#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 1.55 3.96 -0.72 0.00 -1.19 -4.70 105.19 104.09 2rp3 n GLY 2 Ca 0.00 -0.65 -0.28 0.00 0.00 0.00 0.00 46.02 45.09 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 10.01 -0.89 0.03 1.61 4.76 -0.57 -4.02 118.16 129.09 2rp3 n LYS 3 Ca 0.00 0.09 -0.03 0.00 -2.87 0.00 0.00 58.31 55.49 2rp3 n LYS 3 Cb 0.00 -3.16 0.20 0.00 -1.84 0.00 0.00 35.03 30.22 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 -1.07 0.49 -0.86 2.13 -0.00 -1.70 -2.73 116.94 113.19 2rp3 h PHE 4 Ca -0.51 -0.11 0.22 0.00 -0.00 0.00 0.00 57.97 57.57 2rp3 h PHE 4 Cb 1.12 -0.12 -0.05 0.00 -0.00 0.00 0.00 35.95 36.91 2rp3 h PHE 4 CO 0.47 0.69 0.60 1.03 -0.00 0.00 0.00 178.31 181.09 2rp3 h SER 5 N 0.37 0.19 -0.29 -0.68 0.87 -1.84 0.34 113.55 112.51 2rp3 h SER 5 Ca 0.05 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.64 2rp3 h SER 5 Cb 0.73 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 2rp3 h SER 5 CO 0.06 0.07 0.19 1.56 -0.53 0.00 0.00 176.83 178.18 2rp3 h GLN 6 N 0.19 0.37 0.00 2.24 4.20 -1.86 -2.78 115.11 117.47 2rp3 h GLN 6 Ca 0.43 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 59.09 2rp3 h GLN 6 Cb 1.39 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 29.03 2rp3 h GLN 6 CO -0.09 0.24 -0.40 -2.37 -0.67 0.00 0.00 178.83 175.55 2rp3 n THR 7 N -4.49 1.50 -4.26 -0.54 5.66 0.48 -5.03 114.28 107.60 2rp3 n THR 7 Ca 0.01 -2.17 -0.17 0.00 -3.05 0.00 0.00 64.05 58.68 2rp3 n THR 7 Cb 0.08 0.03 -0.14 0.00 -1.55 0.00 0.00 70.33 68.75 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 -0.35 0.63 -1.28 0.00 1.13 0.58 -4.62 117.35 113.43 2rp3 s TYR 9 Ca 0.01 -1.02 -0.04 0.00 -1.41 0.00 0.00 57.07 54.61 2rp3 s TYR 9 Cb -0.04 -0.31 0.01 0.00 -1.10 0.00 0.00 41.96 40.52 2rp3 s TYR 9 CO -0.00 -0.57 1.03 -1.71 -2.51 0.00 0.00 175.55 171.80 2rp3 n ASN 10 N -0.10 -3.58 -4.84 -0.18 5.15 -1.26 -1.35 115.26 109.09 2rp3 n ASN 10 Ca -0.08 -0.62 -0.32 0.00 -0.60 0.00 0.00 54.58 52.96 2rp3 n ASN 10 Cb 0.63 -4.93 -0.05 0.00 -0.53 0.00 0.00 39.78 34.91 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 -3.95 6.74 -0.00 1.20 1.04 -1.26 -3.94 113.70 113.52 2rp3 s SER 11 Ca 0.24 1.55 -0.28 0.00 0.48 0.00 0.00 55.95 57.93 2rp3 s SER 11 Cb -0.11 -2.49 0.07 0.00 0.10 0.00 0.00 66.02 63.59 2rp3 s SER 11 CO 0.74 -0.46 0.64 0.00 0.98 0.00 0.00 173.24 175.14 2rp3 s ALA 12 N -2.40 -1.67 -0.00 5.32 0.00 0.17 -4.92 121.76 118.26 2rp3 s ALA 12 Ca 0.59 1.07 0.01 0.00 0.00 0.00 0.00 51.96 53.63 2rp3 s ALA 12 Cb -0.10 0.20 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 2rp3 s ALA 12 CO 0.24 -0.45 -0.04 0.42 0.00 0.00 0.00 175.76 175.93 2rp3 s ILE 13 N -1.78 0.30 -0.34 0.00 1.01 -1.26 -0.10 121.20 119.03 2rp3 s ILE 13 Ca -0.08 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.38 2rp3 s ILE 13 Cb -0.00 -0.27 0.16 0.00 0.01 0.00 0.00 42.46 42.35 2rp3 s ILE 13 CO 0.05 0.05 0.42 -1.58 0.00 0.00 0.00 174.94 173.87 2rp3 s GLN 14 N -0.19 0.55 0.00 2.79 -0.44 -1.10 -4.09 119.66 117.19 2rp3 s GLN 14 Ca 0.01 -0.33 0.00 0.00 -2.50 0.00 0.00 55.36 52.54 2rp3 s GLN 14 Cb -0.02 -0.43 0.00 0.00 -1.64 0.00 0.00 33.01 30.92 2rp3 s GLN 14 CO -0.00 -1.12 0.00 0.41 0.50 0.00 0.00 175.29 175.08 2rp3 n GLY 15 N 4.79 2.00 0.45 2.59 0.00 -1.24 -4.03 105.19 109.75 2rp3 n GLY 15 Ca 0.06 -0.58 0.00 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 4.04 0.00 -4.24 1.61 2.88 -1.26 -4.51 113.62 112.14 2rp3 n SER 16 Ca 0.00 -1.18 -0.33 0.00 -1.33 0.00 0.00 58.87 56.04 2rp3 n SER 16 Cb 0.00 -0.04 -0.16 0.00 -0.75 0.00 0.00 64.21 63.26 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 2.34 -0.14 2.46 0.11 -1.26 0.04 120.40 123.94 2rp3 s VAL 17 Ca 0.00 -0.90 -0.11 0.00 -2.93 0.00 0.00 61.98 58.04 2rp3 s VAL 17 Cb 0.00 -1.94 -0.05 0.00 -1.53 0.00 0.00 36.38 32.86 2rp3 s VAL 17 CO 0.00 0.54 0.22 -0.22 -3.33 0.00 0.00 175.10 172.31 2rp3 s LEU 18 N 0.57 4.30 -0.04 2.54 0.20 -0.65 -2.71 118.68 122.88 2rp3 s LEU 18 Ca -0.12 0.47 0.01 0.00 0.69 0.00 0.00 54.13 55.18 2rp3 s LEU 18 Cb -0.16 -2.24 0.02 0.00 -0.43 0.00 0.00 46.19 43.38 2rp3 s LEU 18 CO 0.04 0.22 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.39 2rp3 s THR 19 N -0.10 0.52 -0.18 3.68 2.01 0.85 -1.35 115.64 121.07 2rp3 s THR 19 Ca 0.14 -0.12 -0.27 0.00 0.31 0.00 0.00 61.69 61.75 2rp3 s THR 19 Cb -0.13 -0.55 0.07 0.00 0.01 0.00 0.00 72.50 71.91 2rp3 s THR 19 CO 0.03 0.22 0.70 -0.55 -0.69 0.00 0.00 174.62 174.33 2rp3 s SER 20 N 0.86 -0.70 -0.16 3.53 0.15 -1.13 0.44 113.70 116.69 2rp3 s SER 20 Ca -0.11 1.13 -0.24 0.00 0.70 0.00 0.00 55.95 57.42 2rp3 s SER 20 Cb -0.14 1.07 -0.02 0.00 -1.71 0.00 0.00 66.02 65.22 2rp3 s SER 20 CO 0.00 -0.40 0.79 -0.89 1.20 0.00 0.00 173.24 173.94 2rp3 s THR 21 N -0.28 4.92 0.15 6.45 2.01 -0.46 -3.47 115.64 124.96 2rp3 s THR 21 Ca -0.05 1.55 0.06 0.00 0.31 0.00 0.00 61.69 63.56 2rp3 s THR 21 Cb -0.03 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 2rp3 s THR 21 CO 0.05 0.07 -0.13 0.00 -0.69 0.00 0.00 174.62 173.92 2rp3 s GLU 23 N -3.19 4.18 1.15 0.00 2.02 -1.15 -1.19 118.70 120.52 2rp3 s GLU 23 Ca 0.14 1.15 -0.12 0.00 0.02 0.00 0.00 54.97 56.16 2rp3 s GLU 23 Cb -0.02 -3.67 0.28 0.00 0.10 0.00 0.00 34.13 30.82 2rp3 s GLU 23 CO 0.03 -0.67 1.03 0.54 0.02 0.00 0.00 175.26 176.22 2rp3 n ARG 24 N 6.36 -2.29 -0.07 1.61 1.74 0.23 -3.59 116.66 120.65 2rp3 n ARG 24 Ca 0.10 -0.63 -0.07 0.00 -0.77 0.00 0.00 57.85 56.48 2rp3 n ARG 24 Cb 0.47 -2.19 -0.15 0.00 -1.02 0.00 0.00 32.46 29.56 2rp3 n ARG 24 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2rp3 n THR 25 N -4.93 1.23 -0.06 0.55 -1.04 -1.26 -4.70 114.28 104.08 2rp3 n THR 25 Ca 0.04 -0.80 -0.07 0.00 -2.04 0.00 0.00 64.05 61.18 2rp3 n THR 25 Cb 0.54 -0.48 -0.02 0.00 -1.82 0.00 0.00 70.33 68.54 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 -2.73 1.76 -1.97 8.00 2.85 -1.26 -5.04 115.26 116.87 2rp3 n ASN 26 Ca -0.27 0.29 0.00 0.00 -0.11 0.00 0.00 54.58 54.50 2rp3 n ASN 26 Cb 1.06 -0.66 0.00 0.00 1.24 0.00 0.00 39.78 41.42 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 1.84 0.87 0.00 8.20 0.00 -1.26 -5.10 105.19 109.73 2rp3 n GLY 27 Ca -0.11 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 4.96 -0.14 3.72 -0.02 0.00 -1.26 -4.55 105.19 107.90 2rp3 n GLY 28 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 0.54 2.87 -0.23 1.61 2.02 -1.26 0.76 117.35 123.65 2rp3 s TYR 29 Ca 0.00 -0.17 -0.08 0.00 -0.37 0.00 0.00 57.07 56.45 2rp3 s TYR 29 Cb 0.00 -1.29 0.11 0.00 -0.40 0.00 0.00 41.96 40.38 2rp3 s TYR 29 CO 0.00 0.58 0.50 1.21 -1.57 0.00 0.00 175.55 176.27 2rp3 s ASN 30 N -3.67 -0.57 -0.61 2.29 2.47 -0.33 -4.74 114.94 109.76 2rp3 s ASN 30 Ca 0.32 1.20 -0.14 0.00 0.42 0.00 0.00 52.86 54.65 2rp3 s ASN 30 Cb -0.07 1.69 0.15 0.00 -1.45 0.00 0.00 41.25 41.57 2rp3 s ASN 30 CO 0.22 -0.23 0.55 -0.89 -3.72 0.00 0.00 177.10 173.03 2rp3 s THR 31 N 2.72 5.14 0.51 -5.21 2.01 -1.26 -1.99 115.64 117.55 2rp3 s THR 31 Ca -0.03 -1.85 0.06 0.00 0.31 0.00 0.00 61.69 60.17 2rp3 s THR 31 Cb -0.12 -4.27 0.06 0.00 0.01 0.00 0.00 72.50 68.18 2rp3 s THR 31 CO -0.15 -0.90 0.49 -1.54 -0.69 0.00 0.00 174.62 171.82 2rp3 n SER 32 N 4.80 2.38 -3.81 3.53 3.41 -1.23 -4.94 113.62 117.76 2rp3 n SER 32 Ca -0.05 -2.62 -0.12 0.00 -0.26 0.00 0.00 58.87 55.82 2rp3 n SER 32 Cb 0.42 -0.15 -0.09 0.00 -0.26 0.00 0.00 64.21 64.13 2rp3 n SER 32 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2rp3 s SER 33 N -4.04 -0.09 -0.03 4.04 1.04 -1.26 -2.84 113.70 110.53 2rp3 s SER 33 Ca 0.37 -0.06 -0.00 0.00 0.48 0.00 0.00 55.95 56.73 2rp3 s SER 33 Cb -0.03 0.26 0.03 0.00 0.10 0.00 0.00 66.02 66.38 2rp3 s SER 33 CO 0.23 -0.42 0.03 -0.51 0.98 0.00 0.00 173.24 173.55 2rp3 s ILE 34 N -1.41 -0.01 -0.11 -1.02 1.10 -0.46 -4.87 121.20 114.42 2rp3 s ILE 34 Ca -0.14 0.24 -0.29 0.00 -0.51 0.00 0.00 60.65 59.95 2rp3 s ILE 34 Cb -0.06 -0.15 -0.04 0.00 0.15 0.00 0.00 42.46 42.37 2rp3 s ILE 34 CO 0.03 0.13 1.47 -0.62 -2.11 0.00 0.00 174.94 173.83 2rp3 s ASP 35 N 1.35 6.80 0.00 4.50 -1.08 -1.26 -1.64 116.67 125.34 2rp3 s ASP 35 Ca -0.05 1.98 0.26 0.00 -0.52 0.00 0.00 52.55 54.21 2rp3 s ASP 35 Cb -0.13 -2.54 1.32 0.00 -1.46 0.00 0.00 42.92 40.12 2rp3 s ASP 35 CO -0.03 -0.85 1.88 0.18 0.52 0.00 0.00 175.17 176.87 2rp3 n LEU 36 N 6.87 0.00 0.25 -1.34 4.77 0.11 -2.95 117.00 124.70 2rp3 n LEU 36 Ca 0.16 0.26 0.13 0.00 -0.03 0.00 0.00 56.01 56.53 2rp3 n LEU 36 Cb 0.44 -0.26 0.58 0.00 -2.33 0.00 0.00 43.42 41.84 2rp3 n LEU 36 CO 0.59 -0.04 0.90 -1.13 -1.33 0.00 0.00 177.39 176.38 2rp3 h ASN 37 N 0.00 0.00 -0.16 -1.43 -0.73 -1.86 0.50 115.58 111.90 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 0.13 0.00 -1.20 -0.37 0.00 0.00 177.43 175.99 2rp3 n SER 38 N -3.30 1.82 0.00 1.15 7.64 -1.15 -3.47 113.62 116.31 2rp3 n SER 38 Ca 0.00 -1.72 0.00 0.00 1.01 0.00 0.00 58.87 58.17 2rp3 n SER 38 Cb 0.36 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 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 0.42 0.00 -4.49 0.44 0.24 -0.49 -4.67 118.33 109.78 2rp3 n VAL 39 Ca 0.17 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.26 2rp3 n VAL 39 Cb 0.36 0.73 -0.15 0.00 -1.47 0.00 0.00 33.84 33.31 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 0.90 0.06 1.34 -1.09 0.30 -2.07 121.20 120.64 2rp3 s ILE 40 Ca 0.00 -0.46 0.06 0.00 -2.23 0.00 0.00 60.65 58.02 2rp3 s ILE 40 Cb 0.00 -0.76 -0.03 0.00 -1.58 0.00 0.00 42.46 40.09 2rp3 s ILE 40 CO 0.00 0.26 -0.17 0.00 -1.23 0.00 0.00 174.94 173.80 2rp3 s ALA 41 N -0.11 1.40 -0.31 9.38 0.00 -0.47 -1.86 121.76 129.80 2rp3 s ALA 41 Ca 0.02 -0.99 -0.08 0.00 0.00 0.00 0.00 51.96 50.91 2rp3 s ALA 41 Cb -0.06 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.86 2rp3 s ALA 41 CO -0.00 0.27 0.12 0.00 0.00 0.00 0.00 175.76 176.15 2rp3 s ALA 42 N -0.99 3.18 -0.28 0.00 0.00 -1.26 -2.02 121.76 120.39 2rp3 s ALA 42 Ca 0.03 -1.44 -0.00 0.00 0.00 0.00 0.00 51.96 50.54 2rp3 s ALA 42 Cb -0.09 -2.29 0.09 0.00 0.00 0.00 0.00 23.12 20.82 2rp3 s ALA 42 CO 0.02 -0.95 0.05 0.08 0.00 0.00 0.00 175.76 174.96 2rp3 s VAL 43 N 1.56 1.14 -1.61 0.00 1.01 -0.80 -4.78 120.40 116.93 2rp3 s VAL 43 Ca 0.03 -1.36 0.00 0.00 0.00 0.00 0.00 61.98 60.65 2rp3 s VAL 43 Cb -0.17 -1.73 0.00 0.00 0.00 0.00 0.00 36.38 34.47 2rp3 s VAL 43 CO 0.05 -0.48 0.00 -0.67 0.00 0.00 0.00 175.10 174.00 2rp3 n ASP 44 N 4.76 -5.28 -0.22 3.32 -0.08 -1.26 -2.45 116.55 115.34 2rp3 n ASP 44 Ca -0.04 0.04 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2rp3 n ASP 44 Cb 0.43 -4.36 0.00 0.00 2.34 0.00 0.00 41.12 39.54 2rp3 n ASP 44 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2rp3 n GLY 45 N -0.98 0.86 2.84 0.27 0.00 -1.14 -4.47 105.19 102.56 2rp3 n GLY 45 Ca -0.21 -0.61 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.79 1.24 -0.31 1.61 0.01 -1.02 -4.71 113.70 107.73 2rp3 s SER 46 Ca 0.00 -0.11 -0.21 0.00 1.31 0.00 0.00 55.95 56.94 2rp3 s SER 46 Cb 0.00 -0.45 -0.01 0.00 0.21 0.00 0.00 66.02 65.77 2rp3 s SER 46 CO 0.00 -0.12 0.67 -0.76 0.41 0.00 0.00 173.24 173.44 2rp3 s LEU 47 N 1.40 4.14 0.09 2.44 1.43 -1.26 -1.90 118.68 125.02 2rp3 s LEU 47 Ca -0.04 0.47 0.09 0.00 -1.03 0.00 0.00 54.13 53.63 2rp3 s LEU 47 Cb -0.13 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.17 2rp3 s LEU 47 CO -0.03 -0.52 -0.24 -0.54 0.23 0.00 0.00 176.35 175.25 2rp3 s LYS 48 N 2.70 1.41 0.00 1.70 -0.14 -0.85 -4.91 119.74 119.65 2rp3 s LYS 48 Ca 0.27 -1.20 0.00 0.00 -1.36 0.00 0.00 55.97 53.68 2rp3 s LYS 48 Cb -0.15 -1.73 0.00 0.00 -1.68 0.00 0.00 37.83 34.27 2rp3 s LYS 48 CO 0.12 0.42 0.00 0.91 -0.76 0.00 0.00 175.35 176.04 2rp3 n TRP 49 N 1.27 -2.06 -3.01 3.18 7.02 -1.26 -1.36 117.44 121.21 2rp3 n TRP 49 Ca -0.18 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.13 2rp3 n TRP 49 Cb 0.53 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.38 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 -1.09 -0.91 -4.30 -0.99 -0.00 -0.88 -4.53 117.38 104.68 2rp3 n GLN 50 Ca 0.00 0.05 -0.19 0.00 -0.00 0.00 0.00 57.00 56.86 2rp3 n GLN 50 Cb 0.00 -1.85 -0.08 0.00 -0.00 0.00 0.00 30.24 28.31 2rp3 n GLN 50 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2rp3 s GLY 51 N -2.63 2.30 0.29 2.61 0.00 -1.12 -4.93 107.32 103.84 2rp3 s GLY 51 Ca 0.22 -1.99 -0.13 0.00 0.00 0.00 0.00 44.72 42.82 2rp3 s GLY 51 CO 0.44 -1.50 0.57 -1.35 0.00 0.00 0.00 173.10 171.26 2rp3 s SER 52 N -3.38 0.05 -0.92 1.64 1.04 -0.77 0.11 113.70 111.46 2rp3 s SER 52 Ca 0.39 -0.99 -0.04 0.00 0.48 0.00 0.00 55.95 55.80 2rp3 s SER 52 Cb 0.03 0.66 -0.04 0.00 0.10 0.00 0.00 66.02 66.77 2rp3 s SER 52 CO 0.26 -1.28 0.80 0.59 0.98 0.00 0.00 173.24 174.58 2rp3 n ASN 53 N -0.70 -4.95 -0.04 7.02 4.13 -1.23 -4.35 115.26 115.14 2rp3 n ASN 53 Ca -0.03 -0.58 -0.06 0.00 1.68 0.00 0.00 54.58 55.60 2rp3 n ASN 53 Cb 0.61 -4.48 -0.05 0.00 -1.54 0.00 0.00 39.78 34.32 2rp3 n ASN 53 CO 0.00 0.00 0.00 2.22 0.28 0.00 0.00 177.26 179.76 2rp3 n PHE 54 N -3.14 0.00 -0.21 3.10 1.16 -1.25 -4.02 117.46 113.11 2rp3 n PHE 54 Ca -0.11 0.00 -0.01 0.00 -1.87 0.00 0.00 57.45 55.46 2rp3 n PHE 54 Cb 0.61 -0.38 0.20 0.00 -1.61 0.00 0.00 39.48 38.30 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 1.21 -0.55 1.97 6.09 -1.88 0.13 117.51 124.49 2rp3 h ILE 55 Ca -0.22 -0.55 0.12 0.00 -1.37 0.00 0.00 64.86 62.84 2rp3 h ILE 55 Cb 1.40 0.27 -0.03 0.00 0.47 0.00 0.00 36.82 38.93 2rp3 h ILE 55 CO -0.01 0.24 0.38 1.05 -3.07 0.00 0.00 178.15 176.74 2rp3 h GLU 56 N 0.99 0.22 -0.23 2.19 4.11 -1.99 -0.70 114.58 119.17 2rp3 h GLU 56 Ca 0.25 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.67 2rp3 h GLU 56 Cb 0.04 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2rp3 h GLU 56 CO -0.04 0.14 0.00 0.00 0.07 0.00 0.00 179.01 179.19 2rp3 n ALA 57 N -2.57 2.54 -2.52 1.06 0.00 -0.57 -5.01 120.51 113.45 2rp3 n ALA 57 Ca 0.09 -1.83 -0.08 0.00 0.00 0.00 0.00 53.44 51.62 2rp3 n ALA 57 Cb 0.46 -0.51 -0.10 0.00 0.00 0.00 0.00 19.45 19.30 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 0.62 0.96 -3.59 0.00 0.00 -0.63 -4.61 116.66 109.40 2rp3 n ARG 59 Ca -0.18 -2.54 -0.24 0.00 -0.00 0.00 0.00 57.85 54.89 2rp3 n ARG 59 Cb 0.59 2.79 0.05 0.00 -0.00 0.00 0.00 32.46 35.89 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 -1.57 -4.37 -4.81 2.89 3.02 -1.26 -2.27 115.26 106.89 2rp3 n ASN 60 Ca -0.05 -0.89 -0.38 0.00 -0.03 0.00 0.00 54.58 53.24 2rp3 n ASN 60 Cb 0.60 -4.01 -0.06 0.00 -0.61 0.00 0.00 39.78 35.70 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 -3.51 5.14 0.24 3.41 -4.23 -1.26 -4.12 115.64 111.31 2rp3 s THR 61 Ca 0.33 0.74 -0.20 0.00 -1.18 0.00 0.00 61.69 61.38 2rp3 s THR 61 Cb -0.09 -3.68 0.03 0.00 1.34 0.00 0.00 72.50 70.10 2rp3 s THR 61 CO 0.82 0.53 0.65 0.00 -0.54 0.00 0.00 174.62 176.08 2rp3 s GLN 62 N -0.65 1.61 0.08 3.99 -2.07 -0.80 -3.69 119.66 118.14 2rp3 s GLN 62 Ca 0.22 -0.88 -0.23 0.00 -1.82 0.00 0.00 55.36 52.65 2rp3 s GLN 62 Cb -0.15 0.59 -0.07 0.00 -1.09 0.00 0.00 33.01 32.29 2rp3 s GLN 62 CO 0.11 -0.72 0.70 -1.17 -1.32 0.00 0.00 175.29 172.88 2rp3 s LEU 63 N -2.88 4.51 -0.03 2.60 2.96 -1.26 -1.85 118.68 122.72 2rp3 s LEU 63 Ca 0.09 1.42 0.04 0.00 -0.22 0.00 0.00 54.13 55.47 2rp3 s LEU 63 Cb -0.04 -3.13 -0.01 0.00 0.50 0.00 0.00 46.19 43.51 2rp3 s LEU 63 CO 0.02 0.15 -0.16 0.00 -1.32 0.00 0.00 176.35 175.04 2rp3 s ALA 64 N -0.65 1.36 0.00 5.97 0.00 0.12 -4.89 121.76 123.66 2rp3 s ALA 64 Ca 0.34 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2rp3 s ALA 64 Cb -0.21 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.51 2rp3 s ALA 64 CO 0.22 0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.68 2rp3 n GLY 65 N 2.94 1.00 0.02 0.00 0.00 -1.26 -2.23 105.19 105.67 2rp3 n GLY 65 Ca -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2rp3 n GLY 65 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2rp3 n SER 66 N 2.32 0.00 -1.34 1.61 2.88 -1.26 -4.98 113.62 112.85 2rp3 n SER 66 Ca 0.00 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.58 2rp3 n SER 66 Cb 0.00 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 63.53 2rp3 n SER 66 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2rp3 n SER 67 N -0.76 1.19 -4.49 -3.46 3.41 -1.23 -4.84 113.62 103.44 2rp3 n SER 67 Ca 0.00 -2.43 -0.27 0.00 -0.26 0.00 0.00 58.87 55.91 2rp3 n SER 67 Cb 0.00 -0.35 -0.11 0.00 -0.26 0.00 0.00 64.21 63.49 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 -0.82 1.77 -0.28 4.33 2.02 -0.95 0.11 118.70 124.89 2rp3 s GLU 68 Ca 0.35 -1.39 0.02 0.00 0.02 0.00 0.00 54.97 53.96 2rp3 s GLU 68 Cb 0.38 -2.00 0.08 0.00 0.10 0.00 0.00 34.13 32.69 2rp3 s GLU 68 CO -0.14 0.42 -0.01 -1.17 0.02 0.00 0.00 175.26 174.38 2rp3 s LEU 69 N -2.70 3.16 -0.07 1.80 1.98 0.27 -0.70 118.68 122.42 2rp3 s LEU 69 Ca 0.22 -1.52 -0.12 0.00 -2.89 0.00 0.00 54.13 49.82 2rp3 s LEU 69 Cb -0.08 -1.28 -0.05 0.00 0.66 0.00 0.00 46.19 45.44 2rp3 s LEU 69 CO 0.12 -0.30 0.29 0.00 -1.89 0.00 0.00 176.35 174.57 2rp3 s ALA 70 N 1.28 3.76 0.17 5.97 0.00 -0.77 -2.39 121.76 129.77 2rp3 s ALA 70 Ca 0.01 -0.41 -0.23 0.00 0.00 0.00 0.00 51.96 51.32 2rp3 s ALA 70 Cb -0.19 -2.22 0.07 0.00 0.00 0.00 0.00 23.12 20.78 2rp3 s ALA 70 CO -0.10 0.49 1.02 0.00 0.00 0.00 0.00 175.76 177.17 2rp3 s ALA 71 N -0.88 -1.63 -0.15 0.00 0.00 0.56 -1.90 121.76 117.76 2rp3 s ALA 71 Ca 0.19 -0.13 -0.00 0.00 0.00 0.00 0.00 51.96 52.01 2rp3 s ALA 71 Cb -0.14 0.70 -0.01 0.00 0.00 0.00 0.00 23.12 23.66 2rp3 s ALA 71 CO 0.09 -1.06 -0.13 -1.21 0.00 0.00 0.00 175.76 173.45 2rp3 s GLU 72 N -2.58 3.34 -0.02 0.00 2.02 -0.96 -0.20 118.70 120.30 2rp3 s GLU 72 Ca 0.18 -0.70 0.06 0.00 0.02 0.00 0.00 54.97 54.53 2rp3 s GLU 72 Cb -0.02 -2.67 -0.01 0.00 0.10 0.00 0.00 34.13 31.52 2rp3 s GLU 72 CO 0.04 0.11 -0.20 0.00 0.02 0.00 0.00 175.26 175.23 2rp3 s LYS 74 N -0.43 4.42 0.82 0.00 2.20 -0.14 -1.63 119.74 124.99 2rp3 s LYS 74 Ca 0.07 1.92 -0.12 0.00 -0.36 0.00 0.00 55.97 57.48 2rp3 s LYS 74 Cb -0.08 -3.26 0.09 0.00 -1.51 0.00 0.00 37.83 33.07 2rp3 s LYS 74 CO -0.00 -0.23 1.18 0.95 -0.36 0.00 0.00 175.35 176.89 2rp3 s THR 75 N 0.46 2.02 0.56 3.43 -4.23 0.21 -2.90 115.64 115.21 2rp3 s THR 75 Ca 0.57 -0.03 0.26 0.00 -1.18 0.00 0.00 61.69 61.32 2rp3 s THR 75 Cb -0.33 -3.00 0.36 0.00 1.34 0.00 0.00 72.50 70.86 2rp3 s THR 75 CO 0.34 0.00 2.09 0.00 -0.54 0.00 0.00 174.62 176.50 2rp3 h ALA 76 N -1.09 1.99 0.00 3.99 0.00 -1.89 0.37 119.26 122.64 2rp3 h ALA 76 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2rp3 h ALA 76 Cb 1.32 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2rp3 h ALA 76 CO 0.62 -0.33 -0.29 0.00 0.00 0.00 0.00 179.25 179.25 2rp3 n ALA 77 N -2.44 2.58 -0.34 0.00 0.00 -1.26 -4.94 120.51 114.11 2rp3 n ALA 77 Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2rp3 n ALA 77 Cb 0.35 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.47 2rp3 n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rp3 n GLY 78 N 1.32 1.17 3.09 0.00 0.00 0.13 -5.11 105.19 105.80 2rp3 n GLY 78 Ca 0.04 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 2rp3 n GLY 78 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rp3 s GLN 79 N -0.89 1.89 -0.22 1.61 -0.21 -1.25 -4.77 119.66 115.81 2rp3 s GLN 79 Ca 0.00 -0.55 -0.29 0.00 0.02 0.00 0.00 55.36 54.54 2rp3 s GLN 79 Cb 0.00 -1.57 0.00 0.00 1.00 0.00 0.00 33.01 32.45 2rp3 s GLN 79 CO 0.00 0.14 1.14 -0.06 -2.12 0.00 0.00 175.29 174.39 2rp3 s PHE 80 N 0.35 3.10 0.54 0.91 0.08 -1.26 0.67 117.98 122.37 2rp3 s PHE 80 Ca -0.11 1.23 0.06 0.00 0.12 0.00 0.00 56.93 58.24 2rp3 s PHE 80 Cb -0.14 -3.45 0.04 0.00 -0.57 0.00 0.00 43.02 38.90 2rp3 s PHE 80 CO 0.04 -1.03 0.45 0.14 -0.10 0.00 0.00 175.22 174.72 2rp3 s VAL 81 N 3.45 1.78 -0.48 -0.44 -7.23 -0.65 -4.87 120.40 111.96 2rp3 s VAL 81 Ca 0.49 -1.43 -0.18 0.00 -1.81 0.00 0.00 61.98 59.05 2rp3 s VAL 81 Cb -0.17 -2.20 0.05 0.00 0.56 0.00 0.00 36.38 34.62 2rp3 s VAL 81 CO 0.11 0.00 0.52 -0.55 -0.31 0.00 0.00 175.10 174.88 2rp3 s SER 82 N -4.31 6.20 -0.00 4.85 0.15 -1.26 -2.92 113.70 116.40 2rp3 s SER 82 Ca 0.38 -0.95 0.03 0.00 0.70 0.00 0.00 55.95 56.11 2rp3 s SER 82 Cb -0.03 -2.25 -0.03 0.00 -1.71 0.00 0.00 66.02 62.00 2rp3 s SER 82 CO 0.24 -0.76 -0.05 0.42 1.20 0.00 0.00 173.24 174.29 2rp3 s THR 83 N 2.27 3.79 0.07 6.45 -4.23 0.71 -4.99 115.64 119.73 2rp3 s THR 83 Ca 0.12 -0.71 -0.01 0.00 -1.18 0.00 0.00 61.69 59.91 2rp3 s THR 83 Cb -0.20 -2.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.95 2rp3 s THR 83 CO 0.11 0.40 -0.02 -1.59 -0.54 0.00 0.00 174.62 172.99 2rp3 s LYS 84 N -1.42 0.71 -0.27 3.99 -2.85 -1.26 -0.32 119.74 118.32 2rp3 s LYS 84 Ca 0.17 -1.28 -0.25 0.00 -1.00 0.00 0.00 55.97 53.61 2rp3 s LYS 84 Cb -0.11 0.15 0.11 0.00 -2.06 0.00 0.00 37.83 35.92 2rp3 s LYS 84 CO 0.08 -0.13 0.96 -1.50 0.10 0.00 0.00 175.35 174.86 2rp3 s ILE 85 N -3.90 0.00 -0.47 3.79 2.07 -1.01 -4.78 121.20 116.91 2rp3 s ILE 85 Ca 0.11 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 59.07 2rp3 s ILE 85 Cb 0.08 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.69 2rp3 s ILE 85 CO -0.07 0.00 1.10 0.21 -1.91 0.00 0.00 174.94 174.28 2rp3 s ASN 86 N 0.22 6.62 0.53 4.50 3.04 -1.26 -0.57 114.94 128.03 2rp3 s ASN 86 Ca 0.02 0.44 0.21 0.00 0.04 0.00 0.00 52.86 53.57 2rp3 s ASN 86 Cb -0.05 -2.53 1.43 0.00 -1.54 0.00 0.00 41.25 38.56 2rp3 s ASN 86 CO -0.04 -1.21 2.16 -0.07 -3.04 0.00 0.00 177.10 174.90 2rp3 h LEU 87 N 11.08 0.00 0.00 3.21 3.38 0.52 -0.18 115.31 133.32 2rp3 h LEU 87 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2rp3 h LEU 87 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2rp3 h LEU 87 CO 1.11 0.03 0.00 -0.90 0.09 0.00 0.00 178.44 178.77 2rp3 n ASP 88 N -4.22 0.00 0.25 -0.43 5.75 -1.16 -0.71 116.55 116.03 2rp3 n ASP 88 Ca -0.03 0.40 0.12 0.00 -0.01 0.00 0.00 54.79 55.27 2rp3 n ASP 88 Cb 0.12 -0.45 0.67 0.00 -1.03 0.00 0.00 41.12 40.43 2rp3 n ASP 88 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 2rp3 h ASP 89 N 0.00 0.00 0.00 -1.12 1.82 -1.34 -1.53 116.42 114.25 2rp3 h ASP 89 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2rp3 h ASP 89 Cb 0.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.26 2rp3 h ASP 89 CO 0.00 0.14 0.00 1.41 -1.61 0.00 0.00 179.24 179.18 2rp3 n HIS 90 N -3.59 0.00 -1.67 0.28 8.25 -1.13 -4.67 115.22 112.69 2rp3 n HIS 90 Ca -0.01 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.00 2rp3 n HIS 90 Cb 0.28 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.35 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 -1.44 0.57 -4.68 1.59 2.08 0.11 -1.54 119.36 116.04 2rp3 n ILE 91 Ca 0.00 -0.10 -0.30 0.00 0.56 0.00 0.00 62.75 62.91 2rp3 n ILE 91 Cb 0.00 -2.07 -0.09 0.00 -0.75 0.00 0.00 39.64 36.73 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 3.72 3.61 -0.22 -1.39 0.00 0.97 -2.11 121.76 126.33 2rp3 s ALA 92 Ca 0.88 -1.24 -0.01 0.00 0.00 0.00 0.00 51.96 51.59 2rp3 s ALA 92 Cb -0.55 0.15 0.02 0.00 0.00 0.00 0.00 23.12 22.74 2rp3 s ALA 92 CO 0.44 -0.09 -0.09 1.21 0.00 0.00 0.00 175.76 177.23 2rp3 s ASN 93 N -3.78 4.01 -0.34 0.00 2.47 -1.26 -1.38 114.94 114.65 2rp3 s ASN 93 Ca 0.19 -0.72 0.01 0.00 0.42 0.00 0.00 52.86 52.77 2rp3 s ASN 93 Cb 0.05 -1.63 0.09 0.00 -1.45 0.00 0.00 41.25 38.31 2rp3 s ASN 93 CO 0.10 -0.07 0.06 -0.63 -3.72 0.00 0.00 177.10 172.84 2rp3 s ILE 94 N 1.34 2.63 -1.34 -5.21 -1.09 0.12 -4.66 121.20 112.99 2rp3 s ILE 94 Ca 0.02 -2.04 -0.02 0.00 -2.23 0.00 0.00 60.65 56.38 2rp3 s ILE 94 Cb -0.15 -2.79 0.00 0.00 -1.58 0.00 0.00 42.46 37.94 2rp3 s ILE 94 CO -0.06 -0.48 0.29 -0.67 -1.23 0.00 0.00 174.94 172.79 2rp3 n ASP 95 N 4.42 -5.16 0.00 3.58 -0.08 -1.26 -1.84 116.55 116.20 2rp3 n ASP 95 Ca -0.03 -0.14 0.00 0.00 -1.51 0.00 0.00 54.79 53.11 2rp3 n ASP 95 Cb 0.42 -4.11 0.00 0.00 2.34 0.00 0.00 41.12 39.77 2rp3 n ASP 95 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2rp3 n GLY 96 N -1.23 1.04 3.82 0.27 0.00 -1.24 -4.13 105.19 103.73 2rp3 n GLY 96 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.16 4.91 0.01 2.61 -4.23 -0.77 -4.19 115.64 110.82 2rp3 s THR 97 Ca 0.00 -0.44 -0.22 0.00 -1.18 0.00 0.00 61.69 59.85 2rp3 s THR 97 Cb 0.00 -3.31 -0.05 0.00 1.34 0.00 0.00 72.50 70.48 2rp3 s THR 97 CO 0.00 0.27 0.66 -0.76 -0.54 0.00 0.00 174.62 174.24 2rp3 s LEU 98 N -2.03 4.42 0.20 4.79 1.43 -1.26 0.13 118.68 126.36 2rp3 s LEU 98 Ca 0.27 1.25 -0.08 0.00 -1.03 0.00 0.00 54.13 54.54 2rp3 s LEU 98 Cb -0.12 -3.03 -0.02 0.00 0.03 0.00 0.00 46.19 43.05 2rp3 s LEU 98 CO 0.19 0.05 0.32 -0.54 0.23 0.00 0.00 176.35 176.60 2rp3 s LYS 99 N -0.05 1.31 -0.15 1.70 1.02 -0.48 -4.70 119.74 118.39 2rp3 s LYS 99 Ca 0.34 -1.32 -0.08 0.00 0.02 0.00 0.00 55.97 54.94 2rp3 s LYS 99 Cb -0.19 0.38 -0.04 0.00 -0.52 0.00 0.00 37.83 37.46 2rp3 s LYS 99 CO 0.19 -0.50 0.12 -0.47 -0.92 0.00 0.00 175.35 173.78 2rp3 s TYR 100 N -4.03 3.48 0.00 3.18 5.04 -1.26 -0.02 117.35 123.73 2rp3 s TYR 100 Ca 0.25 0.41 0.00 0.00 -2.44 0.00 0.00 57.07 55.28 2rp3 s TYR 100 Cb 0.03 -2.01 0.00 0.00 0.35 0.00 0.00 41.96 40.32 2rp3 s TYR 100 CO 0.06 0.53 0.36 0.39 -1.34 0.00 0.00 175.55 175.55