#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 0.68 4.23 -0.72 0.00 -1.22 -4.81 105.19 103.35 2rp3 n GLY 2 Ca 0.00 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 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 -0.84 0.05 1.61 4.76 -0.46 -4.16 118.16 131.38 2rp3 n LYS 3 Ca 0.00 0.11 0.02 0.00 -2.87 0.00 0.00 58.31 55.56 2rp3 n LYS 3 Cb 0.00 -3.81 0.37 0.00 -1.84 0.00 0.00 35.03 29.75 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 -1.16 0.41 -0.62 2.13 -0.00 -1.69 -2.13 116.94 113.88 2rp3 h PHE 4 Ca -0.58 -0.03 0.18 0.00 -0.00 0.00 0.00 57.97 57.54 2rp3 h PHE 4 Cb 1.28 -0.12 -0.02 0.00 -0.00 0.00 0.00 35.95 37.08 2rp3 h PHE 4 CO 0.57 0.41 0.45 0.66 -0.00 0.00 0.00 178.31 180.40 2rp3 h SER 5 N 0.39 0.00 -0.01 -0.68 4.64 -1.84 0.23 113.55 116.28 2rp3 h SER 5 Ca 0.09 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.39 2rp3 h SER 5 Cb 0.26 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2rp3 h SER 5 CO 0.01 0.00 -0.04 1.56 -0.87 0.00 0.00 176.83 177.48 2rp3 h GLN 6 N 0.00 0.14 0.00 4.77 4.20 -1.75 -2.85 115.11 119.62 2rp3 h GLN 6 Ca 0.29 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.94 2rp3 h GLN 6 Cb 1.20 -0.03 -0.10 0.00 0.30 0.00 0.00 27.48 28.86 2rp3 h GLN 6 CO -0.00 0.19 -0.55 -2.37 -0.67 0.00 0.00 178.83 175.43 2rp3 n THR 7 N -4.41 1.45 -3.93 -0.54 5.66 0.32 -5.03 114.28 107.81 2rp3 n THR 7 Ca -0.01 -2.30 -0.13 0.00 -3.05 0.00 0.00 64.05 58.56 2rp3 n THR 7 Cb 0.17 0.12 -0.14 0.00 -1.55 0.00 0.00 70.33 68.93 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 -0.03 0.89 -1.30 0.00 1.13 0.41 -4.60 117.35 113.84 2rp3 s TYR 9 Ca 0.00 -1.23 -0.05 0.00 -1.41 0.00 0.00 57.07 54.38 2rp3 s TYR 9 Cb -0.00 -0.49 0.01 0.00 -1.10 0.00 0.00 41.96 40.37 2rp3 s TYR 9 CO -0.00 -0.51 1.07 -1.71 -2.51 0.00 0.00 175.55 171.89 2rp3 n ASN 10 N -0.10 -4.17 -4.82 -0.18 5.15 -1.26 -1.32 115.26 108.56 2rp3 n ASN 10 Ca -0.05 -0.60 -0.33 0.00 -0.60 0.00 0.00 54.58 52.99 2rp3 n ASN 10 Cb 0.64 -4.97 -0.07 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 -3.82 6.94 0.02 1.20 1.04 -1.26 -4.00 113.70 113.82 2rp3 s SER 11 Ca 0.31 1.59 -0.19 0.00 0.48 0.00 0.00 55.95 58.14 2rp3 s SER 11 Cb -0.14 -2.50 0.04 0.00 0.10 0.00 0.00 66.02 63.52 2rp3 s SER 11 CO 0.74 -0.28 0.43 0.00 0.98 0.00 0.00 173.24 175.11 2rp3 s ALA 12 N -2.05 -1.07 -0.01 5.32 0.00 0.12 -4.96 121.76 119.12 2rp3 s ALA 12 Ca 0.58 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.98 2rp3 s ALA 12 Cb -0.10 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.29 2rp3 s ALA 12 CO 0.15 -0.42 -0.01 0.42 0.00 0.00 0.00 175.76 175.91 2rp3 s ILE 13 N -2.14 0.12 -0.37 0.00 1.01 -1.26 -0.60 121.20 117.95 2rp3 s ILE 13 Ca -0.07 -0.03 0.05 0.00 0.00 0.00 0.00 60.65 60.60 2rp3 s ILE 13 Cb -0.01 -0.13 0.17 0.00 0.01 0.00 0.00 42.46 42.49 2rp3 s ILE 13 CO 0.00 0.05 0.49 -1.58 0.00 0.00 0.00 174.94 173.90 2rp3 s GLN 14 N 0.18 0.68 0.00 2.79 -0.44 -1.15 -4.19 119.66 117.53 2rp3 s GLN 14 Ca -0.01 -0.47 0.00 0.00 -2.50 0.00 0.00 55.36 52.37 2rp3 s GLN 14 Cb -0.03 -0.33 0.00 0.00 -1.64 0.00 0.00 33.01 31.01 2rp3 s GLN 14 CO -0.01 -1.17 0.00 0.41 0.50 0.00 0.00 175.29 175.02 2rp3 n GLY 15 N 4.47 1.75 1.79 2.59 0.00 -1.24 -4.21 105.19 110.34 2rp3 n GLY 15 Ca 0.10 -0.62 -0.03 0.00 0.00 0.00 0.00 46.02 45.46 2rp3 n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rp3 n SER 16 N 3.79 -0.74 -3.80 1.61 3.41 -1.26 -4.55 113.62 112.08 2rp3 n SER 16 Ca 0.00 -2.08 -0.20 0.00 -0.26 0.00 0.00 58.87 56.33 2rp3 n SER 16 Cb 0.00 0.31 -0.17 0.00 -0.26 0.00 0.00 64.21 64.09 2rp3 n SER 16 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2rp3 s VAL 17 N -0.27 0.30 -0.16 -3.33 0.11 -1.26 -2.78 120.40 113.02 2rp3 s VAL 17 Ca 0.09 0.09 -0.11 0.00 -2.93 0.00 0.00 61.98 59.11 2rp3 s VAL 17 Cb 0.23 -0.42 -0.05 0.00 -1.53 0.00 0.00 36.38 34.61 2rp3 s VAL 17 CO -0.07 0.21 0.22 -0.22 -3.33 0.00 0.00 175.10 171.91 2rp3 s LEU 18 N 1.46 4.27 -0.06 2.54 0.20 -0.58 -2.94 118.68 123.58 2rp3 s LEU 18 Ca -0.03 0.43 0.01 0.00 0.69 0.00 0.00 54.13 55.22 2rp3 s LEU 18 Cb -0.13 -2.23 0.02 0.00 -0.43 0.00 0.00 46.19 43.42 2rp3 s LEU 18 CO -0.03 0.19 -0.06 -0.89 -0.29 0.00 0.00 176.35 175.27 2rp3 s THR 19 N 0.10 0.69 -0.22 3.68 2.01 0.23 -1.19 115.64 120.95 2rp3 s THR 19 Ca 0.14 -0.20 -0.23 0.00 0.31 0.00 0.00 61.69 61.71 2rp3 s THR 19 Cb -0.12 -0.70 0.06 0.00 0.01 0.00 0.00 72.50 71.75 2rp3 s THR 19 CO 0.02 0.27 0.64 -0.55 -0.69 0.00 0.00 174.62 174.30 2rp3 s SER 20 N 0.99 -0.65 -0.14 3.53 0.15 -1.10 0.15 113.70 116.63 2rp3 s SER 20 Ca -0.10 1.21 -0.27 0.00 0.70 0.00 0.00 55.95 57.50 2rp3 s SER 20 Cb -0.14 1.22 -0.02 0.00 -1.71 0.00 0.00 66.02 65.37 2rp3 s SER 20 CO -0.00 -0.26 0.88 -0.89 1.20 0.00 0.00 173.24 174.17 2rp3 s THR 21 N 0.17 4.86 0.06 6.45 2.01 -0.43 -3.63 115.64 125.12 2rp3 s THR 21 Ca -0.01 1.76 0.07 0.00 0.31 0.00 0.00 61.69 63.82 2rp3 s THR 21 Cb -0.04 -4.19 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 2rp3 s THR 21 CO 0.02 0.04 -0.19 0.00 -0.69 0.00 0.00 174.62 173.79 2rp3 s GLU 23 N -1.46 4.30 0.64 0.00 2.02 -1.17 -1.49 118.70 121.53 2rp3 s GLU 23 Ca 0.06 1.77 -0.16 0.00 0.02 0.00 0.00 54.97 56.65 2rp3 s GLU 23 Cb -0.09 -3.63 -0.01 0.00 0.10 0.00 0.00 34.13 30.50 2rp3 s GLU 23 CO 0.03 -0.56 1.14 1.03 0.02 0.00 0.00 175.26 176.91 2rp3 s ARG 24 N 2.66 2.85 0.04 1.61 0.52 0.26 -3.48 118.95 123.39 2rp3 s ARG 24 Ca 0.58 1.53 0.15 0.00 -0.52 0.00 0.00 55.73 57.47 2rp3 s ARG 24 Cb -0.26 -1.94 -0.16 0.00 0.52 0.00 0.00 34.95 33.10 2rp3 s ARG 24 CO 0.22 -1.24 0.82 1.15 0.02 0.00 0.00 175.30 176.27 2rp3 h THR 25 N 0.32 0.69 0.00 0.02 2.02 -1.84 -3.42 112.91 110.69 2rp3 h THR 25 Ca -0.48 -2.31 0.00 0.00 0.77 0.00 0.00 66.41 64.39 2rp3 h THR 25 Cb 1.26 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 69.89 2rp3 h THR 25 CO 0.54 0.39 -0.75 -3.20 0.37 0.00 0.00 175.52 172.88 2rp3 n ASN 26 N -2.98 1.65 0.00 4.18 2.85 -1.26 -5.04 115.26 114.65 2rp3 n ASN 26 Ca -0.11 0.27 0.00 0.00 -0.11 0.00 0.00 54.58 54.63 2rp3 n ASN 26 Cb 0.91 -0.64 0.00 0.00 1.24 0.00 0.00 39.78 41.29 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 1.85 0.84 0.00 8.20 0.00 -1.26 -5.12 105.19 109.71 2rp3 n GLY 27 Ca -0.10 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.92 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 4.95 0.48 3.56 -0.02 0.00 -1.26 -4.65 105.19 108.25 2rp3 n GLY 28 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 1.73 2.90 -0.06 1.61 2.02 -1.26 0.90 117.35 125.19 2rp3 s TYR 29 Ca 0.00 -0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.70 2rp3 s TYR 29 Cb 0.00 -1.70 0.02 0.00 -0.40 0.00 0.00 41.96 39.88 2rp3 s TYR 29 CO 0.00 0.30 -0.07 1.21 -1.57 0.00 0.00 175.55 175.41 2rp3 s ASN 30 N -0.77 1.32 -0.60 2.29 2.47 -0.56 -4.87 114.94 114.23 2rp3 s ASN 30 Ca 0.12 -0.20 -0.08 0.00 0.42 0.00 0.00 52.86 53.12 2rp3 s ASN 30 Cb -0.11 -0.61 0.15 0.00 -1.45 0.00 0.00 41.25 39.24 2rp3 s ASN 30 CO 0.01 -0.03 0.46 -0.89 -3.72 0.00 0.00 177.10 172.94 2rp3 s THR 31 N 0.86 4.27 0.43 -5.21 2.01 -1.26 -1.48 115.64 115.26 2rp3 s THR 31 Ca -0.12 -2.37 0.07 0.00 0.31 0.00 0.00 61.69 59.58 2rp3 s THR 31 Cb -0.15 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 2rp3 s THR 31 CO 0.01 -0.86 0.23 -0.44 -0.69 0.00 0.00 174.62 172.87 2rp3 s SER 32 N 1.80 4.55 0.04 3.53 0.01 -1.24 -4.95 113.70 117.44 2rp3 s SER 32 Ca 0.12 -1.06 -0.01 0.00 1.31 0.00 0.00 55.95 56.32 2rp3 s SER 32 Cb -0.21 -0.37 -0.03 0.00 0.21 0.00 0.00 66.02 65.62 2rp3 s SER 32 CO -0.04 -0.63 -0.03 -0.94 0.41 0.00 0.00 173.24 172.01 2rp3 s SER 33 N -3.98 0.43 -0.01 2.44 1.04 -1.26 -2.70 113.70 109.65 2rp3 s SER 33 Ca 0.40 -0.85 0.01 0.00 0.48 0.00 0.00 55.95 55.99 2rp3 s SER 33 Cb 0.02 0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.32 2rp3 s SER 33 CO 0.23 -0.51 -0.01 -0.51 0.98 0.00 0.00 173.24 173.41 2rp3 s ILE 34 N -3.18 0.18 -0.29 -1.02 1.10 -0.33 -4.86 121.20 112.78 2rp3 s ILE 34 Ca 0.00 -0.02 -0.29 0.00 -0.51 0.00 0.00 60.65 59.83 2rp3 s ILE 34 Cb 0.03 -0.20 0.01 0.00 0.15 0.00 0.00 42.46 42.45 2rp3 s ILE 34 CO -0.07 0.09 1.13 -0.62 -2.11 0.00 0.00 174.94 173.36 2rp3 s ASP 35 N 0.36 6.90 0.00 4.50 -1.08 -1.26 -1.52 116.67 124.56 2rp3 s ASP 35 Ca -0.03 1.17 0.23 0.00 -0.52 0.00 0.00 52.55 53.39 2rp3 s ASP 35 Cb -0.06 -2.54 1.12 0.00 -1.46 0.00 0.00 42.92 39.98 2rp3 s ASP 35 CO -0.01 -0.89 1.76 0.18 0.52 0.00 0.00 175.17 176.73 2rp3 n LEU 36 N 6.95 0.00 0.23 -1.34 4.77 -1.12 -2.92 117.00 123.57 2rp3 n LEU 36 Ca 0.13 0.35 0.10 0.00 -0.03 0.00 0.00 56.01 56.56 2rp3 n LEU 36 Cb 0.47 -0.35 0.51 0.00 -2.33 0.00 0.00 43.42 41.71 2rp3 n LEU 36 CO 0.59 -0.08 0.83 -1.13 -1.33 0.00 0.00 177.39 176.27 2rp3 h ASN 37 N 0.00 0.00 -0.08 -1.43 -0.73 -1.85 -0.50 115.58 110.99 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 0.27 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.86 2rp3 h ASN 37 CO 0.00 0.21 0.00 -0.24 -0.37 0.00 0.00 177.43 177.03 2rp3 n SER 38 N -3.43 1.41 -0.07 1.15 2.88 -1.15 -3.54 113.62 110.88 2rp3 n SER 38 Ca -0.00 -1.55 0.00 0.00 -1.33 0.00 0.00 58.87 55.98 2rp3 n SER 38 Cb 0.39 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 2rp3 n SER 38 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2rp3 n VAL 39 N 0.12 0.00 -4.11 2.46 0.24 -0.76 -4.59 118.33 111.70 2rp3 n VAL 39 Ca 0.18 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.31 2rp3 n VAL 39 Cb 0.32 0.84 -0.15 0.00 -1.47 0.00 0.00 33.84 33.38 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 0.36 0.10 1.34 -1.09 -0.20 -2.30 121.20 119.42 2rp3 s ILE 40 Ca 0.00 -0.14 0.08 0.00 -2.23 0.00 0.00 60.65 58.36 2rp3 s ILE 40 Cb 0.00 -0.35 -0.03 0.00 -1.58 0.00 0.00 42.46 40.50 2rp3 s ILE 40 CO 0.00 0.13 -0.20 0.00 -1.23 0.00 0.00 174.94 173.64 2rp3 s ALA 41 N 0.23 1.75 -0.29 9.38 0.00 -0.36 -2.52 121.76 129.95 2rp3 s ALA 41 Ca -0.02 -1.24 -0.06 0.00 0.00 0.00 0.00 51.96 50.63 2rp3 s ALA 41 Cb -0.06 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.85 2rp3 s ALA 41 CO -0.00 0.33 0.07 0.00 0.00 0.00 0.00 175.76 176.15 2rp3 s ALA 42 N -1.26 3.04 -0.21 0.00 0.00 -1.25 -1.74 121.76 120.34 2rp3 s ALA 42 Ca 0.06 -1.42 -0.01 0.00 0.00 0.00 0.00 51.96 50.59 2rp3 s ALA 42 Cb -0.10 -2.10 0.06 0.00 0.00 0.00 0.00 23.12 20.98 2rp3 s ALA 42 CO 0.04 -0.87 -0.01 0.08 0.00 0.00 0.00 175.76 175.00 2rp3 s VAL 43 N 1.49 1.02 -1.87 0.00 1.01 -0.78 -4.77 120.40 116.51 2rp3 s VAL 43 Ca 0.03 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.12 2rp3 s VAL 43 Cb -0.17 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.80 2rp3 s VAL 43 CO 0.02 -0.16 0.00 0.47 0.00 0.00 0.00 175.10 175.43 2rp3 n ASP 44 N 4.86 -5.82 -0.21 3.32 9.92 -1.26 -1.96 116.55 125.40 2rp3 n ASP 44 Ca -0.10 0.09 0.00 0.00 -0.53 0.00 0.00 54.79 54.24 2rp3 n ASP 44 Cb 0.46 -4.89 0.00 0.00 -0.64 0.00 0.00 41.12 36.04 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 -0.90 0.75 2.84 0.44 0.00 -1.16 -4.52 105.19 102.65 2rp3 n GLY 45 Ca -0.24 -0.70 -0.22 0.00 0.00 0.00 0.00 46.02 44.87 2rp3 n GLY 45 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rp3 s SER 46 N -2.88 1.34 -0.23 1.61 0.15 -0.83 -4.69 113.70 108.17 2rp3 s SER 46 Ca 0.00 -0.12 -0.24 0.00 0.70 0.00 0.00 55.95 56.29 2rp3 s SER 46 Cb 0.00 -0.48 -0.01 0.00 -1.71 0.00 0.00 66.02 63.82 2rp3 s SER 46 CO 0.00 -0.12 0.80 -0.76 1.20 0.00 0.00 173.24 174.35 2rp3 s LEU 47 N 1.46 4.09 0.09 3.45 1.43 -1.26 -1.86 118.68 126.09 2rp3 s LEU 47 Ca -0.02 1.00 0.09 0.00 -1.03 0.00 0.00 54.13 54.17 2rp3 s LEU 47 Cb -0.13 -3.14 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 2rp3 s LEU 47 CO -0.03 -0.47 -0.24 -0.54 0.23 0.00 0.00 176.35 175.30 2rp3 s LYS 48 N 2.67 1.39 0.12 1.70 -0.14 -0.71 -4.91 119.74 119.85 2rp3 s LYS 48 Ca 0.34 -1.16 -0.02 0.00 -1.36 0.00 0.00 55.97 53.77 2rp3 s LYS 48 Cb -0.15 -1.67 0.03 0.00 -1.68 0.00 0.00 37.83 34.35 2rp3 s LYS 48 CO 0.08 0.41 0.12 0.91 -0.76 0.00 0.00 175.35 176.11 2rp3 n TRP 49 N 1.33 -3.29 -3.62 3.18 7.02 -1.26 -1.22 117.44 119.58 2rp3 n TRP 49 Ca -0.18 -0.10 -0.23 0.00 -1.02 0.00 0.00 57.50 55.96 2rp3 n TRP 49 Cb 0.53 -0.11 0.00 0.00 -2.42 0.00 0.00 31.31 29.31 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 -1.71 -0.86 -1.82 -0.99 10.64 -0.97 -4.60 117.38 117.06 2rp3 n GLN 50 Ca 0.02 0.29 -0.00 0.00 -1.83 0.00 0.00 57.00 55.48 2rp3 n GLN 50 Cb 0.06 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 27.94 2rp3 n GLN 50 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2rp3 n GLY 51 N -1.46 1.06 3.79 2.61 0.00 -1.23 -4.92 105.19 105.04 2rp3 n GLY 51 Ca -0.18 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 44.83 2rp3 n GLY 51 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2rp3 s SER 52 N -1.31 0.06 -1.03 1.61 1.04 -1.05 -1.04 113.70 111.99 2rp3 s SER 52 Ca 0.03 -1.21 -0.02 0.00 0.48 0.00 0.00 55.95 55.22 2rp3 s SER 52 Cb -0.00 0.86 -0.03 0.00 0.10 0.00 0.00 66.02 66.95 2rp3 s SER 52 CO 0.00 -1.72 0.87 0.59 0.98 0.00 0.00 173.24 173.97 2rp3 n ASN 53 N -1.51 -3.87 -0.06 7.02 4.13 -1.23 -4.20 115.26 115.53 2rp3 n ASN 53 Ca -0.09 -0.60 -0.08 0.00 1.68 0.00 0.00 54.58 55.50 2rp3 n ASN 53 Cb 0.60 -4.73 -0.07 0.00 -1.54 0.00 0.00 39.78 34.04 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 -3.50 0.00 -0.18 3.10 1.16 -1.24 -3.90 117.46 112.90 2rp3 n PHE 54 Ca -0.18 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.38 2rp3 n PHE 54 Cb 0.63 -0.53 0.19 0.00 -1.61 0.00 0.00 39.48 38.16 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 1.22 -0.81 1.97 6.09 -1.87 0.68 117.51 124.79 2rp3 h ILE 55 Ca -0.30 -0.66 0.18 0.00 -1.37 0.00 0.00 64.86 62.71 2rp3 h ILE 55 Cb 1.54 0.42 -0.05 0.00 0.47 0.00 0.00 36.82 39.19 2rp3 h ILE 55 CO -0.03 0.27 0.55 -0.33 -3.07 0.00 0.00 178.15 175.54 2rp3 h GLU 56 N 0.93 0.31 -0.15 2.19 4.39 -1.99 -0.38 114.58 119.88 2rp3 h GLU 56 Ca 0.22 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.91 2rp3 h GLU 56 Cb 0.14 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2rp3 h GLU 56 CO -0.02 0.21 0.00 0.00 -1.16 0.00 0.00 179.01 178.03 2rp3 n ALA 57 N -2.55 2.60 -2.62 3.43 0.00 -0.58 -5.02 120.51 115.78 2rp3 n ALA 57 Ca 0.16 -2.27 -0.09 0.00 0.00 0.00 0.00 53.44 51.24 2rp3 n ALA 57 Cb 0.66 -0.53 -0.10 0.00 0.00 0.00 0.00 19.45 19.48 2rp3 n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rp3 s ARG 59 N -2.78 2.01 -1.17 0.00 3.03 -0.57 -4.64 118.95 114.82 2rp3 s ARG 59 Ca -0.04 -1.71 -0.08 0.00 2.03 0.00 0.00 55.73 55.93 2rp3 s ARG 59 Cb -0.00 0.49 -0.02 0.00 -1.03 0.00 0.00 34.95 34.38 2rp3 s ARG 59 CO -0.06 -0.86 0.81 0.09 -1.13 0.00 0.00 175.30 174.15 2rp3 n ASN 60 N -1.47 -4.11 -4.79 -2.89 3.02 -1.26 -2.05 115.26 101.71 2rp3 n ASN 60 Ca -0.01 -0.84 -0.38 0.00 -0.03 0.00 0.00 54.58 53.32 2rp3 n ASN 60 Cb 0.61 -4.22 -0.06 0.00 -0.61 0.00 0.00 39.78 35.50 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 5.00 0.22 3.41 -4.23 -1.26 -4.16 115.64 111.11 2rp3 s THR 61 Ca 0.29 1.00 -0.21 0.00 -1.18 0.00 0.00 61.69 61.59 2rp3 s THR 61 Cb -0.07 -3.81 0.04 0.00 1.34 0.00 0.00 72.50 70.00 2rp3 s THR 61 CO 0.80 0.48 0.64 0.00 -0.54 0.00 0.00 174.62 176.00 2rp3 s GLN 62 N -0.46 1.54 0.02 3.99 1.03 -0.81 -3.70 119.66 121.27 2rp3 s GLN 62 Ca 0.26 -0.79 -0.24 0.00 0.04 0.00 0.00 55.36 54.64 2rp3 s GLN 62 Cb -0.17 0.59 -0.05 0.00 0.03 0.00 0.00 33.01 33.40 2rp3 s GLN 62 CO 0.14 -0.69 0.71 -1.17 -2.54 0.00 0.00 175.29 171.75 2rp3 s LEU 63 N -2.85 4.43 -0.04 2.60 2.96 -1.26 -1.95 118.68 122.57 2rp3 s LEU 63 Ca 0.07 1.34 0.04 0.00 -0.22 0.00 0.00 54.13 55.37 2rp3 s LEU 63 Cb -0.03 -3.13 -0.00 0.00 0.50 0.00 0.00 46.19 43.52 2rp3 s LEU 63 CO -0.02 0.03 -0.17 0.00 -1.32 0.00 0.00 176.35 174.87 2rp3 s ALA 64 N -0.01 1.47 0.00 5.97 0.00 0.15 -4.87 121.76 124.47 2rp3 s ALA 64 Ca 0.36 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2rp3 s ALA 64 Cb -0.20 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.45 2rp3 s ALA 64 CO 0.21 0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.66 2rp3 n GLY 65 N 3.09 0.98 0.00 0.00 0.00 -1.26 -1.96 105.19 106.04 2rp3 n GLY 65 Ca -0.18 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 2.39 0.00 -0.44 1.61 7.64 -1.26 -4.97 113.62 118.60 2rp3 n SER 66 Ca 0.00 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.92 2rp3 n SER 66 Cb 0.00 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.26 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 0.00 0.94 -4.70 6.43 3.41 -1.24 -4.91 113.62 113.56 2rp3 n SER 67 Ca 0.00 -2.46 -0.28 0.00 -0.26 0.00 0.00 58.87 55.87 2rp3 n SER 67 Cb 0.00 -0.30 -0.07 0.00 -0.26 0.00 0.00 64.21 63.58 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 -1.12 2.56 -0.27 4.33 2.02 -0.83 0.46 118.70 125.86 2rp3 s GLU 68 Ca 0.15 -0.92 0.03 0.00 0.02 0.00 0.00 54.97 54.25 2rp3 s GLU 68 Cb 0.14 -2.51 0.07 0.00 0.10 0.00 0.00 34.13 31.93 2rp3 s GLU 68 CO -0.01 0.51 -0.06 -1.17 0.02 0.00 0.00 175.26 174.55 2rp3 s LEU 69 N -2.62 3.53 -0.11 1.80 1.98 -0.30 -0.68 118.68 122.29 2rp3 s LEU 69 Ca 0.27 -1.52 -0.11 0.00 -2.89 0.00 0.00 54.13 49.88 2rp3 s LEU 69 Cb -0.11 -1.48 -0.05 0.00 0.66 0.00 0.00 46.19 45.21 2rp3 s LEU 69 CO 0.19 -0.24 0.26 0.00 -1.89 0.00 0.00 176.35 174.67 2rp3 s ALA 70 N 1.12 3.73 0.14 5.97 0.00 -0.82 -2.78 121.76 129.12 2rp3 s ALA 70 Ca -0.04 -0.47 -0.25 0.00 0.00 0.00 0.00 51.96 51.20 2rp3 s ALA 70 Cb -0.20 -2.23 0.07 0.00 0.00 0.00 0.00 23.12 20.76 2rp3 s ALA 70 CO -0.06 0.38 0.95 0.00 0.00 0.00 0.00 175.76 177.03 2rp3 s ALA 71 N -0.47 -1.66 -0.18 0.00 0.00 -0.30 -1.93 121.76 117.23 2rp3 s ALA 71 Ca 0.17 0.18 -0.04 0.00 0.00 0.00 0.00 51.96 52.28 2rp3 s ALA 71 Cb -0.14 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.60 2rp3 s ALA 71 CO 0.06 -1.02 -0.04 -1.21 0.00 0.00 0.00 175.76 173.55 2rp3 s GLU 72 N -3.29 3.56 -0.02 0.00 2.02 -0.87 -0.05 118.70 120.04 2rp3 s GLU 72 Ca 0.12 -0.56 0.06 0.00 0.02 0.00 0.00 54.97 54.60 2rp3 s GLU 72 Cb -0.01 -2.93 -0.01 0.00 0.10 0.00 0.00 34.13 31.27 2rp3 s GLU 72 CO 0.01 0.09 -0.20 0.00 0.02 0.00 0.00 175.26 175.19 2rp3 s LYS 74 N -0.42 4.45 0.88 0.00 2.20 -0.60 -1.66 119.74 124.59 2rp3 s LYS 74 Ca 0.06 1.79 -0.13 0.00 -0.36 0.00 0.00 55.97 57.34 2rp3 s LYS 74 Cb -0.08 -3.32 0.13 0.00 -1.51 0.00 0.00 37.83 33.04 2rp3 s LYS 74 CO -0.00 -0.20 1.21 0.95 -0.36 0.00 0.00 175.35 176.94 2rp3 s THR 75 N 0.75 1.99 0.57 3.43 -4.23 0.12 -2.97 115.64 115.30 2rp3 s THR 75 Ca 0.57 0.00 0.26 0.00 -1.18 0.00 0.00 61.69 61.34 2rp3 s THR 75 Cb -0.30 -2.95 0.35 0.00 1.34 0.00 0.00 72.50 70.93 2rp3 s THR 75 CO 0.31 0.00 2.14 0.00 -0.54 0.00 0.00 174.62 176.53 2rp3 h ALA 76 N -1.32 1.84 0.00 3.99 0.00 -1.89 0.21 119.26 122.10 2rp3 h ALA 76 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2rp3 h ALA 76 Cb 1.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2rp3 h ALA 76 CO 0.57 -0.20 -0.30 0.00 0.00 0.00 0.00 179.25 179.33 2rp3 h ALA 77 N 1.87 0.81 -0.07 0.00 0.00 -1.96 -3.47 119.26 116.43 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 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 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 1.31 1.27 3.09 0.00 0.00 0.75 -5.11 105.19 106.50 2rp3 n GLY 78 Ca 0.04 -0.08 -0.28 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 -0.79 2.31 -0.24 1.61 -0.21 -1.25 -4.79 119.66 116.30 2rp3 s GLN 79 Ca 0.00 -0.61 -0.29 0.00 0.02 0.00 0.00 55.36 54.48 2rp3 s GLN 79 Cb 0.00 -1.88 0.00 0.00 1.00 0.00 0.00 33.01 32.13 2rp3 s GLN 79 CO 0.00 0.02 1.19 -0.06 -2.12 0.00 0.00 175.29 174.32 2rp3 s PHE 80 N 0.76 2.97 0.46 0.91 0.08 -1.26 0.12 117.98 122.01 2rp3 s PHE 80 Ca -0.11 1.11 0.07 0.00 0.12 0.00 0.00 56.93 58.11 2rp3 s PHE 80 Cb -0.16 -3.58 -0.01 0.00 -0.57 0.00 0.00 43.02 38.70 2rp3 s PHE 80 CO 0.02 -1.28 0.33 0.14 -0.10 0.00 0.00 175.22 174.34 2rp3 s VAL 81 N 3.67 2.23 -0.39 -0.44 -7.23 -0.67 -4.87 120.40 112.71 2rp3 s VAL 81 Ca 0.51 -1.49 -0.20 0.00 -1.81 0.00 0.00 61.98 59.00 2rp3 s VAL 81 Cb -0.17 -2.72 0.01 0.00 0.56 0.00 0.00 36.38 34.06 2rp3 s VAL 81 CO 0.15 0.00 0.60 -0.44 -0.31 0.00 0.00 175.10 175.10 2rp3 s SER 82 N -4.12 6.35 -0.01 4.85 0.01 -1.26 -2.54 113.70 116.98 2rp3 s SER 82 Ca 0.42 -0.13 0.02 0.00 1.31 0.00 0.00 55.95 57.57 2rp3 s SER 82 Cb -0.01 -2.31 -0.03 0.00 0.21 0.00 0.00 66.02 63.88 2rp3 s SER 82 CO 0.24 -0.65 -0.03 0.42 0.41 0.00 0.00 173.24 173.64 2rp3 s THR 83 N 2.67 3.97 0.07 1.44 -4.23 0.92 -4.98 115.64 115.50 2rp3 s THR 83 Ca 0.22 -0.64 0.01 0.00 -1.18 0.00 0.00 61.69 60.11 2rp3 s THR 83 Cb -0.15 -2.74 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 2rp3 s THR 83 CO 0.16 0.40 -0.06 -1.59 -0.54 0.00 0.00 174.62 173.00 2rp3 s LYS 84 N -1.44 0.71 -0.28 3.99 -2.85 -1.26 -1.15 119.74 117.46 2rp3 s LYS 84 Ca 0.18 -1.17 -0.24 0.00 -1.00 0.00 0.00 55.97 53.75 2rp3 s LYS 84 Cb -0.11 -0.13 0.12 0.00 -2.06 0.00 0.00 37.83 35.65 2rp3 s LYS 84 CO 0.08 -0.02 0.97 -1.50 0.10 0.00 0.00 175.35 174.98 2rp3 s ILE 85 N -3.14 0.00 -0.34 3.79 2.07 -1.12 -4.77 121.20 117.69 2rp3 s ILE 85 Ca 0.05 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 59.02 2rp3 s ILE 85 Cb 0.02 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.63 2rp3 s ILE 85 CO -0.05 0.00 1.01 0.21 -1.91 0.00 0.00 174.94 174.20 2rp3 s ASN 86 N 0.43 6.82 0.42 4.50 3.04 -1.26 -1.15 114.94 127.74 2rp3 s ASN 86 Ca 0.01 0.86 0.14 0.00 0.04 0.00 0.00 52.86 53.91 2rp3 s ASN 86 Cb -0.05 -2.51 0.90 0.00 -1.54 0.00 0.00 41.25 38.05 2rp3 s ASN 86 CO -0.07 -0.86 1.93 -0.07 -3.04 0.00 0.00 177.10 174.99 2rp3 h LEU 87 N 10.07 0.00 -1.29 3.21 3.38 -0.33 -1.53 115.31 128.82 2rp3 h LEU 87 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2rp3 h LEU 87 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2rp3 h LEU 87 CO 1.01 0.25 0.00 -2.24 0.09 0.00 0.00 178.44 177.55 2rp3 h ASP 88 N 0.00 0.00 0.01 -0.43 3.04 -1.78 0.38 116.42 117.64 2rp3 h ASP 88 Ca -0.00 0.00 -0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2rp3 h ASP 88 Cb 0.45 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.74 2rp3 h ASP 88 CO 0.03 0.00 -0.01 -0.78 -2.04 0.00 0.00 179.24 176.45 2rp3 h ASP 89 N 0.00 0.00 0.00 4.15 1.82 -1.61 -1.21 116.42 119.57 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 0.21 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.22 2rp3 h ASP 89 CO 0.00 0.01 0.00 1.41 -1.61 0.00 0.00 179.24 179.05 2rp3 n HIS 90 N -4.10 -0.30 -1.61 0.28 8.25 -0.93 -4.72 115.22 112.10 2rp3 n HIS 90 Ca -0.03 0.00 -0.51 0.00 -0.26 0.00 0.00 57.72 56.92 2rp3 n HIS 90 Cb 0.09 0.21 -0.06 0.00 1.12 0.00 0.00 29.99 31.36 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 -1.93 0.39 -4.58 1.59 2.08 0.13 -2.56 119.36 114.48 2rp3 n ILE 91 Ca 0.00 -0.16 -0.30 0.00 0.56 0.00 0.00 62.75 62.84 2rp3 n ILE 91 Cb 0.00 -1.71 -0.05 0.00 -0.75 0.00 0.00 39.64 37.13 2rp3 n ILE 91 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2rp3 n ALA 92 N 7.67 0.49 -4.05 -1.39 0.00 0.58 -2.04 120.51 121.78 2rp3 n ALA 92 Ca 0.30 -2.20 -0.31 0.00 0.00 0.00 0.00 53.44 51.23 2rp3 n ALA 92 Cb 0.25 1.15 -0.16 0.00 0.00 0.00 0.00 19.45 20.69 2rp3 n ALA 92 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2rp3 s ASN 93 N -3.78 2.86 -0.25 0.00 2.47 -1.26 -2.16 114.94 112.82 2rp3 s ASN 93 Ca 0.05 -0.56 -0.02 0.00 0.42 0.00 0.00 52.86 52.75 2rp3 s ASN 93 Cb -0.00 -1.27 0.02 0.00 -1.45 0.00 0.00 41.25 38.55 2rp3 s ASN 93 CO 0.03 -0.05 -0.05 -0.63 -3.72 0.00 0.00 177.10 172.68 2rp3 s ILE 94 N 1.42 2.97 -0.55 -5.21 -1.09 0.92 -4.65 121.20 115.02 2rp3 s ILE 94 Ca 0.05 -0.95 0.00 0.00 -2.23 0.00 0.00 60.65 57.51 2rp3 s ILE 94 Cb -0.13 -2.49 0.00 0.00 -1.58 0.00 0.00 42.46 38.26 2rp3 s ILE 94 CO -0.11 0.22 0.00 -0.90 -1.23 0.00 0.00 174.94 172.92 2rp3 n ASP 95 N 4.69 -2.46 0.00 3.58 5.68 -1.26 0.59 116.55 127.37 2rp3 n ASP 95 Ca -0.17 0.34 0.00 0.00 -0.50 0.00 0.00 54.79 54.46 2rp3 n ASP 95 Cb 0.47 -2.18 0.00 0.00 -1.14 0.00 0.00 41.12 38.28 2rp3 n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rp3 n GLY 96 N -0.63 0.86 3.23 6.12 0.00 -1.23 -3.74 105.19 109.80 2rp3 n GLY 96 Ca -0.07 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 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 1.63 -0.13 2.61 -4.23 0.20 -4.39 115.64 109.33 2rp3 s THR 97 Ca 0.00 -1.07 -0.25 0.00 -1.18 0.00 0.00 61.69 59.19 2rp3 s THR 97 Cb 0.00 -1.40 -0.02 0.00 1.34 0.00 0.00 72.50 72.42 2rp3 s THR 97 CO 0.00 0.29 0.79 -0.76 -0.54 0.00 0.00 174.62 174.40 2rp3 s LEU 98 N -0.92 4.23 0.09 4.79 1.43 -1.26 -0.05 118.68 126.98 2rp3 s LEU 98 Ca 0.07 1.19 -0.07 0.00 -1.03 0.00 0.00 54.13 54.30 2rp3 s LEU 98 Cb -0.08 -3.19 -0.01 0.00 0.03 0.00 0.00 46.19 42.94 2rp3 s LEU 98 CO 0.01 -0.29 0.14 -0.54 0.23 0.00 0.00 176.35 175.90 2rp3 s LYS 99 N 1.62 0.81 -0.08 1.70 1.02 -0.92 -4.64 119.74 119.25 2rp3 s LYS 99 Ca 0.38 -1.05 -0.14 0.00 0.02 0.00 0.00 55.97 55.19 2rp3 s LYS 99 Cb -0.17 0.31 -0.05 0.00 -0.52 0.00 0.00 37.83 37.40 2rp3 s LYS 99 CO 0.15 -0.24 0.34 -0.47 -0.92 0.00 0.00 175.35 174.22 2rp3 s TYR 100 N -3.89 3.60 0.00 3.18 5.04 -1.26 -0.31 117.35 123.71 2rp3 s TYR 100 Ca 0.07 0.79 0.00 0.00 -2.44 0.00 0.00 57.07 55.49 2rp3 s TYR 100 Cb 0.06 -2.29 0.00 0.00 0.35 0.00 0.00 41.96 40.08 2rp3 s TYR 100 CO -0.10 0.47 0.49 0.39 -1.34 0.00 0.00 175.55 175.46