#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pp6 h ASN -1 N 0.00 0.42 0.00 -3.46 4.21 -2.09 -2.85 115.58 111.81 2pp6 h ASN -1 Ca 0.00 0.14 0.00 0.00 1.21 0.00 0.00 56.30 57.65 2pp6 h ASN -1 Cb 0.00 0.10 0.00 0.00 -1.12 0.00 0.00 38.32 37.30 2pp6 h ASN -1 CO 0.00 0.06 0.00 0.00 -1.29 0.00 0.00 177.43 176.20 2pp6 n ALA 0 N -2.46 0.32 0.00 -0.83 0.00 -1.26 0.27 120.51 116.56 2pp6 n ALA 0 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2pp6 n ALA 0 Cb 0.62 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2pp6 n ALA 0 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pp6 n ALA 2 N -0.14 0.00 0.11 0.00 0.00 -1.08 -0.73 120.51 118.68 2pp6 n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2pp6 n ALA 2 Cb 0.00 0.00 0.31 0.00 0.00 0.00 0.00 19.45 19.76 2pp6 n ALA 2 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2pp6 h ASP 3 N 0.00 0.22 0.09 0.00 3.32 0.35 -1.59 116.42 118.82 2pp6 h ASP 3 Ca 0.00 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 2pp6 h ASP 3 Cb 0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.49 2pp6 h ASP 3 CO 0.00 0.51 -0.05 0.25 -1.72 0.00 0.00 179.24 178.23 2pp6 h LEU 4 N 0.20 -0.11 -1.07 1.55 6.46 -1.11 -2.69 115.31 118.54 2pp6 h LEU 4 Ca 0.03 -0.37 0.12 0.00 -0.12 0.00 0.00 57.88 57.54 2pp6 h LEU 4 Cb 0.60 0.03 -0.08 0.00 -0.73 0.00 0.00 40.66 40.48 2pp6 h LEU 4 CO 0.04 0.33 0.62 -0.26 -0.62 0.00 0.00 178.44 178.56 2pp6 h PHE 5 N -0.58 1.08 -0.36 1.25 -1.00 -1.76 -2.01 116.94 113.57 2pp6 h PHE 5 Ca -0.01 0.03 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 2pp6 h PHE 5 Cb 0.47 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 39.67 2pp6 h PHE 5 CO 0.07 0.44 0.10 0.22 -1.61 0.00 0.00 178.31 177.53 2pp6 h ASP 6 N 0.95 0.53 0.00 2.17 3.58 -1.25 -1.24 116.42 121.16 2pp6 h ASP 6 Ca 0.48 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.71 2pp6 h ASP 6 Cb 0.50 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.41 2pp6 h ASP 6 CO -0.24 0.61 0.00 0.61 -2.88 0.00 0.00 179.24 177.33 2pp6 n GLY 7 N -0.61 0.48 0.47 -0.78 0.00 -0.76 -0.54 105.19 103.44 2pp6 n GLY 7 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2pp6 n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pp6 n LYS 9 N 0.85 0.00 -0.18 1.61 5.02 -0.47 -1.09 118.16 123.90 2pp6 n LYS 9 Ca 0.00 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.23 2pp6 n LYS 9 Cb 0.12 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.17 2pp6 n LYS 9 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2pp6 h ARG 10 N 0.00 0.62 -1.75 1.97 2.43 -1.08 -1.87 114.38 114.70 2pp6 h ARG 10 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2pp6 h ARG 10 Cb 0.00 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 2pp6 h ARG 10 CO 0.00 0.41 0.00 0.54 -1.51 0.00 0.00 179.97 179.41 2pp6 n ARG 11 N -4.78 0.46 0.00 0.20 1.74 -0.25 -2.34 116.66 111.68 2pp6 n ARG 11 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 2pp6 n ARG 11 Cb 0.07 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 2pp6 n ARG 11 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2pp6 n ASP 13 N 1.23 0.00 0.22 0.55 8.00 -0.70 -1.98 116.55 123.87 2pp6 n ASP 13 Ca 0.00 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.56 2pp6 n ASP 13 Cb 0.23 0.00 0.49 0.00 -0.02 0.00 0.00 41.12 41.82 2pp6 n ASP 13 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pp6 h ALA 14 N 0.00 1.41 0.06 2.24 0.00 -1.73 -1.28 119.26 119.96 2pp6 h ALA 14 Ca 0.00 -0.23 -0.26 0.00 0.00 0.00 0.00 54.91 54.42 2pp6 h ALA 14 Cb 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 17.77 2pp6 h ALA 14 CO 0.00 0.32 -1.03 1.25 0.00 0.00 0.00 179.25 179.79 2pp6 h LEU 15 N 0.00 0.81 -0.68 0.00 5.85 -1.69 -1.75 115.31 117.85 2pp6 h LEU 15 Ca -0.00 -0.79 -0.03 0.00 0.84 0.00 0.00 57.88 57.90 2pp6 h LEU 15 Cb 0.50 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 2pp6 h LEU 15 CO 0.03 1.50 0.29 0.40 -0.34 0.00 0.00 178.44 180.33 2pp6 h ILE 16 N 0.21 1.24 -0.65 4.05 2.04 -1.76 -0.38 117.51 122.25 2pp6 h ILE 16 Ca -0.14 -0.72 -0.07 0.00 1.00 0.00 0.00 64.86 64.93 2pp6 h ILE 16 Cb 1.71 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 38.21 2pp6 h ILE 16 CO 0.20 0.29 0.12 0.00 0.00 0.00 0.00 178.15 178.76 2pp6 h ALA 17 N 1.13 0.97 -0.59 1.87 0.00 -1.25 0.36 119.26 121.76 2pp6 h ALA 17 Ca 0.23 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2pp6 h ALA 17 Cb 0.18 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2pp6 h ALA 17 CO -0.02 0.65 0.02 1.49 0.00 0.00 0.00 179.25 181.38 2pp6 h GLU 18 N 1.00 1.02 0.25 0.00 4.57 -0.86 0.47 114.58 121.03 2pp6 h GLU 18 Ca 0.20 -0.31 -0.34 0.00 -1.18 0.00 0.00 59.36 57.74 2pp6 h GLU 18 Cb 0.41 -0.10 0.03 0.00 -0.16 0.00 0.00 28.75 28.93 2pp6 h GLU 18 CO 0.01 0.99 -1.51 0.00 -1.18 0.00 0.00 179.01 177.32 2pp6 h ARG 19 N 0.94 0.52 -0.00 1.92 3.08 -0.84 -3.40 114.38 116.60 2pp6 h ARG 19 Ca 0.17 -0.89 0.00 0.00 0.07 0.00 0.00 59.98 59.34 2pp6 h ARG 19 Cb 0.52 0.33 0.00 0.00 0.08 0.00 0.00 29.97 30.90 2pp6 h ARG 19 CO 0.03 1.42 -0.12 1.19 -1.07 0.00 0.00 179.97 181.42 2pp6 n PHE 20 N -3.70 0.00 -0.01 3.04 3.72 0.10 -5.10 117.46 115.52 2pp6 n PHE 20 Ca -0.18 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.22 2pp6 n PHE 20 Cb 1.10 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.65 2pp6 n PHE 20 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2pp6 n GLY 21 N 0.97 -3.01 2.93 1.37 0.00 0.16 -4.66 105.19 102.96 2pp6 n GLY 21 Ca 0.01 -0.99 -0.24 0.00 0.00 0.00 0.00 46.02 44.80 2pp6 n GLY 21 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2pp6 s LYS 23 N -2.47 1.30 0.03 1.61 2.47 -1.26 -4.89 119.74 116.53 2pp6 s LYS 23 Ca 0.01 -0.23 -0.07 0.00 -1.56 0.00 0.00 55.97 54.13 2pp6 s LYS 23 Cb -0.00 -1.26 -0.01 0.00 -1.46 0.00 0.00 37.83 35.10 2pp6 s LYS 23 CO 0.01 -0.13 0.12 0.54 0.16 0.00 0.00 175.35 176.06 2pp6 s VAL 24 N 1.18 0.12 -0.22 4.02 0.11 0.64 -4.77 120.40 121.47 2pp6 s VAL 24 Ca -0.06 -0.95 -0.06 0.00 -2.93 0.00 0.00 61.98 57.98 2pp6 s VAL 24 Cb -0.14 -0.76 -0.02 0.00 -1.53 0.00 0.00 36.38 33.92 2pp6 s VAL 24 CO -0.02 -0.52 0.03 0.21 -3.33 0.00 0.00 175.10 171.46 2pp6 s ASN 25 N -1.92 4.91 -0.19 3.54 3.84 -1.03 0.11 114.94 124.21 2pp6 s ASN 25 Ca -0.08 -0.22 0.01 0.00 0.21 0.00 0.00 52.86 52.78 2pp6 s ASN 25 Cb -0.03 -1.86 0.02 0.00 -0.55 0.00 0.00 41.25 38.83 2pp6 s ASN 25 CO -0.03 0.01 -0.18 -0.63 -2.79 0.00 0.00 177.10 173.49 2pp6 s ILE 26 N 1.32 2.19 -1.59 -5.21 1.01 0.37 -0.38 121.20 118.89 2pp6 s ILE 26 Ca 0.04 -0.98 -0.07 0.00 0.00 0.00 0.00 60.65 59.64 2pp6 s ILE 26 Cb -0.15 -1.97 0.07 0.00 0.01 0.00 0.00 42.46 40.42 2pp6 s ILE 26 CO 0.02 0.46 0.35 -3.20 0.00 0.00 0.00 174.94 172.57 2pp6 n ASN 27 N 4.61 -0.56 0.00 3.58 5.15 -0.63 -0.98 115.26 126.43 2pp6 n ASN 27 Ca -0.20 -1.16 0.00 0.00 -0.60 0.00 0.00 54.58 52.63 2pp6 n ASN 27 Cb 0.49 -2.19 0.00 0.00 -0.53 0.00 0.00 39.78 37.55 2pp6 n ASN 27 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2pp6 n GLY 28 N -1.97 1.45 3.35 8.20 0.00 -1.26 -5.03 105.19 109.92 2pp6 n GLY 28 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2pp6 n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pp6 s THR 29 N -2.85 2.81 0.26 2.61 2.01 -0.15 -5.11 115.64 115.22 2pp6 s THR 29 Ca 0.00 -0.76 -0.29 0.00 0.31 0.00 0.00 61.69 60.95 2pp6 s THR 29 Cb 0.00 -2.15 -0.09 0.00 0.01 0.00 0.00 72.50 70.27 2pp6 s THR 29 CO 0.00 0.54 0.94 -1.81 -0.69 0.00 0.00 174.62 173.60 2pp6 s ASP 30 N 0.18 7.59 0.25 3.53 1.01 -1.26 -0.48 116.67 127.49 2pp6 s ASP 30 Ca -0.09 1.93 -0.22 0.00 0.71 0.00 0.00 52.55 54.88 2pp6 s ASP 30 Cb -0.16 -2.60 0.04 0.00 1.01 0.00 0.00 42.92 41.21 2pp6 s ASP 30 CO 0.06 0.12 0.82 0.00 0.21 0.00 0.00 175.17 176.37 2pp6 s ILE 32 N -3.43 5.33 0.08 0.00 1.09 -1.26 -0.26 121.20 122.75 2pp6 s ILE 32 Ca 0.13 0.15 0.03 0.00 -1.10 0.00 0.00 60.65 59.85 2pp6 s ILE 32 Cb -0.04 -3.37 -0.04 0.00 -1.06 0.00 0.00 42.46 37.96 2pp6 s ILE 32 CO 0.06 0.54 -0.08 0.54 -0.10 0.00 0.00 174.94 175.89 2pp6 s VAL 33 N -0.40 0.77 -0.07 2.92 0.11 -1.26 -1.27 120.40 121.20 2pp6 s VAL 33 Ca 0.11 -1.61 0.02 0.00 -2.93 0.00 0.00 61.98 57.58 2pp6 s VAL 33 Cb -0.12 -1.29 0.01 0.00 -1.53 0.00 0.00 36.38 33.46 2pp6 s VAL 33 CO 0.01 -0.62 -0.13 -0.69 -3.33 0.00 0.00 175.10 170.35 2pp6 s VAL 34 N -2.58 1.19 0.35 2.04 1.01 -0.62 -4.28 120.40 117.52 2pp6 s VAL 34 Ca 0.04 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 2pp6 s VAL 34 Cb -0.02 -1.08 -0.11 0.00 0.00 0.00 0.00 36.38 35.16 2pp6 s VAL 34 CO -0.01 0.37 1.52 -0.62 0.00 0.00 0.00 175.10 176.36 2pp6 n GLU 35 N 3.84 2.69 0.21 2.72 1.02 -1.26 -1.79 120.64 128.06 2pp6 n GLU 35 Ca -0.22 0.95 0.15 0.00 -0.02 0.00 0.00 57.16 58.01 2pp6 n GLU 35 Cb 0.52 -2.69 0.71 0.00 -0.02 0.00 0.00 31.44 29.96 2pp6 n GLU 35 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 2pp6 h SER 36 N 3.48 0.00 -0.37 1.62 0.02 -1.70 -2.50 113.55 114.10 2pp6 h SER 36 Ca -0.50 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 60.51 2pp6 h SER 36 Cb 1.24 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.73 2pp6 h SER 36 CO 0.68 0.00 0.09 0.44 -1.14 0.00 0.00 176.83 176.90 2pp6 h ASP 37 N 0.00 0.04 0.39 3.07 3.45 -1.89 -0.03 116.42 121.45 2pp6 h ASP 37 Ca 0.00 0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.52 2pp6 h ASP 37 Cb 0.15 0.07 0.00 0.00 -0.56 0.00 0.00 39.33 38.99 2pp6 h ASP 37 CO 0.00 0.06 0.00 0.49 -1.57 0.00 0.00 179.24 178.22 2pp6 n PHE 38 N -5.07 0.00 0.00 4.55 3.72 -0.94 -3.98 117.46 115.73 2pp6 n PHE 38 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2pp6 n PHE 38 Cb 0.16 -0.43 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 2pp6 n PHE 38 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2pp6 n LEU 39 N -1.43 0.54 0.00 4.37 4.77 -0.66 -5.11 117.00 119.49 2pp6 n LEU 39 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2pp6 n LEU 39 Cb 0.14 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2pp6 n LEU 39 CO 0.12 0.09 0.00 0.00 -1.33 0.00 0.00 177.39 176.27 2pp6 n ALA 40 N -1.94 0.00 -3.70 -1.18 0.00 -0.12 -5.13 120.51 108.45 2pp6 n ALA 40 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 2pp6 n ALA 40 Cb 0.44 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.90 2pp6 n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pp6 n GLY 49 N 0.00 -0.73 3.62 0.00 0.00 -1.26 -5.12 105.19 101.70 2pp6 n GLY 49 Ca 0.00 0.32 -0.38 0.00 0.00 0.00 0.00 46.02 45.96 2pp6 n GLY 49 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2pp6 n LYS 50 N -2.91 0.95 -4.42 1.61 3.00 -0.79 -4.68 118.16 110.93 2pp6 n LYS 50 Ca -0.15 0.37 -0.22 0.00 -0.00 0.00 0.00 58.31 58.31 2pp6 n LYS 50 Cb 0.43 -2.18 -0.16 0.00 0.00 0.00 0.00 35.03 33.11 2pp6 n LYS 50 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 2pp6 s ASN 51 N -1.21 1.37 0.01 3.14 3.84 -1.26 -0.54 114.94 120.29 2pp6 s ASN 51 Ca 0.75 -0.22 -0.13 0.00 0.21 0.00 0.00 52.86 53.47 2pp6 s ASN 51 Cb -0.42 -0.57 0.02 0.00 -0.55 0.00 0.00 41.25 39.73 2pp6 s ASN 51 CO 0.48 0.02 0.28 0.68 -2.79 0.00 0.00 177.10 175.77 2pp6 s VAL 52 N 0.58 0.07 -0.08 -5.21 -7.23 -0.77 -1.73 120.40 106.04 2pp6 s VAL 52 Ca -0.10 -0.60 0.01 0.00 -1.81 0.00 0.00 61.98 59.48 2pp6 s VAL 52 Cb -0.13 -0.74 -0.03 0.00 0.56 0.00 0.00 36.38 36.04 2pp6 s VAL 52 CO 0.02 -0.33 -0.09 0.68 -0.31 0.00 0.00 175.10 175.07 2pp6 s VAL 53 N -1.86 3.50 -0.26 1.32 -7.23 -0.74 0.17 120.40 115.31 2pp6 s VAL 53 Ca -0.10 -0.55 -0.23 0.00 -1.81 0.00 0.00 61.98 59.29 2pp6 s VAL 53 Cb -0.04 -2.43 -0.01 0.00 0.56 0.00 0.00 36.38 34.47 2pp6 s VAL 53 CO 0.01 0.58 0.77 -0.69 -0.31 0.00 0.00 175.10 175.46 2pp6 s VAL 54 N -0.60 4.86 -0.12 1.32 1.01 -0.08 -1.59 120.40 125.22 2pp6 s VAL 54 Ca 0.09 1.36 0.08 0.00 0.00 0.00 0.00 61.98 63.51 2pp6 s VAL 54 Cb -0.12 -4.08 -0.24 0.00 0.00 0.00 0.00 36.38 31.95 2pp6 s VAL 54 CO 0.02 -0.09 0.38 0.49 0.00 0.00 0.00 175.10 175.89 2pp6 n PHE 55 N 5.98 0.74 -1.84 5.22 3.72 -0.40 -4.35 117.46 126.54 2pp6 n PHE 55 Ca 0.04 0.23 -0.39 0.00 -0.05 0.00 0.00 57.45 57.28 2pp6 n PHE 55 Cb 0.48 -1.12 0.03 0.00 -0.94 0.00 0.00 39.48 37.93 2pp6 n PHE 55 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2pp6 s SER 56 N -6.22 5.49 0.00 4.37 0.01 -1.21 -4.91 113.70 111.23 2pp6 s SER 56 Ca -0.13 2.75 0.22 0.00 1.31 0.00 0.00 55.95 60.10 2pp6 s SER 56 Cb 0.07 -2.64 0.57 0.00 0.21 0.00 0.00 66.02 64.24 2pp6 s SER 56 CO 0.79 -1.42 1.49 0.61 0.41 0.00 0.00 173.24 175.12 2pp6 n GLY 57 N 0.67 2.09 1.42 3.44 0.00 -1.26 -4.34 105.19 107.21 2pp6 n GLY 57 Ca 0.09 -0.75 0.11 0.00 0.00 0.00 0.00 46.02 45.47 2pp6 n GLY 57 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2pp6 n ASN 58 N 1.51 4.24 -4.16 1.61 6.94 -1.26 -4.94 115.26 119.19 2pp6 n ASN 58 Ca 0.22 -2.17 -0.14 0.00 -0.02 0.00 0.00 54.58 52.47 2pp6 n ASN 58 Cb 0.59 -0.52 -0.11 0.00 -2.36 0.00 0.00 39.78 37.38 2pp6 n ASN 58 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2pp6 s VAL 59 N -1.32 0.89 -0.44 3.53 -7.23 -1.26 -5.08 120.40 109.50 2pp6 s VAL 59 Ca 0.49 -1.59 0.02 0.00 -1.81 0.00 0.00 61.98 59.09 2pp6 s VAL 59 Cb 0.28 -1.30 0.14 0.00 0.56 0.00 0.00 36.38 36.07 2pp6 s VAL 59 CO 0.30 -0.55 0.26 0.27 -0.31 0.00 0.00 175.10 175.07 2pp6 s ILE 60 N -2.37 1.12 0.65 -0.62 -4.36 -1.26 -5.05 121.20 109.31 2pp6 s ILE 60 Ca 0.04 -2.52 -0.18 0.00 -0.26 0.00 0.00 60.65 57.73 2pp6 s ILE 60 Cb -0.03 -1.79 -0.01 0.00 1.25 0.00 0.00 42.46 41.88 2pp6 s ILE 60 CO -0.00 -0.96 1.28 -2.16 0.24 0.00 0.00 174.94 173.34 2pp6 s PRO 61 N 0.33 2.57 0.05 0.37 0.04 -1.26 -5.05 135.00 132.05 2pp6 s PRO 61 Ca 0.20 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.28 2pp6 s PRO 61 Cb -0.19 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 2pp6 s PRO 61 CO -0.03 -1.58 -0.06 1.03 0.04 0.00 0.00 177.00 176.41 2pp6 s ARG 62 N -3.40 0.55 0.20 4.56 0.52 -1.26 -5.09 118.95 115.03 2pp6 s ARG 62 Ca 0.82 -0.92 -0.31 0.00 -0.52 0.00 0.00 55.73 54.79 2pp6 s ARG 62 Cb -0.36 -0.09 -0.11 0.00 0.52 0.00 0.00 34.95 34.91 2pp6 s ARG 62 CO 0.39 -0.02 1.60 1.03 0.02 0.00 0.00 175.30 178.33 2pp6 s ARG 63 N -2.42 4.18 0.00 3.54 0.52 -1.26 -2.09 118.95 121.43 2pp6 s ARG 63 Ca -0.04 2.45 0.00 0.00 -0.52 0.00 0.00 55.73 57.62 2pp6 s ARG 63 Cb -0.04 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.32 2pp6 s ARG 63 CO -0.03 -0.63 0.00 0.41 0.02 0.00 0.00 175.30 175.07 2pp6 n GLY 64 N 3.43 3.28 3.42 -3.53 0.00 -0.49 -4.99 105.19 106.31 2pp6 n GLY 64 Ca 0.13 -0.98 -0.49 0.00 0.00 0.00 0.00 46.02 44.68 2pp6 n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2pp6 n ASP 65 N 0.41 -1.01 -4.82 1.61 8.00 -0.89 -4.55 116.55 115.30 2pp6 n ASP 65 Ca 0.00 1.13 -0.38 0.00 0.71 0.00 0.00 54.79 56.26 2pp6 n ASP 65 Cb 0.00 -0.96 -0.06 0.00 -0.02 0.00 0.00 41.12 40.08 2pp6 n ASP 65 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pp6 s ARG 66 N -0.90 3.95 -0.15 -1.24 1.70 -1.26 -2.01 118.95 119.04 2pp6 s ARG 66 Ca 0.67 0.38 0.00 0.00 -0.47 0.00 0.00 55.73 56.31 2pp6 s ARG 66 Cb -0.96 -3.25 0.02 0.00 -0.57 0.00 0.00 34.95 30.20 2pp6 s ARG 66 CO 0.56 0.63 -0.14 0.08 -1.08 0.00 0.00 175.30 175.36 2pp6 s VAL 67 N -0.87 1.55 -0.33 4.99 1.01 -0.27 -1.60 120.40 124.88 2pp6 s VAL 67 Ca 0.23 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.41 2pp6 s VAL 67 Cb -0.16 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 2pp6 s VAL 67 CO 0.12 0.46 0.51 -0.69 0.00 0.00 0.00 175.10 175.50 2pp6 s VAL 68 N 1.48 5.03 -0.07 2.92 1.01 0.48 -0.71 120.40 130.54 2pp6 s VAL 68 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.46 2pp6 s VAL 68 Cb -0.13 -3.93 0.02 0.00 0.00 0.00 0.00 36.38 32.34 2pp6 s VAL 68 CO -0.10 -0.16 -0.06 -0.22 0.00 0.00 0.00 175.10 174.56 2pp6 s LEU 69 N 2.37 1.20 -1.27 3.92 2.96 0.39 -2.46 118.68 125.80 2pp6 s LEU 69 Ca 0.19 -0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 53.85 2pp6 s LEU 69 Cb -0.15 -0.64 0.03 0.00 0.50 0.00 0.00 46.19 45.92 2pp6 s LEU 69 CO 0.13 -0.08 0.28 0.54 -1.32 0.00 0.00 176.35 175.90 2pp6 n ARG 70 N 4.48 -3.09 -0.14 1.98 1.74 -1.26 -1.27 116.66 119.10 2pp6 n ARG 70 Ca -0.17 0.63 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 2pp6 n ARG 70 Cb 0.51 -5.32 0.00 0.00 -1.02 0.00 0.00 32.46 26.62 2pp6 n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2pp6 n GLY 71 N -1.08 1.11 3.59 -0.13 0.00 -1.26 -5.05 105.19 102.37 2pp6 n GLY 71 Ca -0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.65 2pp6 n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pp6 s SER 72 N -2.91 4.36 -0.09 1.61 0.01 -0.39 -5.12 113.70 111.17 2pp6 s SER 72 Ca 0.00 -0.52 -0.10 0.00 1.31 0.00 0.00 55.95 56.64 2pp6 s SER 72 Cb 0.00 -0.79 -0.05 0.00 0.21 0.00 0.00 66.02 65.40 2pp6 s SER 72 CO 0.00 0.11 0.22 -0.70 0.41 0.00 0.00 173.24 173.29 2pp6 s GLU 73 N -2.74 3.67 0.31 12.44 2.12 -1.26 -0.46 118.70 132.78 2pp6 s GLU 73 Ca 0.25 0.03 0.03 0.00 0.36 0.00 0.00 54.97 55.63 2pp6 s GLU 73 Cb -0.09 -3.23 -0.04 0.00 0.26 0.00 0.00 34.13 31.02 2pp6 s GLU 73 CO 0.15 0.69 0.11 -0.06 -0.54 0.00 0.00 175.26 175.62 2pp6 s PHE 74 N -0.85 1.68 -0.04 5.30 0.40 0.11 -2.52 117.98 122.05 2pp6 s PHE 74 Ca 0.17 -1.22 0.02 0.00 -0.60 0.00 0.00 56.93 55.30 2pp6 s PHE 74 Cb -0.13 -1.00 0.02 0.00 0.51 0.00 0.00 43.02 42.41 2pp6 s PHE 74 CO 0.06 -0.33 -0.07 0.99 0.70 0.00 0.00 175.22 176.57 2pp6 s THR 75 N -3.54 0.73 -0.52 0.64 2.01 0.54 -1.12 115.64 114.39 2pp6 s THR 75 Ca 0.35 -0.26 -0.28 0.00 0.31 0.00 0.00 61.69 61.81 2pp6 s THR 75 Cb 0.06 -0.70 0.01 0.00 0.01 0.00 0.00 72.50 71.88 2pp6 s THR 75 CO 0.15 0.26 1.49 -0.69 -0.69 0.00 0.00 174.62 175.14 2pp6 s VAL 76 N 0.69 3.74 0.03 3.82 1.01 -0.85 -1.06 120.40 127.78 2pp6 s VAL 76 Ca -0.11 0.66 0.10 0.00 0.00 0.00 0.00 61.98 62.63 2pp6 s VAL 76 Cb -0.14 -4.29 -0.22 0.00 0.00 0.00 0.00 36.38 31.74 2pp6 s VAL 76 CO 0.01 -1.01 0.95 0.71 0.00 0.00 0.00 175.10 175.76 2pp6 h THR 77 N 6.48 1.25 -3.22 3.92 1.35 -0.88 -1.31 112.91 120.49 2pp6 h THR 77 Ca -0.27 -3.04 -0.06 0.00 -0.55 0.00 0.00 66.41 62.49 2pp6 h THR 77 Cb 1.11 2.62 -0.14 0.00 -1.73 0.00 0.00 68.15 70.00 2pp6 h THR 77 CO 1.15 0.72 -0.07 0.00 -0.25 0.00 0.00 175.52 177.07 2pp6 s ARG 78 N -2.65 1.02 -0.13 4.72 1.70 -1.22 -4.91 118.95 117.47 2pp6 s ARG 78 Ca -0.02 -0.56 -0.02 0.00 -0.47 0.00 0.00 55.73 54.67 2pp6 s ARG 78 Cb 0.09 0.45 0.04 0.00 -0.57 0.00 0.00 34.95 34.96 2pp6 s ARG 78 CO 0.82 -0.38 -0.00 0.42 -1.08 0.00 0.00 175.30 175.08 2pp6 s ILE 79 N -3.27 0.61 0.00 4.99 1.01 -1.26 -1.47 121.20 121.81 2pp6 s ILE 79 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.37 2pp6 s ILE 79 Cb 0.01 -0.88 0.00 0.00 0.01 0.00 0.00 42.46 41.60 2pp6 s ILE 79 CO -0.08 0.08 0.00 0.54 0.00 0.00 0.00 174.94 175.48 2pp6 n ARG 80 N 5.05 1.77 -4.80 2.79 1.74 0.03 -4.90 116.66 118.34 2pp6 n ARG 80 Ca -0.09 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.72 2pp6 n ARG 80 Cb 0.49 0.00 -0.15 0.00 -1.02 0.00 0.00 32.46 31.78 2pp6 n ARG 80 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2pp6 s ARG 81 N -1.29 1.57 -0.32 5.56 3.00 -1.26 -1.73 118.95 124.49 2pp6 s ARG 81 Ca 0.00 -0.96 -0.02 0.00 0.00 0.00 0.00 55.73 54.75 2pp6 s ARG 81 Cb 0.00 -1.67 0.11 0.00 0.00 0.00 0.00 34.95 33.39 2pp6 s ARG 81 CO 0.00 0.44 0.15 0.12 0.00 0.00 0.00 175.30 176.00 2pp6 s PHE 82 N -0.75 0.82 -1.44 -0.53 5.36 -0.08 -4.80 117.98 116.56 2pp6 s PHE 82 Ca 0.09 -1.34 -0.08 0.00 -0.96 0.00 0.00 56.93 54.64 2pp6 s PHE 82 Cb -0.09 -1.15 0.05 0.00 -0.34 0.00 0.00 43.02 41.49 2pp6 s PHE 82 CO 0.01 -0.84 0.86 0.09 -1.46 0.00 0.00 175.22 173.88 2pp6 n ASN 83 N 4.78 -3.26 0.00 6.13 4.13 -1.26 -0.93 115.26 124.84 2pp6 n ASN 83 Ca -0.00 -0.80 0.00 0.00 1.68 0.00 0.00 54.58 55.45 2pp6 n ASN 83 Cb 0.40 -3.91 0.00 0.00 -1.54 0.00 0.00 39.78 34.73 2pp6 n ASN 83 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2pp6 n GLY 84 N -1.67 0.68 3.61 7.41 0.00 -1.26 -5.03 105.19 108.94 2pp6 n GLY 84 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2pp6 n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pp6 s LYS 85 N -0.08 2.58 0.00 1.61 1.02 -0.11 -5.06 119.74 119.70 2pp6 s LYS 85 Ca 0.00 -0.72 -0.31 0.00 0.02 0.00 0.00 55.97 54.96 2pp6 s LYS 85 Cb 0.00 -2.53 -0.10 0.00 -0.52 0.00 0.00 37.83 34.69 2pp6 s LYS 85 CO 0.00 0.60 1.96 -2.30 -0.92 0.00 0.00 175.35 174.69 2pp6 n PRO 86 N 1.46 2.69 -3.70 -1.68 -0.02 -1.26 -0.90 135.00 131.59 2pp6 n PRO 86 Ca -0.15 0.99 -0.38 0.00 -2.02 0.00 0.00 63.50 61.93 2pp6 n PRO 86 Cb 0.53 -2.92 -0.12 0.00 -0.02 0.00 0.00 33.50 30.96 2pp6 n PRO 86 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2pp6 s GLN 87 N 4.40 2.88 -0.10 -0.52 0.74 -0.70 -0.90 119.66 125.45 2pp6 s GLN 87 Ca 0.90 -1.02 -0.10 0.00 0.05 0.00 0.00 55.36 55.19 2pp6 s GLN 87 Cb -0.50 -3.52 -0.05 0.00 1.10 0.00 0.00 33.01 30.05 2pp6 s GLN 87 CO 0.45 -0.59 0.23 -0.51 -0.55 0.00 0.00 175.29 174.32 2pp6 s LEU 88 N 1.49 4.38 -0.28 3.68 1.43 0.13 -0.79 118.68 128.72 2pp6 s LEU 88 Ca 0.01 0.58 -0.10 0.00 -1.03 0.00 0.00 54.13 53.60 2pp6 s LEU 88 Cb -0.18 -2.24 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 2pp6 s LEU 88 CO 0.04 0.33 0.14 -0.89 0.23 0.00 0.00 176.35 176.21 2pp6 s THR 89 N -0.76 4.83 -0.07 5.49 2.01 -0.54 -1.84 115.64 124.75 2pp6 s THR 89 Ca 0.17 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.12 2pp6 s THR 89 Cb -0.13 -3.32 -0.03 0.00 0.01 0.00 0.00 72.50 69.03 2pp6 s THR 89 CO 0.06 0.24 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.38 2pp6 s LEU 90 N 1.68 2.99 -0.02 4.42 1.43 0.29 -0.13 118.68 129.35 2pp6 s LEU 90 Ca 0.06 -0.12 0.08 0.00 -1.03 0.00 0.00 54.13 53.13 2pp6 s LEU 90 Cb -0.16 -1.64 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2pp6 s LEU 90 CO 0.08 0.32 -0.25 -1.61 0.23 0.00 0.00 176.35 175.12 2pp6 s GLU 91 N -0.59 2.11 0.97 1.70 0.41 -0.22 -1.88 118.70 121.20 2pp6 s GLU 91 Ca 0.09 -0.93 -0.11 0.00 -0.41 0.00 0.00 54.97 53.60 2pp6 s GLU 91 Cb -0.12 -2.06 0.14 0.00 -1.78 0.00 0.00 34.13 30.32 2pp6 s GLU 91 CO 0.02 0.56 0.91 0.39 -0.49 0.00 0.00 175.26 176.65 2pp6 n GLU 92 N 2.36 -0.79 0.00 1.61 -0.58 -1.26 -0.34 120.64 121.64 2pp6 n GLU 92 Ca -0.16 -0.18 0.06 0.00 -0.42 0.00 0.00 57.16 56.46 2pp6 n GLU 92 Cb 0.51 -2.20 0.05 0.00 -0.57 0.00 0.00 31.44 29.23 2pp6 n GLU 92 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74