#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ry3 n ASN -17 N 0.00 7.44 -4.02 6.12 2.85 -1.26 -4.82 115.26 121.57 1ry3 n ASN -17 Ca 0.00 -3.07 -0.43 0.00 -0.11 0.00 0.00 54.58 50.97 1ry3 n ASN -17 Cb 0.00 -1.34 0.00 0.00 1.24 0.00 0.00 39.78 39.68 1ry3 n ASN -17 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1ry3 n SER -16 N 1.67 5.33 -0.01 1.20 7.64 -1.26 -4.60 113.62 123.59 1ry3 n SER -16 Ca 0.58 -3.13 0.01 0.00 1.01 0.00 0.00 58.87 57.34 1ry3 n SER -16 Cb 0.39 -1.46 -0.12 0.00 -1.01 0.00 0.00 64.21 62.00 1ry3 n SER -16 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1ry3 n VAL -15 N 3.24 0.89 0.02 0.44 0.31 -1.26 -2.57 118.33 119.40 1ry3 n VAL -15 Ca 0.37 -0.68 -0.08 0.00 -0.01 0.00 0.00 64.34 63.93 1ry3 n VAL -15 Cb 0.37 -0.44 -0.13 0.00 -0.91 0.00 0.00 33.84 32.73 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 0.01 0.19 5.55 1.63 -1.99 -2.15 116.57 119.82 1ry3 h LYS -14 Ca -0.22 -0.02 -0.31 0.00 -0.85 0.00 0.00 60.65 59.25 1ry3 h LYS -14 Cb 1.58 0.01 0.03 0.00 -0.60 0.00 0.00 32.23 33.25 1ry3 h LYS -14 CO 0.03 0.74 -1.37 0.93 -3.45 0.00 0.00 179.45 176.33 1ry3 h GLU -13 N 0.00 0.50 0.00 1.90 4.39 -1.92 -3.07 114.58 116.38 1ry3 h GLU -13 Ca -0.16 -0.79 -0.10 0.00 0.34 0.00 0.00 59.36 58.65 1ry3 h GLU -13 Cb 1.91 0.29 -0.01 0.00 -0.10 0.00 0.00 28.75 30.83 1ry3 h GLU -13 CO 0.10 1.37 -0.45 1.25 -1.16 0.00 0.00 179.01 180.12 1ry3 h LEU -12 N 0.16 0.00 -0.69 1.33 7.12 -1.61 -2.97 115.31 118.65 1ry3 h LEU -12 Ca -0.21 0.00 -0.14 0.00 0.13 0.00 0.00 57.88 57.66 1ry3 h LEU -12 Cb 2.06 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 42.18 1ry3 h LEU -12 CO 0.25 0.45 -0.62 -1.13 -0.13 0.00 0.00 178.44 177.27 1ry3 h ASN -11 N 0.00 0.17 -0.07 1.25 -0.73 -1.43 -3.20 115.58 111.57 1ry3 h ASN -11 Ca -0.00 -0.10 -0.19 0.00 1.87 0.00 0.00 56.30 57.88 1ry3 h ASN -11 Cb 1.15 -0.05 0.01 0.00 0.27 0.00 0.00 38.32 39.70 1ry3 h ASN -11 CO 0.06 0.74 -0.68 0.58 -0.37 0.00 0.00 177.43 177.76 1ry3 h VAL -10 N 0.11 1.35 -0.33 2.57 2.07 -1.47 -3.17 116.25 117.38 1ry3 h VAL -10 Ca -0.01 -1.99 0.09 0.00 0.82 0.00 0.00 66.70 65.61 1ry3 h VAL -10 Cb 1.11 2.28 -0.01 0.00 -1.52 0.00 0.00 31.29 33.15 1ry3 h VAL -10 CO 0.09 0.60 0.31 0.11 0.02 0.00 0.00 177.57 178.70 1ry3 h LYS -9 N 0.20 0.00 0.00 1.57 6.56 -1.52 -0.57 116.57 122.81 1ry3 h LYS -9 Ca -0.07 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1ry3 h LYS -9 Cb 1.34 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.00 1ry3 h LYS -9 CO 0.14 0.00 0.00 0.39 -2.06 0.00 0.00 179.45 177.92 1ry3 n GLU -8 N -3.95 0.00 -0.07 3.15 -0.58 -1.20 -0.96 120.64 117.04 1ry3 n GLU -8 Ca 0.05 0.22 0.02 0.00 -0.42 0.00 0.00 57.16 57.03 1ry3 n GLU -8 Cb 0.47 -1.12 0.33 0.00 -0.57 0.00 0.00 31.44 30.55 1ry3 n GLU -8 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ry3 h MET -7 N 0.00 0.68 -0.09 3.49 -0.00 -1.71 -2.64 114.93 114.67 1ry3 h MET -7 Ca 0.00 -0.07 0.04 0.00 -0.00 0.00 0.00 59.70 59.67 1ry3 h MET -7 Cb 0.00 -0.14 -0.05 0.00 -0.00 0.00 0.00 31.60 31.41 1ry3 h MET -7 CO 0.00 0.50 -0.21 0.87 -0.00 0.00 0.00 176.91 178.08 1ry3 h LYS -6 N 0.69 -0.27 -0.63 -0.10 1.57 -1.10 0.49 116.57 117.22 1ry3 h LYS -6 Ca 0.18 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1ry3 h LYS -6 Cb 0.02 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1ry3 h LYS -6 CO -0.03 -0.18 0.00 1.04 -0.57 0.00 0.00 179.45 179.71 1ry3 n GLN -5 N -5.34 1.80 -0.10 3.15 1.13 -0.13 -3.42 117.38 114.47 1ry3 n GLN -5 Ca -0.03 -0.77 -0.22 0.00 -1.94 0.00 0.00 57.00 54.03 1ry3 n GLN -5 Cb 0.25 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 28.99 1ry3 n GLN -5 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1ry3 n LEU -4 N 0.13 1.92 0.15 1.08 7.94 0.14 -4.24 117.00 124.12 1ry3 n LEU -4 Ca 0.07 0.40 0.13 0.00 -1.11 0.00 0.00 56.01 55.50 1ry3 n LEU -4 Cb 0.37 -0.97 0.30 0.00 0.53 0.00 0.00 43.42 43.66 1ry3 n LEU -4 CO 0.07 0.34 0.84 1.12 -1.11 0.00 0.00 177.39 178.64 1ry3 h HIS -3 N -0.93 0.00 0.00 1.96 2.07 -1.58 -3.41 115.15 113.26 1ry3 h HIS -3 Ca -0.38 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.14 1ry3 h HIS -3 Cb 1.37 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.35 1ry3 h HIS -3 CO 0.08 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.35 1ry3 n GLY -2 N 1.22 -1.11 0.00 6.13 0.00 -1.22 -5.05 105.19 105.15 1ry3 n GLY -2 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 -0.95 3.20 -0.02 0.00 -1.26 -5.14 105.19 101.02 1ry3 n GLY -1 Ca 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1ry3 n GLY -1 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ry3 n VAL 1 N 0.00 0.02 -3.44 1.61 0.31 -1.26 -4.97 118.33 110.59 1ry3 n VAL 1 Ca 0.00 -0.35 -0.26 0.00 -0.01 0.00 0.00 64.34 63.71 1ry3 n VAL 1 Cb 0.00 -0.30 -0.09 0.00 -0.91 0.00 0.00 33.84 32.54 1ry3 n VAL 1 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1ry3 n ASN 2 N 1.20 1.17 -2.72 4.52 2.85 -1.26 -4.94 115.26 116.09 1ry3 n ASN 2 Ca 0.02 -2.82 -0.01 0.00 -0.11 0.00 0.00 54.58 51.65 1ry3 n ASN 2 Cb 0.55 -0.64 0.00 0.00 1.24 0.00 0.00 39.78 40.93 1ry3 n ASN 2 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 1ry3 n TYR 3 N 1.90 -2.47 -1.90 1.20 4.02 -1.26 -4.99 117.16 113.66 1ry3 n TYR 3 Ca 0.25 0.96 -0.04 0.00 -0.01 0.00 0.00 57.90 59.06 1ry3 n TYR 3 Cb 0.45 -3.59 -0.03 0.00 -0.02 0.00 0.00 39.34 36.15 1ry3 n TYR 3 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ry3 n GLY 4 N -1.37 0.22 0.08 2.72 0.00 -1.26 -4.96 105.19 100.62 1ry3 n GLY 4 Ca 0.02 -0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1ry3 n GLY 4 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ry3 n ASN 5 N -0.10 0.55 0.00 1.61 2.85 -1.26 -5.04 115.26 113.87 1ry3 n ASN 5 Ca -0.17 0.22 0.00 0.00 -0.11 0.00 0.00 54.58 54.52 1ry3 n ASN 5 Cb 0.56 0.91 0.00 0.00 1.24 0.00 0.00 39.78 42.49 1ry3 n ASN 5 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ry3 n GLY 6 N 1.26 0.93 1.75 8.20 0.00 -1.26 -4.99 105.19 111.09 1ry3 n GLY 6 Ca -0.04 -0.80 0.08 0.00 0.00 0.00 0.00 46.02 45.26 1ry3 n GLY 6 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ry3 n VAL 7 N 0.74 2.47 -2.80 1.61 0.31 -1.26 -4.96 118.33 114.44 1ry3 n VAL 7 Ca 0.00 -1.37 -0.32 0.00 -0.01 0.00 0.00 64.34 62.64 1ry3 n VAL 7 Cb 0.00 -0.15 -0.04 0.00 -0.91 0.00 0.00 33.84 32.74 1ry3 n VAL 7 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ry3 s SER 8 N -0.88 6.66 0.09 4.52 0.15 -1.26 -4.99 113.70 117.98 1ry3 s SER 8 Ca 0.53 1.35 -0.31 0.00 0.70 0.00 0.00 55.95 58.22 1ry3 s SER 8 Cb 0.39 -2.41 -0.10 0.00 -1.71 0.00 0.00 66.02 62.19 1ry3 s SER 8 CO 0.18 -0.40 1.87 0.00 1.20 0.00 0.00 173.24 176.10 1ry3 s SER 10 N 3.21 0.06 0.00 0.00 0.01 -1.26 -4.89 113.70 110.83 1ry3 s SER 10 Ca 0.84 0.33 0.00 0.00 1.31 0.00 0.00 55.95 58.43 1ry3 s SER 10 Cb -0.48 1.23 0.00 0.00 0.21 0.00 0.00 66.02 66.98 1ry3 s SER 10 CO 0.39 -0.29 0.00 1.17 0.41 0.00 0.00 173.24 174.92 1ry3 n LYS 11 N 5.37 -0.28 -3.80 12.44 4.81 -1.26 -4.85 118.16 130.59 1ry3 n LYS 11 Ca -0.04 0.07 -0.10 0.00 -0.87 0.00 0.00 58.31 57.38 1ry3 n LYS 11 Cb 0.50 -4.54 -0.05 0.00 0.02 0.00 0.00 35.03 30.96 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 -0.99 0.05 1.30 3.15 2.01 -1.26 -5.16 115.64 114.73 1ry3 s THR 12 Ca 0.00 -0.97 -0.19 0.00 0.31 0.00 0.00 61.69 60.84 1ry3 s THR 12 Cb 0.00 -1.59 0.30 0.00 0.01 0.00 0.00 72.50 71.22 1ry3 s THR 12 CO 0.00 -0.23 0.75 0.29 -0.69 0.00 0.00 174.62 174.74 1ry3 n LYS 13 N -0.27 -3.52 -0.88 4.92 4.01 -1.26 -4.75 118.16 116.40 1ry3 n LYS 13 Ca -0.10 -1.03 -0.08 0.00 -0.51 0.00 0.00 58.31 56.58 1ry3 n LYS 13 Cb 0.63 -1.91 0.23 0.00 -0.51 0.00 0.00 35.03 33.46 1ry3 n LYS 13 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ry3 s SER 15 N -0.76 3.35 0.88 0.00 1.04 -1.26 -5.02 113.70 111.93 1ry3 s SER 15 Ca 0.46 -1.05 -0.11 0.00 0.48 0.00 0.00 55.95 55.72 1ry3 s SER 15 Cb 0.37 -0.80 0.12 0.00 0.10 0.00 0.00 66.02 65.81 1ry3 s SER 15 CO 0.11 -0.30 1.09 -0.69 0.98 0.00 0.00 173.24 174.43 1ry3 s VAL 16 N 1.69 2.73 -0.88 5.02 1.01 -1.26 -4.90 120.40 123.81 1ry3 s VAL 16 Ca -0.01 0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.15 1ry3 s VAL 16 Cb -0.18 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1ry3 s VAL 16 CO -0.10 -0.31 2.92 0.59 0.00 0.00 0.00 175.10 178.19 1ry3 n ASN 17 N -3.88 7.20 0.00 3.32 4.13 -1.26 -4.61 115.26 120.16 1ry3 n ASN 17 Ca 0.08 -2.86 0.05 0.00 1.68 0.00 0.00 54.58 53.53 1ry3 n ASN 17 Cb 0.54 -1.39 0.23 0.00 -1.54 0.00 0.00 39.78 37.62 1ry3 n ASN 17 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 1ry3 n TRP 18 N 2.16 0.00 -0.04 3.10 7.02 -1.26 -2.42 117.44 126.00 1ry3 n TRP 18 Ca 0.59 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 57.01 1ry3 n TRP 18 Cb 0.47 -0.39 -0.02 0.00 -2.42 0.00 0.00 31.31 28.95 1ry3 n TRP 18 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1ry3 n GLY 19 N -0.46 -0.37 0.38 6.99 0.00 -1.26 -4.18 105.19 106.30 1ry3 n GLY 19 Ca 0.04 -0.22 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.65 -0.73 0.00 1.61 4.15 -1.94 -0.10 115.11 117.44 1ry3 h GLN 20 Ca 0.00 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1ry3 h GLN 20 Cb 0.65 0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.51 1ry3 h GLN 20 CO 0.00 -0.49 0.00 0.00 -1.93 0.00 0.00 178.83 176.41 1ry3 n ALA 21 N -2.69 1.65 -0.07 3.38 0.00 -1.02 -1.01 120.51 120.75 1ry3 n ALA 21 Ca -0.09 -0.04 -0.14 0.00 0.00 0.00 0.00 53.44 53.17 1ry3 n ALA 21 Cb 0.35 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 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 0.77 0.00 0.00 3.57 -1.14 -0.53 116.94 119.61 1ry3 h PHE 22 Ca 0.00 -0.27 -0.04 0.00 3.53 0.00 0.00 57.97 61.19 1ry3 h PHE 22 Cb 0.04 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1ry3 h PHE 22 CO 0.00 1.01 -0.20 1.96 -2.23 0.00 0.00 178.31 178.85 1ry3 h GLN 23 N 0.30 0.00 0.22 1.11 1.08 -0.82 -3.06 115.11 113.94 1ry3 h GLN 23 Ca 0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1ry3 h GLN 23 Cb 0.95 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.38 1ry3 h GLN 23 CO 0.08 0.20 -0.10 0.93 -0.95 0.00 0.00 178.83 178.99 1ry3 h GLU 24 N 0.00 -0.28 -0.36 1.46 5.08 -1.20 -2.93 114.58 116.35 1ry3 h GLU 24 Ca -0.00 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 1ry3 h GLU 24 Cb 0.74 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 1ry3 h GLU 24 CO 0.03 0.09 0.26 0.00 -1.00 0.00 0.00 179.01 178.39 1ry3 h ARG 25 N -0.76 0.05 0.08 2.33 2.47 -1.10 0.37 114.38 117.82 1ry3 h ARG 25 Ca -0.03 -0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1ry3 h ARG 25 Cb 0.50 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.81 1ry3 h ARG 25 CO 0.05 0.03 -0.04 -0.92 0.56 0.00 0.00 179.97 179.65 1ry3 h TYR 26 N 0.05 -0.10 -0.03 3.04 3.20 -1.49 -1.57 116.97 120.07 1ry3 h TYR 26 Ca 0.17 -0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.88 1ry3 h TYR 26 Cb 0.62 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 1ry3 h TYR 26 CO -0.00 0.15 -0.69 1.15 -1.64 0.00 0.00 178.16 177.13 1ry3 h THR 27 N -0.34 1.44 -0.41 1.81 2.02 -1.17 -2.97 112.91 113.30 1ry3 h THR 27 Ca -0.01 -2.23 -0.00 0.00 0.77 0.00 0.00 66.41 64.94 1ry3 h THR 27 Cb 0.29 2.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.87 1ry3 h THR 27 CO 0.02 0.65 0.24 0.00 0.37 0.00 0.00 175.52 176.80 1ry3 h ALA 28 N 1.18 0.52 0.22 6.16 0.00 -0.21 0.36 119.26 127.48 1ry3 h ALA 28 Ca -0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1ry3 h ALA 28 Cb 1.23 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ry3 h ALA 28 CO 0.10 0.01 -0.10 0.78 0.00 0.00 0.00 179.25 180.04 1ry3 h GLY 29 N 0.53 -0.31 2.00 0.00 0.00 -1.29 -2.96 103.07 101.05 1ry3 h GLY 29 Ca 0.15 0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.56 1ry3 h GLY 29 CO -0.03 -0.11 -0.13 -2.22 0.00 0.00 0.00 176.54 174.05 1ry3 h ILE 30 N -0.56 1.04 0.18 2.60 2.04 -1.47 -2.70 117.51 118.64 1ry3 h ILE 30 Ca -0.03 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 1ry3 h ILE 30 Cb 0.41 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 1ry3 h ILE 30 CO 0.05 0.13 -0.20 0.78 0.00 0.00 0.00 178.15 178.91 1ry3 h ASN 31 N 0.00 -0.55 -0.54 1.72 4.21 -0.11 0.52 115.58 120.84 1ry3 h ASN 31 Ca -0.00 0.05 0.11 0.00 1.21 0.00 0.00 56.30 57.67 1ry3 h ASN 31 Cb 0.24 0.18 -0.03 0.00 -1.12 0.00 0.00 38.32 37.59 1ry3 h ASN 31 CO 0.02 -0.26 0.37 -1.28 -1.29 0.00 0.00 177.43 174.99 1ry3 h SER 32 N -0.38 0.22 0.82 5.81 0.87 -1.50 -1.46 113.55 117.92 1ry3 h SER 32 Ca -0.02 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.50 1ry3 h SER 32 Cb 0.34 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.27 1ry3 h SER 32 CO -0.03 0.13 -0.39 0.15 -0.53 0.00 0.00 176.83 176.15 1ry3 h PHE 33 N 0.24 -1.02 0.06 2.24 3.57 -1.06 0.25 116.94 121.23 1ry3 h PHE 33 Ca 0.25 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 1ry3 h PHE 33 Cb 0.68 0.34 -0.00 0.00 2.79 0.00 0.00 35.95 39.75 1ry3 h PHE 33 CO -0.00 -0.63 -0.06 0.28 -2.23 0.00 0.00 178.31 175.66 1ry3 h VAL 34 N -1.29 0.00 -0.33 1.41 2.07 0.53 -2.90 116.25 115.74 1ry3 h VAL 34 Ca -0.11 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.47 1ry3 h VAL 34 Cb 0.84 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.53 1ry3 h VAL 34 CO 0.18 0.00 -0.39 -1.28 0.02 0.00 0.00 177.57 176.10 1ry3 h SER 35 N -0.12 -1.27 -0.69 0.57 0.87 -1.41 3.22 113.55 114.71 1ry3 h SER 35 Ca -0.01 0.20 0.21 0.00 -1.23 0.00 0.00 61.79 60.96 1ry3 h SER 35 Cb 0.11 0.56 -0.13 0.00 -0.44 0.00 0.00 62.40 62.50 1ry3 h SER 35 CO -0.01 -0.37 0.07 0.61 -0.53 0.00 0.00 176.83 176.60 1ry3 n GLY 36 N -1.42 -0.88 0.01 5.77 0.00 0.08 0.24 105.19 108.99 1ry3 n GLY 36 Ca -0.01 0.66 -0.00 0.00 0.00 0.00 0.00 46.02 46.67 1ry3 n GLY 36 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ry3 n VAL 37 N -4.88 0.10 0.00 1.61 0.31 0.64 -4.63 118.33 111.48 1ry3 n VAL 37 Ca 0.18 0.48 0.00 0.00 -0.01 0.00 0.00 64.34 64.99 1ry3 n VAL 37 Cb 0.59 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 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 -2.39 0.00 0.44 3.52 0.00 1.04 -4.37 120.51 118.75 1ry3 n ALA 38 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1ry3 n ALA 38 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 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 -1.40 0.07 -1.78 0.00 2.88 -1.10 -3.39 113.62 108.89 1ry3 n SER 39 Ca 0.00 -0.51 -0.10 0.00 -1.33 0.00 0.00 58.87 56.93 1ry3 n SER 39 Cb 0.00 -0.03 0.19 0.00 -0.75 0.00 0.00 64.21 63.62 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 -0.08 3.41 1.31 0.46 0.00 0.66 -4.10 105.19 106.85 1ry3 n GLY 40 Ca 0.00 -0.77 -0.03 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.30 0.92 1.77 4.61 0.00 -1.22 -4.94 120.51 121.35 1ry3 n ALA 41 Ca 0.36 -0.42 0.15 0.00 0.00 0.00 0.00 53.44 53.53 1ry3 n ALA 41 Cb 1.23 -0.44 0.86 0.00 0.00 0.00 0.00 19.45 21.09 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 -0.33 -1.02 1.61 0.00 0.00 -1.26 -3.15 105.19 101.05 1ry3 n GLY 42 Ca -0.12 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1ry3 n GLY 42 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ry3 n SER 43 N -1.07 4.51 -2.18 1.61 3.41 -1.26 -4.50 113.62 114.14 1ry3 n SER 43 Ca 0.21 -3.18 -0.30 0.00 -0.26 0.00 0.00 58.87 55.33 1ry3 n SER 43 Cb 0.13 -0.67 0.08 0.00 -0.26 0.00 0.00 64.21 63.49 1ry3 n SER 43 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ry3 n ILE 44 N -0.22 3.25 0.00 -1.33 0.13 -1.19 -4.81 119.36 115.19 1ry3 n ILE 44 Ca 0.33 -3.22 0.00 0.00 -1.10 0.00 0.00 62.75 58.76 1ry3 n ILE 44 Cb 1.20 -1.07 0.00 0.00 -0.84 0.00 0.00 39.64 38.92 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 -0.89 -1.52 0.00 4.50 0.00 -1.26 -5.20 105.19 100.83 1ry3 n GLY 45 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1ry3 n GLY 45 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36