#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 2.38 4.04 -0.72 0.00 -1.19 -4.64 105.19 105.06 2rp3 n GLY 2 Ca 0.00 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 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 10.97 -0.34 0.11 1.61 4.01 -0.13 -3.99 118.16 130.39 2rp3 n LYS 3 Ca 0.00 0.01 -0.21 0.00 -0.51 0.00 0.00 58.31 57.60 2rp3 n LYS 3 Cb 0.00 -2.03 -0.15 0.00 -0.51 0.00 0.00 35.03 32.34 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 -1.92 0.74 -0.34 2.13 -0.00 -1.78 -3.25 116.94 112.51 2rp3 h PHE 4 Ca -0.63 -0.54 0.10 0.00 -0.00 0.00 0.00 57.97 56.90 2rp3 h PHE 4 Cb 1.24 -0.03 -0.01 0.00 -0.00 0.00 0.00 35.95 37.15 2rp3 h PHE 4 CO 0.32 1.52 0.41 0.66 -0.00 0.00 0.00 178.31 181.21 2rp3 h SER 5 N 0.11 0.00 -0.02 -0.68 4.64 -1.86 0.39 113.55 116.13 2rp3 h SER 5 Ca -0.26 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.02 2rp3 h SER 5 Cb 2.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.17 2rp3 h SER 5 CO 0.22 0.00 -0.08 1.56 -0.87 0.00 0.00 176.83 177.66 2rp3 h GLN 6 N 0.00 0.23 -0.16 4.77 4.20 -1.94 -3.01 115.11 119.19 2rp3 h GLN 6 Ca 0.16 -0.04 -0.17 0.00 0.06 0.00 0.00 58.65 58.66 2rp3 h GLN 6 Cb 0.97 -0.04 -0.26 0.00 0.30 0.00 0.00 27.48 28.46 2rp3 h GLN 6 CO -0.00 0.32 -0.83 -2.37 -0.67 0.00 0.00 178.83 175.29 2rp3 n THR 7 N -4.33 1.32 -3.83 -0.54 5.66 0.11 -5.04 114.28 107.64 2rp3 n THR 7 Ca -0.01 -2.52 -0.12 0.00 -3.05 0.00 0.00 64.05 58.35 2rp3 n THR 7 Cb 0.23 0.30 -0.13 0.00 -1.55 0.00 0.00 70.33 69.17 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 0.17 1.12 -1.14 0.00 1.13 0.57 -4.57 117.35 114.63 2rp3 s TYR 9 Ca -0.01 -1.09 -0.02 0.00 -1.41 0.00 0.00 57.07 54.54 2rp3 s TYR 9 Cb -0.02 -0.64 0.00 0.00 -1.10 0.00 0.00 41.96 40.20 2rp3 s TYR 9 CO -0.00 -0.31 0.96 -1.71 -2.51 0.00 0.00 175.55 171.98 2rp3 n ASN 10 N -0.21 -3.14 -4.81 -0.18 5.15 -1.26 -0.80 115.26 110.00 2rp3 n ASN 10 Ca -0.06 -0.55 -0.33 0.00 -0.60 0.00 0.00 54.58 53.04 2rp3 n ASN 10 Cb 0.63 -4.70 -0.07 0.00 -0.53 0.00 0.00 39.78 35.11 2rp3 n ASN 10 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2rp3 s SER 11 N -3.98 6.95 -0.05 1.20 0.01 -1.26 -3.87 113.70 112.70 2rp3 s SER 11 Ca 0.15 1.72 -0.22 0.00 1.31 0.00 0.00 55.95 58.90 2rp3 s SER 11 Cb -0.07 -2.55 0.05 0.00 0.21 0.00 0.00 66.02 63.67 2rp3 s SER 11 CO 0.67 -0.35 0.49 0.00 0.41 0.00 0.00 173.24 174.46 2rp3 s ALA 12 N -2.11 -1.27 -0.01 1.44 0.00 0.19 -4.96 121.76 115.04 2rp3 s ALA 12 Ca 0.61 0.88 0.01 0.00 0.00 0.00 0.00 51.96 53.45 2rp3 s ALA 12 Cb -0.10 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 22.98 2rp3 s ALA 12 CO 0.14 -0.31 -0.02 0.42 0.00 0.00 0.00 175.76 176.00 2rp3 s ILE 13 N -1.12 0.21 -0.40 0.00 1.01 -1.26 -0.47 121.20 119.17 2rp3 s ILE 13 Ca -0.11 -0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.55 2rp3 s ILE 13 Cb -0.03 -0.23 0.17 0.00 0.01 0.00 0.00 42.46 42.39 2rp3 s ILE 13 CO 0.06 0.09 0.56 -1.58 0.00 0.00 0.00 174.94 174.08 2rp3 s GLN 14 N 0.32 0.78 0.00 2.79 2.00 -1.19 -4.24 119.66 120.13 2rp3 s GLN 14 Ca -0.03 -0.48 0.00 0.00 -2.00 0.00 0.00 55.36 52.85 2rp3 s GLN 14 Cb -0.06 -0.15 0.00 0.00 0.80 0.00 0.00 33.01 33.60 2rp3 s GLN 14 CO -0.01 -1.20 0.00 0.41 -0.50 0.00 0.00 175.29 173.99 2rp3 n GLY 15 N 4.30 2.16 0.55 2.59 0.00 -1.26 -4.31 105.19 109.23 2rp3 n GLY 15 Ca 0.11 -0.66 -0.01 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 2.45 -0.17 -4.14 1.61 3.41 -1.26 -4.75 113.62 110.78 2rp3 n SER 16 Ca 0.00 -1.10 -0.31 0.00 -0.26 0.00 0.00 58.87 57.20 2rp3 n SER 16 Cb 0.00 0.05 -0.17 0.00 -0.26 0.00 0.00 64.21 63.84 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 0.00 1.91 -0.14 -3.33 0.11 -1.26 -1.00 120.40 116.69 2rp3 s VAL 17 Ca 0.00 -0.89 -0.13 0.00 -2.93 0.00 0.00 61.98 58.03 2rp3 s VAL 17 Cb 0.00 -1.70 -0.05 0.00 -1.53 0.00 0.00 36.38 33.11 2rp3 s VAL 17 CO 0.00 0.52 0.28 -0.22 -3.33 0.00 0.00 175.10 172.35 2rp3 s LEU 18 N 0.86 4.28 -0.06 2.54 2.96 -0.62 -3.14 118.68 125.50 2rp3 s LEU 18 Ca -0.07 0.53 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 2rp3 s LEU 18 Cb -0.15 -2.34 0.02 0.00 0.50 0.00 0.00 46.19 44.22 2rp3 s LEU 18 CO -0.02 0.17 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.22 2rp3 s THR 19 N 0.11 0.73 -0.24 3.68 2.01 0.38 -1.39 115.64 120.92 2rp3 s THR 19 Ca 0.16 -0.21 -0.23 0.00 0.31 0.00 0.00 61.69 61.72 2rp3 s THR 19 Cb -0.13 -0.73 0.06 0.00 0.01 0.00 0.00 72.50 71.71 2rp3 s THR 19 CO 0.04 0.28 0.65 -0.55 -0.69 0.00 0.00 174.62 174.35 2rp3 s SER 20 N 1.01 -0.67 -0.11 3.53 0.15 -1.18 0.57 113.70 117.00 2rp3 s SER 20 Ca -0.09 1.29 -0.28 0.00 0.70 0.00 0.00 55.95 57.56 2rp3 s SER 20 Cb -0.14 1.30 -0.02 0.00 -1.71 0.00 0.00 66.02 65.45 2rp3 s SER 20 CO -0.00 -0.23 0.96 -0.89 1.20 0.00 0.00 173.24 174.27 2rp3 s THR 21 N 0.30 4.82 0.14 6.45 2.01 0.02 -3.80 115.64 125.58 2rp3 s THR 21 Ca -0.00 1.94 0.09 0.00 0.31 0.00 0.00 61.69 64.02 2rp3 s THR 21 Cb -0.04 -4.27 -0.04 0.00 0.01 0.00 0.00 72.50 68.16 2rp3 s THR 21 CO 0.01 0.03 -0.20 0.00 -0.69 0.00 0.00 174.62 173.77 2rp3 s GLU 23 N -2.39 4.27 0.63 0.00 2.02 -1.17 -1.69 118.70 120.37 2rp3 s GLU 23 Ca 0.12 1.62 -0.16 0.00 0.02 0.00 0.00 54.97 56.57 2rp3 s GLU 23 Cb -0.08 -3.69 -0.01 0.00 0.10 0.00 0.00 34.13 30.45 2rp3 s GLU 23 CO 0.06 -0.62 1.13 1.03 0.02 0.00 0.00 175.26 176.88 2rp3 s ARG 24 N 3.08 2.88 0.09 1.61 0.52 0.12 -3.21 118.95 124.05 2rp3 s ARG 24 Ca 0.54 1.49 0.15 0.00 -0.52 0.00 0.00 55.73 57.39 2rp3 s ARG 24 Cb -0.22 -1.95 -0.12 0.00 0.52 0.00 0.00 34.95 33.18 2rp3 s ARG 24 CO 0.16 -1.20 0.96 1.15 0.02 0.00 0.00 175.30 176.38 2rp3 h THR 25 N 0.32 0.73 0.00 0.02 2.02 -1.86 -3.42 112.91 110.73 2rp3 h THR 25 Ca -0.48 -2.28 -0.11 0.00 0.77 0.00 0.00 66.41 64.31 2rp3 h THR 25 Cb 1.26 2.24 -0.02 0.00 -1.74 0.00 0.00 68.15 69.89 2rp3 h THR 25 CO 0.54 0.42 -1.13 -3.20 0.37 0.00 0.00 175.52 172.52 2rp3 n ASN 26 N -3.02 1.11 0.00 4.18 4.05 -1.26 -5.06 115.26 115.25 2rp3 n ASN 26 Ca -0.08 0.18 0.00 0.00 0.45 0.00 0.00 54.58 55.13 2rp3 n ASN 26 Cb 0.86 -0.42 0.00 0.00 1.23 0.00 0.00 39.78 41.46 2rp3 n ASN 26 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2rp3 n GLY 27 N 2.42 0.92 0.00 8.20 0.00 -1.26 -5.12 105.19 110.35 2rp3 n GLY 27 Ca -0.16 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.78 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 0.63 3.61 -0.02 0.00 -1.26 -4.66 105.19 108.49 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 1.72 3.02 -0.05 1.61 2.02 -1.26 0.16 117.35 124.57 2rp3 s TYR 29 Ca 0.00 0.06 0.00 0.00 -0.37 0.00 0.00 57.07 56.77 2rp3 s TYR 29 Cb 0.00 -1.75 0.02 0.00 -0.40 0.00 0.00 41.96 39.83 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 -0.77 1.07 -0.57 2.29 2.47 -0.68 -4.90 114.94 113.86 2rp3 s ASN 30 Ca 0.12 -0.11 -0.04 0.00 0.42 0.00 0.00 52.86 53.24 2rp3 s ASN 30 Cb -0.11 -0.43 0.15 0.00 -1.45 0.00 0.00 41.25 39.40 2rp3 s ASN 30 CO 0.02 -0.09 0.39 -0.89 -3.72 0.00 0.00 177.10 172.81 2rp3 s THR 31 N 1.19 3.80 0.46 -5.21 2.01 -1.26 -1.30 115.64 115.33 2rp3 s THR 31 Ca -0.07 -2.55 0.07 0.00 0.31 0.00 0.00 61.69 59.45 2rp3 s THR 31 Cb -0.14 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 68.88 2rp3 s THR 31 CO -0.02 -0.83 0.41 -0.44 -0.69 0.00 0.00 174.62 173.06 2rp3 s SER 32 N 1.33 4.93 0.08 3.53 0.01 -1.25 -4.94 113.70 117.39 2rp3 s SER 32 Ca 0.13 -0.89 0.03 0.00 1.31 0.00 0.00 55.95 56.54 2rp3 s SER 32 Cb -0.21 -0.26 -0.03 0.00 0.21 0.00 0.00 66.02 65.73 2rp3 s SER 32 CO -0.04 -0.81 -0.09 -0.94 0.41 0.00 0.00 173.24 171.77 2rp3 s SER 33 N -4.20 1.26 -0.02 2.44 1.04 -1.26 -3.11 113.70 109.84 2rp3 s SER 33 Ca 0.46 -0.75 -0.00 0.00 0.48 0.00 0.00 55.95 56.14 2rp3 s SER 33 Cb -0.03 0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.14 2rp3 s SER 33 CO 0.27 -0.26 0.03 -0.51 0.98 0.00 0.00 173.24 173.75 2rp3 s ILE 34 N -2.20 -0.02 -0.23 -1.02 1.10 -0.48 -4.86 121.20 113.49 2rp3 s ILE 34 Ca 0.01 0.22 -0.29 0.00 -0.51 0.00 0.00 60.65 60.08 2rp3 s ILE 34 Cb -0.04 -0.13 -0.00 0.00 0.15 0.00 0.00 42.46 42.44 2rp3 s ILE 34 CO -0.00 0.11 1.22 1.51 -2.11 0.00 0.00 174.94 175.67 2rp3 s ASP 35 N 1.20 6.89 0.00 4.50 -4.77 -1.26 -1.59 116.67 121.64 2rp3 s ASP 35 Ca -0.07 1.44 0.23 0.00 -3.30 0.00 0.00 52.55 50.85 2rp3 s ASP 35 Cb -0.13 -2.54 1.12 0.00 -1.09 0.00 0.00 42.92 40.28 2rp3 s ASP 35 CO -0.03 -0.85 1.76 0.18 0.70 0.00 0.00 175.17 176.93 2rp3 n LEU 36 N 6.88 0.00 0.27 2.11 4.77 -0.17 -2.96 117.00 127.90 2rp3 n LEU 36 Ca 0.14 0.35 0.16 0.00 -0.03 0.00 0.00 56.01 56.63 2rp3 n LEU 36 Cb 0.46 -0.35 0.67 0.00 -2.33 0.00 0.00 43.42 41.86 2rp3 n LEU 36 CO 0.58 -0.08 0.97 -1.13 -1.33 0.00 0.00 177.39 176.40 2rp3 h ASN 37 N 0.00 0.00 -0.09 -1.43 -0.73 -1.86 -0.94 115.58 110.53 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 0.03 0.00 -0.24 -0.37 0.00 0.00 177.43 176.85 2rp3 n SER 38 N -3.15 1.76 -0.07 1.15 2.88 -1.16 -3.40 113.62 111.63 2rp3 n SER 38 Ca 0.00 -1.64 0.00 0.00 -1.33 0.00 0.00 58.87 55.91 2rp3 n SER 38 Cb 0.32 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 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 0.38 0.00 -4.14 2.46 0.24 -0.39 -4.59 118.33 112.28 2rp3 n VAL 39 Ca 0.18 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.30 2rp3 n VAL 39 Cb 0.37 0.80 -0.15 0.00 -1.47 0.00 0.00 33.84 33.39 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 0.43 0.12 1.34 -1.09 0.13 -2.22 121.20 119.91 2rp3 s ILE 40 Ca 0.00 -0.15 0.09 0.00 -2.23 0.00 0.00 60.65 58.36 2rp3 s ILE 40 Cb 0.00 -0.42 -0.04 0.00 -1.58 0.00 0.00 42.46 40.43 2rp3 s ILE 40 CO 0.00 0.16 -0.22 0.00 -1.23 0.00 0.00 174.94 173.65 2rp3 s ALA 41 N 0.38 1.96 -0.30 9.38 0.00 -0.59 -2.29 121.76 130.30 2rp3 s ALA 41 Ca -0.04 -1.32 -0.07 0.00 0.00 0.00 0.00 51.96 50.53 2rp3 s ALA 41 Cb -0.08 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2rp3 s ALA 41 CO -0.00 0.39 0.08 0.00 0.00 0.00 0.00 175.76 176.22 2rp3 s ALA 42 N -1.24 3.05 -0.21 0.00 0.00 -1.25 -2.19 121.76 119.92 2rp3 s ALA 42 Ca 0.09 -1.47 -0.01 0.00 0.00 0.00 0.00 51.96 50.57 2rp3 s ALA 42 Cb -0.10 -2.14 0.06 0.00 0.00 0.00 0.00 23.12 20.94 2rp3 s ALA 42 CO 0.05 -0.94 -0.01 0.08 0.00 0.00 0.00 175.76 174.94 2rp3 s VAL 43 N 1.49 1.01 -1.84 0.00 1.01 -0.91 -4.77 120.40 116.39 2rp3 s VAL 43 Ca 0.02 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2rp3 s VAL 43 Cb -0.17 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 34.82 2rp3 s VAL 43 CO 0.02 -0.14 0.00 0.47 0.00 0.00 0.00 175.10 175.45 2rp3 n ASP 44 N 4.87 -5.60 -0.40 3.32 9.92 -1.26 -2.01 116.55 125.39 2rp3 n ASP 44 Ca -0.10 0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.31 2rp3 n ASP 44 Cb 0.46 -4.76 0.00 0.00 -0.64 0.00 0.00 41.12 36.18 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 -0.81 0.93 2.77 0.44 0.00 -1.13 -4.49 105.19 102.90 2rp3 n GLY 45 Ca -0.23 -0.61 -0.20 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.88 1.00 -0.25 1.61 0.01 -0.85 -4.69 113.70 107.66 2rp3 s SER 46 Ca 0.00 -0.03 -0.22 0.00 1.31 0.00 0.00 55.95 57.01 2rp3 s SER 46 Cb 0.00 -0.29 -0.01 0.00 0.21 0.00 0.00 66.02 65.93 2rp3 s SER 46 CO 0.00 -0.16 0.72 -0.76 0.41 0.00 0.00 173.24 173.44 2rp3 s LEU 47 N 1.59 4.07 0.04 2.44 1.43 -1.26 -2.13 118.68 124.87 2rp3 s LEU 47 Ca -0.02 0.86 0.07 0.00 -1.03 0.00 0.00 54.13 54.02 2rp3 s LEU 47 Cb -0.13 -3.00 -0.03 0.00 0.03 0.00 0.00 46.19 43.06 2rp3 s LEU 47 CO -0.03 -0.43 -0.21 -0.54 0.23 0.00 0.00 176.35 175.37 2rp3 s LYS 48 N 2.63 1.44 0.06 1.70 -0.14 -0.93 -4.91 119.74 119.58 2rp3 s LYS 48 Ca 0.30 -0.95 -0.01 0.00 -1.36 0.00 0.00 55.97 53.96 2rp3 s LYS 48 Cb -0.15 -1.55 0.01 0.00 -1.68 0.00 0.00 37.83 34.46 2rp3 s LYS 48 CO 0.08 0.40 0.04 0.91 -0.76 0.00 0.00 175.35 176.02 2rp3 n TRP 49 N 1.87 -2.74 -3.89 3.18 7.02 -1.26 -1.54 117.44 120.08 2rp3 n TRP 49 Ca -0.17 -0.04 -0.31 0.00 -1.02 0.00 0.00 57.50 55.96 2rp3 n TRP 49 Cb 0.53 -0.05 0.01 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 -1.81 -0.56 -2.90 -0.99 10.64 -0.94 -4.60 117.38 116.22 2rp3 n GLN 50 Ca 0.01 -0.00 -0.04 0.00 -1.83 0.00 0.00 57.00 55.13 2rp3 n GLN 50 Cb 0.03 -1.47 0.02 0.00 -0.86 0.00 0.00 30.24 27.95 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 -1.69 1.09 3.78 2.61 0.00 -1.19 -4.92 105.19 104.87 2rp3 n GLY 51 Ca -0.11 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.46 0.08 -0.92 1.61 1.04 -0.97 0.19 113.70 112.26 2rp3 s SER 52 Ca 0.13 -1.17 -0.00 0.00 0.48 0.00 0.00 55.95 55.38 2rp3 s SER 52 Cb -0.03 0.84 -0.00 0.00 0.10 0.00 0.00 66.02 66.93 2rp3 s SER 52 CO 0.06 -1.66 0.77 -3.20 0.98 0.00 0.00 173.24 170.18 2rp3 n ASN 53 N -1.41 -2.34 -0.07 7.02 5.15 -1.22 -4.22 115.26 118.16 2rp3 n ASN 53 Ca -0.08 -0.49 -0.09 0.00 -0.60 0.00 0.00 54.58 53.33 2rp3 n ASN 53 Cb 0.60 -4.10 -0.07 0.00 -0.53 0.00 0.00 39.78 35.68 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 -3.38 0.00 -0.15 1.20 1.16 -1.24 -3.95 117.46 111.11 2rp3 n PHE 54 Ca -0.21 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.34 2rp3 n PHE 54 Cb 0.63 -0.55 0.20 0.00 -1.61 0.00 0.00 39.48 38.14 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 -0.57 1.97 6.09 -1.87 -0.96 117.51 123.39 2rp3 h ILE 55 Ca -0.32 -0.74 0.17 0.00 -1.37 0.00 0.00 64.86 62.59 2rp3 h ILE 55 Cb 1.54 0.57 -0.02 0.00 0.47 0.00 0.00 36.82 39.38 2rp3 h ILE 55 CO -0.04 0.29 0.48 -0.33 -3.07 0.00 0.00 178.15 175.48 2rp3 h GLU 56 N 0.84 0.00 -0.01 2.19 4.39 -1.98 -0.11 114.58 119.90 2rp3 h GLU 56 Ca 0.19 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 2rp3 h GLU 56 Cb 0.23 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2rp3 h GLU 56 CO -0.01 0.00 -0.18 0.00 -1.16 0.00 0.00 179.01 177.66 2rp3 n ALA 57 N -2.52 2.81 -2.28 3.43 0.00 -0.46 -5.05 120.51 116.44 2rp3 n ALA 57 Ca 0.11 -2.88 -0.09 0.00 0.00 0.00 0.00 53.44 50.59 2rp3 n ALA 57 Cb 0.71 -0.38 -0.09 0.00 0.00 0.00 0.00 19.45 19.69 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 -0.03 0.67 -3.73 0.00 0.00 -0.06 -4.80 116.66 108.72 2rp3 n ARG 59 Ca -0.11 -2.37 -0.27 0.00 -0.00 0.00 0.00 57.85 55.10 2rp3 n ARG 59 Cb 0.62 2.36 0.01 0.00 -0.00 0.00 0.00 32.46 35.46 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 -5.22 -4.83 2.89 3.02 -1.26 -1.80 115.26 106.40 2rp3 n ASN 60 Ca -0.01 -0.92 -0.36 0.00 -0.03 0.00 0.00 54.58 53.26 2rp3 n ASN 60 Cb 0.51 -2.51 -0.07 0.00 -0.61 0.00 0.00 39.78 37.11 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 -3.19 5.33 0.31 3.41 -4.23 -1.26 -4.08 115.64 111.93 2rp3 s THR 61 Ca 0.19 0.15 -0.16 0.00 -1.18 0.00 0.00 61.69 60.69 2rp3 s THR 61 Cb -0.09 -3.33 0.02 0.00 1.34 0.00 0.00 72.50 70.44 2rp3 s THR 61 CO 0.88 0.59 0.66 0.00 -0.54 0.00 0.00 174.62 176.22 2rp3 s GLN 62 N -0.80 1.88 -0.13 3.99 -2.07 -0.87 -4.22 119.66 117.44 2rp3 s GLN 62 Ca 0.14 -1.25 -0.23 0.00 -1.82 0.00 0.00 55.36 52.19 2rp3 s GLN 62 Cb -0.12 0.57 -0.03 0.00 -1.09 0.00 0.00 33.01 32.34 2rp3 s GLN 62 CO 0.03 -0.85 0.73 -1.17 -1.32 0.00 0.00 175.29 172.71 2rp3 s LEU 63 N -3.01 4.23 -0.09 2.60 2.96 -1.26 -2.65 118.68 121.45 2rp3 s LEU 63 Ca 0.17 1.10 0.04 0.00 -0.22 0.00 0.00 54.13 55.21 2rp3 s LEU 63 Cb -0.04 -3.09 -0.00 0.00 0.50 0.00 0.00 46.19 43.56 2rp3 s LEU 63 CO 0.10 -0.25 -0.23 0.00 -1.32 0.00 0.00 176.35 174.65 2rp3 s ALA 64 N 1.54 2.10 0.00 5.97 0.00 0.80 -4.82 121.76 127.34 2rp3 s ALA 64 Ca 0.36 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.38 2rp3 s ALA 64 Cb -0.17 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.18 2rp3 s ALA 64 CO 0.14 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.61 2rp3 n GLY 65 N 3.46 1.11 0.00 0.00 0.00 -1.26 -1.85 105.19 106.65 2rp3 n GLY 65 Ca -0.19 -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 -1.26 0.00 0.00 0.00 173.32 172.06 2rp3 n SER 66 N 2.51 0.00 -1.27 1.61 2.88 -1.26 -4.96 113.62 113.12 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 0.05 0.00 -0.75 0.00 0.00 64.21 63.51 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 0.00 1.03 -4.28 -3.46 3.41 -1.23 -4.90 113.62 104.19 2rp3 n SER 67 Ca 0.00 -2.27 -0.32 0.00 -0.26 0.00 0.00 58.87 56.02 2rp3 n SER 67 Cb 0.00 -0.32 -0.16 0.00 -0.26 0.00 0.00 64.21 63.47 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 -0.48 3.04 -0.40 4.33 2.02 -0.77 0.70 118.70 127.14 2rp3 s GLU 68 Ca 0.32 -0.83 -0.17 0.00 0.02 0.00 0.00 54.97 54.31 2rp3 s GLU 68 Cb 0.35 -2.37 0.01 0.00 0.10 0.00 0.00 34.13 32.23 2rp3 s GLU 68 CO -0.14 0.24 0.45 -1.17 0.02 0.00 0.00 175.26 174.66 2rp3 s LEU 69 N 0.22 4.71 -0.14 1.80 1.98 0.10 -0.14 118.68 127.21 2rp3 s LEU 69 Ca -0.13 -0.51 -0.06 0.00 -2.89 0.00 0.00 54.13 50.54 2rp3 s LEU 69 Cb -0.16 -2.42 -0.04 0.00 0.66 0.00 0.00 46.19 44.22 2rp3 s LEU 69 CO 0.07 -0.54 0.08 0.00 -1.89 0.00 0.00 176.35 174.07 2rp3 s ALA 70 N 2.19 3.56 0.17 5.97 0.00 -1.08 -2.45 121.76 130.11 2rp3 s ALA 70 Ca 0.13 -0.72 -0.24 0.00 0.00 0.00 0.00 51.96 51.13 2rp3 s ALA 70 Cb -0.17 -1.84 0.06 0.00 0.00 0.00 0.00 23.12 21.17 2rp3 s ALA 70 CO 0.14 0.43 0.92 0.00 0.00 0.00 0.00 175.76 177.26 2rp3 s ALA 71 N -0.43 -1.58 -0.16 0.00 0.00 -0.39 -2.05 121.76 117.14 2rp3 s ALA 71 Ca 0.10 0.04 -0.02 0.00 0.00 0.00 0.00 51.96 52.08 2rp3 s ALA 71 Cb -0.12 0.67 -0.02 0.00 0.00 0.00 0.00 23.12 23.66 2rp3 s ALA 71 CO 0.02 -1.05 -0.08 -1.21 0.00 0.00 0.00 175.76 173.45 2rp3 s GLU 72 N -3.37 3.48 -0.02 0.00 2.02 -0.74 -0.29 118.70 119.78 2rp3 s GLU 72 Ca 0.12 -0.61 0.06 0.00 0.02 0.00 0.00 54.97 54.56 2rp3 s GLU 72 Cb -0.02 -2.83 -0.02 0.00 0.10 0.00 0.00 34.13 31.37 2rp3 s GLU 72 CO 0.03 0.12 -0.21 0.00 0.02 0.00 0.00 175.26 175.22 2rp3 s LYS 74 N -0.47 4.33 0.86 0.00 2.20 -0.07 -1.63 119.74 124.96 2rp3 s LYS 74 Ca 0.07 2.07 -0.13 0.00 -0.36 0.00 0.00 55.97 57.62 2rp3 s LYS 74 Cb -0.08 -3.25 0.12 0.00 -1.51 0.00 0.00 37.83 33.11 2rp3 s LYS 74 CO -0.01 -0.42 1.21 0.95 -0.36 0.00 0.00 175.35 176.72 2rp3 s THR 75 N 1.03 1.99 0.55 3.43 -4.23 0.22 -2.85 115.64 115.78 2rp3 s THR 75 Ca 0.64 0.00 0.22 0.00 -1.18 0.00 0.00 61.69 61.37 2rp3 s THR 75 Cb -0.37 -2.97 0.32 0.00 1.34 0.00 0.00 72.50 70.82 2rp3 s THR 75 CO 0.31 0.00 2.15 0.00 -0.54 0.00 0.00 174.62 176.54 2rp3 h ALA 76 N -1.25 1.91 0.00 3.99 0.00 -1.88 0.10 119.26 122.13 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 1.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2rp3 h ALA 76 CO 0.59 -0.12 -0.33 0.00 0.00 0.00 0.00 179.25 179.39 2rp3 n ALA 77 N -2.47 2.70 -0.06 0.00 0.00 -1.26 -4.93 120.51 114.48 2rp3 n ALA 77 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2rp3 n ALA 77 Cb 0.18 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.33 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 1.36 1.62 3.15 0.00 0.00 0.35 -5.11 105.19 106.56 2rp3 n GLY 78 Ca 0.05 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.76 2.44 -0.24 1.61 -0.21 -1.25 -4.77 119.66 116.46 2rp3 s GLN 79 Ca 0.00 -0.70 -0.29 0.00 0.02 0.00 0.00 55.36 54.39 2rp3 s GLN 79 Cb 0.00 -1.91 0.01 0.00 1.00 0.00 0.00 33.01 32.10 2rp3 s GLN 79 CO 0.00 0.15 1.11 -0.06 -2.12 0.00 0.00 175.29 174.37 2rp3 s PHE 80 N 0.39 3.16 0.50 0.91 0.08 -1.26 0.70 117.98 122.45 2rp3 s PHE 80 Ca -0.15 1.28 0.06 0.00 0.12 0.00 0.00 56.93 58.24 2rp3 s PHE 80 Cb -0.16 -3.45 0.01 0.00 -0.57 0.00 0.00 43.02 38.85 2rp3 s PHE 80 CO 0.06 -0.87 0.39 0.14 -0.10 0.00 0.00 175.22 174.84 2rp3 s VAL 81 N 3.44 2.00 -0.34 -0.44 -7.23 -0.65 -4.86 120.40 112.33 2rp3 s VAL 81 Ca 0.47 -1.46 -0.18 0.00 -1.81 0.00 0.00 61.98 59.00 2rp3 s VAL 81 Cb -0.16 -2.46 -0.01 0.00 0.56 0.00 0.00 36.38 34.31 2rp3 s VAL 81 CO 0.11 0.00 0.51 -0.44 -0.31 0.00 0.00 175.10 174.96 2rp3 s SER 82 N -4.21 6.32 0.04 4.85 0.01 -1.26 -2.37 113.70 117.08 2rp3 s SER 82 Ca 0.39 0.01 0.06 0.00 1.31 0.00 0.00 55.95 57.73 2rp3 s SER 82 Cb -0.02 -2.27 -0.03 0.00 0.21 0.00 0.00 66.02 63.91 2rp3 s SER 82 CO 0.24 -0.46 -0.14 0.42 0.41 0.00 0.00 173.24 173.71 2rp3 s THR 83 N 2.37 3.09 0.05 1.44 -4.23 0.60 -5.00 115.64 113.96 2rp3 s THR 83 Ca 0.19 -1.11 -0.01 0.00 -1.18 0.00 0.00 61.69 59.57 2rp3 s THR 83 Cb -0.15 -2.34 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 2rp3 s THR 83 CO 0.13 0.31 -0.03 -1.59 -0.54 0.00 0.00 174.62 172.89 2rp3 s LYS 84 N -1.58 0.59 -0.27 3.99 0.00 -1.26 -1.26 119.74 119.95 2rp3 s LYS 84 Ca 0.16 -1.16 -0.25 0.00 0.00 0.00 0.00 55.97 54.72 2rp3 s LYS 84 Cb -0.11 0.17 0.12 0.00 0.00 0.00 0.00 37.83 38.01 2rp3 s LYS 84 CO 0.07 -0.10 1.01 -1.50 0.00 0.00 0.00 175.35 174.83 2rp3 s ILE 85 N -3.63 0.00 -0.30 3.79 2.07 -1.03 -4.77 121.20 117.32 2rp3 s ILE 85 Ca 0.05 0.00 -0.29 0.00 -1.41 0.00 0.00 60.65 59.00 2rp3 s ILE 85 Cb 0.06 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.66 2rp3 s ILE 85 CO -0.09 0.00 1.06 0.21 -1.91 0.00 0.00 174.94 174.21 2rp3 s ASN 86 N 0.15 6.95 0.40 4.50 3.04 -1.26 -0.72 114.94 128.00 2rp3 s ASN 86 Ca 0.03 1.10 0.15 0.00 0.04 0.00 0.00 52.86 54.17 2rp3 s ASN 86 Cb -0.05 -2.54 0.84 0.00 -1.54 0.00 0.00 41.25 37.96 2rp3 s ASN 86 CO -0.05 -0.84 1.87 -0.07 -3.04 0.00 0.00 177.10 174.97 2rp3 h LEU 87 N 9.96 0.00 0.00 3.21 3.38 -0.08 -1.81 115.31 129.98 2rp3 h LEU 87 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 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 1.02 0.32 0.00 -0.90 0.09 0.00 0.00 178.44 178.97 2rp3 n ASP 88 N -4.04 0.00 0.17 -0.43 5.68 -1.20 -0.95 116.55 115.78 2rp3 n ASP 88 Ca -0.02 0.48 0.04 0.00 -0.50 0.00 0.00 54.79 54.80 2rp3 n ASP 88 Cb 0.37 -0.49 0.46 0.00 -1.14 0.00 0.00 41.12 40.32 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 0.12 0.00 -1.12 1.82 -1.63 -0.32 116.42 115.28 2rp3 h ASP 89 Ca 0.00 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.62 2rp3 h ASP 89 Cb 0.19 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.17 2rp3 h ASP 89 CO 0.00 0.26 0.00 1.41 -1.61 0.00 0.00 179.24 179.30 2rp3 n HIS 90 N -4.33 0.00 -1.67 0.28 8.25 -1.11 -4.49 115.22 112.16 2rp3 n HIS 90 Ca -0.01 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.00 2rp3 n HIS 90 Cb 0.23 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.31 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 -1.45 0.68 -4.75 1.59 2.08 -0.13 -2.26 119.36 115.12 2rp3 n ILE 91 Ca 0.00 -0.12 -0.33 0.00 0.56 0.00 0.00 62.75 62.86 2rp3 n ILE 91 Cb 0.00 -2.14 -0.07 0.00 -0.75 0.00 0.00 39.64 36.67 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 4.21 4.08 -0.22 -1.39 0.00 -0.23 -2.60 121.76 125.62 2rp3 s ALA 92 Ca 0.90 -0.33 -0.02 0.00 0.00 0.00 0.00 51.96 52.51 2rp3 s ALA 92 Cb -0.53 0.07 0.01 0.00 0.00 0.00 0.00 23.12 22.67 2rp3 s ALA 92 CO 0.45 -0.04 -0.09 1.21 0.00 0.00 0.00 175.76 177.30 2rp3 s ASN 93 N -3.87 3.99 -0.24 0.00 2.47 -1.26 -2.51 114.94 113.52 2rp3 s ASN 93 Ca 0.05 -0.55 -0.01 0.00 0.42 0.00 0.00 52.86 52.77 2rp3 s ASN 93 Cb 0.01 -1.66 0.02 0.00 -1.45 0.00 0.00 41.25 38.18 2rp3 s ASN 93 CO 0.03 -0.04 -0.08 -0.63 -3.72 0.00 0.00 177.10 172.67 2rp3 s ILE 94 N 1.40 2.78 -0.83 -5.21 -1.09 0.97 -4.66 121.20 114.57 2rp3 s ILE 94 Ca 0.05 -1.01 -0.05 0.00 -2.23 0.00 0.00 60.65 57.41 2rp3 s ILE 94 Cb -0.14 -2.39 0.04 0.00 -1.58 0.00 0.00 42.46 38.38 2rp3 s ILE 94 CO -0.06 0.24 0.18 -0.90 -1.23 0.00 0.00 174.94 173.17 2rp3 n ASP 95 N 4.66 -2.70 0.00 3.58 5.75 -1.26 0.65 116.55 127.23 2rp3 n ASP 95 Ca -0.17 0.02 0.00 0.00 -0.01 0.00 0.00 54.79 54.63 2rp3 n ASP 95 Cb 0.47 -2.33 0.00 0.00 -1.03 0.00 0.00 41.12 38.24 2rp3 n ASP 95 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2rp3 n GLY 96 N -0.82 0.63 3.19 6.12 0.00 -1.20 -3.98 105.19 109.13 2rp3 n GLY 96 Ca -0.04 -0.77 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 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 1.22 -0.22 2.61 -4.23 0.21 -4.31 115.64 108.92 2rp3 s THR 97 Ca 0.00 -1.34 -0.20 0.00 -1.18 0.00 0.00 61.69 58.98 2rp3 s THR 97 Cb 0.00 -1.16 -0.03 0.00 1.34 0.00 0.00 72.50 72.66 2rp3 s THR 97 CO 0.00 -0.19 0.58 -0.76 -0.54 0.00 0.00 174.62 173.71 2rp3 s LEU 98 N -1.74 4.12 -0.02 4.79 1.43 -1.26 -0.02 118.68 125.97 2rp3 s LEU 98 Ca -0.00 0.72 -0.13 0.00 -1.03 0.00 0.00 54.13 53.69 2rp3 s LEU 98 Cb -0.10 -2.80 0.02 0.00 0.03 0.00 0.00 46.19 43.34 2rp3 s LEU 98 CO 0.03 -0.26 0.28 -0.54 0.23 0.00 0.00 176.35 176.08 2rp3 s LYS 99 N 1.97 0.61 0.14 1.70 3.01 -1.05 -4.58 119.74 121.54 2rp3 s LYS 99 Ca 0.26 -0.17 -0.28 0.00 -1.01 0.00 0.00 55.97 54.76 2rp3 s LYS 99 Cb -0.16 0.27 -0.07 0.00 -1.01 0.00 0.00 37.83 36.86 2rp3 s LYS 99 CO 0.10 -0.16 0.88 -0.47 0.51 0.00 0.00 175.35 176.20 2rp3 s TYR 100 N -1.20 3.86 -0.67 3.18 6.14 -1.26 -1.06 117.35 126.33 2rp3 s TYR 100 Ca -0.13 1.73 0.05 0.00 0.64 0.00 0.00 57.07 59.36 2rp3 s TYR 100 Cb -0.05 -2.93 0.04 0.00 0.42 0.00 0.00 41.96 39.44 2rp3 s TYR 100 CO 0.03 0.35 0.67 0.39 0.64 0.00 0.00 175.55 177.63