#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rp3 n GLY 2 N 0.00 1.31 4.04 -0.72 0.00 -1.20 -4.73 105.19 103.89 2rp3 n GLY 2 Ca 0.00 -0.55 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 2rp3 n GLY 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2rp3 n LYS 3 N 12.24 -0.90 0.11 1.61 4.76 0.42 -4.06 118.16 132.34 2rp3 n LYS 3 Ca 0.00 0.09 0.01 0.00 -2.87 0.00 0.00 58.31 55.53 2rp3 n LYS 3 Cb 0.00 -3.24 0.33 0.00 -1.84 0.00 0.00 35.03 30.27 2rp3 n LYS 3 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2rp3 h PHE 4 N -1.20 0.25 -0.42 2.13 -0.00 -1.65 -2.42 116.94 113.63 2rp3 h PHE 4 Ca -0.54 -0.04 0.12 0.00 -0.00 0.00 0.00 57.97 57.51 2rp3 h PHE 4 Cb 1.18 -0.07 -0.02 0.00 -0.00 0.00 0.00 35.95 37.04 2rp3 h PHE 4 CO 0.48 0.46 0.37 1.03 -0.00 0.00 0.00 178.31 180.64 2rp3 h SER 5 N 0.21 0.00 -0.15 -0.68 0.87 -1.84 0.56 113.55 112.51 2rp3 h SER 5 Ca 0.03 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 2rp3 h SER 5 Cb 0.55 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 2rp3 h SER 5 CO 0.04 0.00 0.10 1.56 -0.53 0.00 0.00 176.83 178.00 2rp3 h GLN 6 N 0.00 0.18 -0.23 2.24 4.20 -1.80 -2.89 115.11 116.81 2rp3 h GLN 6 Ca 0.20 -0.01 -0.21 0.00 0.06 0.00 0.00 58.65 58.69 2rp3 h GLN 6 Cb 0.93 -0.04 -0.30 0.00 0.30 0.00 0.00 27.48 28.37 2rp3 h GLN 6 CO -0.00 0.12 -0.88 -2.37 -0.67 0.00 0.00 178.83 175.02 2rp3 n THR 7 N -4.51 1.29 -3.82 -0.54 5.66 0.03 -5.04 114.28 107.35 2rp3 n THR 7 Ca -0.01 -2.57 -0.13 0.00 -3.05 0.00 0.00 64.05 58.29 2rp3 n THR 7 Cb 0.10 0.39 -0.14 0.00 -1.55 0.00 0.00 70.33 69.12 2rp3 n THR 7 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rp3 s TYR 9 N 0.47 1.19 -1.29 0.00 1.13 0.54 -4.64 117.35 114.75 2rp3 s TYR 9 Ca -0.04 -1.18 -0.06 0.00 -1.41 0.00 0.00 57.07 54.38 2rp3 s TYR 9 Cb -0.05 -0.66 0.01 0.00 -1.10 0.00 0.00 41.96 40.15 2rp3 s TYR 9 CO -0.02 -0.40 1.11 -1.71 -2.51 0.00 0.00 175.55 172.03 2rp3 n ASN 10 N -0.26 -5.01 -4.82 -0.18 5.15 -1.26 -0.76 115.26 108.11 2rp3 n ASN 10 Ca -0.03 -0.55 -0.33 0.00 -0.60 0.00 0.00 54.58 53.06 2rp3 n ASN 10 Cb 0.65 -4.99 -0.05 0.00 -0.53 0.00 0.00 39.78 34.85 2rp3 n ASN 10 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2rp3 s SER 11 N -3.63 6.73 -0.04 1.20 1.04 -1.26 -3.91 113.70 113.84 2rp3 s SER 11 Ca 0.40 1.72 -0.25 0.00 0.48 0.00 0.00 55.95 58.30 2rp3 s SER 11 Cb -0.18 -2.54 0.05 0.00 0.10 0.00 0.00 66.02 63.46 2rp3 s SER 11 CO 0.72 -0.51 0.54 0.00 0.98 0.00 0.00 173.24 174.97 2rp3 s ALA 12 N -2.23 -1.41 -0.00 5.32 0.00 0.90 -4.96 121.76 119.37 2rp3 s ALA 12 Ca 0.63 0.95 0.01 0.00 0.00 0.00 0.00 51.96 53.55 2rp3 s ALA 12 Cb -0.11 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.05 2rp3 s ALA 12 CO 0.18 -0.33 -0.03 0.42 0.00 0.00 0.00 175.76 176.00 2rp3 s ILE 13 N -1.26 0.22 -0.37 0.00 1.01 -1.26 -0.84 121.20 118.70 2rp3 s ILE 13 Ca -0.12 -0.10 0.04 0.00 0.00 0.00 0.00 60.65 60.47 2rp3 s ILE 13 Cb -0.02 -0.20 0.16 0.00 0.01 0.00 0.00 42.46 42.41 2rp3 s ILE 13 CO 0.08 0.07 0.42 -1.58 0.00 0.00 0.00 174.94 173.93 2rp3 s GLN 14 N 0.03 0.65 0.01 2.79 -0.44 -1.14 -4.24 119.66 117.31 2rp3 s GLN 14 Ca 0.00 -0.64 0.00 0.00 -2.50 0.00 0.00 55.36 52.22 2rp3 s GLN 14 Cb -0.02 -0.53 0.00 0.00 -1.64 0.00 0.00 33.01 30.82 2rp3 s GLN 14 CO -0.00 -1.18 0.00 0.41 0.50 0.00 0.00 175.29 175.02 2rp3 n GLY 15 N 4.40 1.87 0.95 2.59 0.00 -1.23 -4.11 105.19 109.67 2rp3 n GLY 15 Ca 0.10 -0.59 -0.03 0.00 0.00 0.00 0.00 46.02 45.50 2rp3 n GLY 15 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2rp3 n SER 16 N 3.97 -0.34 -4.03 1.61 2.88 -1.26 -4.56 113.62 111.88 2rp3 n SER 16 Ca 0.00 -1.79 -0.27 0.00 -1.33 0.00 0.00 58.87 55.48 2rp3 n SER 16 Cb 0.00 0.09 -0.17 0.00 -0.75 0.00 0.00 64.21 63.38 2rp3 n SER 16 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2rp3 s VAL 17 N 0.00 1.33 -0.18 2.46 0.11 -1.26 -0.27 120.40 122.58 2rp3 s VAL 17 Ca 0.06 -0.55 -0.09 0.00 -2.93 0.00 0.00 61.98 58.48 2rp3 s VAL 17 Cb 0.07 -1.22 -0.05 0.00 -1.53 0.00 0.00 36.38 33.65 2rp3 s VAL 17 CO -0.03 0.41 0.12 -0.22 -3.33 0.00 0.00 175.10 172.04 2rp3 s LEU 18 N 0.96 4.15 -0.04 2.54 0.20 -0.86 -2.87 118.68 122.76 2rp3 s LEU 18 Ca -0.08 0.24 0.00 0.00 0.69 0.00 0.00 54.13 54.99 2rp3 s LEU 18 Cb -0.15 -2.06 0.02 0.00 -0.43 0.00 0.00 46.19 43.58 2rp3 s LEU 18 CO -0.00 0.23 -0.02 -0.89 -0.29 0.00 0.00 176.35 175.37 2rp3 s THR 19 N 0.08 0.35 -0.21 3.68 2.01 -0.02 -0.97 115.64 120.57 2rp3 s THR 19 Ca 0.08 0.01 -0.20 0.00 0.31 0.00 0.00 61.69 61.90 2rp3 s THR 19 Cb -0.11 -0.43 0.05 0.00 0.01 0.00 0.00 72.50 72.02 2rp3 s THR 19 CO -0.00 0.20 0.56 -0.55 -0.69 0.00 0.00 174.62 174.14 2rp3 s SER 20 N 1.13 -0.59 -0.16 3.53 0.15 -1.09 -0.07 113.70 116.60 2rp3 s SER 20 Ca -0.08 1.13 -0.29 0.00 0.70 0.00 0.00 55.95 57.41 2rp3 s SER 20 Cb -0.14 1.14 -0.01 0.00 -1.71 0.00 0.00 66.02 65.31 2rp3 s SER 20 CO -0.01 -0.20 1.17 -0.89 1.20 0.00 0.00 173.24 174.50 2rp3 s THR 21 N 0.28 4.43 0.09 6.45 2.01 0.06 -3.83 115.64 125.14 2rp3 s THR 21 Ca -0.00 1.73 0.09 0.00 0.31 0.00 0.00 61.69 63.82 2rp3 s THR 21 Cb -0.04 -4.12 -0.03 0.00 0.01 0.00 0.00 72.50 68.32 2rp3 s THR 21 CO 0.01 -0.11 -0.23 0.00 -0.69 0.00 0.00 174.62 173.59 2rp3 s GLU 23 N -1.73 3.90 0.85 0.00 2.02 -1.14 -1.41 118.70 121.19 2rp3 s GLU 23 Ca 0.10 1.42 -0.11 0.00 0.02 0.00 0.00 54.97 56.39 2rp3 s GLU 23 Cb -0.10 -3.92 0.11 0.00 0.10 0.00 0.00 34.13 30.32 2rp3 s GLU 23 CO 0.04 -1.14 1.15 1.03 0.02 0.00 0.00 175.26 176.36 2rp3 s ARG 24 N 4.28 1.48 -0.09 1.61 0.52 0.15 -3.62 118.95 123.27 2rp3 s ARG 24 Ca 0.61 1.52 0.15 0.00 -0.52 0.00 0.00 55.73 57.49 2rp3 s ARG 24 Cb -0.20 -1.78 -0.23 0.00 0.52 0.00 0.00 34.95 33.26 2rp3 s ARG 24 CO 0.24 -2.29 0.45 2.41 0.02 0.00 0.00 175.30 176.14 2rp3 n THR 25 N -3.80 1.47 -0.06 0.02 -1.04 -1.25 -4.67 114.28 104.95 2rp3 n THR 25 Ca 0.12 -0.81 -0.06 0.00 -2.04 0.00 0.00 64.05 61.26 2rp3 n THR 25 Cb 0.52 -0.79 -0.02 0.00 -1.82 0.00 0.00 70.33 68.22 2rp3 n THR 25 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2rp3 n ASN 26 N -2.91 1.49 0.00 8.00 2.85 -1.26 -5.04 115.26 118.39 2rp3 n ASN 26 Ca -0.22 0.25 0.00 0.00 -0.11 0.00 0.00 54.58 54.50 2rp3 n ASN 26 Cb 1.07 -0.63 0.00 0.00 1.24 0.00 0.00 39.78 41.46 2rp3 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2rp3 n GLY 27 N 1.78 0.53 0.00 8.20 0.00 -1.26 -5.11 105.19 109.33 2rp3 n GLY 27 Ca -0.10 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.73 2rp3 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rp3 n GLY 28 N 4.61 0.30 3.57 -0.02 0.00 -1.26 -4.67 105.19 107.73 2rp3 n GLY 28 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2rp3 n GLY 28 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2rp3 s TYR 29 N 1.30 2.90 -0.05 1.61 2.02 -1.26 0.29 117.35 124.16 2rp3 s TYR 29 Ca 0.00 -0.01 0.01 0.00 -0.37 0.00 0.00 57.07 56.70 2rp3 s TYR 29 Cb 0.00 -1.68 0.02 0.00 -0.40 0.00 0.00 41.96 39.90 2rp3 s TYR 29 CO 0.00 0.33 -0.05 1.21 -1.57 0.00 0.00 175.55 175.46 2rp3 s ASN 30 N -0.94 1.17 -0.57 2.29 2.47 -0.50 -4.86 114.94 114.00 2rp3 s ASN 30 Ca 0.13 -0.15 -0.03 0.00 0.42 0.00 0.00 52.86 53.23 2rp3 s ASN 30 Cb -0.11 -0.51 0.15 0.00 -1.45 0.00 0.00 41.25 39.32 2rp3 s ASN 30 CO 0.03 -0.06 0.37 -0.89 -3.72 0.00 0.00 177.10 172.83 2rp3 s THR 31 N 1.03 3.58 0.48 -5.21 2.01 -1.26 -0.95 115.64 115.32 2rp3 s THR 31 Ca -0.09 -2.72 0.04 0.00 0.31 0.00 0.00 61.69 59.22 2rp3 s THR 31 Cb -0.14 -3.37 0.04 0.00 0.01 0.00 0.00 72.50 69.04 2rp3 s THR 31 CO -0.00 -0.83 0.32 -1.20 -0.69 0.00 0.00 174.62 172.22 2rp3 n SER 32 N 3.78 2.62 -3.84 3.53 7.64 -1.25 -4.94 113.62 121.17 2rp3 n SER 32 Ca 0.05 -2.69 -0.11 0.00 1.01 0.00 0.00 58.87 57.13 2rp3 n SER 32 Cb 0.39 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.51 2rp3 n SER 32 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2rp3 s SER 33 N -3.78 0.01 -0.05 6.43 1.04 -1.26 -2.69 113.70 113.41 2rp3 s SER 33 Ca 0.24 -0.33 -0.00 0.00 0.48 0.00 0.00 55.95 56.34 2rp3 s SER 33 Cb -0.02 0.29 0.03 0.00 0.10 0.00 0.00 66.02 66.42 2rp3 s SER 33 CO 0.15 -0.55 -0.01 -0.51 0.98 0.00 0.00 173.24 173.31 2rp3 s ILE 34 N -2.46 0.34 -0.06 -1.02 1.10 -0.14 -4.89 121.20 114.07 2rp3 s ILE 34 Ca -0.06 0.06 -0.30 0.00 -0.51 0.00 0.00 60.65 59.84 2rp3 s ILE 34 Cb -0.02 -0.45 -0.05 0.00 0.15 0.00 0.00 42.46 42.09 2rp3 s ILE 34 CO -0.03 0.21 1.60 -0.62 -2.11 0.00 0.00 174.94 173.99 2rp3 s ASP 35 N 1.42 6.71 0.00 4.50 -1.08 -1.26 -2.03 116.67 124.92 2rp3 s ASP 35 Ca -0.04 2.18 0.22 0.00 -0.52 0.00 0.00 52.55 54.39 2rp3 s ASP 35 Cb -0.13 -2.54 1.11 0.00 -1.46 0.00 0.00 42.92 39.90 2rp3 s ASP 35 CO -0.03 -0.89 1.71 0.18 0.52 0.00 0.00 175.17 176.66 2rp3 n LEU 36 N 6.92 0.00 0.25 -1.34 4.77 0.62 -2.77 117.00 125.45 2rp3 n LEU 36 Ca 0.17 0.30 0.13 0.00 -0.03 0.00 0.00 56.01 56.58 2rp3 n LEU 36 Cb 0.43 -0.30 0.52 0.00 -2.33 0.00 0.00 43.42 41.74 2rp3 n LEU 36 CO 0.62 -0.08 0.88 -1.13 -1.33 0.00 0.00 177.39 176.35 2rp3 h ASN 37 N 0.00 0.00 -0.13 -1.43 -0.73 -1.86 -1.44 115.58 109.99 2rp3 h ASN 37 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2rp3 h ASN 37 Cb 0.22 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.81 2rp3 h ASN 37 CO 0.00 0.11 0.00 -1.20 -0.37 0.00 0.00 177.43 175.97 2rp3 n SER 38 N -3.22 1.74 -0.25 1.15 7.64 -1.11 -3.16 113.62 116.40 2rp3 n SER 38 Ca 0.01 -1.67 0.00 0.00 1.01 0.00 0.00 58.87 58.22 2rp3 n SER 38 Cb 0.39 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 2rp3 n SER 38 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2rp3 n VAL 39 N 0.36 0.00 -4.03 0.44 0.24 -0.50 -4.68 118.33 110.16 2rp3 n VAL 39 Ca 0.17 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.32 2rp3 n VAL 39 Cb 0.36 0.56 -0.15 0.00 -1.47 0.00 0.00 33.84 33.14 2rp3 n VAL 39 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2rp3 s ILE 40 N 0.00 0.25 0.06 1.34 -1.09 0.41 -2.33 121.20 119.84 2rp3 s ILE 40 Ca 0.00 -0.10 0.07 0.00 -2.23 0.00 0.00 60.65 58.40 2rp3 s ILE 40 Cb 0.00 -0.24 -0.03 0.00 -1.58 0.00 0.00 42.46 40.61 2rp3 s ILE 40 CO 0.00 0.09 -0.20 0.00 -1.23 0.00 0.00 174.94 173.60 2rp3 s ALA 41 N 0.17 1.72 -0.38 9.38 0.00 -0.62 -1.90 121.76 130.12 2rp3 s ALA 41 Ca -0.01 -1.09 -0.14 0.00 0.00 0.00 0.00 51.96 50.72 2rp3 s ALA 41 Cb -0.04 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2rp3 s ALA 41 CO -0.00 0.37 0.27 0.00 0.00 0.00 0.00 175.76 176.40 2rp3 s ALA 42 N -0.90 3.47 -0.20 0.00 0.00 -1.26 -2.41 121.76 120.47 2rp3 s ALA 42 Ca 0.07 -1.61 -0.01 0.00 0.00 0.00 0.00 51.96 50.40 2rp3 s ALA 42 Cb -0.09 -2.79 0.06 0.00 0.00 0.00 0.00 23.12 20.29 2rp3 s ALA 42 CO 0.02 -1.30 -0.00 0.54 0.00 0.00 0.00 175.76 175.02 2rp3 s VAL 43 N 1.68 0.88 -1.66 0.00 0.11 -0.93 -4.79 120.40 115.69 2rp3 s VAL 43 Ca 0.05 -0.73 0.00 0.00 -2.93 0.00 0.00 61.98 58.37 2rp3 s VAL 43 Cb -0.18 -1.26 0.00 0.00 -1.53 0.00 0.00 36.38 33.40 2rp3 s VAL 43 CO 0.10 -0.12 0.00 0.47 -3.33 0.00 0.00 175.10 172.22 2rp3 n ASP 44 N 4.92 -5.29 -0.27 3.54 9.92 -1.26 -1.61 116.55 126.50 2rp3 n ASP 44 Ca -0.10 0.12 0.00 0.00 -0.53 0.00 0.00 54.79 54.27 2rp3 n ASP 44 Cb 0.46 -4.47 0.00 0.00 -0.64 0.00 0.00 41.12 36.47 2rp3 n ASP 44 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2rp3 n GLY 45 N -0.85 0.72 2.78 0.44 0.00 -1.19 -4.50 105.19 102.60 2rp3 n GLY 45 Ca -0.21 -0.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.86 2rp3 n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rp3 s SER 46 N -2.97 1.01 -0.25 1.61 0.01 -0.64 -4.67 113.70 107.79 2rp3 s SER 46 Ca 0.00 -0.03 -0.25 0.00 1.31 0.00 0.00 55.95 56.98 2rp3 s SER 46 Cb 0.00 -0.30 -0.00 0.00 0.21 0.00 0.00 66.02 65.93 2rp3 s SER 46 CO 0.00 -0.16 0.85 -0.76 0.41 0.00 0.00 173.24 173.58 2rp3 s LEU 47 N 1.56 4.08 0.08 2.44 1.43 -1.26 -2.20 118.68 124.81 2rp3 s LEU 47 Ca -0.02 1.01 0.09 0.00 -1.03 0.00 0.00 54.13 54.18 2rp3 s LEU 47 Cb -0.13 -3.21 -0.03 0.00 0.03 0.00 0.00 46.19 42.85 2rp3 s LEU 47 CO -0.03 -0.55 -0.24 -0.54 0.23 0.00 0.00 176.35 175.22 2rp3 s LYS 48 N 2.91 1.44 0.00 1.70 -0.14 -1.01 -4.89 119.74 119.75 2rp3 s LYS 48 Ca 0.35 -1.15 0.00 0.00 -1.36 0.00 0.00 55.97 53.81 2rp3 s LYS 48 Cb -0.15 -1.72 0.00 0.00 -1.68 0.00 0.00 37.83 34.28 2rp3 s LYS 48 CO 0.08 0.42 0.00 0.91 -0.76 0.00 0.00 175.35 176.00 2rp3 n TRP 49 N 1.39 -2.97 -4.16 3.18 7.02 -1.26 -1.59 117.44 119.05 2rp3 n TRP 49 Ca -0.18 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 55.94 2rp3 n TRP 49 Cb 0.53 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.35 2rp3 n TRP 49 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2rp3 n GLN 50 N -1.30 -0.78 -4.25 -0.99 10.64 -0.98 -4.61 117.38 115.10 2rp3 n GLN 50 Ca 0.00 0.11 -0.18 0.00 -1.83 0.00 0.00 57.00 55.10 2rp3 n GLN 50 Cb 0.00 -3.95 -0.08 0.00 -0.86 0.00 0.00 30.24 25.36 2rp3 n GLN 50 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 2rp3 s GLY 51 N -3.21 2.18 0.25 2.61 0.00 -1.18 -4.93 107.32 103.06 2rp3 s GLY 51 Ca 0.60 -1.99 -0.17 0.00 0.00 0.00 0.00 44.72 43.16 2rp3 s GLY 51 CO 0.90 -1.40 0.58 -1.35 0.00 0.00 0.00 173.10 171.83 2rp3 s SER 52 N -3.35 -0.18 -0.73 1.64 1.04 -0.80 0.16 113.70 111.48 2rp3 s SER 52 Ca 0.39 -0.75 -0.01 0.00 0.48 0.00 0.00 55.95 56.06 2rp3 s SER 52 Cb 0.02 0.64 -0.02 0.00 0.10 0.00 0.00 66.02 66.77 2rp3 s SER 52 CO 0.26 -1.22 0.62 -3.20 0.98 0.00 0.00 173.24 170.68 2rp3 n ASN 53 N -0.41 -3.17 -0.05 7.02 5.15 -1.19 -4.40 115.26 118.21 2rp3 n ASN 53 Ca -0.04 -0.42 -0.05 0.00 -0.60 0.00 0.00 54.58 53.47 2rp3 n ASN 53 Cb 0.61 -3.47 -0.08 0.00 -0.53 0.00 0.00 39.78 36.30 2rp3 n ASN 53 CO 0.00 0.00 0.00 2.22 1.40 0.00 0.00 177.26 180.88 2rp3 n PHE 54 N -2.84 0.00 0.14 1.20 1.16 -1.24 -4.13 117.46 111.76 2rp3 n PHE 54 Ca -0.13 0.00 0.01 0.00 -1.87 0.00 0.00 57.45 55.46 2rp3 n PHE 54 Cb 0.60 -0.52 0.32 0.00 -1.61 0.00 0.00 39.48 38.27 2rp3 n PHE 54 CO 0.00 0.00 0.00 0.97 -1.87 0.00 0.00 176.76 175.86 2rp3 h ILE 55 N 0.00 1.26 -0.55 1.97 6.09 -1.87 -0.73 117.51 123.67 2rp3 h ILE 55 Ca -0.29 -1.22 0.10 0.00 -1.37 0.00 0.00 64.86 62.08 2rp3 h ILE 55 Cb 1.65 1.56 -0.03 0.00 0.47 0.00 0.00 36.82 40.47 2rp3 h ILE 55 CO 0.01 0.36 0.37 -0.33 -3.07 0.00 0.00 178.15 175.50 2rp3 h GLU 56 N 0.12 0.33 -0.11 2.19 4.39 -1.99 -1.65 114.58 117.86 2rp3 h GLU 56 Ca 0.02 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2rp3 h GLU 56 Cb 0.63 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.20 2rp3 h GLU 56 CO 0.05 0.22 -0.05 0.00 -1.16 0.00 0.00 179.01 178.06 2rp3 n ALA 57 N -2.53 2.81 -2.74 3.43 0.00 -0.78 -5.03 120.51 115.67 2rp3 n ALA 57 Ca 0.09 -2.64 -0.10 0.00 0.00 0.00 0.00 53.44 50.79 2rp3 n ALA 57 Cb 0.38 -0.51 -0.09 0.00 0.00 0.00 0.00 19.45 19.23 2rp3 n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rp3 n ARG 59 N 0.65 0.67 -3.67 0.00 0.00 -0.39 -4.66 116.66 109.26 2rp3 n ARG 59 Ca -0.18 -2.36 -0.31 0.00 -0.00 0.00 0.00 57.85 55.00 2rp3 n ARG 59 Cb 0.59 2.36 0.04 0.00 -0.00 0.00 0.00 32.46 35.45 2rp3 n ARG 59 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2rp3 n ASN 60 N -1.65 -5.40 -4.83 2.89 3.02 -1.26 -1.83 115.26 106.19 2rp3 n ASN 60 Ca -0.01 -0.99 -0.36 0.00 -0.03 0.00 0.00 54.58 53.20 2rp3 n ASN 60 Cb 0.51 -3.35 -0.07 0.00 -0.61 0.00 0.00 39.78 36.27 2rp3 n ASN 60 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2rp3 s THR 61 N -3.43 5.18 0.38 3.41 -4.23 -1.26 -4.01 115.64 111.68 2rp3 s THR 61 Ca 0.44 0.01 -0.16 0.00 -1.18 0.00 0.00 61.69 60.80 2rp3 s THR 61 Cb -0.16 -3.27 0.05 0.00 1.34 0.00 0.00 72.50 70.46 2rp3 s THR 61 CO 0.86 0.55 0.79 0.00 -0.54 0.00 0.00 174.62 176.28 2rp3 s GLN 62 N -1.19 2.20 -0.07 3.99 -2.07 -0.62 -3.53 119.66 118.36 2rp3 s GLN 62 Ca 0.17 -1.40 -0.19 0.00 -1.82 0.00 0.00 55.36 52.12 2rp3 s GLN 62 Cb -0.12 0.62 -0.05 0.00 -1.09 0.00 0.00 33.01 32.38 2rp3 s GLN 62 CO 0.07 -1.03 0.51 -1.17 -1.32 0.00 0.00 175.29 172.35 2rp3 s LEU 63 N -3.06 4.34 -0.05 2.60 2.96 -1.26 -2.23 118.68 121.98 2rp3 s LEU 63 Ca 0.15 0.94 0.04 0.00 -0.22 0.00 0.00 54.13 55.05 2rp3 s LEU 63 Cb -0.05 -2.76 -0.00 0.00 0.50 0.00 0.00 46.19 43.87 2rp3 s LEU 63 CO 0.11 0.06 -0.18 0.00 -1.32 0.00 0.00 176.35 175.02 2rp3 s ALA 64 N 0.22 1.62 0.00 5.97 0.00 -0.49 -4.89 121.76 124.19 2rp3 s ALA 64 Ca 0.28 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2rp3 s ALA 64 Cb -0.16 -0.55 0.00 0.00 0.00 0.00 0.00 23.12 22.41 2rp3 s ALA 64 CO 0.13 0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.58 2rp3 n GLY 65 N 3.20 0.85 0.38 0.00 0.00 -1.26 -2.42 105.19 105.94 2rp3 n GLY 65 Ca -0.18 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2rp3 n GLY 65 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2rp3 n SER 66 N 2.10 -0.05 -1.85 1.61 7.64 -1.26 -4.98 113.62 116.83 2rp3 n SER 66 Ca 0.00 0.03 -0.01 0.00 1.01 0.00 0.00 58.87 59.90 2rp3 n SER 66 Cb 0.00 0.16 0.06 0.00 -1.01 0.00 0.00 64.21 63.42 2rp3 n SER 66 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2rp3 n SER 67 N -2.15 1.89 -4.49 6.43 3.41 -1.24 -4.94 113.62 112.52 2rp3 n SER 67 Ca 0.00 -2.60 -0.26 0.00 -0.26 0.00 0.00 58.87 55.75 2rp3 n SER 67 Cb 0.00 -0.40 -0.10 0.00 -0.26 0.00 0.00 64.21 63.44 2rp3 n SER 67 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2rp3 s GLU 68 N -2.30 1.77 -0.29 4.33 2.02 -1.01 0.15 118.70 123.37 2rp3 s GLU 68 Ca 0.35 -1.47 0.02 0.00 0.02 0.00 0.00 54.97 53.89 2rp3 s GLU 68 Cb 0.37 -1.96 0.08 0.00 0.10 0.00 0.00 34.13 32.72 2rp3 s GLU 68 CO -0.08 0.40 0.00 -1.17 0.02 0.00 0.00 175.26 174.43 2rp3 s LEU 69 N -2.91 3.45 -0.05 1.80 1.98 -0.19 -1.39 118.68 121.37 2rp3 s LEU 69 Ca 0.24 -1.66 -0.19 0.00 -2.89 0.00 0.00 54.13 49.63 2rp3 s LEU 69 Cb -0.08 -1.34 -0.05 0.00 0.66 0.00 0.00 46.19 45.38 2rp3 s LEU 69 CO 0.13 -0.31 0.54 0.00 -1.89 0.00 0.00 176.35 174.81 2rp3 s ALA 70 N 1.21 3.49 0.15 5.97 0.00 -0.95 -2.94 121.76 128.70 2rp3 s ALA 70 Ca 0.03 -0.07 -0.24 0.00 0.00 0.00 0.00 51.96 51.67 2rp3 s ALA 70 Cb -0.19 -2.68 0.06 0.00 0.00 0.00 0.00 23.12 20.31 2rp3 s ALA 70 CO -0.10 0.12 0.80 0.00 0.00 0.00 0.00 175.76 176.58 2rp3 s ALA 71 N 0.08 -1.57 -0.19 0.00 0.00 -0.02 -1.59 121.76 118.47 2rp3 s ALA 71 Ca 0.29 0.31 -0.05 0.00 0.00 0.00 0.00 51.96 52.51 2rp3 s ALA 71 Cb -0.17 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.63 2rp3 s ALA 71 CO 0.14 -0.89 -0.01 -1.21 0.00 0.00 0.00 175.76 173.79 2rp3 s GLU 72 N -3.51 3.63 -0.01 0.00 2.02 -0.76 -0.09 118.70 119.98 2rp3 s GLU 72 Ca 0.08 -0.52 0.06 0.00 0.02 0.00 0.00 54.97 54.61 2rp3 s GLU 72 Cb -0.02 -3.03 -0.02 0.00 0.10 0.00 0.00 34.13 31.16 2rp3 s GLU 72 CO -0.03 0.08 -0.20 0.00 0.02 0.00 0.00 175.26 175.13 2rp3 s LYS 74 N -0.57 4.40 0.94 0.00 2.20 -0.71 -1.78 119.74 124.21 2rp3 s LYS 74 Ca 0.08 1.80 -0.14 0.00 -0.36 0.00 0.00 55.97 57.35 2rp3 s LYS 74 Cb -0.08 -3.39 0.16 0.00 -1.51 0.00 0.00 37.83 33.01 2rp3 s LYS 74 CO -0.00 -0.33 1.17 0.95 -0.36 0.00 0.00 175.35 176.78 2rp3 s THR 75 N 1.34 1.95 0.58 3.43 -4.23 0.11 -3.15 115.64 115.69 2rp3 s THR 75 Ca 0.59 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 61.38 2rp3 s THR 75 Cb -0.30 -2.79 0.36 0.00 1.34 0.00 0.00 72.50 71.11 2rp3 s THR 75 CO 0.28 0.00 2.14 0.00 -0.54 0.00 0.00 174.62 176.50 2rp3 h ALA 76 N -1.59 1.76 0.00 3.99 0.00 -1.89 0.20 119.26 121.72 2rp3 h ALA 76 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2rp3 h ALA 76 Cb 1.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2rp3 h ALA 76 CO 0.55 -0.21 -0.42 0.00 0.00 0.00 0.00 179.25 179.17 2rp3 h ALA 77 N 1.84 0.74 -0.01 0.00 0.00 -1.96 -3.48 119.26 116.39 2rp3 h ALA 77 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2rp3 h ALA 77 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2rp3 h ALA 77 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2rp3 n GLY 78 N 1.27 1.46 3.16 0.00 0.00 0.69 -5.11 105.19 106.67 2rp3 n GLY 78 Ca 0.04 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2rp3 n GLY 78 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2rp3 s GLN 79 N -0.59 2.86 -0.28 1.61 0.74 -1.25 -4.78 119.66 117.96 2rp3 s GLN 79 Ca 0.00 -0.80 -0.29 0.00 0.05 0.00 0.00 55.36 54.32 2rp3 s GLN 79 Cb 0.00 -2.27 0.00 0.00 1.10 0.00 0.00 33.01 31.85 2rp3 s GLN 79 CO 0.00 0.04 1.22 -0.06 -0.55 0.00 0.00 175.29 175.94 2rp3 s PHE 80 N 0.68 2.88 0.56 1.67 0.08 -1.26 0.10 117.98 122.69 2rp3 s PHE 80 Ca -0.11 1.01 0.06 0.00 0.12 0.00 0.00 56.93 58.01 2rp3 s PHE 80 Cb -0.16 -3.75 0.05 0.00 -0.57 0.00 0.00 43.02 38.59 2rp3 s PHE 80 CO 0.02 -1.38 0.46 0.14 -0.10 0.00 0.00 175.22 174.36 2rp3 s VAL 81 N 3.96 1.63 -0.43 -0.44 -7.23 -0.73 -4.87 120.40 112.29 2rp3 s VAL 81 Ca 0.52 -1.43 -0.18 0.00 -1.81 0.00 0.00 61.98 59.08 2rp3 s VAL 81 Cb -0.16 -2.06 0.02 0.00 0.56 0.00 0.00 36.38 34.74 2rp3 s VAL 81 CO 0.19 0.00 0.46 -0.94 -0.31 0.00 0.00 175.10 174.50 2rp3 s SER 82 N -4.35 6.21 -0.02 4.85 1.04 -1.26 -2.86 113.70 117.30 2rp3 s SER 82 Ca 0.36 -0.67 0.01 0.00 0.48 0.00 0.00 55.95 56.14 2rp3 s SER 82 Cb -0.03 -2.23 -0.03 0.00 0.10 0.00 0.00 66.02 63.82 2rp3 s SER 82 CO 0.23 -0.61 -0.01 0.42 0.98 0.00 0.00 173.24 174.25 2rp3 s THR 83 N 2.20 4.08 0.02 2.02 -4.23 0.88 -4.99 115.64 115.63 2rp3 s THR 83 Ca 0.13 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 60.08 2rp3 s THR 83 Cb -0.17 -2.78 -0.02 0.00 1.34 0.00 0.00 72.50 70.86 2rp3 s THR 83 CO 0.14 0.43 -0.03 -1.59 -0.54 0.00 0.00 174.62 173.03 2rp3 s LYS 84 N -1.37 0.35 -0.22 3.99 0.00 -1.26 -0.84 119.74 120.39 2rp3 s LYS 84 Ca 0.18 -0.67 -0.19 0.00 0.00 0.00 0.00 55.97 55.28 2rp3 s LYS 84 Cb -0.11 0.08 0.06 0.00 0.00 0.00 0.00 37.83 37.86 2rp3 s LYS 84 CO 0.08 -0.05 0.58 -1.50 0.00 0.00 0.00 175.35 174.46 2rp3 s ILE 85 N -1.64 -0.00 -0.41 3.79 2.07 -1.15 -4.79 121.20 119.07 2rp3 s ILE 85 Ca -0.14 0.00 -0.29 0.00 -1.41 0.00 0.00 60.65 58.82 2rp3 s ILE 85 Cb -0.09 -0.81 0.02 0.00 0.13 0.00 0.00 42.46 41.71 2rp3 s ILE 85 CO -0.02 0.00 1.22 0.21 -1.91 0.00 0.00 174.94 174.44 2rp3 s ASN 86 N 0.43 6.62 0.42 4.50 3.04 -1.26 -1.02 114.94 127.66 2rp3 s ASN 86 Ca -0.01 0.76 0.11 0.00 0.04 0.00 0.00 52.86 53.76 2rp3 s ASN 86 Cb -0.04 -2.55 0.90 0.00 -1.54 0.00 0.00 41.25 38.02 2rp3 s ASN 86 CO -0.01 -1.21 1.97 -0.07 -3.04 0.00 0.00 177.10 174.75 2rp3 h LEU 87 N 11.21 0.17 -0.12 3.21 3.38 0.11 -1.15 115.31 132.12 2rp3 h LEU 87 Ca -0.24 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2rp3 h LEU 87 Cb 1.08 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2rp3 h LEU 87 CO 1.09 0.29 0.00 0.47 0.09 0.00 0.00 178.44 180.38 2rp3 n ASP 88 N -4.34 0.10 0.17 -0.43 8.00 -1.18 -0.62 116.55 118.25 2rp3 n ASP 88 Ca -0.01 0.53 0.06 0.00 0.71 0.00 0.00 54.79 56.08 2rp3 n ASP 88 Cb 0.22 -0.55 0.54 0.00 -0.02 0.00 0.00 41.12 41.31 2rp3 n ASP 88 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 2rp3 h ASP 89 N 0.00 0.16 0.00 -2.24 1.82 -1.53 0.12 116.42 114.75 2rp3 h ASP 89 Ca 0.00 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 2rp3 h ASP 89 Cb 0.23 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.20 2rp3 h ASP 89 CO 0.00 0.16 0.00 1.41 -1.61 0.00 0.00 179.24 179.20 2rp3 n HIS 90 N -4.47 0.00 -1.66 0.28 8.25 -1.11 -4.58 115.22 111.93 2rp3 n HIS 90 Ca -0.01 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 56.99 2rp3 n HIS 90 Cb 0.12 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.19 2rp3 n HIS 90 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2rp3 n ILE 91 N -1.34 0.62 -4.58 1.59 2.08 0.21 -1.94 119.36 116.00 2rp3 n ILE 91 Ca 0.00 -0.16 -0.29 0.00 0.56 0.00 0.00 62.75 62.86 2rp3 n ILE 91 Cb 0.00 -2.10 -0.09 0.00 -0.75 0.00 0.00 39.64 36.69 2rp3 n ILE 91 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2rp3 s ALA 92 N 4.78 3.53 -0.26 -1.39 0.00 0.76 -1.90 121.76 127.29 2rp3 s ALA 92 Ca 0.93 -1.69 -0.03 0.00 0.00 0.00 0.00 51.96 51.17 2rp3 s ALA 92 Cb -0.57 0.04 0.02 0.00 0.00 0.00 0.00 23.12 22.61 2rp3 s ALA 92 CO 0.46 -0.11 -0.03 1.21 0.00 0.00 0.00 175.76 177.30 2rp3 s ASN 93 N -3.80 4.50 -0.34 0.00 2.47 -1.26 -1.66 114.94 114.86 2rp3 s ASN 93 Ca 0.27 -0.85 -0.01 0.00 0.42 0.00 0.00 52.86 52.69 2rp3 s ASN 93 Cb 0.06 -1.71 0.08 0.00 -1.45 0.00 0.00 41.25 38.23 2rp3 s ASN 93 CO 0.14 -0.14 0.07 -0.63 -3.72 0.00 0.00 177.10 172.82 2rp3 s ILE 94 N 1.36 2.97 -1.82 -5.21 -1.09 0.84 -4.64 121.20 113.60 2rp3 s ILE 94 Ca 0.00 -1.74 0.00 0.00 -2.23 0.00 0.00 60.65 56.69 2rp3 s ILE 94 Cb -0.17 -2.88 0.00 0.00 -1.58 0.00 0.00 42.46 37.84 2rp3 s ILE 94 CO -0.03 -0.36 0.00 0.47 -1.23 0.00 0.00 174.94 173.79 2rp3 n ASP 95 N 4.56 -5.87 0.00 3.58 9.92 -1.26 -1.49 116.55 125.99 2rp3 n ASP 95 Ca -0.07 0.03 0.00 0.00 -0.53 0.00 0.00 54.79 54.22 2rp3 n ASP 95 Cb 0.42 -4.90 0.00 0.00 -0.64 0.00 0.00 41.12 36.00 2rp3 n ASP 95 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2rp3 n GLY 96 N -0.96 0.70 3.45 0.44 0.00 -1.24 -3.94 105.19 103.64 2rp3 n GLY 96 Ca -0.24 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 2rp3 n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rp3 s THR 97 N -2.00 2.69 -0.20 2.61 -4.23 -0.56 -4.29 115.64 109.66 2rp3 s THR 97 Ca 0.00 -1.37 -0.20 0.00 -1.18 0.00 0.00 61.69 58.94 2rp3 s THR 97 Cb 0.00 -2.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.65 2rp3 s THR 97 CO 0.00 0.24 0.59 -0.76 -0.54 0.00 0.00 174.62 174.15 2rp3 s LEU 98 N -1.71 4.14 0.07 4.79 1.43 -1.26 -0.11 118.68 126.03 2rp3 s LEU 98 Ca 0.15 0.77 -0.01 0.00 -1.03 0.00 0.00 54.13 54.02 2rp3 s LEU 98 Cb -0.10 -2.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.26 2rp3 s LEU 98 CO 0.07 -0.24 -0.02 -0.54 0.23 0.00 0.00 176.35 175.84 2rp3 s LYS 99 N 1.82 0.69 -0.10 1.70 1.02 -0.66 -4.64 119.74 119.57 2rp3 s LYS 99 Ca 0.27 -1.27 -0.16 0.00 0.02 0.00 0.00 55.97 54.83 2rp3 s LYS 99 Cb -0.16 0.15 -0.05 0.00 -0.52 0.00 0.00 37.83 37.26 2rp3 s LYS 99 CO 0.10 -0.12 0.41 -0.47 -0.92 0.00 0.00 175.35 174.35 2rp3 s TYR 100 N -3.89 3.56 -0.85 3.18 5.04 -1.26 -0.17 117.35 122.96 2rp3 s TYR 100 Ca 0.10 0.84 0.07 0.00 -2.44 0.00 0.00 57.07 55.64 2rp3 s TYR 100 Cb 0.08 -2.42 0.05 0.00 0.35 0.00 0.00 41.96 40.01 2rp3 s TYR 100 CO -0.07 0.31 0.71 0.39 -1.34 0.00 0.00 175.55 175.55