#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 6chy s ASP 3 N 0.00 4.56 0.13 0.00 2.15 -1.26 -5.01 116.67 117.23 6chy s ASP 3 Ca 0.00 -0.13 0.27 0.00 0.43 0.00 0.00 52.55 53.12 6chy s ASP 3 Cb 0.00 -1.49 0.96 0.00 -0.30 0.00 0.00 42.92 42.09 6chy s ASP 3 CO 0.00 0.25 1.82 2.29 -0.17 0.00 0.00 175.17 179.36 6chy n LYS 4 N 3.01 0.16 -0.22 4.34 2.85 -1.26 -3.52 118.16 123.52 6chy n LYS 4 Ca -0.18 0.13 0.08 0.00 -1.05 0.00 0.00 58.31 57.29 6chy n LYS 4 Cb 0.53 -1.68 0.17 0.00 -0.65 0.00 0.00 35.03 33.39 6chy n LYS 4 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 6chy n GLU 5 N -1.96 2.33 -1.62 -1.58 1.02 -1.26 -3.85 120.64 113.71 6chy n GLU 5 Ca 0.06 -2.48 -0.48 0.00 -0.02 0.00 0.00 57.16 54.24 6chy n GLU 5 Cb 0.40 -1.54 -0.04 0.00 -0.02 0.00 0.00 31.44 30.23 6chy n GLU 5 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 6chy n LEU 6 N -0.72 2.29 -4.63 -4.62 7.94 -1.23 -4.81 117.00 111.22 6chy n LEU 6 Ca 0.15 1.12 -0.42 0.00 -1.11 0.00 0.00 56.01 55.76 6chy n LEU 6 Cb 0.66 -1.31 -0.04 0.00 0.53 0.00 0.00 43.42 43.26 6chy n LEU 6 CO 0.07 -0.82 0.64 -0.75 -1.11 0.00 0.00 177.39 175.43 6chy s LYS 7 N 0.09 4.06 0.10 1.96 2.20 -1.25 -4.51 119.74 122.38 6chy s LYS 7 Ca 0.76 0.77 0.01 0.00 -0.36 0.00 0.00 55.97 57.15 6chy s LYS 7 Cb -0.79 -3.70 -0.04 0.00 -1.51 0.00 0.00 37.83 31.80 6chy s LYS 7 CO 0.47 -0.63 0.25 -0.06 -0.36 0.00 0.00 175.35 175.02 6chy s PHE 8 N 2.97 3.51 -0.24 4.03 0.40 0.84 -0.24 117.98 129.25 6chy s PHE 8 Ca 0.34 0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.91 6chy s PHE 8 Cb -0.14 -1.74 0.06 0.00 0.51 0.00 0.00 43.02 41.71 6chy s PHE 8 CO 0.11 0.55 -0.09 -1.17 0.70 0.00 0.00 175.22 175.32 6chy s LEU 9 N -2.79 2.90 -0.43 -0.37 2.96 -0.29 -1.43 118.68 119.24 6chy s LEU 9 Ca 0.35 -1.21 -0.10 0.00 -0.22 0.00 0.00 54.13 52.95 6chy s LEU 9 Cb -0.12 -1.37 0.08 0.00 0.50 0.00 0.00 46.19 45.28 6chy s LEU 9 CO 0.28 -0.19 0.28 -0.69 -1.32 0.00 0.00 176.35 174.71 6chy s VAL 10 N 1.26 4.37 -0.36 1.68 1.01 -0.28 -1.28 120.40 126.80 6chy s VAL 10 Ca -0.06 -1.35 -0.16 0.00 0.00 0.00 0.00 61.98 60.41 6chy s VAL 10 Cb -0.19 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.53 6chy s VAL 10 CO -0.06 -0.51 0.42 -0.69 0.00 0.00 0.00 175.10 174.25 6chy s VAL 11 N 1.46 5.11 -0.11 2.92 1.01 -0.23 -2.68 120.40 127.86 6chy s VAL 11 Ca 0.03 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 6chy s VAL 11 Cb -0.23 -3.92 0.10 0.00 0.00 0.00 0.00 36.38 32.34 6chy s VAL 11 CO 0.03 -0.21 0.86 -0.62 0.00 0.00 0.00 175.10 175.15 6chy s ASP 12 N 1.76 -0.50 0.26 3.32 -1.08 -0.81 -1.09 116.67 118.53 6chy s ASP 12 Ca 0.14 0.55 0.20 0.00 -0.52 0.00 0.00 52.55 52.91 6chy s ASP 12 Cb -0.16 0.41 0.08 0.00 -1.46 0.00 0.00 42.92 41.79 6chy s ASP 12 CO 0.13 -0.46 1.25 -0.78 0.52 0.00 0.00 175.17 175.83 6chy h ASP 13 N 2.76 0.00 -2.97 -0.34 3.58 -1.84 -3.38 116.42 114.24 6chy h ASP 13 Ca -0.22 0.00 -0.72 0.00 0.42 0.00 0.00 57.03 56.51 6chy h ASP 13 Cb 1.15 0.00 -0.21 0.00 1.72 0.00 0.00 39.33 41.99 6chy h ASP 13 CO 0.34 0.22 0.02 0.12 -2.88 0.00 0.00 179.24 177.06 6chy s PHE 14 N -3.15 3.09 0.43 0.28 5.36 -1.26 -4.93 117.98 117.80 6chy s PHE 14 Ca 0.02 -1.09 0.20 0.00 -0.96 0.00 0.00 56.93 55.10 6chy s PHE 14 Cb 0.08 -3.95 1.14 0.00 -0.34 0.00 0.00 43.02 39.95 6chy s PHE 14 CO 0.75 -1.21 1.83 0.66 -1.46 0.00 0.00 175.22 175.79 6chy h SER 15 N 9.06 0.37 0.16 6.13 4.64 -1.97 -1.61 113.55 130.33 6chy h SER 15 Ca -0.28 0.05 0.01 0.00 -0.47 0.00 0.00 61.79 61.10 6chy h SER 15 Cb 1.09 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 63.14 6chy h SER 15 CO 1.08 0.12 -0.25 0.74 -0.87 0.00 0.00 176.83 177.65 6chy h THR 16 N 0.36 0.46 -0.00 2.95 2.02 -1.97 -0.71 112.91 116.01 6chy h THR 16 Ca 0.51 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.65 6chy h THR 16 Cb 1.37 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 6chy h THR 16 CO -0.19 0.00 -0.19 -0.03 0.37 0.00 0.00 175.52 175.48 6chy h MET 17 N -0.48 0.01 0.00 6.66 -1.53 -1.75 -1.09 114.93 116.75 6chy h MET 17 Ca 0.02 -0.00 -0.10 0.00 -3.44 0.00 0.00 59.70 56.18 6chy h MET 17 Cb 0.48 -0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.51 6chy h MET 17 CO -0.11 0.19 -0.47 -0.09 0.14 0.00 0.00 176.91 176.58 6chy h ARG 18 N 0.01 0.00 -0.12 0.39 2.43 -0.80 -1.25 114.38 115.04 6chy h ARG 18 Ca -0.00 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 6chy h ARG 18 Cb 0.34 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.88 6chy h ARG 18 CO 0.02 0.47 -0.17 -0.09 -1.51 0.00 0.00 179.97 178.69 6chy h ARG 19 N 0.00 0.32 -0.29 0.20 2.43 0.07 -1.28 114.38 115.84 6chy h ARG 19 Ca -0.00 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 58.97 6chy h ARG 19 Cb 1.23 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 6chy h ARG 19 CO 0.06 0.76 0.17 0.82 -1.51 0.00 0.00 179.97 180.27 6chy h ILE 20 N -0.09 1.11 0.19 1.20 2.04 -1.20 -1.30 117.51 119.46 6chy h ILE 20 Ca 0.01 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 6chy h ILE 20 Cb 0.72 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 6chy h ILE 20 CO 0.04 0.11 -0.09 0.58 0.00 0.00 0.00 178.15 178.78 6chy h VAL 21 N 0.36 0.85 -0.78 1.67 2.07 -1.18 0.21 116.25 119.46 6chy h VAL 21 Ca 0.10 -0.19 0.14 0.00 0.82 0.00 0.00 66.70 67.57 6chy h VAL 21 Cb 0.02 0.97 -0.14 0.00 -1.52 0.00 0.00 31.29 30.62 6chy h VAL 21 CO -0.02 0.04 -0.31 -0.09 0.02 0.00 0.00 177.57 177.22 6chy h ARG 22 N -0.35 -0.06 -0.74 1.57 9.65 -1.08 -0.53 114.38 122.84 6chy h ARG 22 Ca -0.03 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.81 6chy h ARG 22 Cb 0.27 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.83 6chy h ARG 22 CO 0.04 -0.04 0.26 -0.91 2.80 0.00 0.00 179.97 182.13 6chy h ASN 23 N -0.07 1.05 -0.30 -3.80 -0.26 -1.07 -2.52 115.58 108.61 6chy h ASN 23 Ca 0.32 -0.19 0.02 0.00 -0.56 0.00 0.00 56.30 55.88 6chy h ASN 23 Cb 0.58 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.54 6chy h ASN 23 CO -0.82 0.96 0.16 -0.07 -1.06 0.00 0.00 177.43 176.60 6chy h LEU 24 N 1.08 0.24 -0.67 1.61 3.38 0.56 -0.03 115.31 121.48 6chy h LEU 24 Ca 0.24 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.27 6chy h LEU 24 Cb 0.26 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 6chy h LEU 24 CO -0.01 0.18 0.39 -0.07 0.09 0.00 0.00 178.44 179.02 6chy h LEU 25 N 0.33 0.60 0.79 1.67 3.38 -1.04 -2.95 115.31 118.09 6chy h LEU 25 Ca 0.12 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 6chy h LEU 25 Cb 0.03 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 6chy h LEU 25 CO -0.08 0.40 -0.47 0.50 0.09 0.00 0.00 178.44 178.88 6chy h LYS 26 N 0.73 -1.13 0.00 1.13 3.11 -1.17 0.28 116.57 119.52 6chy h LYS 26 Ca 0.29 0.08 0.00 0.00 -2.81 0.00 0.00 60.65 58.21 6chy h LYS 26 Cb 0.13 0.26 0.00 0.00 -1.00 0.00 0.00 32.23 31.62 6chy h LYS 26 CO -0.16 -0.75 0.00 -0.85 -2.81 0.00 0.00 179.45 174.88 6chy n GLU 27 N -5.41 0.00 0.00 1.90 0.28 -0.05 0.70 120.64 118.05 6chy n GLU 27 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.86 6chy n GLU 27 Cb 0.48 -1.03 0.00 0.00 1.43 0.00 0.00 31.44 32.32 6chy n GLU 27 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 6chy n LEU 28 N -0.50 1.19 0.00 -1.84 4.77 -0.64 -4.99 117.00 114.99 6chy n LEU 28 Ca 0.00 -1.19 0.00 0.00 -0.03 0.00 0.00 56.01 54.79 6chy n LEU 28 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 6chy n LEU 28 CO 0.00 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 6chy n GLY 29 N -0.24 0.57 3.28 -0.72 0.00 0.22 -5.06 105.19 103.23 6chy n GLY 29 Ca 0.00 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 6chy n GLY 29 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 6chy s PHE 30 N -2.00 3.34 -0.33 1.61 0.08 0.91 -4.82 117.98 116.77 6chy s PHE 30 Ca 0.00 -1.49 0.11 0.00 0.12 0.00 0.00 56.93 55.68 6chy s PHE 30 Cb 0.00 -3.11 0.46 0.00 -0.57 0.00 0.00 43.02 39.80 6chy s PHE 30 CO 0.00 -0.87 1.12 0.09 -0.10 0.00 0.00 175.22 175.46 6chy n ASN 31 N 4.97 3.71 -3.21 1.36 3.02 -1.25 -2.97 115.26 120.89 6chy n ASN 31 Ca -0.10 -3.24 -0.24 0.00 -0.03 0.00 0.00 54.58 50.96 6chy n ASN 31 Cb 0.43 -0.43 -0.07 0.00 -0.61 0.00 0.00 39.78 39.10 6chy n ASN 31 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 6chy n ASN 32 N -0.54 0.23 -4.27 6.41 5.15 -1.26 -5.07 115.26 115.90 6chy n ASN 32 Ca 0.30 -2.69 -0.21 0.00 -0.60 0.00 0.00 54.58 51.38 6chy n ASN 32 Cb 0.83 -0.63 -0.12 0.00 -0.53 0.00 0.00 39.78 39.33 6chy n ASN 32 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 6chy s VAL 33 N -1.13 1.57 0.19 3.44 1.01 -1.26 -0.11 120.40 124.11 6chy s VAL 33 Ca 0.35 -1.64 -0.06 0.00 0.00 0.00 0.00 61.98 60.63 6chy s VAL 33 Cb 0.16 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 6chy s VAL 33 CO -0.11 -0.22 0.25 -0.70 0.00 0.00 0.00 175.10 174.32 6chy s GLU 34 N -2.26 1.24 0.11 2.72 -6.30 -0.51 -4.92 118.70 108.77 6chy s GLU 34 Ca 0.08 -1.38 0.06 0.00 -2.50 0.00 0.00 54.97 51.23 6chy s GLU 34 Cb -0.08 0.35 -0.04 0.00 0.00 0.00 0.00 34.13 34.36 6chy s GLU 34 CO 0.04 -0.45 -0.14 -1.21 0.02 0.00 0.00 175.26 173.52 6chy s GLU 35 N -4.05 0.97 0.00 4.30 2.02 -1.26 -1.12 118.70 119.55 6chy s GLU 35 Ca 0.27 -1.15 0.00 0.00 0.02 0.00 0.00 54.97 54.10 6chy s GLU 35 Cb 0.04 -0.90 -0.00 0.00 0.10 0.00 0.00 34.13 33.37 6chy s GLU 35 CO 0.06 0.18 -0.00 0.00 0.02 0.00 0.00 175.26 175.52 6chy s ALA 36 N -1.86 0.02 -0.83 5.21 0.00 -1.09 -4.95 121.76 118.26 6chy s ALA 36 Ca 0.06 -0.06 0.23 0.00 0.00 0.00 0.00 51.96 52.19 6chy s ALA 36 Cb -0.06 0.01 0.17 0.00 0.00 0.00 0.00 23.12 23.24 6chy s ALA 36 CO 0.03 -0.01 1.16 0.39 0.00 0.00 0.00 175.76 177.32 6chy n GLU 37 N 2.93 0.13 -3.83 0.00 1.02 -1.26 -1.93 120.64 117.69 6chy n GLU 37 Ca -0.13 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 56.98 6chy n GLU 37 Cb 0.59 -1.55 0.01 0.00 -0.02 0.00 0.00 31.44 30.48 6chy n GLU 37 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 6chy s ASP 38 N -3.43 -0.05 0.32 1.62 1.47 -1.26 -3.38 116.67 111.96 6chy s ASP 38 Ca 0.07 -0.59 0.01 0.00 1.18 0.00 0.00 52.55 53.22 6chy s ASP 38 Cb 0.16 0.49 0.53 0.00 -0.34 0.00 0.00 42.92 43.76 6chy s ASP 38 CO 0.77 -0.96 1.91 1.23 0.68 0.00 0.00 175.17 178.80 6chy h GLY 39 N 2.00 0.84 0.94 2.12 0.00 -1.06 -1.15 103.07 106.77 6chy h GLY 39 Ca -0.27 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 46.65 6chy h GLY 39 CO 0.33 0.39 0.06 -2.08 0.00 0.00 0.00 176.54 175.23 6chy h VAL 40 N 0.78 1.08 -0.37 4.60 2.07 -1.87 0.50 116.25 123.04 6chy h VAL 40 Ca 0.19 -0.22 -0.09 0.00 0.82 0.00 0.00 66.70 67.40 6chy h VAL 40 Cb 0.14 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 6chy h VAL 40 CO -0.02 0.07 -0.15 -0.78 0.02 0.00 0.00 177.57 176.71 6chy h ASP 41 N 0.07 0.67 0.45 0.57 3.58 -1.93 -2.18 116.42 117.67 6chy h ASP 41 Ca 0.04 -0.21 -0.02 0.00 0.42 0.00 0.00 57.03 57.26 6chy h ASP 41 Cb 0.06 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 6chy h ASP 41 CO -0.01 0.84 -0.32 0.00 -2.88 0.00 0.00 179.24 176.87 6chy h ALA 42 N 1.22 -1.10 -0.77 -0.78 0.00 -0.79 -1.26 119.26 115.78 6chy h ALA 42 Ca 0.10 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.03 6chy h ALA 42 Cb 0.60 0.48 -0.14 0.00 0.00 0.00 0.00 17.79 18.73 6chy h ALA 42 CO 0.04 -1.09 -0.08 -0.07 0.00 0.00 0.00 179.25 178.05 6chy h LEU 43 N -0.74 -0.52 -0.51 0.00 3.38 -0.73 0.77 115.31 116.96 6chy h LEU 43 Ca -0.06 0.22 0.10 0.00 0.09 0.00 0.00 57.88 58.23 6chy h LEU 43 Cb 0.61 0.41 -0.09 0.00 0.09 0.00 0.00 40.66 41.68 6chy h LEU 43 CO 0.03 -0.22 -0.01 0.78 0.09 0.00 0.00 178.44 179.10 6chy h ASN 44 N 0.05 -0.25 0.04 -0.43 2.35 -1.11 -1.47 115.58 114.76 6chy h ASN 44 Ca 0.40 0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 56.28 6chy h ASN 44 Cb 0.68 0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.28 6chy h ASN 44 CO -0.74 -0.09 -0.02 0.11 -1.65 0.00 0.00 177.43 175.05 6chy h LYS 45 N 0.10 -0.05 -0.69 0.81 1.57 0.32 -3.26 116.57 115.37 6chy h LYS 45 Ca 0.26 0.00 0.14 0.00 -1.87 0.00 0.00 60.65 59.18 6chy h LYS 45 Cb 0.39 0.01 -0.10 0.00 0.08 0.00 0.00 32.23 32.61 6chy h LYS 45 CO -0.44 0.30 0.14 -0.07 -0.57 0.00 0.00 179.45 178.82 6chy h LEU 46 N -0.42 -0.02 -1.64 2.94 3.38 -1.00 -1.90 115.31 116.63 6chy h LEU 46 Ca -0.01 0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.22 6chy h LEU 46 Cb 0.39 0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 6chy h LEU 46 CO 0.01 -0.03 0.43 1.56 0.09 0.00 0.00 178.44 180.50 6chy h GLN 47 N 0.25 0.38 -0.75 1.13 4.20 -1.31 -0.81 115.11 118.20 6chy h GLN 47 Ca 0.38 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 59.02 6chy h GLN 47 Cb 0.62 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.28 6chy h GLN 47 CO -0.48 0.25 0.30 0.00 -0.67 0.00 0.00 178.83 178.22 6chy h ALA 48 N 1.68 1.11 0.00 3.87 0.00 -1.41 -3.48 119.26 121.03 6chy h ALA 48 Ca 0.30 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.02 6chy h ALA 48 Cb 0.66 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.15 6chy h ALA 48 CO -0.08 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.21 6chy n GLY 49 N -0.92 1.61 3.04 0.00 0.00 -0.31 -5.06 105.19 103.55 6chy n GLY 49 Ca 0.07 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.93 6chy n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 6chy n GLY 50 N -0.18 1.77 3.79 -0.02 0.00 -1.26 -4.91 105.19 104.38 6chy n GLY 50 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 6chy n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 6chy s TYR 51 N -3.51 2.92 0.00 1.61 2.02 -1.26 -4.35 117.35 114.77 6chy s TYR 51 Ca 0.00 1.54 0.00 0.00 -0.37 0.00 0.00 57.07 58.24 6chy s TYR 51 Cb 0.00 -3.07 0.00 0.00 -0.40 0.00 0.00 41.96 38.49 6chy s TYR 51 CO 0.00 -1.15 0.02 0.41 -1.57 0.00 0.00 175.55 173.25 6chy n GLY 52 N -0.61 0.91 3.58 0.71 0.00 0.66 -4.87 105.19 105.57 6chy n GLY 52 Ca 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 6chy n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 6chy s PHE 53 N -0.15 -0.79 -0.10 1.61 2.19 -1.06 -4.33 117.98 115.35 6chy s PHE 53 Ca 0.00 1.85 0.04 0.00 0.33 0.00 0.00 56.93 59.14 6chy s PHE 53 Cb 0.00 0.32 0.00 0.00 -1.31 0.00 0.00 43.02 42.03 6chy s PHE 53 CO 0.00 -0.39 -0.23 0.08 1.83 0.00 0.00 175.22 176.52 6chy s VAL 54 N 0.61 1.97 -0.30 3.12 1.01 -0.07 -1.13 120.40 125.60 6chy s VAL 54 Ca -0.02 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.03 6chy s VAL 54 Cb -0.05 -1.72 0.08 0.00 0.00 0.00 0.00 36.38 34.69 6chy s VAL 54 CO -0.03 0.54 -0.02 -0.63 0.00 0.00 0.00 175.10 174.96 6chy s ILE 55 N 0.46 2.29 -0.07 2.22 1.01 -0.41 -1.08 121.20 125.62 6chy s ILE 55 Ca -0.16 -1.98 0.04 0.00 0.00 0.00 0.00 60.65 58.54 6chy s ILE 55 Cb -0.17 -2.52 -0.02 0.00 0.01 0.00 0.00 42.46 39.76 6chy s ILE 55 CO 0.07 -0.32 -0.18 -0.55 0.00 0.00 0.00 174.94 173.95 6chy s SER 56 N 1.03 3.65 0.79 3.58 0.15 -0.72 -1.07 113.70 121.11 6chy s SER 56 Ca 0.01 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.32 6chy s SER 56 Cb -0.20 -0.97 0.00 0.00 -1.71 0.00 0.00 66.02 63.14 6chy s SER 56 CO -0.06 0.27 0.00 -0.67 1.20 0.00 0.00 173.24 173.98 6chy n ASP 57 N 2.78 -0.55 -0.06 5.45 -0.08 -0.25 -1.32 116.55 122.52 6chy n ASP 57 Ca -0.17 -0.51 -0.10 0.00 -1.51 0.00 0.00 54.79 52.49 6chy n ASP 57 Cb 0.52 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.95 6chy n ASP 57 CO 0.00 0.00 0.00 1.87 0.12 0.00 0.00 177.20 179.19 6chy n TRP 58 N -1.93 0.00 -2.87 -0.67 -0.00 -1.20 -4.09 117.44 106.67 6chy n TRP 58 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.50 57.07 6chy n TRP 58 Cb 0.00 -0.43 -0.03 0.00 -0.00 0.00 0.00 31.31 30.85 6chy n TRP 58 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 6chy s ASN 59 N -6.17 6.51 0.04 5.87 0.01 -1.26 -1.54 114.94 118.40 6chy s ASN 59 Ca -0.21 -1.75 0.06 0.00 -0.71 0.00 0.00 52.86 50.25 6chy s ASN 59 Cb 0.05 -2.42 -0.02 0.00 0.41 0.00 0.00 41.25 39.27 6chy s ASN 59 CO 0.29 -1.19 -0.16 -0.04 -1.51 0.00 0.00 177.10 174.48 6chy s MET 60 N 3.23 1.07 0.81 -0.60 -1.94 -1.26 -4.71 119.30 115.90 6chy s MET 60 Ca 0.32 -0.83 -0.11 0.00 -1.71 0.00 0.00 55.69 53.35 6chy s MET 60 Cb -0.07 -1.12 0.08 0.00 2.01 0.00 0.00 34.83 35.73 6chy s MET 60 CO -0.05 0.28 1.10 -1.25 -0.01 0.00 0.00 175.02 175.08 6chy s PRO 61 N -1.21 1.97 0.00 2.03 0.04 -1.26 -3.23 135.00 133.35 6chy s PRO 61 Ca 0.03 0.68 0.00 0.00 0.04 0.00 0.00 61.00 61.75 6chy s PRO 61 Cb -0.08 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.56 6chy s PRO 61 CO 0.02 -1.71 0.00 0.09 0.04 0.00 0.00 177.00 175.44 6chy n ASN 62 N -3.50 0.00 -3.51 6.66 3.02 -1.26 -4.39 115.26 112.27 6chy n ASN 62 Ca 0.07 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.56 6chy n ASN 62 Cb 0.56 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.66 6chy n ASN 62 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 6chy s MET 63 N 0.00 0.39 0.80 3.52 1.75 -1.26 -4.95 119.30 119.55 6chy s MET 63 Ca 0.00 0.95 -0.08 0.00 -1.25 0.00 0.00 55.69 55.31 6chy s MET 63 Cb 0.00 0.20 0.13 0.00 2.84 0.00 0.00 34.83 38.01 6chy s MET 63 CO 0.00 -0.40 1.12 0.16 -0.65 0.00 0.00 175.02 175.25 6chy s ASP 64 N 2.66 4.04 0.11 1.11 1.47 -1.20 -0.55 116.67 124.31 6chy s ASP 64 Ca 0.04 0.10 -0.30 0.00 1.18 0.00 0.00 52.55 53.57 6chy s ASP 64 Cb -0.13 -0.44 -0.10 0.00 -0.34 0.00 0.00 42.92 41.91 6chy s ASP 64 CO -0.15 -2.10 1.59 1.23 0.68 0.00 0.00 175.17 176.42 6chy h GLY 65 N -0.95 -0.79 1.16 2.12 0.00 -1.43 -1.06 103.07 102.12 6chy h GLY 65 Ca -0.42 0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.28 6chy h GLY 65 CO 0.45 -0.27 -0.08 -2.00 0.00 0.00 0.00 176.54 174.65 6chy h LEU 66 N -0.63 0.98 0.43 3.11 5.85 -1.84 -1.39 115.31 121.81 6chy h LEU 66 Ca 0.02 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 6chy h LEU 66 Cb 0.66 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.43 6chy h LEU 66 CO -0.23 1.08 -0.21 -0.33 -0.34 0.00 0.00 178.44 178.41 6chy h GLU 67 N 0.89 -0.56 -0.60 1.25 4.39 -1.94 -0.60 114.58 117.41 6chy h GLU 67 Ca 0.15 0.04 0.09 0.00 0.34 0.00 0.00 59.36 59.97 6chy h GLU 67 Cb 0.62 0.13 -0.11 0.00 -0.10 0.00 0.00 28.75 29.30 6chy h GLU 67 CO 0.04 -0.27 -0.45 1.25 -1.16 0.00 0.00 179.01 178.42 6chy h LEU 68 N -0.81 -1.57 -0.43 1.33 5.85 -1.04 0.15 115.31 118.78 6chy h LEU 68 Ca -0.06 0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.99 6chy h LEU 68 Cb 0.55 0.71 -0.09 0.00 0.37 0.00 0.00 40.66 42.19 6chy h LEU 68 CO 0.10 -0.34 -0.36 0.25 -0.34 0.00 0.00 178.44 177.75 6chy h LEU 69 N -0.22 -1.21 -1.43 2.25 5.85 -1.19 -1.79 115.31 117.56 6chy h LEU 69 Ca 0.17 0.21 0.08 0.00 0.84 0.00 0.00 57.88 59.18 6chy h LEU 69 Cb 0.56 0.56 -0.05 0.00 0.37 0.00 0.00 40.66 42.10 6chy h LEU 69 CO -0.70 -0.33 0.47 0.11 -0.34 0.00 0.00 178.44 177.64 6chy h LYS 70 N -0.26 0.65 0.00 1.25 1.57 0.86 -1.78 116.57 118.86 6chy h LYS 70 Ca 0.17 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.79 6chy h LYS 70 Cb 0.56 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 6chy h LYS 70 CO -0.57 0.43 -0.69 0.00 -0.57 0.00 0.00 179.45 178.05 6chy h THR 71 N 0.67 0.80 -0.13 -0.16 1.03 -0.57 -1.47 112.91 113.09 6chy h THR 71 Ca 0.32 -2.18 -0.20 0.00 -0.01 0.00 0.00 66.41 64.34 6chy h THR 71 Cb 0.36 2.35 0.00 0.00 -1.07 0.00 0.00 68.15 69.78 6chy h THR 71 CO -0.11 0.45 -0.73 0.40 -0.01 0.00 0.00 175.52 175.53 6chy h ILE 72 N 0.00 1.33 -0.48 0.00 2.04 -0.77 -2.54 117.51 117.09 6chy h ILE 72 Ca -0.03 -2.02 -0.11 0.00 1.00 0.00 0.00 64.86 63.70 6chy h ILE 72 Cb 1.42 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 39.49 6chy h ILE 72 CO 0.06 0.63 -0.12 0.03 0.00 0.00 0.00 178.15 178.75 6chy h ARG 73 N 0.42 0.92 0.00 2.37 2.47 -1.31 -2.77 114.38 116.48 6chy h ARG 73 Ca -0.03 -0.35 0.00 0.00 -1.26 0.00 0.00 59.98 58.33 6chy h ARG 73 Cb 1.32 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 6chy h ARG 73 CO 0.14 1.01 -0.12 0.00 0.56 0.00 0.00 179.97 181.56 6chy n ALA 74 N -2.48 2.44 -2.63 0.04 0.00 -0.56 -4.65 120.51 112.68 6chy n ALA 74 Ca 0.00 -0.08 -0.43 0.00 0.00 0.00 0.00 53.44 52.93 6chy n ALA 74 Cb 0.39 -1.41 -0.05 0.00 0.00 0.00 0.00 19.45 18.38 6chy n ALA 74 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 6chy s ASP 75 N -4.15 6.35 0.58 0.00 -1.08 -0.96 -4.96 116.67 112.46 6chy s ASP 75 Ca 0.11 -0.33 0.28 0.00 -0.52 0.00 0.00 52.55 52.09 6chy s ASP 75 Cb 0.14 -2.40 1.51 0.00 -1.46 0.00 0.00 42.92 40.71 6chy s ASP 75 CO 0.61 -1.06 1.95 1.23 0.52 0.00 0.00 175.17 178.42 6chy h GLY 76 N 10.48 0.00 0.67 2.66 0.00 -1.84 0.58 103.07 115.62 6chy h GLY 76 Ca -0.26 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.91 6chy h GLY 76 CO 1.02 0.00 -0.69 0.00 0.00 0.00 0.00 176.54 176.88 6chy h ALA 77 N 1.55 -0.03 -0.01 3.60 0.00 -1.93 -3.37 119.26 119.07 6chy h ALA 77 Ca 0.20 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.47 6chy h ALA 77 Cb 1.03 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.89 6chy h ALA 77 CO -0.00 0.34 -0.62 -1.33 0.00 0.00 0.00 179.25 177.63 6chy n MET 78 N -4.19 0.67 -0.51 0.00 2.81 -1.04 -4.82 117.12 110.03 6chy n MET 78 Ca -0.12 -0.53 0.41 0.00 -1.81 0.00 0.00 57.70 55.65 6chy n MET 78 Cb 0.75 -1.49 0.66 0.00 -0.71 0.00 0.00 33.22 32.43 6chy n MET 78 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 6chy n SER 79 N -0.70 0.11 -1.06 7.83 3.41 0.20 -2.11 113.62 121.30 6chy n SER 79 Ca 0.08 1.09 0.08 0.00 -0.26 0.00 0.00 58.87 59.86 6chy n SER 79 Cb 0.40 -0.54 0.27 0.00 -0.26 0.00 0.00 64.21 64.08 6chy n SER 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 6chy n ALA 80 N -2.66 2.96 -2.38 7.33 0.00 -1.26 -4.60 120.51 119.90 6chy n ALA 80 Ca 0.38 -1.94 -0.42 0.00 0.00 0.00 0.00 53.44 51.45 6chy n ALA 80 Cb 1.58 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 20.25 6chy n ALA 80 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 6chy s LEU 81 N -2.33 4.28 0.21 0.00 2.96 -0.90 -5.00 118.68 117.90 6chy s LEU 81 Ca 0.41 1.89 -0.30 0.00 -0.22 0.00 0.00 54.13 55.91 6chy s LEU 81 Cb 0.31 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 43.35 6chy s LEU 81 CO 0.13 -0.65 1.36 -2.84 -1.32 0.00 0.00 176.35 173.04 6chy s PRO 82 N 2.45 4.34 -0.14 0.98 0.02 -1.26 -4.90 135.00 136.49 6chy s PRO 82 Ca 0.58 2.15 -0.01 0.00 0.02 0.00 0.00 61.00 63.74 6chy s PRO 82 Cb -0.26 -3.17 0.04 0.00 0.02 0.00 0.00 34.50 31.13 6chy s PRO 82 CO 0.23 -0.33 -0.01 0.08 -0.33 0.00 0.00 177.00 176.64 6chy s VAL 83 N 0.15 0.69 -0.22 3.83 1.01 -1.26 -0.89 120.40 123.70 6chy s VAL 83 Ca 0.58 -0.33 -0.10 0.00 0.00 0.00 0.00 61.98 62.13 6chy s VAL 83 Cb -0.39 -0.94 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 6chy s VAL 83 CO 0.39 0.09 0.13 -0.22 0.00 0.00 0.00 175.10 175.49 6chy s LEU 84 N 1.82 4.05 -0.13 3.92 2.96 -0.24 -0.42 118.68 130.64 6chy s LEU 84 Ca 0.02 0.12 -0.04 0.00 -0.22 0.00 0.00 54.13 54.01 6chy s LEU 84 Cb -0.15 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.44 6chy s LEU 84 CO -0.07 0.10 0.01 -0.04 -1.32 0.00 0.00 176.35 175.04 6chy s MET 85 N 0.81 3.46 -0.45 1.98 -1.94 -0.75 -1.75 119.30 120.67 6chy s MET 85 Ca 0.07 -0.41 -0.20 0.00 -1.71 0.00 0.00 55.69 53.44 6chy s MET 85 Cb -0.13 -2.96 0.03 0.00 2.01 0.00 0.00 34.83 33.79 6chy s MET 85 CO 0.02 0.46 0.61 0.08 -0.01 0.00 0.00 175.02 176.18 6chy s VAL 86 N -0.20 4.87 -0.09 -6.03 1.01 -0.43 -1.37 120.40 118.16 6chy s VAL 86 Ca 0.06 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 61.96 6chy s VAL 86 Cb -0.12 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.03 6chy s VAL 86 CO 0.02 -0.63 -0.19 0.27 0.00 0.00 0.00 175.10 174.57 6chy s ILE 87 N 2.68 2.61 0.00 2.22 -4.36 -0.04 -3.24 121.20 121.08 6chy s ILE 87 Ca 0.19 -0.85 -0.02 0.00 -0.26 0.00 0.00 60.65 59.72 6chy s ILE 87 Cb -0.16 -2.03 -0.01 0.00 1.25 0.00 0.00 42.46 41.52 6chy s ILE 87 CO 0.16 0.56 1.03 0.00 0.24 0.00 0.00 174.94 176.92 6chy h ALA 88 N 6.25 -0.54 -4.12 2.27 0.00 -1.83 -0.24 119.26 121.04 6chy h ALA 88 Ca -0.30 -0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.08 6chy h ALA 88 Cb 1.20 0.50 -0.30 0.00 0.00 0.00 0.00 17.79 19.18 6chy h ALA 88 CO 0.51 -0.55 -0.83 -2.00 0.00 0.00 0.00 179.25 176.38 6chy s GLU 89 N -3.12 1.42 0.00 0.00 2.12 -1.26 -4.10 118.70 113.75 6chy s GLU 89 Ca -0.01 -0.56 0.00 0.00 0.36 0.00 0.00 54.97 54.76 6chy s GLU 89 Cb 0.00 -1.32 0.00 0.00 0.26 0.00 0.00 34.13 33.07 6chy s GLU 89 CO 0.03 0.30 0.29 0.00 -0.54 0.00 0.00 175.26 175.34 6chy n ALA 90 N 2.88 0.84 -2.03 6.30 0.00 -1.26 -4.69 120.51 122.54 6chy n ALA 90 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 6chy n ALA 90 Cb 0.54 -1.66 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 6chy n ALA 90 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 6chy s LYS 91 N 2.10 3.19 0.30 0.00 -0.14 -1.26 -4.80 119.74 119.14 6chy s LYS 91 Ca 0.00 1.22 0.03 0.00 -1.36 0.00 0.00 55.97 55.86 6chy s LYS 91 Cb 0.00 -4.23 0.78 0.00 -1.68 0.00 0.00 37.83 32.70 6chy s LYS 91 CO 0.00 -2.04 1.60 0.87 -0.76 0.00 0.00 175.35 175.02 6chy h LYS 92 N 13.22 0.07 -1.00 1.68 1.57 -2.00 -1.96 116.57 128.15 6chy h LYS 92 Ca -0.31 -0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.66 6chy h LYS 92 Cb 1.16 -0.02 -0.11 0.00 0.08 0.00 0.00 32.23 33.35 6chy h LYS 92 CO 1.08 0.05 0.61 0.93 -0.57 0.00 0.00 179.45 181.54 6chy h GLU 93 N 0.07 0.73 0.01 3.15 3.07 -1.96 0.67 114.58 120.33 6chy h GLU 93 Ca 0.60 -0.04 -0.26 0.00 -0.50 0.00 0.00 59.36 59.15 6chy h GLU 93 Cb 1.27 -0.17 -0.04 0.00 -0.84 0.00 0.00 28.75 28.98 6chy h GLU 93 CO -0.81 0.49 -1.43 -0.91 -1.40 0.00 0.00 179.01 174.95 6chy h ASN 94 N 0.76 0.03 -0.02 1.42 2.35 -1.75 -2.38 115.58 115.98 6chy h ASN 94 Ca 0.58 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 56.29 6chy h ASN 94 Cb 0.91 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 39.27 6chy h ASN 94 CO -0.39 1.04 0.01 0.40 -1.65 0.00 0.00 177.43 176.84 6chy h ILE 95 N 0.00 1.19 -0.50 2.81 2.04 -0.78 -0.94 117.51 121.34 6chy h ILE 95 Ca -0.18 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.16 6chy h ILE 95 Cb 1.92 1.52 -0.04 0.00 -0.74 0.00 0.00 36.82 39.48 6chy h ILE 95 CO 0.10 0.15 0.26 0.40 0.00 0.00 0.00 178.15 179.06 6chy h ILE 96 N -0.19 0.98 -0.46 -0.67 2.04 -0.96 -1.11 117.51 117.15 6chy h ILE 96 Ca 0.01 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.70 6chy h ILE 96 Cb 0.24 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 6chy h ILE 96 CO 0.00 0.09 0.30 0.00 0.00 0.00 0.00 178.15 178.54 6chy h ALA 97 N 1.26 0.58 -0.43 1.87 0.00 -1.33 -0.43 119.26 120.78 6chy h ALA 97 Ca 0.21 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 6chy h ALA 97 Cb 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 6chy h ALA 97 CO -0.14 0.02 0.01 0.00 0.00 0.00 0.00 179.25 179.14 6chy h ALA 98 N 1.17 0.57 -0.01 0.00 0.00 -0.62 -0.02 119.26 120.34 6chy h ALA 98 Ca 0.17 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 6chy h ALA 98 Cb -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 6chy h ALA 98 CO -0.04 0.34 -0.65 0.00 0.00 0.00 0.00 179.25 178.90 6chy h ALA 99 N 0.91 0.90 -0.35 0.00 0.00 -1.22 0.44 119.26 119.93 6chy h ALA 99 Ca 0.12 -0.58 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 6chy h ALA 99 Cb 0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 6chy h ALA 99 CO 0.02 0.80 -0.19 0.37 0.00 0.00 0.00 179.25 180.25 6chy h GLN 100 N 0.04 0.65 -0.54 0.00 -0.00 -0.86 -2.99 115.11 111.41 6chy h GLN 100 Ca -0.01 -0.23 0.00 0.00 -0.00 0.00 0.00 58.65 58.41 6chy h GLN 100 Cb 1.15 -0.04 0.00 0.00 0.00 0.00 0.00 27.48 28.59 6chy h GLN 100 CO 0.09 0.80 0.00 0.00 0.00 0.00 0.00 178.83 179.72 6chy n ALA 101 N -2.49 2.45 -0.18 3.38 0.00 -0.04 -4.97 120.51 118.67 6chy n ALA 101 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.50 6chy n ALA 101 Cb 0.39 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.88 6chy n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 6chy n GLY 102 N 1.31 0.72 3.69 0.00 0.00 -1.07 -4.43 105.19 105.41 6chy n GLY 102 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 6chy n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 6chy s ALA 103 N -2.21 3.73 0.66 4.61 0.00 0.12 -4.86 121.76 123.80 6chy s ALA 103 Ca 0.00 1.37 0.33 0.00 0.00 0.00 0.00 51.96 53.66 6chy s ALA 103 Cb 0.00 -3.75 1.81 0.00 0.00 0.00 0.00 23.12 21.17 6chy s ALA 103 CO 0.00 -1.22 2.04 0.77 0.00 0.00 0.00 175.76 177.34 6chy h SER 104 N 8.70 0.00 0.00 0.00 0.02 -1.06 -3.43 113.55 117.78 6chy h SER 104 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 6chy h SER 104 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 6chy h SER 104 CO 0.94 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 177.24 6chy n GLY 105 N -1.22 -0.41 3.13 -3.77 0.00 -1.19 -4.89 105.19 96.84 6chy n GLY 105 Ca -0.01 -1.16 -0.08 0.00 0.00 0.00 0.00 46.02 44.77 6chy n GLY 105 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 6chy s TRP 106 N -2.00 0.30 0.00 1.61 -2.14 -1.26 -1.80 118.94 113.65 6chy s TRP 106 Ca 0.00 -0.72 0.01 0.00 2.66 0.00 0.00 56.10 58.04 6chy s TRP 106 Cb 0.00 -0.21 -0.00 0.00 -3.10 0.00 0.00 33.47 30.16 6chy s TRP 106 CO 0.00 -0.41 -0.02 0.54 -2.66 0.00 0.00 176.95 174.39 6chy s VAL 107 N -3.37 0.17 -0.27 -0.66 0.11 -0.47 -4.92 120.40 111.00 6chy s VAL 107 Ca 0.02 -0.24 -0.17 0.00 -2.93 0.00 0.00 61.98 58.66 6chy s VAL 107 Cb 0.03 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.67 6chy s VAL 107 CO -0.08 -0.04 0.46 -0.69 -3.33 0.00 0.00 175.10 171.42 6chy s VAL 108 N -0.28 5.10 0.22 2.04 1.01 -1.25 -0.86 120.40 126.38 6chy s VAL 108 Ca -0.02 0.73 -0.13 0.00 0.00 0.00 0.00 61.98 62.56 6chy s VAL 108 Cb -0.02 -3.79 -0.08 0.00 0.00 0.00 0.00 36.38 32.49 6chy s VAL 108 CO -0.00 0.09 0.60 -1.59 0.00 0.00 0.00 175.10 174.20 6chy s LYS 109 N 2.23 3.94 0.37 2.72 -2.85 -0.10 -3.88 119.74 122.17 6chy s LYS 109 Ca 0.19 0.48 -0.26 0.00 -1.00 0.00 0.00 55.97 55.38 6chy s LYS 109 Cb -0.16 -2.72 -0.09 0.00 -2.06 0.00 0.00 37.83 32.80 6chy s LYS 109 CO 0.10 0.35 1.12 -1.25 0.10 0.00 0.00 175.35 175.77 6chy s PRO 110 N -2.48 4.21 0.06 1.78 0.04 -1.26 -4.63 135.00 132.71 6chy s PRO 110 Ca 0.45 1.74 0.04 0.00 0.04 0.00 0.00 61.00 63.27 6chy s PRO 110 Cb -0.13 -2.75 -0.03 0.00 0.04 0.00 0.00 34.50 31.64 6chy s PRO 110 CO 0.20 -0.16 -0.11 -0.59 0.04 0.00 0.00 177.00 176.38 6chy s PHE 111 N -1.43 0.94 0.72 0.56 -0.12 -1.25 -5.15 117.98 112.24 6chy s PHE 111 Ca 0.55 -0.51 -0.02 0.00 -0.05 0.00 0.00 56.93 56.89 6chy s PHE 111 Cb -0.29 -0.54 0.15 0.00 -0.63 0.00 0.00 43.02 41.71 6chy s PHE 111 CO 0.36 -0.02 0.98 0.25 -0.05 0.00 0.00 175.22 176.74 6chy n THR 112 N 1.25 0.00 0.16 -4.49 -2.24 -1.26 -4.97 114.28 102.73 6chy n THR 112 Ca -0.21 -1.42 0.02 0.00 -2.27 0.00 0.00 64.05 60.17 6chy n THR 112 Cb 0.55 -0.99 0.21 0.00 -2.10 0.00 0.00 70.33 67.99 6chy n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 6chy h ALA 113 N -0.75 0.88 0.20 6.98 0.00 -1.98 -2.82 119.26 121.77 6chy h ALA 113 Ca -0.32 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.11 6chy h ALA 113 Cb 1.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.86 6chy h ALA 113 CO 0.33 0.64 -0.10 0.00 0.00 0.00 0.00 179.25 180.12 6chy h ALA 114 N 1.49 -0.27 -0.48 0.00 0.00 -1.96 -0.61 119.26 117.42 6chy h ALA 114 Ca -0.01 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.73 6chy h ALA 114 Cb 1.10 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 6chy h ALA 114 CO 0.07 -0.33 0.28 1.79 0.00 0.00 0.00 179.25 181.05 6chy h THR 115 N -0.92 1.03 0.11 0.00 1.35 -1.96 -1.38 112.91 111.15 6chy h THR 115 Ca -0.03 -0.19 0.02 0.00 -0.55 0.00 0.00 66.41 65.66 6chy h THR 115 Cb 0.49 0.43 -0.03 0.00 -1.73 0.00 0.00 68.15 67.31 6chy h THR 115 CO 0.05 0.10 -0.24 0.25 -0.25 0.00 0.00 175.52 175.42 6chy h LEU 116 N 0.56 -0.69 -1.73 3.87 5.85 -1.57 -0.14 115.31 121.46 6chy h LEU 116 Ca 0.20 0.08 0.13 0.00 0.84 0.00 0.00 57.88 59.13 6chy h LEU 116 Cb 0.03 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 6chy h LEU 116 CO -0.10 -0.33 0.42 -0.08 -0.34 0.00 0.00 178.44 178.01 6chy h GLU 117 N -0.44 0.28 0.00 1.25 4.81 -0.39 0.13 114.58 120.21 6chy h GLU 117 Ca 0.03 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 6chy h GLU 117 Cb 0.47 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 6chy h GLU 117 CO -0.14 0.19 -0.79 0.93 -0.73 0.00 0.00 179.01 178.46 6chy h GLU 118 N 0.29 0.00 -0.08 1.92 5.08 -0.79 -1.63 114.58 119.36 6chy h GLU 118 Ca 0.30 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.54 6chy h GLU 118 Cb 0.77 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.03 6chy h GLU 118 CO -0.07 0.12 -0.41 0.87 -1.00 0.00 0.00 179.01 178.52 6chy h LYS 119 N 0.00 0.43 0.47 2.33 1.79 0.23 -1.15 116.57 120.67 6chy h LYS 119 Ca -0.03 -0.35 -0.02 0.00 -2.18 0.00 0.00 60.65 58.07 6chy h LYS 119 Cb 1.17 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 6chy h LYS 119 CO 0.02 0.98 -0.22 -0.07 -1.08 0.00 0.00 179.45 179.08 6chy h LEU 120 N -0.03 -0.53 -0.93 2.94 3.38 -1.10 -1.54 115.31 117.49 6chy h LEU 120 Ca -0.03 0.02 0.27 0.00 0.09 0.00 0.00 57.88 58.23 6chy h LEU 120 Cb 1.06 0.14 -0.14 0.00 0.09 0.00 0.00 40.66 41.81 6chy h LEU 120 CO 0.09 -0.26 0.37 0.78 0.09 0.00 0.00 178.44 179.51 6chy h ASN 121 N -0.88 0.20 1.64 -0.43 2.35 -1.38 1.08 115.58 118.17 6chy h ASN 121 Ca -0.06 0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 6chy h ASN 121 Cb 0.48 0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.07 6chy h ASN 121 CO 0.11 -0.14 0.00 0.07 -1.65 0.00 0.00 177.43 175.81 6chy h LYS 122 N 0.26 0.00 0.05 0.81 2.10 -1.19 -1.48 116.57 117.12 6chy h LYS 122 Ca 0.62 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.99 6chy h LYS 122 Cb 1.32 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.68 6chy h LYS 122 CO -0.64 0.00 -1.12 0.82 -2.00 0.00 0.00 179.45 176.52 6chy h ILE 123 N 0.00 1.28 0.24 0.07 2.04 0.21 -2.33 117.51 119.02 6chy h ILE 123 Ca 0.00 -2.32 -0.01 0.00 1.00 0.00 0.00 64.86 63.52 6chy h ILE 123 Cb 0.82 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 39.41 6chy h ILE 123 CO 0.00 0.71 -0.12 -0.26 0.00 0.00 0.00 178.15 178.49 6chy h PHE 124 N 0.34 -0.30 -0.59 1.37 0.04 -0.23 -0.64 116.94 116.92 6chy h PHE 124 Ca -0.15 -0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.70 6chy h PHE 124 Cb 1.78 0.10 -0.07 0.00 2.20 0.00 0.00 35.95 39.96 6chy h PHE 124 CO 0.11 -0.19 0.22 0.93 -0.60 0.00 0.00 178.31 178.78 6chy h GLU 125 N -0.33 0.39 0.00 1.51 5.08 -1.34 0.13 114.58 120.02 6chy h GLU 125 Ca -0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 6chy h GLU 125 Cb 0.25 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.41 6chy h GLU 125 CO 0.05 0.26 0.00 -0.22 -1.00 0.00 0.00 179.01 178.10 6chy h LYS 126 N 0.40 0.00 -0.26 2.33 3.64 -1.12 -3.14 116.57 118.42 6chy h LYS 126 Ca 0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 6chy h LYS 126 Cb 0.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 6chy h LYS 126 CO -0.30 0.00 0.00 1.28 -2.27 0.00 0.00 179.45 178.16 6chy n LEU 127 N -2.99 3.14 -0.14 5.20 4.32 -0.27 -4.93 117.00 121.32 6chy n LEU 127 Ca 0.02 -1.26 -0.02 0.00 -0.02 0.00 0.00 56.01 54.73 6chy n LEU 127 Cb 0.39 -0.16 -0.01 0.00 -1.62 0.00 0.00 43.42 42.02 6chy n LEU 127 CO 0.29 0.63 -0.02 0.61 -1.22 0.00 0.00 177.39 177.69 6chy n GLY 128 N 1.43 0.46 0.32 -0.72 0.00 -0.97 -5.06 105.19 100.65 6chy n GLY 128 Ca 0.18 -0.98 0.15 0.00 0.00 0.00 0.00 46.02 45.37 6chy n GLY 128 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35