#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 0.36 4.00 -0.72 0.00 -1.21 -4.80 105.19 102.82 2rp3 n GLY 2 Ca 0.00 -0.79 -0.40 0.00 0.00 0.00 0.00 46.02 44.82 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 10.81 -0.47 0.11 1.61 4.01 -0.48 -4.03 118.16 129.72 2rp3 n LYS 3 Ca 0.00 0.13 -0.20 0.00 -0.51 0.00 0.00 58.31 57.73 2rp3 n LYS 3 Cb 0.00 -2.14 -0.15 0.00 -0.51 0.00 0.00 35.03 32.24 2rp3 n LYS 3 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 2rp3 h PHE 4 N -1.86 0.68 -0.46 2.13 -0.00 -1.73 -3.24 116.94 112.47 2rp3 h PHE 4 Ca -0.65 -0.49 0.13 0.00 -0.00 0.00 0.00 57.97 56.96 2rp3 h PHE 4 Cb 1.30 -0.03 -0.02 0.00 -0.00 0.00 0.00 35.95 37.20 2rp3 h PHE 4 CO 0.32 1.43 0.41 1.03 -0.00 0.00 0.00 178.31 181.50 2rp3 h SER 5 N 0.10 0.00 -0.13 -0.68 0.87 -1.85 0.18 113.55 112.04 2rp3 h SER 5 Ca -0.21 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2rp3 h SER 5 Cb 2.06 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 64.01 2rp3 h SER 5 CO 0.22 0.00 0.08 1.56 -0.53 0.00 0.00 176.83 178.16 2rp3 h GLN 6 N 0.00 0.20 -0.03 2.24 4.20 -1.94 -2.93 115.11 116.86 2rp3 h GLN 6 Ca 0.22 -0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.80 2rp3 h GLN 6 Cb 1.03 -0.04 -0.23 0.00 0.30 0.00 0.00 27.48 28.54 2rp3 h GLN 6 CO -0.00 0.16 -0.81 -2.37 -0.67 0.00 0.00 178.83 175.13 2rp3 n THR 7 N -4.49 1.02 -4.11 -0.54 5.66 0.38 -5.05 114.28 107.14 2rp3 n THR 7 Ca -0.01 -2.07 -0.14 0.00 -3.05 0.00 0.00 64.05 58.78 2rp3 n THR 7 Cb 0.10 0.44 -0.13 0.00 -1.55 0.00 0.00 70.33 69.19 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 -0.82 0.42 -1.24 0.00 -0.85 0.38 -4.67 117.35 110.57 2rp3 s TYR 9 Ca -0.05 -0.84 -0.03 0.00 -0.52 0.00 0.00 57.07 55.63 2rp3 s TYR 9 Cb -0.07 -0.20 0.00 0.00 0.38 0.00 0.00 41.96 42.08 2rp3 s TYR 9 CO 0.00 -0.55 1.05 -1.71 -1.52 0.00 0.00 175.55 172.82 2rp3 n ASN 10 N -0.07 -3.58 -4.82 -0.18 5.15 -1.26 -1.52 115.26 108.98 2rp3 n ASN 10 Ca -0.11 -0.58 -0.33 0.00 -0.60 0.00 0.00 54.58 52.96 2rp3 n ASN 10 Cb 0.62 -5.03 -0.06 0.00 -0.53 0.00 0.00 39.78 34.78 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 -3.97 6.84 -0.02 1.20 1.04 -1.26 -3.91 113.70 113.61 2rp3 s SER 11 Ca 0.21 1.71 -0.21 0.00 0.48 0.00 0.00 55.95 58.14 2rp3 s SER 11 Cb -0.09 -2.54 0.04 0.00 0.10 0.00 0.00 66.02 63.53 2rp3 s SER 11 CO 0.72 -0.43 0.45 0.00 0.98 0.00 0.00 173.24 174.96 2rp3 s ALA 12 N -2.19 -1.17 -0.01 5.32 0.00 0.17 -4.95 121.76 118.93 2rp3 s ALA 12 Ca 0.62 0.68 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2rp3 s ALA 12 Cb -0.10 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.11 2rp3 s ALA 12 CO 0.15 -0.32 -0.01 0.42 0.00 0.00 0.00 175.76 176.00 2rp3 s ILE 13 N -1.41 0.11 -0.32 0.00 1.01 -1.26 -0.34 121.20 118.99 2rp3 s ILE 13 Ca -0.12 -0.03 0.05 0.00 0.00 0.00 0.00 60.65 60.55 2rp3 s ILE 13 Cb -0.03 -0.12 0.18 0.00 0.01 0.00 0.00 42.46 42.50 2rp3 s ILE 13 CO 0.06 0.05 0.52 -1.58 0.00 0.00 0.00 174.94 173.99 2rp3 s GLN 14 N 0.16 0.57 0.00 2.79 2.00 -1.14 -4.09 119.66 119.95 2rp3 s GLN 14 Ca -0.01 0.13 0.00 0.00 -2.00 0.00 0.00 55.36 53.47 2rp3 s GLN 14 Cb -0.03 -0.05 0.00 0.00 0.80 0.00 0.00 33.01 33.73 2rp3 s GLN 14 CO -0.00 -1.09 0.00 0.41 -0.50 0.00 0.00 175.29 174.11 2rp3 n GLY 15 N 5.09 2.02 1.22 2.59 0.00 -1.25 -4.10 105.19 110.76 2rp3 n GLY 15 Ca 0.05 -0.53 -0.06 0.00 0.00 0.00 0.00 46.02 45.48 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 4.11 -0.95 -3.88 1.61 3.41 -1.26 -4.67 113.62 111.99 2rp3 n SER 16 Ca 0.00 -2.02 -0.23 0.00 -0.26 0.00 0.00 58.87 56.36 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 -0.01 0.66 -0.16 -3.33 0.11 -1.26 -2.31 120.40 114.10 2rp3 s VAL 17 Ca 0.03 -0.13 -0.12 0.00 -2.93 0.00 0.00 61.98 58.82 2rp3 s VAL 17 Cb 0.07 -0.70 -0.05 0.00 -1.53 0.00 0.00 36.38 34.17 2rp3 s VAL 17 CO -0.02 0.28 0.23 -0.22 -3.33 0.00 0.00 175.10 172.04 2rp3 s LEU 18 N 1.31 4.26 -0.04 2.54 0.20 -0.14 -2.88 118.68 123.93 2rp3 s LEU 18 Ca -0.04 0.44 0.01 0.00 0.69 0.00 0.00 54.13 55.23 2rp3 s LEU 18 Cb -0.14 -2.26 0.02 0.00 -0.43 0.00 0.00 46.19 43.39 2rp3 s LEU 18 CO -0.02 0.17 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.27 2rp3 s THR 19 N 0.18 0.53 -0.24 3.68 2.01 0.54 -0.97 115.64 121.37 2rp3 s THR 19 Ca 0.14 -0.12 -0.17 0.00 0.31 0.00 0.00 61.69 61.85 2rp3 s THR 19 Cb -0.12 -0.56 0.07 0.00 0.01 0.00 0.00 72.50 71.90 2rp3 s THR 19 CO 0.03 0.22 0.60 -0.55 -0.69 0.00 0.00 174.62 174.23 2rp3 s SER 20 N 0.91 -0.74 -0.05 3.53 0.15 -1.17 0.42 113.70 116.75 2rp3 s SER 20 Ca -0.11 1.28 -0.30 0.00 0.70 0.00 0.00 55.95 57.52 2rp3 s SER 20 Cb -0.14 1.21 -0.04 0.00 -1.71 0.00 0.00 66.02 65.34 2rp3 s SER 20 CO 0.00 -0.22 1.27 -0.89 1.20 0.00 0.00 173.24 174.60 2rp3 s THR 21 N 1.04 4.09 0.09 6.45 2.01 -0.58 -4.01 115.64 124.73 2rp3 s THR 21 Ca -0.06 1.42 0.06 0.00 0.31 0.00 0.00 61.69 63.43 2rp3 s THR 21 Cb -0.05 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 2rp3 s THR 21 CO -0.10 -0.02 -0.17 0.00 -0.69 0.00 0.00 174.62 173.65 2rp3 s GLU 23 N -1.96 4.24 0.82 0.00 2.02 -1.16 -1.63 118.70 121.03 2rp3 s GLU 23 Ca 0.03 1.84 -0.10 0.00 0.02 0.00 0.00 54.97 56.75 2rp3 s GLU 23 Cb -0.09 -3.76 0.09 0.00 0.10 0.00 0.00 34.13 30.47 2rp3 s GLU 23 CO 0.03 -0.68 1.11 1.03 0.02 0.00 0.00 175.26 176.77 2rp3 s ARG 24 N 3.27 1.85 -0.07 1.61 0.52 0.16 -3.38 118.95 122.91 2rp3 s ARG 24 Ca 0.61 1.29 0.16 0.00 -0.52 0.00 0.00 55.73 57.27 2rp3 s ARG 24 Cb -0.26 -1.84 -0.22 0.00 0.52 0.00 0.00 34.95 33.14 2rp3 s ARG 24 CO 0.21 -1.96 0.47 2.41 0.02 0.00 0.00 175.30 176.45 2rp3 n THR 25 N -3.75 1.28 -0.05 0.02 -1.04 -1.26 -4.67 114.28 104.81 2rp3 n THR 25 Ca 0.10 -0.77 -0.06 0.00 -2.04 0.00 0.00 64.05 61.28 2rp3 n THR 25 Cb 0.53 -0.66 -0.02 0.00 -1.82 0.00 0.00 70.33 68.36 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 -2.83 1.69 0.00 8.00 5.15 -1.26 -5.05 115.26 120.96 2rp3 n ASN 26 Ca -0.20 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.06 2rp3 n ASN 26 Cb 0.99 -0.62 0.00 0.00 -0.53 0.00 0.00 39.78 39.62 2rp3 n ASN 26 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2rp3 n GLY 27 N 2.06 0.90 0.00 8.20 0.00 -1.26 -5.11 105.19 109.97 2rp3 n GLY 27 Ca -0.10 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 5.00 0.39 3.60 -0.02 0.00 -1.26 -4.66 105.19 108.23 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 1.40 2.95 -0.03 1.61 2.02 -1.26 0.35 117.35 124.39 2rp3 s TYR 29 Ca 0.00 0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.73 2rp3 s TYR 29 Cb 0.00 -1.69 0.02 0.00 -0.40 0.00 0.00 41.96 39.89 2rp3 s TYR 29 CO 0.00 0.36 -0.03 1.21 -1.57 0.00 0.00 175.55 175.52 2rp3 s ASN 30 N -1.00 0.69 -0.52 2.29 2.47 -0.64 -4.87 114.94 113.36 2rp3 s ASN 30 Ca 0.14 -0.08 0.01 0.00 0.42 0.00 0.00 52.86 53.34 2rp3 s ASN 30 Cb -0.11 -0.32 0.13 0.00 -1.45 0.00 0.00 41.25 39.50 2rp3 s ASN 30 CO 0.03 -0.06 0.29 -0.89 -3.72 0.00 0.00 177.10 172.75 2rp3 s THR 31 N 0.83 3.06 0.23 -5.21 2.01 -1.26 -1.06 115.64 114.24 2rp3 s THR 31 Ca -0.10 -2.87 0.03 0.00 0.31 0.00 0.00 61.69 59.06 2rp3 s THR 31 Cb -0.13 -3.08 0.03 0.00 0.01 0.00 0.00 72.50 69.33 2rp3 s THR 31 CO -0.00 -0.78 0.25 -1.20 -0.69 0.00 0.00 174.62 172.20 2rp3 n SER 32 N 3.62 1.23 -3.80 3.53 7.64 -1.26 -4.93 113.62 119.66 2rp3 n SER 32 Ca 0.05 -1.69 -0.11 0.00 1.01 0.00 0.00 58.87 58.13 2rp3 n SER 32 Cb 0.37 -0.10 -0.08 0.00 -1.01 0.00 0.00 64.21 63.39 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 -2.39 -0.05 -0.01 6.43 1.04 -1.26 -3.03 113.70 114.43 2rp3 s SER 33 Ca 0.19 -0.24 0.01 0.00 0.48 0.00 0.00 55.95 56.39 2rp3 s SER 33 Cb -0.02 0.31 0.01 0.00 0.10 0.00 0.00 66.02 66.42 2rp3 s SER 33 CO 0.12 -0.56 -0.03 -0.51 0.98 0.00 0.00 173.24 173.24 2rp3 s ILE 34 N -2.36 0.31 -0.31 -1.02 1.10 -0.14 -4.84 121.20 113.94 2rp3 s ILE 34 Ca -0.06 -0.12 -0.26 0.00 -0.51 0.00 0.00 60.65 59.70 2rp3 s ILE 34 Cb -0.02 -0.30 0.01 0.00 0.15 0.00 0.00 42.46 42.30 2rp3 s ILE 34 CO -0.02 0.12 0.92 -0.62 -2.11 0.00 0.00 174.94 173.22 2rp3 s ASP 35 N 0.23 6.78 0.00 4.50 -1.08 -1.26 -0.97 116.67 124.88 2rp3 s ASP 35 Ca -0.02 0.83 0.22 0.00 -0.52 0.00 0.00 52.55 53.05 2rp3 s ASP 35 Cb -0.05 -2.47 1.01 0.00 -1.46 0.00 0.00 42.92 39.95 2rp3 s ASP 35 CO -0.00 -0.74 1.70 0.18 0.52 0.00 0.00 175.17 176.83 2rp3 n LEU 36 N 6.50 0.00 0.24 -1.34 4.77 -0.98 -2.86 117.00 123.34 2rp3 n LEU 36 Ca 0.07 0.38 0.13 0.00 -0.03 0.00 0.00 56.01 56.57 2rp3 n LEU 36 Cb 0.48 -0.38 0.56 0.00 -2.33 0.00 0.00 43.42 41.74 2rp3 n LEU 36 CO 0.54 -0.10 0.88 -1.13 -1.33 0.00 0.00 177.39 176.25 2rp3 h ASN 37 N 0.00 0.00 -0.10 -1.43 -0.73 -1.86 -1.16 115.58 110.31 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 0.28 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.87 2rp3 h ASN 37 CO 0.00 0.14 0.00 -0.24 -0.37 0.00 0.00 177.43 176.96 2rp3 n SER 38 N -3.32 1.37 -0.17 1.15 2.88 -1.14 -3.31 113.62 111.09 2rp3 n SER 38 Ca 0.00 -1.58 0.00 0.00 -1.33 0.00 0.00 58.87 55.96 2rp3 n SER 38 Cb 0.37 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 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 0.10 0.00 -4.12 2.46 0.24 -0.48 -4.71 118.33 111.82 2rp3 n VAL 39 Ca 0.17 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.31 2rp3 n VAL 39 Cb 0.30 0.57 -0.15 0.00 -1.47 0.00 0.00 33.84 33.10 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 0.38 0.08 1.34 -1.09 0.67 -1.91 121.20 120.68 2rp3 s ILE 40 Ca 0.00 -0.17 0.08 0.00 -2.23 0.00 0.00 60.65 58.33 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 0.00 174.94 173.63 2rp3 s ALA 41 N 0.15 1.75 -0.33 9.38 0.00 -0.77 -1.81 121.76 130.13 2rp3 s ALA 41 Ca -0.01 -1.16 -0.09 0.00 0.00 0.00 0.00 51.96 50.69 2rp3 s ALA 41 Cb -0.05 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.81 2rp3 s ALA 41 CO -0.00 0.36 0.15 0.00 0.00 0.00 0.00 175.76 176.27 2rp3 s ALA 42 N -1.04 3.22 -0.24 0.00 0.00 -1.26 -2.59 121.76 119.85 2rp3 s ALA 42 Ca 0.06 -1.51 -0.01 0.00 0.00 0.00 0.00 51.96 50.51 2rp3 s ALA 42 Cb -0.10 -2.39 0.07 0.00 0.00 0.00 0.00 23.12 20.71 2rp3 s ALA 42 CO 0.03 -1.06 0.01 0.08 0.00 0.00 0.00 175.76 174.82 2rp3 s VAL 43 N 1.56 1.13 -1.89 0.00 1.01 -0.93 -4.76 120.40 116.51 2rp3 s VAL 43 Ca 0.03 -1.10 0.00 0.00 0.00 0.00 0.00 61.98 60.92 2rp3 s VAL 43 Cb -0.18 -1.57 0.00 0.00 0.00 0.00 0.00 36.38 34.63 2rp3 s VAL 43 CO 0.05 -0.26 0.00 0.47 0.00 0.00 0.00 175.10 175.36 2rp3 n ASP 44 N 4.80 -5.66 -0.34 3.32 9.92 -1.26 -2.03 116.55 125.30 2rp3 n ASP 44 Ca -0.08 0.17 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 2rp3 n ASP 44 Cb 0.45 -4.78 0.00 0.00 -0.64 0.00 0.00 41.12 36.14 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 -0.82 0.90 2.82 0.44 0.00 -1.16 -4.49 105.19 102.89 2rp3 n GLY 45 Ca -0.23 -0.60 -0.23 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.84 1.57 -0.28 1.61 0.01 -0.86 -4.73 113.70 108.19 2rp3 s SER 46 Ca 0.00 -0.14 -0.21 0.00 1.31 0.00 0.00 55.95 56.92 2rp3 s SER 46 Cb 0.00 -0.52 -0.01 0.00 0.21 0.00 0.00 66.02 65.70 2rp3 s SER 46 CO 0.00 -0.15 0.65 -0.76 0.41 0.00 0.00 173.24 173.39 2rp3 s LEU 47 N 1.70 4.10 0.04 2.44 1.43 -1.26 -2.20 118.68 124.93 2rp3 s LEU 47 Ca 0.02 0.61 0.06 0.00 -1.03 0.00 0.00 54.13 53.78 2rp3 s LEU 47 Cb -0.13 -2.87 -0.02 0.00 0.03 0.00 0.00 46.19 43.20 2rp3 s LEU 47 CO -0.05 -0.44 -0.16 -0.54 0.23 0.00 0.00 176.35 175.39 2rp3 s LYS 48 N 2.59 1.07 0.00 1.70 -0.14 -1.07 -4.90 119.74 118.99 2rp3 s LYS 48 Ca 0.27 -0.82 0.00 0.00 -1.36 0.00 0.00 55.97 54.05 2rp3 s LYS 48 Cb -0.15 -1.11 0.00 0.00 -1.68 0.00 0.00 37.83 34.89 2rp3 s LYS 48 CO 0.10 0.28 0.00 0.91 -0.76 0.00 0.00 175.35 175.88 2rp3 n TRP 49 N 1.85 -2.34 -4.00 3.18 7.02 -1.26 -1.84 117.44 120.06 2rp3 n TRP 49 Ca -0.18 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.00 2rp3 n TRP 49 Cb 0.54 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.36 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 -1.81 -0.85 -4.17 -0.99 10.64 -0.80 -4.58 117.38 114.82 2rp3 n GLN 50 Ca 0.00 0.10 -0.15 0.00 -1.83 0.00 0.00 57.00 55.11 2rp3 n GLN 50 Cb 0.00 -3.43 -0.07 0.00 -0.86 0.00 0.00 30.24 25.88 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 -3.46 1.70 0.24 2.61 0.00 -1.07 -4.91 107.32 102.42 2rp3 s GLY 51 Ca 0.36 -1.70 -0.16 0.00 0.00 0.00 0.00 44.72 43.22 2rp3 s GLY 51 CO 0.83 -1.22 0.55 -1.35 0.00 0.00 0.00 173.10 171.91 2rp3 s SER 52 N -3.25 -0.17 -0.71 1.64 1.04 -0.75 0.24 113.70 111.73 2rp3 s SER 52 Ca 0.35 -0.73 -0.01 0.00 0.48 0.00 0.00 55.95 56.04 2rp3 s SER 52 Cb 0.02 0.62 -0.02 0.00 0.10 0.00 0.00 66.02 66.74 2rp3 s SER 52 CO 0.20 -1.17 0.60 -3.20 0.98 0.00 0.00 173.24 170.66 2rp3 n ASN 53 N -0.39 -3.11 -0.06 7.02 5.15 -1.21 -4.38 115.26 118.29 2rp3 n ASN 53 Ca -0.04 -0.41 -0.07 0.00 -0.60 0.00 0.00 54.58 53.46 2rp3 n ASN 53 Cb 0.61 -3.40 -0.07 0.00 -0.53 0.00 0.00 39.78 36.39 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 -2.81 0.00 -0.19 1.20 1.16 -1.24 -4.09 117.46 111.49 2rp3 n PHE 54 Ca -0.13 0.00 -0.04 0.00 -1.87 0.00 0.00 57.45 55.41 2rp3 n PHE 54 Cb 0.59 -0.50 0.15 0.00 -1.61 0.00 0.00 39.48 38.12 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 1.24 -0.93 1.97 6.09 -1.87 -1.33 117.51 122.68 2rp3 h ILE 55 Ca -0.28 -0.79 0.25 0.00 -1.37 0.00 0.00 64.86 62.67 2rp3 h ILE 55 Cb 1.55 0.52 -0.05 0.00 0.47 0.00 0.00 36.82 39.31 2rp3 h ILE 55 CO -0.01 0.31 0.65 -0.33 -3.07 0.00 0.00 178.15 175.70 2rp3 h GLU 56 N 0.93 0.12 -0.13 2.19 4.39 -1.98 0.76 114.58 120.85 2rp3 h GLU 56 Ca 0.21 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.88 2rp3 h GLU 56 Cb 0.25 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2rp3 h GLU 56 CO -0.01 0.08 -0.06 0.00 -1.16 0.00 0.00 179.01 177.86 2rp3 n ALA 57 N -2.65 2.91 -2.23 3.43 0.00 -0.60 -5.03 120.51 116.33 2rp3 n ALA 57 Ca 0.20 -2.65 -0.08 0.00 0.00 0.00 0.00 53.44 50.91 2rp3 n ALA 57 Cb 0.92 -0.54 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 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 -3.91 2.06 -0.98 0.00 3.03 -0.06 -4.77 118.95 114.33 2rp3 s ARG 59 Ca 0.07 -1.74 -0.13 0.00 2.03 0.00 0.00 55.73 55.97 2rp3 s ARG 59 Cb 0.07 0.49 0.01 0.00 -1.03 0.00 0.00 34.95 34.49 2rp3 s ARG 59 CO -0.10 -0.89 0.69 0.09 -1.13 0.00 0.00 175.30 173.96 2rp3 n ASN 60 N -1.56 -5.30 -4.85 -2.89 3.02 -1.26 -1.68 115.26 100.74 2rp3 n ASN 60 Ca -0.01 -0.91 -0.36 0.00 -0.03 0.00 0.00 54.58 53.27 2rp3 n ASN 60 Cb 0.61 -2.69 -0.06 0.00 -0.61 0.00 0.00 39.78 37.03 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 -3.23 5.29 0.27 3.41 -4.23 -1.26 -3.96 115.64 111.93 2rp3 s THR 61 Ca 0.23 0.04 -0.21 0.00 -1.18 0.00 0.00 61.69 60.57 2rp3 s THR 61 Cb -0.10 -3.34 0.05 0.00 1.34 0.00 0.00 72.50 70.45 2rp3 s THR 61 CO 0.88 0.54 0.83 0.00 -0.54 0.00 0.00 174.62 176.33 2rp3 s GLN 62 N -1.24 1.73 -0.03 3.99 -2.07 -0.45 -3.94 119.66 117.66 2rp3 s GLN 62 Ca 0.18 -1.03 -0.20 0.00 -1.82 0.00 0.00 55.36 52.49 2rp3 s GLN 62 Cb -0.12 0.54 -0.05 0.00 -1.09 0.00 0.00 33.01 32.29 2rp3 s GLN 62 CO 0.07 -0.80 0.59 -1.17 -1.32 0.00 0.00 175.29 172.66 2rp3 s LEU 63 N -3.02 4.39 -0.02 2.60 2.96 -1.26 -1.81 118.68 122.51 2rp3 s LEU 63 Ca 0.14 1.11 0.04 0.00 -0.22 0.00 0.00 54.13 55.20 2rp3 s LEU 63 Cb -0.04 -2.90 -0.01 0.00 0.50 0.00 0.00 46.19 43.74 2rp3 s LEU 63 CO 0.07 0.07 -0.15 0.00 -1.32 0.00 0.00 176.35 175.02 2rp3 s ALA 64 N 0.00 1.32 0.00 5.97 0.00 -0.38 -4.88 121.76 123.80 2rp3 s ALA 64 Ca 0.31 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.63 2rp3 s ALA 64 Cb -0.18 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.55 2rp3 s ALA 64 CO 0.16 0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.61 2rp3 n GLY 65 N 2.93 1.02 0.00 0.00 0.00 -1.26 -2.23 105.19 105.66 2rp3 n GLY 65 Ca -0.16 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2rp3 n GLY 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rp3 n SER 66 N 2.54 0.00 -1.84 1.61 3.41 -1.26 -4.97 113.62 113.10 2rp3 n SER 66 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 2rp3 n SER 66 Cb 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.01 2rp3 n SER 66 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2rp3 n SER 67 N 0.00 1.81 -4.41 4.04 3.41 -1.24 -4.94 113.62 112.29 2rp3 n SER 67 Ca 0.00 -2.55 -0.29 0.00 -0.26 0.00 0.00 58.87 55.77 2rp3 n SER 67 Cb 0.00 -0.40 -0.12 0.00 -0.26 0.00 0.00 64.21 63.43 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 -2.20 1.49 -0.33 4.33 2.02 -0.95 0.12 118.70 123.19 2rp3 s GLU 68 Ca 0.35 -1.34 -0.00 0.00 0.02 0.00 0.00 54.97 53.99 2rp3 s GLU 68 Cb 0.37 -1.93 0.08 0.00 0.10 0.00 0.00 34.13 32.74 2rp3 s GLU 68 CO -0.09 0.45 0.05 -1.17 0.02 0.00 0.00 175.26 174.52 2rp3 s LEU 69 N -2.16 4.36 -0.11 1.80 1.98 0.50 -1.25 118.68 123.80 2rp3 s LEU 69 Ca 0.16 -1.66 -0.16 0.00 -2.89 0.00 0.00 54.13 49.58 2rp3 s LEU 69 Cb -0.10 -1.71 -0.05 0.00 0.66 0.00 0.00 46.19 45.00 2rp3 s LEU 69 CO 0.07 -0.35 0.41 0.00 -1.89 0.00 0.00 176.35 174.59 2rp3 s ALA 70 N 1.14 3.56 0.24 5.97 0.00 -0.75 -2.73 121.76 129.18 2rp3 s ALA 70 Ca 0.01 -0.28 -0.22 0.00 0.00 0.00 0.00 51.96 51.48 2rp3 s ALA 70 Cb -0.20 -2.51 0.04 0.00 0.00 0.00 0.00 23.12 20.44 2rp3 s ALA 70 CO -0.04 0.13 0.70 0.00 0.00 0.00 0.00 175.76 176.55 2rp3 s ALA 71 N 0.21 -1.34 -0.17 0.00 0.00 -0.08 -1.34 121.76 119.04 2rp3 s ALA 71 Ca 0.23 -0.08 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 2rp3 s ALA 71 Cb -0.15 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.80 2rp3 s ALA 71 CO 0.09 -0.97 -0.07 -1.21 0.00 0.00 0.00 175.76 173.61 2rp3 s GLU 72 N -3.85 3.50 -0.02 0.00 2.02 -0.68 -0.05 118.70 119.63 2rp3 s GLU 72 Ca 0.08 -0.60 0.06 0.00 0.02 0.00 0.00 54.97 54.53 2rp3 s GLU 72 Cb -0.05 -2.86 -0.01 0.00 0.10 0.00 0.00 34.13 31.31 2rp3 s GLU 72 CO 0.02 0.10 -0.19 0.00 0.02 0.00 0.00 175.26 175.21 2rp3 s LYS 74 N -0.41 4.38 0.85 0.00 2.20 -0.25 -1.71 119.74 124.80 2rp3 s LYS 74 Ca 0.06 1.96 -0.13 0.00 -0.36 0.00 0.00 55.97 57.51 2rp3 s LYS 74 Cb -0.08 -3.27 0.11 0.00 -1.51 0.00 0.00 37.83 33.08 2rp3 s LYS 74 CO -0.00 -0.31 1.20 0.95 -0.36 0.00 0.00 175.35 176.82 2rp3 s THR 75 N 0.79 2.00 0.59 3.43 -4.23 0.17 -2.97 115.64 115.41 2rp3 s THR 75 Ca 0.60 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 61.40 2rp3 s THR 75 Cb -0.34 -2.97 0.35 0.00 1.34 0.00 0.00 72.50 70.88 2rp3 s THR 75 CO 0.32 0.00 2.20 0.00 -0.54 0.00 0.00 174.62 176.60 2rp3 h ALA 76 N -1.21 1.65 0.00 3.99 0.00 -1.89 0.20 119.26 122.00 2rp3 h ALA 76 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2rp3 h ALA 76 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2rp3 h ALA 76 CO 0.61 -0.09 -0.32 0.00 0.00 0.00 0.00 179.25 179.44 2rp3 n ALA 77 N -2.34 2.63 -0.17 0.00 0.00 -1.26 -4.93 120.51 114.43 2rp3 n ALA 77 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2rp3 n ALA 77 Cb 0.16 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 1.33 1.42 3.08 0.00 0.00 0.69 -5.11 105.19 106.60 2rp3 n GLY 78 Ca 0.04 -0.06 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 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 2.16 -0.21 1.61 -0.21 -1.25 -4.78 119.66 116.18 2rp3 s GLN 79 Ca 0.00 -0.56 -0.29 0.00 0.02 0.00 0.00 55.36 54.52 2rp3 s GLN 79 Cb 0.00 -1.74 -0.00 0.00 1.00 0.00 0.00 33.01 32.27 2rp3 s GLN 79 CO 0.00 0.05 1.16 -0.06 -2.12 0.00 0.00 175.29 174.32 2rp3 s PHE 80 N 0.65 3.05 0.51 0.91 0.08 -1.26 0.44 117.98 122.35 2rp3 s PHE 80 Ca -0.14 1.19 0.06 0.00 0.12 0.00 0.00 56.93 58.16 2rp3 s PHE 80 Cb -0.16 -3.46 0.02 0.00 -0.57 0.00 0.00 43.02 38.85 2rp3 s PHE 80 CO 0.04 -1.15 0.39 0.14 -0.10 0.00 0.00 175.22 174.53 2rp3 s VAL 81 N 3.47 1.89 -0.42 -0.44 -7.23 -0.69 -4.87 120.40 112.11 2rp3 s VAL 81 Ca 0.50 -1.48 -0.19 0.00 -1.81 0.00 0.00 61.98 59.00 2rp3 s VAL 81 Cb -0.18 -2.37 0.02 0.00 0.56 0.00 0.00 36.38 34.41 2rp3 s VAL 81 CO 0.12 0.00 0.54 -0.44 -0.31 0.00 0.00 175.10 175.01 2rp3 s SER 82 N -4.23 6.27 0.02 4.85 0.01 -1.26 -2.60 113.70 116.76 2rp3 s SER 82 Ca 0.38 -0.45 0.03 0.00 1.31 0.00 0.00 55.95 57.21 2rp3 s SER 82 Cb -0.02 -2.27 -0.04 0.00 0.21 0.00 0.00 66.02 63.90 2rp3 s SER 82 CO 0.23 -0.66 -0.01 0.42 0.41 0.00 0.00 173.24 173.63 2rp3 s THR 83 N 2.48 4.06 0.05 1.44 -4.23 0.93 -4.99 115.64 115.37 2rp3 s THR 83 Ca 0.18 -0.72 -0.04 0.00 -1.18 0.00 0.00 61.69 59.92 2rp3 s THR 83 Cb -0.16 -2.84 -0.02 0.00 1.34 0.00 0.00 72.50 70.83 2rp3 s THR 83 CO 0.16 0.31 0.07 -1.59 -0.54 0.00 0.00 174.62 173.03 2rp3 s LYS 84 N -1.74 0.60 -0.16 3.99 0.00 -1.26 -0.91 119.74 120.27 2rp3 s LYS 84 Ca 0.21 -0.87 -0.28 0.00 0.00 0.00 0.00 55.97 55.02 2rp3 s LYS 84 Cb -0.12 0.23 0.09 0.00 0.00 0.00 0.00 37.83 38.03 2rp3 s LYS 84 CO 0.12 -0.15 0.80 -1.50 0.00 0.00 0.00 175.35 174.63 2rp3 s ILE 85 N -2.96 0.00 -0.33 3.79 2.07 -1.11 -4.80 121.20 117.86 2rp3 s ILE 85 Ca -0.02 0.00 -0.29 0.00 -1.41 0.00 0.00 60.65 58.93 2rp3 s ILE 85 Cb 0.01 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.62 2rp3 s ILE 85 CO -0.06 0.00 1.08 0.21 -1.91 0.00 0.00 174.94 174.26 2rp3 s ASN 86 N -0.56 6.91 0.32 4.50 3.04 -1.26 -0.37 114.94 127.51 2rp3 s ASN 86 Ca -0.04 1.00 0.08 0.00 0.04 0.00 0.00 52.86 53.94 2rp3 s ASN 86 Cb -0.02 -2.54 0.54 0.00 -1.54 0.00 0.00 41.25 37.69 2rp3 s ASN 86 CO 0.04 -0.91 1.75 -0.07 -3.04 0.00 0.00 177.10 174.86 2rp3 h LEU 87 N 10.18 0.18 0.00 3.21 3.38 0.64 -2.51 115.31 130.39 2rp3 h LEU 87 Ca -0.21 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2rp3 h LEU 87 Cb 1.06 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2rp3 h LEU 87 CO 1.04 0.55 0.00 -0.90 0.09 0.00 0.00 178.44 179.22 2rp3 n ASP 88 N -4.06 0.00 -0.28 -0.43 5.68 -1.16 -1.31 116.55 114.99 2rp3 n ASP 88 Ca -0.01 0.24 -0.06 0.00 -0.50 0.00 0.00 54.79 54.45 2rp3 n ASP 88 Cb 0.45 -0.35 0.06 0.00 -1.14 0.00 0.00 41.12 40.14 2rp3 n ASP 88 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 2rp3 h ASP 89 N 0.00 1.07 0.00 -1.12 1.82 -1.77 -1.27 116.42 115.15 2rp3 h ASP 89 Ca 0.00 -0.18 0.00 0.00 -0.39 0.00 0.00 57.03 56.46 2rp3 h ASP 89 Cb 0.13 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 39.86 2rp3 h ASP 89 CO 0.00 0.96 -0.34 1.41 -1.61 0.00 0.00 179.24 179.66 2rp3 n HIS 90 N -4.29 0.00 -1.68 0.28 8.25 -1.15 -4.55 115.22 112.08 2rp3 n HIS 90 Ca 0.07 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.07 2rp3 n HIS 90 Cb 0.19 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.26 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 -1.59 0.53 -4.56 1.59 2.08 -0.43 -2.49 119.36 114.49 2rp3 n ILE 91 Ca 0.00 -0.09 -0.26 0.00 0.56 0.00 0.00 62.75 62.96 2rp3 n ILE 91 Cb 0.17 -1.96 -0.10 0.00 -0.75 0.00 0.00 39.64 37.00 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 3.63 2.94 -0.22 -1.39 0.00 -0.18 -2.23 121.76 124.30 2rp3 s ALA 92 Ca 0.89 -1.87 -0.05 0.00 0.00 0.00 0.00 51.96 50.93 2rp3 s ALA 92 Cb -0.61 0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 2rp3 s ALA 92 CO 0.46 -0.20 -0.01 1.21 0.00 0.00 0.00 175.76 177.22 2rp3 s ASN 93 N -3.63 4.58 -0.31 0.00 2.47 -1.26 -2.09 114.94 114.70 2rp3 s ASN 93 Ca 0.31 -0.31 0.01 0.00 0.42 0.00 0.00 52.86 53.29 2rp3 s ASN 93 Cb 0.08 -1.79 0.07 0.00 -1.45 0.00 0.00 41.25 38.16 2rp3 s ASN 93 CO 0.15 -0.00 -0.01 -0.63 -3.72 0.00 0.00 177.10 172.89 2rp3 s ILE 94 N 1.38 2.57 -1.37 -5.21 -1.09 0.14 -4.67 121.20 112.96 2rp3 s ILE 94 Ca 0.05 -1.76 -0.01 0.00 -2.23 0.00 0.00 60.65 56.69 2rp3 s ILE 94 Cb -0.14 -2.62 0.01 0.00 -1.58 0.00 0.00 42.46 38.12 2rp3 s ILE 94 CO -0.00 -0.25 0.09 0.47 -1.23 0.00 0.00 174.94 174.01 2rp3 n ASP 95 N 4.47 -4.79 0.00 3.58 9.92 -1.26 -0.47 116.55 128.00 2rp3 n ASP 95 Ca -0.08 0.04 0.00 0.00 -0.53 0.00 0.00 54.79 54.21 2rp3 n ASP 95 Cb 0.42 -4.00 0.00 0.00 -0.64 0.00 0.00 41.12 36.90 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 -0.97 0.70 3.51 0.44 0.00 -1.22 -3.98 105.19 103.68 2rp3 n GLY 96 Ca -0.17 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 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 2.99 0.03 2.61 -4.23 0.38 -4.09 115.64 111.32 2rp3 s THR 97 Ca 0.00 -1.34 -0.24 0.00 -1.18 0.00 0.00 61.69 58.92 2rp3 s THR 97 Cb 0.00 -2.35 -0.05 0.00 1.34 0.00 0.00 72.50 71.44 2rp3 s THR 97 CO 0.00 0.17 0.74 -0.76 -0.54 0.00 0.00 174.62 174.23 2rp3 s LEU 98 N -1.96 4.43 -0.13 4.79 1.43 -1.26 0.27 118.68 126.26 2rp3 s LEU 98 Ca 0.18 1.39 -0.22 0.00 -1.03 0.00 0.00 54.13 54.45 2rp3 s LEU 98 Cb -0.11 -3.18 0.05 0.00 0.03 0.00 0.00 46.19 42.98 2rp3 s LEU 98 CO 0.10 0.01 0.55 -0.54 0.23 0.00 0.00 176.35 176.70 2rp3 s LYS 99 N 0.02 0.78 0.11 1.70 1.02 -0.89 -4.68 119.74 117.80 2rp3 s LYS 99 Ca 0.38 0.44 -0.27 0.00 0.02 0.00 0.00 55.97 56.54 2rp3 s LYS 99 Cb -0.20 0.37 -0.06 0.00 -0.52 0.00 0.00 37.83 37.42 2rp3 s LYS 99 CO 0.22 -0.17 0.84 -0.47 -0.92 0.00 0.00 175.35 174.85 2rp3 s TYR 100 N -0.46 3.82 -2.59 3.18 6.14 -1.26 -1.01 117.35 125.17 2rp3 s TYR 100 Ca -0.06 1.64 0.21 0.00 0.64 0.00 0.00 57.07 59.50 2rp3 s TYR 100 Cb -0.03 -2.89 0.16 0.00 0.42 0.00 0.00 41.96 39.62 2rp3 s TYR 100 CO 0.04 0.33 1.16 0.39 0.64 0.00 0.00 175.55 178.11