#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i22 n LYS 2 N 0.00 0.00 0.01 3.17 5.02 -1.26 -4.99 118.16 120.11 3i22 n LYS 2 Ca 0.00 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 3i22 n LYS 2 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 3i22 n LYS 2 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i22 n ALA 3 N -3.00 3.56 0.32 7.82 0.00 -1.26 -4.12 120.51 123.83 3i22 n ALA 3 Ca 0.00 -0.49 0.19 0.00 0.00 0.00 0.00 53.44 53.15 3i22 n ALA 3 Cb 0.00 -0.85 1.07 0.00 0.00 0.00 0.00 19.45 19.67 3i22 n ALA 3 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3i22 h LYS 4 N 0.00 0.00 -2.36 0.00 6.56 -2.05 -2.45 116.57 116.27 3i22 h LYS 4 Ca 0.00 0.00 -0.79 0.00 -1.06 0.00 0.00 60.65 58.80 3i22 h LYS 4 Cb 0.76 0.00 -0.24 0.00 -0.57 0.00 0.00 32.23 32.18 3i22 h LYS 4 CO 0.00 0.00 1.34 0.39 -2.06 0.00 0.00 179.45 179.12 3i22 n GLU 5 N -3.38 5.24 -3.68 3.15 -0.58 -1.26 -4.91 120.64 115.23 3i22 n GLU 5 Ca -0.03 -4.40 -0.11 0.00 -0.42 0.00 0.00 57.16 52.21 3i22 n GLU 5 Cb 0.11 -2.51 -0.11 0.00 -0.57 0.00 0.00 31.44 28.36 3i22 n GLU 5 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3i22 s LEU 6 N -3.79 -0.28 -0.97 -4.62 1.43 -0.93 -4.95 118.68 104.57 3i22 s LEU 6 Ca 0.42 0.80 -0.03 0.00 -1.03 0.00 0.00 54.13 54.29 3i22 s LEU 6 Cb 0.18 1.10 0.00 0.00 0.03 0.00 0.00 46.19 47.51 3i22 s LEU 6 CO -0.12 -0.22 0.83 -1.14 0.23 0.00 0.00 176.35 175.94 3i22 n ARG 7 N 4.93 -5.53 -3.30 1.70 0.63 -1.26 -4.98 116.66 108.86 3i22 n ARG 7 Ca -0.14 0.64 -0.26 0.00 -0.92 0.00 0.00 57.85 57.16 3i22 n ARG 7 Cb 0.51 -5.07 -0.07 0.00 0.45 0.00 0.00 32.46 28.29 3i22 n ARG 7 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 3i22 n GLU 8 N -3.64 2.45 -2.49 -0.14 0.00 -1.26 -5.00 120.64 110.56 3i22 n GLU 8 Ca -0.11 -4.54 -0.02 0.00 0.00 0.00 0.00 57.16 52.49 3i22 n GLU 8 Cb 0.59 -2.14 -0.01 0.00 0.00 0.00 0.00 31.44 29.88 3i22 n GLU 8 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 3i22 n LYS 9 N 0.67 -3.10 -0.07 3.44 3.00 -1.26 -4.46 118.16 116.38 3i22 n LYS 9 Ca 0.29 2.34 0.19 0.00 -0.00 0.00 0.00 58.31 61.14 3i22 n LYS 9 Cb 0.42 -3.09 0.64 0.00 0.00 0.00 0.00 35.03 33.00 3i22 n LYS 9 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3i22 h SER 10 N 4.36 0.12 0.12 3.14 0.87 -2.02 0.34 113.55 120.48 3i22 h SER 10 Ca -0.16 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 3i22 h SER 10 Cb 0.36 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 3i22 h SER 10 CO 0.00 0.06 0.00 0.52 -0.53 0.00 0.00 176.83 176.88 3i22 n VAL 11 N -4.40 1.04 -0.01 2.23 0.31 -1.26 -1.31 118.33 114.93 3i22 n VAL 11 Ca 0.12 0.26 -0.22 0.00 -0.01 0.00 0.00 64.34 64.49 3i22 n VAL 11 Cb 0.61 -1.17 -0.13 0.00 -0.91 0.00 0.00 33.84 32.24 3i22 n VAL 11 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3i22 h GLU 12 N 0.00 0.21 -0.27 5.55 5.08 -0.54 -3.37 114.58 121.25 3i22 h GLU 12 Ca 0.00 -0.36 0.08 0.00 -1.00 0.00 0.00 59.36 58.08 3i22 h GLU 12 Cb 0.06 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3i22 h GLU 12 CO 0.00 1.17 0.39 0.93 -1.00 0.00 0.00 179.01 180.50 3i22 h GLU 13 N -0.27 0.00 -0.14 2.33 4.39 -1.28 0.45 114.58 120.06 3i22 h GLU 13 Ca -0.37 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.17 3i22 h GLU 13 Cb 1.80 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.45 3i22 h GLU 13 CO 0.02 0.00 -0.53 -0.07 -1.16 0.00 0.00 179.01 177.27 3i22 h LEU 14 N 0.00 0.71 -0.13 1.33 3.38 -1.71 -2.77 115.31 116.12 3i22 h LEU 14 Ca 0.13 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3i22 h LEU 14 Cb 0.91 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3i22 h LEU 14 CO -0.00 1.20 0.00 0.59 0.09 0.00 0.00 178.44 180.32 3i22 n ASN 15 N -4.18 0.18 -0.08 -0.43 5.03 0.11 -2.68 115.26 113.21 3i22 n ASN 15 Ca -0.07 -1.89 -0.07 0.00 0.87 0.00 0.00 54.58 53.42 3i22 n ASN 15 Cb 0.61 -0.02 -0.02 0.00 -1.02 0.00 0.00 39.78 39.33 3i22 n ASN 15 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 3i22 n THR 16 N -0.45 1.45 0.30 3.41 -1.04 -0.95 -4.08 114.28 112.92 3i22 n THR 16 Ca 0.04 0.18 0.18 0.00 -2.04 0.00 0.00 64.05 62.41 3i22 n THR 16 Cb 0.04 -2.36 0.85 0.00 -1.82 0.00 0.00 70.33 67.04 3i22 n THR 16 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3i22 h GLU 17 N -1.00 0.00 -0.29 -2.82 5.08 -1.63 0.28 114.58 114.19 3i22 h GLU 17 Ca -0.02 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 3i22 h GLU 17 Cb 0.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 3i22 h GLU 17 CO -0.01 0.00 0.21 1.25 -1.00 0.00 0.00 179.01 179.46 3i22 h LEU 18 N 0.00 0.00 -2.04 1.33 7.12 -1.68 -1.41 115.31 118.63 3i22 h LEU 18 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 3i22 h LEU 18 Cb 0.26 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.39 3i22 h LEU 18 CO 0.00 0.00 0.00 0.18 -0.13 0.00 0.00 178.44 178.49 3i22 n LEU 19 N -4.39 2.66 -0.04 2.25 4.32 0.91 -3.86 117.00 118.86 3i22 n LEU 19 Ca 0.04 -1.35 -0.01 0.00 -0.02 0.00 0.00 56.01 54.67 3i22 n LEU 19 Cb 0.38 -0.12 -0.00 0.00 -1.62 0.00 0.00 43.42 42.06 3i22 n LEU 19 CO 0.35 0.56 -0.07 0.78 -1.22 0.00 0.00 177.39 177.79 3i22 h ASN 20 N 3.01 0.00 0.00 -1.43 4.21 -0.63 -3.35 115.58 117.40 3i22 h ASN 20 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 3i22 h ASN 20 Cb 0.72 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.92 3i22 h ASN 20 CO 0.00 0.42 0.00 0.18 -1.29 0.00 0.00 177.43 176.74 3i22 n LEU 21 N -4.02 0.00 0.00 1.61 4.77 -1.17 -3.33 117.00 114.85 3i22 n LEU 21 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3i22 n LEU 21 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3i22 n LEU 21 CO 0.02 0.00 0.00 -0.11 -1.33 0.00 0.00 177.39 175.97 3i22 n LEU 22 N -0.90 0.00 -0.05 2.23 7.94 -1.25 -3.07 117.00 121.90 3i22 n LEU 22 Ca 0.16 0.00 0.24 0.00 -1.11 0.00 0.00 56.01 55.30 3i22 n LEU 22 Cb 0.07 0.00 0.72 0.00 0.53 0.00 0.00 43.42 44.74 3i22 n LEU 22 CO 0.12 -0.34 1.22 0.03 -1.11 0.00 0.00 177.39 177.31 3i22 h ARG 23 N 0.00 0.00 0.00 1.96 2.47 -1.87 1.24 114.38 118.18 3i22 h ARG 23 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3i22 h ARG 23 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3i22 h ARG 23 CO 0.00 0.00 0.00 0.39 0.56 0.00 0.00 179.97 180.92 3i22 n GLU 24 N -4.05 0.06 0.00 0.04 1.02 -1.26 -0.26 120.64 116.19 3i22 n GLU 24 Ca 0.13 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 3i22 n GLU 24 Cb 0.79 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 3i22 n GLU 24 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3i22 n GLN 25 N -1.45 1.74 0.03 3.49 7.27 0.68 -4.44 117.38 124.69 3i22 n GLN 25 Ca 0.05 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 57.00 3i22 n GLN 25 Cb 0.20 -0.81 -0.09 0.00 2.41 0.00 0.00 30.24 31.95 3i22 n GLN 25 CO 0.00 0.00 0.00 0.35 0.07 0.00 0.00 177.06 177.48 3i22 h PHE 26 N 0.00 -0.12 0.00 3.69 3.04 0.14 0.15 116.94 123.84 3i22 h PHE 26 Ca 0.00 -0.00 -0.07 0.00 3.98 0.00 0.00 57.97 61.88 3i22 h PHE 26 Cb 0.62 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.16 3i22 h PHE 26 CO 0.00 0.37 -0.32 -0.91 -2.02 0.00 0.00 178.31 175.43 3i22 h ASN 27 N -0.72 0.00 -0.50 0.41 -0.26 -0.77 -2.32 115.58 111.42 3i22 h ASN 27 Ca -0.01 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.66 3i22 h ASN 27 Cb 0.55 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.79 3i22 h ASN 27 CO 0.02 0.32 0.07 0.25 -1.06 0.00 0.00 177.43 177.03 3i22 h LEU 28 N 0.00 0.86 -1.23 1.61 7.12 -1.37 -0.21 115.31 122.08 3i22 h LEU 28 Ca -0.00 -0.19 0.00 0.00 0.13 0.00 0.00 57.88 57.81 3i22 h LEU 28 Cb 0.90 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 40.80 3i22 h LEU 28 CO 0.04 0.88 0.00 0.54 -0.13 0.00 0.00 178.44 179.77 3i22 n ARG 29 N -4.23 1.48 -0.02 1.25 1.74 0.50 -2.39 116.66 114.99 3i22 n ARG 29 Ca 0.03 -0.41 0.03 0.00 -0.77 0.00 0.00 57.85 56.74 3i22 n ARG 29 Cb 0.28 -1.55 0.04 0.00 -1.02 0.00 0.00 32.46 30.22 3i22 n ARG 29 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 3i22 n MET 30 N 0.05 2.46 -0.00 5.56 1.56 -0.10 -4.53 117.12 122.11 3i22 n MET 30 Ca 0.04 -1.84 0.02 0.00 -0.27 0.00 0.00 57.70 55.65 3i22 n MET 30 Cb 0.34 -1.16 -0.03 0.00 2.15 0.00 0.00 33.22 34.53 3i22 n MET 30 CO 0.00 0.00 0.00 1.04 -0.73 0.00 0.00 175.97 176.28 3i22 n GLN 31 N -0.79 3.86 0.00 2.12 6.02 -1.01 -3.64 117.38 123.94 3i22 n GLN 31 Ca 0.05 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 3i22 n GLN 31 Cb 0.37 -0.85 0.00 0.00 1.02 0.00 0.00 30.24 30.79 3i22 n GLN 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i22 n ALA 32 N -1.28 1.92 0.00 -1.58 0.00 -1.25 -2.00 120.51 116.32 3i22 n ALA 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3i22 n ALA 32 Cb 0.09 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.54 3i22 n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i22 n ALA 33 N -0.49 2.25 0.71 0.00 0.00 -1.26 -4.81 120.51 116.91 3i22 n ALA 33 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 3i22 n ALA 33 Cb 0.00 0.00 0.32 0.00 0.00 0.00 0.00 19.45 19.77 3i22 n ALA 33 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3i22 n SER 34 N -1.98 0.00 -3.46 0.00 7.64 -1.17 -4.86 113.62 109.79 3i22 n SER 34 Ca 0.00 -0.37 -0.19 0.00 1.01 0.00 0.00 58.87 59.32 3i22 n SER 34 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 3i22 n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i22 n GLY 35 N -0.28 -1.16 3.04 0.23 0.00 -0.85 -5.00 105.19 101.17 3i22 n GLY 35 Ca 0.08 0.51 -0.15 0.00 0.00 0.00 0.00 46.02 46.46 3i22 n GLY 35 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i22 s GLN 36 N -4.67 0.57 0.17 1.61 -0.21 -1.17 -5.04 119.66 110.92 3i22 s GLN 36 Ca 0.23 -0.57 0.00 0.00 0.02 0.00 0.00 55.36 55.04 3i22 s GLN 36 Cb -0.07 -0.46 0.00 0.00 1.00 0.00 0.00 33.01 33.48 3i22 s GLN 36 CO 0.82 0.11 0.00 1.28 -2.12 0.00 0.00 175.29 175.38 3i22 n LEU 37 N 2.04 -6.22 -0.22 2.90 4.77 -1.26 -4.81 117.00 114.21 3i22 n LEU 37 Ca -0.19 3.19 0.12 0.00 -0.03 0.00 0.00 56.01 59.10 3i22 n LEU 37 Cb 0.56 -3.18 0.20 0.00 -2.33 0.00 0.00 43.42 38.67 3i22 n LEU 37 CO 0.23 -2.03 0.44 0.00 -1.33 0.00 0.00 177.39 174.69 3i22 n GLN 38 N 1.89 0.63 -2.01 3.23 6.02 -1.26 -4.70 117.38 121.18 3i22 n GLN 38 Ca 0.00 -0.43 -0.26 0.00 -0.01 0.00 0.00 57.00 56.30 3i22 n GLN 38 Cb 0.00 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.71 3i22 n GLN 38 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3i22 s GLN 39 N -2.67 2.41 0.40 -1.09 1.11 -1.26 -4.76 119.66 113.80 3i22 s GLN 39 Ca 0.18 -0.65 0.12 0.00 0.01 0.00 0.00 55.36 55.02 3i22 s GLN 39 Cb 0.18 -5.13 0.93 0.00 -1.01 0.00 0.00 33.01 27.99 3i22 s GLN 39 CO 0.62 -3.82 1.92 0.77 0.01 0.00 0.00 175.29 174.80 3i22 h SER 40 N 10.67 0.50 0.06 5.90 0.02 -1.99 0.59 113.55 129.31 3i22 h SER 40 Ca 0.14 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3i22 h SER 40 Cb 0.97 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.43 3i22 h SER 40 CO 1.20 0.28 0.00 0.00 -1.14 0.00 0.00 176.83 177.17 3i22 n HIS 41 N -4.50 0.00 -0.06 3.45 1.44 -1.26 -2.95 115.22 111.34 3i22 n HIS 41 Ca 0.14 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.74 3i22 n HIS 41 Cb 0.43 -0.24 -0.04 0.00 0.12 0.00 0.00 29.99 30.26 3i22 n HIS 41 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 3i22 h LEU 42 N 0.00 0.29 -0.34 2.39 6.46 -1.21 0.27 115.31 123.17 3i22 h LEU 42 Ca 0.00 -0.14 0.07 0.00 -0.12 0.00 0.00 57.88 57.68 3i22 h LEU 42 Cb 0.03 -0.07 -0.06 0.00 -0.73 0.00 0.00 40.66 39.82 3i22 h LEU 42 CO 0.00 0.35 -0.06 -0.07 -0.62 0.00 0.00 178.44 178.04 3i22 h LEU 43 N 0.21 -0.27 -0.48 2.25 -0.00 -1.76 -1.77 115.31 113.49 3i22 h LEU 43 Ca 0.07 0.10 0.07 0.00 -0.00 0.00 0.00 57.88 58.12 3i22 h LEU 43 Cb 0.15 0.19 -0.06 0.00 -0.00 0.00 0.00 40.66 40.94 3i22 h LEU 43 CO -0.01 -0.09 0.15 0.50 -0.00 0.00 0.00 178.44 178.99 3i22 h LYS 44 N 0.02 0.30 -7.43 1.13 1.63 -1.65 -3.40 116.57 107.17 3i22 h LYS 44 Ca 0.16 -0.02 -0.42 0.00 -0.85 0.00 0.00 60.65 59.52 3i22 h LYS 44 Cb 0.24 -0.07 0.19 0.00 -0.60 0.00 0.00 32.23 31.99 3i22 h LYS 44 CO -0.33 0.20 0.17 -0.65 -3.45 0.00 0.00 179.45 175.38 3i22 s GLN 45 N -6.14 -0.86 0.00 1.90 1.11 0.92 -3.36 119.66 113.23 3i22 s GLN 45 Ca -0.13 -0.04 0.00 0.00 0.01 0.00 0.00 55.36 55.20 3i22 s GLN 45 Cb 0.14 -1.64 0.00 0.00 -1.01 0.00 0.00 33.01 30.51 3i22 s GLN 45 CO 0.73 -3.48 0.00 0.28 0.01 0.00 0.00 175.29 172.83 3i22 n VAL 46 N -4.60 0.00 0.00 1.09 0.31 -1.26 -4.70 118.33 109.18 3i22 n VAL 46 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 3i22 n VAL 46 Cb 0.59 -0.81 0.00 0.00 -0.91 0.00 0.00 33.84 32.71 3i22 n VAL 46 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3i22 n ARG 47 N 0.02 0.00 -0.40 5.55 0.63 -1.21 -4.61 116.66 116.64 3i22 n ARG 47 Ca 0.00 0.00 0.34 0.00 -0.92 0.00 0.00 57.85 57.27 3i22 n ARG 47 Cb 0.32 0.00 0.61 0.00 0.45 0.00 0.00 32.46 33.84 3i22 n ARG 47 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3i22 h ARG 48 N 0.00 0.11 0.00 -0.14 3.08 -1.84 1.91 114.38 117.50 3i22 h ARG 48 Ca 0.00 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 3i22 h ARG 48 Cb 0.00 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 3i22 h ARG 48 CO 0.00 0.07 -0.52 -0.44 -1.07 0.00 0.00 179.97 178.01 3i22 h ASP 49 N 0.11 0.00 0.43 7.04 3.32 -1.89 -2.23 116.42 123.20 3i22 h ASP 49 Ca 0.81 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.84 3i22 h ASP 49 Cb 2.36 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.90 3i22 h ASP 49 CO -0.52 0.52 -0.11 0.58 -1.72 0.00 0.00 179.24 177.99 3i22 h VAL 50 N 0.00 0.49 0.00 -1.35 2.07 0.28 0.46 116.25 118.19 3i22 h VAL 50 Ca -0.01 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.98 3i22 h VAL 50 Cb 1.08 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 3i22 h VAL 50 CO 0.07 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.77 3i22 n ALA 51 N -2.25 2.05 -0.11 1.67 0.00 -0.84 -2.32 120.51 118.72 3i22 n ALA 51 Ca -0.02 -0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.20 3i22 n ALA 51 Cb 0.24 -1.33 -0.15 0.00 0.00 0.00 0.00 19.45 18.22 3i22 n ALA 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3i22 n ARG 52 N -1.32 0.68 0.00 0.00 1.74 0.15 -1.11 116.66 116.80 3i22 n ARG 52 Ca 0.09 0.06 0.04 0.00 -0.77 0.00 0.00 57.85 57.26 3i22 n ARG 52 Cb 0.17 -1.53 0.19 0.00 -1.02 0.00 0.00 32.46 30.27 3i22 n ARG 52 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3i22 n VAL 53 N -2.94 0.93 -0.05 1.55 0.31 -0.59 -1.22 118.33 116.33 3i22 n VAL 53 Ca -0.37 0.23 -0.10 0.00 -0.01 0.00 0.00 64.34 64.09 3i22 n VAL 53 Cb 1.10 -1.11 -0.03 0.00 -0.91 0.00 0.00 33.84 32.89 3i22 n VAL 53 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3i22 n LYS 54 N -1.31 0.23 0.32 5.55 5.02 -1.05 -4.26 118.16 122.66 3i22 n LYS 54 Ca 0.03 0.10 -0.18 0.00 -2.02 0.00 0.00 58.31 56.25 3i22 n LYS 54 Cb 0.06 -0.89 -0.09 0.00 -0.02 0.00 0.00 35.03 34.10 3i22 n LYS 54 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3i22 h THR 55 N -0.40 0.16 0.00 -0.18 2.02 -0.93 0.82 112.91 114.40 3i22 h THR 55 Ca -0.23 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3i22 h THR 55 Cb 1.10 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 3i22 h THR 55 CO -0.14 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.93 3i22 n LEU 56 N -5.53 0.32 0.03 2.58 7.99 -0.36 -1.20 117.00 120.84 3i22 n LEU 56 Ca -0.12 0.59 0.12 0.00 -0.01 0.00 0.00 56.01 56.59 3i22 n LEU 56 Cb 0.42 -0.56 0.19 0.00 -0.11 0.00 0.00 43.42 43.37 3i22 n LEU 56 CO 0.31 -0.45 0.36 -0.11 -1.51 0.00 0.00 177.39 175.99 3i22 n LEU 57 N -1.87 0.60 0.03 2.23 -0.00 0.12 -3.89 117.00 114.23 3i22 n LEU 57 Ca 0.02 0.11 -0.12 0.00 -0.00 0.00 0.00 56.01 56.03 3i22 n LEU 57 Cb 0.17 -0.20 -0.14 0.00 -0.00 0.00 0.00 43.42 43.25 3i22 n LEU 57 CO 0.15 0.03 -0.32 0.78 -0.00 0.00 0.00 177.39 178.03 3i22 h ASN 58 N 0.00 0.17 0.00 1.96 4.21 0.20 -3.11 115.58 119.02 3i22 h ASN 58 Ca 0.00 -0.26 0.00 0.00 1.21 0.00 0.00 56.30 57.25 3i22 h ASN 58 Cb 0.64 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.79 3i22 h ASN 58 CO 0.00 1.22 0.00 -1.84 -1.29 0.00 0.00 177.43 175.52 3i22 n GLU 59 N -3.30 0.36 -0.38 0.81 0.28 -1.16 -0.29 120.64 116.96 3i22 n GLU 59 Ca -0.14 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.79 3i22 n GLU 59 Cb 1.02 -1.45 0.05 0.00 1.43 0.00 0.00 31.44 32.49 3i22 n GLU 59 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 3i22 n LYS 60 N -0.95 1.35 -2.86 3.44 4.81 -1.18 -4.78 118.16 118.00 3i22 n LYS 60 Ca 0.08 -0.83 -0.43 0.00 -0.87 0.00 0.00 58.31 56.26 3i22 n LYS 60 Cb 0.04 -1.32 -0.04 0.00 0.02 0.00 0.00 35.03 33.72 3i22 n LYS 60 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3i22 s ALA 61 N -0.91 3.31 0.00 3.14 0.00 0.60 -4.01 121.76 123.88 3i22 s ALA 61 Ca 0.16 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.39 3i22 s ALA 61 Cb 0.13 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.70 3i22 s ALA 61 CO 0.03 -1.86 0.00 0.41 0.00 0.00 0.00 175.76 174.34 3i22 n GLY 62 N 4.77 2.38 0.00 0.00 0.00 -1.26 -5.17 105.19 105.91 3i22 n GLY 62 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3i22 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32