cb 1.21 0.19 0.00 0.00 -0.60 0.00 0.00 32.23 33.03 1ry3 h LYS -6 CO -0.20 -0.57 0.00 1.04 -3.45 0.00 0.00 179.45 176.27 1ry3 n GLN -5 N -5.28 1.88 -0.05 1.90 3.00 -0.60 -3.67 117.38 114.55 1ry3 n GLN -5 Ca -0.10 -0.81 -0.22 0.00 -0.01 0.00 0.00 57.00 55.86 1ry3 n GLN -5 Cb 0.42 -1.54 -0.13 0.00 0.00 0.00 0.00 30.24 28.99 1ry3 n GLN -5 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 1ry3 n LEU -4 N 0.14 2.26 0.20 1.08 -0.00 -0.50 -4.20 117.00 115.99 1ry3 n LEU -4 Ca 0.07 0.31 0.09 0.00 -0.00 0.00 0.00 56.01 56.49 1ry3 n LEU -4 Cb 0.40 -1.04 0.19 0.00 -0.00 0.00 0.00 43.42 42.97 1ry3 n LEU -4 CO 0.08 0.58 0.72 1.12 -0.00 0.00 0.00 177.39 179.88 1ry3 h HIS -3 N -0.45 0.00 -3.81 1.96 2.07 -1.58 -3.49 115.15 109.85 1ry3 h HIS -3 Ca -0.39 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.13 1ry3 h HIS -3 Cb 1.68 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.66 1ry3 h HIS -3 CO 0.08 0.18 -0.07 0.41 -3.07 0.00 0.00 177.93 175.47 1ry3 n GLY -2 N 0.97 -0.73 2.64 6.13 0.00 -1.25 -5.07 105.19 107.87 1ry3 n GLY -2 Ca 0.03 0.16 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 1ry3 n GLY -2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ry3 n GLY -1 N -0.95 0.80 3.90 -0.02 0.00 -1.26 -5.10 105.19 102.56 1ry3 n GLY -1 Ca 0.02 -2.02 -0.28 0.00 0.00 0.00 0.00 46.02 43.73 1ry3 n GLY -1 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ry3 s VAL 1 N -1.97 4.68 -0.41 1.61 0.11 -1.26 -5.04 120.40 118.12 1ry3 s VAL 1 Ca 0.45 0.34 0.11 0.00 -2.93 0.00 0.00 61.98 59.95 1ry3 s VAL 1 Cb -0.03 -3.81 0.40 0.00 -1.53 0.00 0.00 36.38 31.42 1ry3 s VAL 1 CO 0.30 -0.87 0.94 0.59 -3.33 0.00 0.00 175.10 172.72 1ry3 n ASN 2 N -2.43 2.64 -3.41 3.54 4.13 -1.26 -5.01 115.26 113.46 1ry3 n ASN 2 Ca 0.02 -3.20 -0.34 0.00 1.68 0.00 0.00 54.58 52.74 1ry3 n ASN 2 Cb 0.55 -0.54 0.03 0.00 -1.54 0.00 0.00 39.78 38.29 1ry3 n ASN 2 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ry3 n TYR 3 N -0.12 -2.80 -2.67 3.10 4.11 -1.26 -4.98 117.16 112.54 1ry3 n TYR 3 Ca 0.24 1.17 -0.03 0.00 -0.00 0.00 0.00 57.90 59.27 1ry3 n TYR 3 Cb 0.67 -2.12 0.03 0.00 -0.00 0.00 0.00 39.34 37.92 1ry3 n TYR 3 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1ry3 n GLY 4 N -0.18 -1.71 0.33 -7.48 0.00 -1.26 -5.00 105.19 89.89 1ry3 n GLY 4 Ca -0.05 1.30 0.18 0.00 0.00 0.00 0.00 46.02 47.45 1ry3 n GLY 4 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ry3 h ASN 5 N 4.18 0.00 -3.61 1.61 2.35 -2.05 -3.47 115.58 114.60 1ry3 h ASN 5 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1ry3 h ASN 5 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1ry3 h ASN 5 CO -0.11 0.00 -0.17 0.61 -1.65 0.00 0.00 177.43 176.11 1ry3 n GLY 6 N -1.26 -1.44 3.90 2.83 0.00 -1.26 -5.05 105.19 102.91 1ry3 n GLY 6 Ca -0.01 0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1ry3 n GLY 6 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ry3 s VAL 7 N -1.20 4.26 -0.14 1.61 1.01 -1.26 -5.09 120.40 119.60 1ry3 s VAL 7 Ca 0.05 0.33 -0.04 0.00 0.00 0.00 0.00 61.98 62.33 1ry3 s VAL 7 Cb -0.01 -3.68 0.06 0.00 0.00 0.00 0.00 36.38 32.75 1ry3 s VAL 7 CO 0.21 -0.76 0.15 -0.44 0.00 0.00 0.00 175.10 174.26 1ry3 s SER 8 N -4.22 1.37 -0.32 3.32 0.01 -1.26 -5.11 113.70 107.48 1ry3 s SER 8 Ca 0.53 -0.09 -0.12 0.00 1.31 0.00 0.00 55.95 57.58 1ry3 s SER 8 Cb -0.11 0.13 -0.02 0.00 0.21 0.00 0.00 66.02 66.24 1ry3 s SER 8 CO 0.48 -0.30 0.21 0.00 0.41 0.00 0.00 173.24 174.05 1ry3 s SER 10 N 1.71 1.54 0.00 0.00 0.01 -1.26 -4.85 113.70 110.85 1ry3 s SER 10 Ca 0.06 -0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.12 1ry3 s SER 10 Cb -0.17 0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.17 1ry3 s SER 10 CO 0.10 -0.31 0.00 1.17 0.41 0.00 0.00 173.24 174.61 1ry3 n LYS 11 N 5.31 -0.86 -3.96 12.44 4.81 -1.26 -4.85 118.16 129.78 1ry3 n LYS 11 Ca -0.06 0.21 -0.09 0.00 -0.87 0.00 0.00 58.31 57.50 1ry3 n LYS 11 Cb 0.49 -4.61 -0.05 0.00 0.02 0.00 0.00 35.03 30.88 1ry3 n LYS 11 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1ry3 s THR 12 N -0.97 0.01 0.02 3.15 2.01 -1.26 -5.17 115.64 113.43 1ry3 s THR 12 Ca 0.00 -1.33 -0.00 0.00 0.31 0.00 0.00 61.69 60.67 1ry3 s THR 12 Cb 0.00 -2.10 0.00 0.00 0.01 0.00 0.00 72.50 70.41 1ry3 s THR 12 CO 0.00 -0.04 0.01 2.29 -0.69 0.00 0.00 174.62 176.19 1ry3 n LYS 13 N -0.36 -1.02 0.00 4.92 2.85 -1.26 -4.77 118.16 118.51 1ry3 n LYS 13 Ca -0.03 -0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 1ry3 n LYS 13 Cb 0.62 -0.02 0.00 0.00 -0.65 0.00 0.00 35.03 34.98 1ry3 n LYS 13 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ry3 s SER 15 N 0.27 -0.27 0.72 0.00 0.15 -1.26 -5.05 113.70 108.27 1ry3 s SER 15 Ca 0.00 0.68 -0.11 0.00 0.70 0.00 0.00 55.95 57.22 1ry3 s SER 15 Cb 0.00 0.62 0.02 0.00 -1.71 0.00 0.00 66.02 64.95 1ry3 s SER 15 CO 0.00 -0.19 1.07 -0.69 1.20 0.00 0.00 173.24 174.63 1ry3 s VAL 16 N 1.54 3.79 -0.48 4.45 1.01 -1.26 -4.94 120.40 124.51 1ry3 s VAL 16 Ca -0.08 0.58 -0.02 0.00 0.00 0.00 0.00 61.98 62.47 1ry3 s VAL 16 Cb -0.10 -3.24 0.25 0.00 0.00 0.00 0.00 36.38 33.29 1ry3 s VAL 16 CO -0.10 -0.76 2.18 0.59 0.00 0.00 0.00 175.10 177.00 1ry3 n ASN 17 N -3.26 6.88 0.06 3.32 4.13 -1.26 -4.52 115.26 120.60 1ry3 n ASN 17 Ca 0.08 -3.34 0.09 0.00 1.68 0.00 0.00 54.58 53.09 1ry3 n ASN 17 Cb 0.53 -1.07 0.38 0.00 -1.54 0.00 0.00 39.78 38.08 1ry3 n ASN 17 CO 0.00 0.00 0.00 1.87 0.28 0.00 0.00 177.26 179.41 1ry3 n TRP 18 N 0.06 0.34 -0.08 3.10 -0.00 -1.26 -2.59 117.44 117.01 1ry3 n TRP 18 Ca 0.44 0.14 -0.17 0.00 -0.00 0.00 0.00 57.50 57.91 1ry3 n TRP 18 Cb 0.57 -0.72 -0.06 0.00 -0.00 0.00 0.00 31.31 31.10 1ry3 n TRP 18 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1ry3 n GLY 19 N -0.07 -0.27 0.31 5.87 0.00 -1.26 -4.19 105.19 105.59 1ry3 n GLY 19 Ca 0.03 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 1ry3 n GLY 19 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1ry3 h GLN 20 N -0.58 -0.59 0.00 1.61 4.15 -1.90 -0.22 115.11 117.59 1ry3 h GLN 20 Ca -0.38 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.08 1ry3 h GLN 20 Cb 1.31 0.13 0.00 0.00 0.21 0.00 0.00 27.48 29.13 1ry3 h GLN 20 CO -0.23 -0.39 0.00 0.00 -1.93 0.00 0.00 178.83 176.27 1ry3 n ALA 21 N -2.61 1.67 -0.05 3.38 0.00 -1.07 -0.90 120.51 120.93 1ry3 n ALA 21 Ca -0.07 -0.04 -0.16 0.00 0.00 0.00 0.00 53.44 53.16 1ry3 n ALA 21 Cb 0.28 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.54 1ry3 n ALA 21 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1ry3 h PHE 22 N 0.00 1.08 0.00 0.00 3.57 -1.21 -2.26 116.94 118.13 1ry3 h PHE 22 Ca 0.00 -0.44 -0.07 0.00 3.53 0.00 0.00 57.97 60.99 1ry3 h PHE 22 Cb 0.04 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1ry3 h PHE 22 CO 0.00 1.27 -0.33 1.96 -2.23 0.00 0.00 178.31 178.98 1ry3 h GLN 23 N 0.58 0.00 0.20 1.11 7.50 -0.70 -2.89 115.11 120.92 1ry3 h GLN 23 Ca -0.03 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.11 1ry3 h GLN 23 Cb 1.30 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.83 1ry3 h GLN 23 CO 0.14 0.33 -0.09 0.93 -1.50 0.00 0.00 178.83 178.64 1ry3 h GLU 24 N 0.00 -0.26 0.00 1.46 4.39 -1.25 -1.56 114.58 117.37 1ry3 h GLU 24 Ca -0.00 0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 1ry3 h GLU 24 Cb 0.94 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 1ry3 h GLU 24 CO 0.04 -0.07 -0.25 0.00 -1.16 0.00 0.00 179.01 177.57 1ry3 h ARG 25 N -0.39 0.00 -0.35 2.33 3.08 -1.41 -2.67 114.38 114.96 1ry3 h ARG 25 Ca -0.03 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1ry3 h ARG 25 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1ry3 h ARG 25 CO 0.04 0.25 0.03 -0.92 -1.07 0.00 0.00 179.97 178.31 1ry3 h TYR 26 N 0.00 0.65 -0.80 3.04 5.03 -1.26 -2.02 116.97 121.61 1ry3 h TYR 26 Ca -0.00 -0.10 -0.02 0.00 2.58 0.00 0.00 58.73 61.19 1ry3 h TYR 26 Cb 0.47 -0.17 -0.04 0.00 1.55 0.00 0.00 36.73 38.53 1ry3 h TYR 26 CO 0.00 0.68 0.42 1.15 -1.32 0.00 0.00 178.16 179.09 1ry3 h THR 27 N 0.43 1.24 -0.14 1.81 2.02 -0.96 -2.03 112.91 115.28 1ry3 h THR 27 Ca 0.10 -0.65 -0.05 0.00 0.77 0.00 0.00 66.41 66.59 1ry3 h THR 27 Cb 0.40 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1ry3 h THR 27 CO 0.01 0.28 -0.15 0.00 0.37 0.00 0.00 175.52 176.04 1ry3 h ALA 28 N 1.22 1.50 -0.09 6.16 0.00 -1.33 -2.58 119.26 124.13 1ry3 h ALA 28 Ca 0.28 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1ry3 h ALA 28 Cb 0.07 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ry3 h ALA 28 CO -0.04 0.36 -0.08 0.78 0.00 0.00 0.00 179.25 180.27 1ry3 h GLY 29 N 0.76 0.24 1.78 0.00 0.00 -0.68 -3.10 103.07 102.07 1ry3 h GLY 29 Ca 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 1ry3 h GLY 29 CO 0.02 0.22 0.12 -2.22 0.00 0.00 0.00 176.54 174.68 1ry3 h ILE 30 N -0.18 1.07 0.25 2.60 2.04 -1.29 -1.35 117.51 120.65 1ry3 h ILE 30 Ca 0.02 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1ry3 h ILE 30 Cb 0.58 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1ry3 h ILE 30 CO 0.02 0.08 -0.24 0.78 0.00 0.00 0.00 178.15 178.79 1ry3 h ASN 31 N 0.30 -0.66 -0.16 1.72 -0.26 -1.39 0.37 115.58 115.51 1ry3 h ASN 31 Ca 0.08 0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 55.87 1ry3 h ASN 31 Cb 0.01 0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.48 1ry3 h ASN 31 CO -0.01 -0.32 0.09 -1.28 -1.06 0.00 0.00 177.43 174.85 1ry3 h SER 32 N -0.49 0.21 -0.46 5.81 0.87 -1.53 -1.94 113.55 116.01 1ry3 h SER 32 Ca -0.03 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 1ry3 h SER 32 Cb 0.42 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 1ry3 h SER 32 CO -0.02 0.17 0.22 0.15 -0.53 0.00 0.00 176.83 176.82 1ry3 h PHE 33 N 0.24 0.66 0.00 2.24 3.57 -0.75 -1.56 116.94 121.34 1ry3 h PHE 33 Ca 0.06 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1ry3 h PHE 33 Cb 0.01 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.55 1ry3 h PHE 33 CO 0.00 0.54 0.00 0.28 -2.23 0.00 0.00 178.31 176.90 1ry3 n VAL 34 N -4.64 0.00 -0.13 1.41 0.31 0.13 -2.57 118.33 112.84 1ry3 n VAL 34 Ca 0.01 1.21 0.28 0.00 -0.01 0.00 0.00 64.34 65.82 1ry3 n VAL 34 Cb 0.12 -2.21 0.66 0.00 -0.91 0.00 0.00 33.84 31.50 1ry3 n VAL 34 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1ry3 h SER 35 N 0.00 0.00 -0.03 4.52 4.64 -1.62 3.94 113.55 125.00 1ry3 h SER 35 Ca 0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1ry3 h SER 35 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1ry3 h SER 35 CO 0.00 0.00 -0.02 1.23 -0.87 0.00 0.00 176.83 177.17 1ry3 h GLY 36 N 0.00 0.01 0.00 -0.77 0.00 -1.17 1.51 103.07 102.65 1ry3 h GLY 36 Ca 0.40 0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.65 1ry3 h GLY 36 CO -0.00 -0.02 -0.91 -0.62 0.00 0.00 0.00 176.54 174.98 1ry3 n VAL 37 N -5.12 1.47 0.00 4.60 0.31 0.34 -4.53 118.33 115.41 1ry3 n VAL 37 Ca -0.06 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1ry3 n VAL 37 Cb 0.05 -2.25 0.00 0.00 -0.91 0.00 0.00 33.84 30.73 1ry3 n VAL 37 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ry3 n ALA 38 N -3.68 0.00 0.25 3.52 0.00 1.22 -4.36 120.51 117.46 1ry3 n ALA 38 Ca -0.18 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.25 1ry3 n ALA 38 Cb 0.46 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.01 1ry3 n ALA 38 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ry3 n SER 39 N -1.45 0.00 -2.17 0.00 2.88 -1.15 -4.80 113.62 106.94 1ry3 n SER 39 Ca 0.00 -0.15 -0.09 0.00 -1.33 0.00 0.00 58.87 57.30 1ry3 n SER 39 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1ry3 n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ry3 n GLY 40 N -0.69 -0.16 3.28 0.46 0.00 0.44 -1.26 105.19 107.27 1ry3 n GLY 40 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 1ry3 n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ry3 n ALA 41 N -1.71 -1.05 0.00 4.61 0.00 0.27 -4.38 120.51 118.25 1ry3 n ALA 41 Ca -0.11 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1ry3 n ALA 41 Cb 0.52 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1ry3 n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ry3 n GLY 42 N -0.97 1.57 0.07 0.00 0.00 -0.39 -4.93 105.19 100.54 1ry3 n GLY 42 Ca -0.00 -0.91 -0.06 0.00 0.00 0.00 0.00 46.02 45.05 1ry3 n GLY 42 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ry3 h SER 43 N 0.00 0.00 -0.01 1.61 4.64 -1.77 -3.42 113.55 114.60 1ry3 h SER 43 Ca 0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 1ry3 h SER 43 Cb 0.00 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 61.95 1ry3 h SER 43 CO 0.00 0.93 -0.40 0.00 -0.87 0.00 0.00 176.83 176.49 1ry3 n ILE 44 N -3.28 0.00 0.00 0.95 0.13 -1.26 -5.13 119.36 110.76 1ry3 n ILE 44 Ca -0.02 -1.32 0.00 0.00 -1.10 0.00 0.00 62.75 60.30 1ry3 n ILE 44 Cb 0.93 1.41 0.00 0.00 -0.84 0.00 0.00 39.64 41.14 1ry3 n ILE 44 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1ry3 n GLY 45 N 1.64 -0.25 3.92 4.50 0.00 -1.26 -5.30 105.19 108.44 1ry3 n GLY 45 Ca 0.08 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1ry3 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86