#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 0.74 4.33 -0.72 0.00 -1.20 -4.82 105.19 103.51 2rp3 n GLY 2 Ca 0.00 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 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 12.28 -1.76 -0.27 1.61 4.01 0.03 -4.15 118.16 129.92 2rp3 n LYS 3 Ca 0.00 0.22 -0.04 0.00 -0.51 0.00 0.00 58.31 57.98 2rp3 n LYS 3 Cb 0.00 -4.51 0.11 0.00 -0.51 0.00 0.00 35.03 30.12 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 -1.39 1.14 -0.81 2.13 -0.00 -1.54 -2.10 116.94 114.36 2rp3 h PHE 4 Ca -0.62 -0.07 0.24 0.00 -0.00 0.00 0.00 57.97 57.52 2rp3 h PHE 4 Cb 1.39 -0.35 -0.03 0.00 -0.00 0.00 0.00 35.95 36.96 2rp3 h PHE 4 CO 0.61 0.85 0.63 1.03 -0.00 0.00 0.00 178.31 181.43 2rp3 h SER 5 N 1.11 0.00 0.10 -0.68 0.87 -1.84 0.38 113.55 113.50 2rp3 h SER 5 Ca 0.26 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.80 2rp3 h SER 5 Cb 0.16 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2rp3 h SER 5 CO -0.03 0.00 -0.09 1.56 -0.53 0.00 0.00 176.83 177.75 2rp3 h GLN 6 N 0.00 0.00 -0.12 2.24 4.20 -1.75 -2.86 115.11 116.83 2rp3 h GLN 6 Ca 0.39 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.93 2rp3 h GLN 6 Cb 1.63 0.00 -0.27 0.00 0.30 0.00 0.00 27.48 29.14 2rp3 h GLN 6 CO -0.00 0.09 -0.86 -2.37 -0.67 0.00 0.00 178.83 175.01 2rp3 n THR 7 N -4.31 1.09 -3.79 -0.54 5.66 0.10 -5.04 114.28 107.46 2rp3 n THR 7 Ca -0.03 -2.25 -0.14 0.00 -3.05 0.00 0.00 64.05 58.59 2rp3 n THR 7 Cb 0.17 0.46 -0.15 0.00 -1.55 0.00 0.00 70.33 69.25 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 0.79 1.47 -1.29 0.00 1.13 0.65 -4.57 117.35 115.55 2rp3 s TYR 9 Ca -0.06 -1.07 -0.08 0.00 -1.41 0.00 0.00 57.07 54.45 2rp3 s TYR 9 Cb -0.09 -0.86 0.01 0.00 -1.10 0.00 0.00 41.96 39.91 2rp3 s TYR 9 CO -0.03 -0.22 1.12 -1.71 -2.51 0.00 0.00 175.55 172.21 2rp3 n ASN 10 N -0.40 -5.85 -4.80 -0.18 5.15 -1.26 -0.59 115.26 107.32 2rp3 n ASN 10 Ca -0.03 -0.52 -0.32 0.00 -0.60 0.00 0.00 54.58 53.11 2rp3 n ASN 10 Cb 0.65 -4.85 0.04 0.00 -0.53 0.00 0.00 39.78 35.09 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 -3.39 5.36 -0.04 1.20 1.04 -1.26 -4.10 113.70 112.51 2rp3 s SER 11 Ca 0.51 1.76 -0.29 0.00 0.48 0.00 0.00 55.95 58.41 2rp3 s SER 11 Cb -0.23 -2.52 0.08 0.00 0.10 0.00 0.00 66.02 63.46 2rp3 s SER 11 CO 0.70 -1.46 0.75 0.00 0.98 0.00 0.00 173.24 174.20 2rp3 s ALA 12 N -2.74 -1.78 -0.01 5.32 0.00 0.11 -4.94 121.76 117.72 2rp3 s ALA 12 Ca 0.61 1.22 0.01 0.00 0.00 0.00 0.00 51.96 53.80 2rp3 s ALA 12 Cb -0.16 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2rp3 s ALA 12 CO 0.47 -0.44 -0.01 0.42 0.00 0.00 0.00 175.76 176.20 2rp3 s ILE 13 N -1.70 0.16 -0.40 0.00 1.01 -1.26 -0.60 121.20 118.41 2rp3 s ILE 13 Ca -0.06 -0.00 0.06 0.00 0.00 0.00 0.00 60.65 60.64 2rp3 s ILE 13 Cb -0.00 -0.19 0.17 0.00 0.01 0.00 0.00 42.46 42.45 2rp3 s ILE 13 CO 0.03 0.09 0.53 -1.58 0.00 0.00 0.00 174.94 174.01 2rp3 s GLN 14 N 0.43 0.75 0.00 2.79 2.00 -1.16 -4.21 119.66 120.26 2rp3 s GLN 14 Ca -0.04 -0.52 0.00 0.00 -2.00 0.00 0.00 55.36 52.80 2rp3 s GLN 14 Cb -0.07 -0.24 0.00 0.00 0.80 0.00 0.00 33.01 33.50 2rp3 s GLN 14 CO -0.01 -1.20 0.00 0.41 -0.50 0.00 0.00 175.29 174.00 2rp3 n GLY 15 N 4.33 1.96 1.03 2.59 0.00 -1.26 -4.22 105.19 109.62 2rp3 n GLY 15 Ca 0.11 -0.63 -0.06 0.00 0.00 0.00 0.00 46.02 45.45 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 3.59 -0.87 -3.87 1.61 3.41 -1.26 -4.74 113.62 111.49 2rp3 n SER 16 Ca 0.00 -1.70 -0.23 0.00 -0.26 0.00 0.00 58.87 56.68 2rp3 n SER 16 Cb 0.00 0.28 -0.17 0.00 -0.26 0.00 0.00 64.21 64.06 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 0.65 -0.04 -3.33 0.11 -1.26 -1.79 120.40 114.75 2rp3 s VAL 17 Ca 0.01 -0.12 -0.15 0.00 -2.93 0.00 0.00 61.98 58.78 2rp3 s VAL 17 Cb 0.03 -0.71 -0.05 0.00 -1.53 0.00 0.00 36.38 34.12 2rp3 s VAL 17 CO -0.01 0.28 0.40 -0.22 -3.33 0.00 0.00 175.10 172.23 2rp3 s LEU 18 N 1.37 4.41 -0.06 2.54 2.96 -0.25 -2.99 118.68 126.66 2rp3 s LEU 18 Ca -0.03 0.88 -0.00 0.00 -0.22 0.00 0.00 54.13 54.75 2rp3 s LEU 18 Cb -0.13 -2.58 0.03 0.00 0.50 0.00 0.00 46.19 44.00 2rp3 s LEU 18 CO -0.03 0.24 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.33 2rp3 s THR 19 N -0.58 0.48 -0.11 3.68 2.01 0.24 -0.98 115.64 120.39 2rp3 s THR 19 Ca 0.23 -0.00 -0.20 0.00 0.31 0.00 0.00 61.69 62.03 2rp3 s THR 19 Cb -0.16 -0.58 0.05 0.00 0.01 0.00 0.00 72.50 71.82 2rp3 s THR 19 CO 0.12 0.25 0.50 -0.55 -0.69 0.00 0.00 174.62 174.25 2rp3 s SER 20 N 1.56 -0.47 -0.18 3.53 0.15 -1.07 0.08 113.70 117.29 2rp3 s SER 20 Ca -0.01 0.70 -0.21 0.00 0.70 0.00 0.00 55.95 57.14 2rp3 s SER 20 Cb -0.13 0.73 -0.03 0.00 -1.71 0.00 0.00 66.02 64.88 2rp3 s SER 20 CO -0.04 -0.36 0.62 -0.89 1.20 0.00 0.00 173.24 173.77 2rp3 s THR 21 N -0.52 5.04 0.13 6.45 2.01 0.24 -3.53 115.64 125.46 2rp3 s THR 21 Ca -0.06 1.17 0.08 0.00 0.31 0.00 0.00 61.69 63.19 2rp3 s THR 21 Cb -0.03 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 2rp3 s THR 21 CO 0.04 0.14 -0.19 0.00 -0.69 0.00 0.00 174.62 173.91 2rp3 s GLU 23 N -2.36 4.21 0.76 0.00 2.02 -1.15 -1.80 118.70 120.37 2rp3 s GLU 23 Ca 0.11 1.70 -0.14 0.00 0.02 0.00 0.00 54.97 56.66 2rp3 s GLU 23 Cb -0.08 -3.80 0.05 0.00 0.10 0.00 0.00 34.13 30.41 2rp3 s GLU 23 CO 0.05 -0.75 1.17 1.03 0.02 0.00 0.00 175.26 176.79 2rp3 s ARG 24 N 3.60 2.04 0.02 1.61 0.52 0.17 -3.59 118.95 123.32 2rp3 s ARG 24 Ca 0.57 1.62 0.16 0.00 -0.52 0.00 0.00 55.73 57.55 2rp3 s ARG 24 Cb -0.23 -1.84 -0.17 0.00 0.52 0.00 0.00 34.95 33.24 2rp3 s ARG 24 CO 0.17 -1.88 0.75 2.41 0.02 0.00 0.00 175.30 176.76 2rp3 n THR 25 N -3.02 1.32 -0.05 0.02 -1.04 -1.25 -4.62 114.28 105.65 2rp3 n THR 25 Ca 0.12 -0.73 -0.07 0.00 -2.04 0.00 0.00 64.05 61.33 2rp3 n THR 25 Cb 0.51 -0.82 -0.02 0.00 -1.82 0.00 0.00 70.33 68.17 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 -2.93 1.60 0.00 8.00 5.15 -1.26 -5.05 115.26 120.77 2rp3 n ASN 26 Ca -0.13 0.26 0.00 0.00 -0.60 0.00 0.00 54.58 54.11 2rp3 n ASN 26 Cb 0.91 -0.59 0.00 0.00 -0.53 0.00 0.00 39.78 39.58 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 2.16 0.88 0.00 8.20 0.00 -1.26 -5.11 105.19 110.05 2rp3 n GLY 27 Ca -0.12 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 0.46 3.57 -0.02 0.00 -1.26 -4.67 105.19 108.26 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 2.88 -0.07 1.61 2.02 -1.26 0.41 117.35 124.34 2rp3 s TYR 29 Ca 0.00 -0.02 0.00 0.00 -0.37 0.00 0.00 57.07 56.68 2rp3 s TYR 29 Cb 0.00 -1.67 0.02 0.00 -0.40 0.00 0.00 41.96 39.91 2rp3 s TYR 29 CO 0.00 0.32 -0.04 1.21 -1.57 0.00 0.00 175.55 175.47 2rp3 s ASN 30 N -0.96 1.50 -0.54 2.29 2.47 -0.75 -4.87 114.94 114.09 2rp3 s ASN 30 Ca 0.13 -0.16 -0.08 0.00 0.42 0.00 0.00 52.86 53.17 2rp3 s ASN 30 Cb -0.11 -0.56 0.14 0.00 -1.45 0.00 0.00 41.25 39.27 2rp3 s ASN 30 CO 0.03 -0.11 0.40 -0.89 -3.72 0.00 0.00 177.10 172.81 2rp3 s THR 31 N 1.43 4.24 0.50 -5.21 2.01 -1.26 -1.85 115.64 115.50 2rp3 s THR 31 Ca -0.02 -2.09 0.02 0.00 0.31 0.00 0.00 61.69 59.91 2rp3 s THR 31 Cb -0.13 -3.77 0.02 0.00 0.01 0.00 0.00 72.50 68.62 2rp3 s THR 31 CO -0.03 -0.82 0.13 -1.54 -0.69 0.00 0.00 174.62 171.67 2rp3 n SER 32 N 4.54 3.12 -3.93 3.53 3.41 -1.23 -4.97 113.62 118.09 2rp3 n SER 32 Ca -0.02 -3.02 -0.10 0.00 -0.26 0.00 0.00 58.87 55.47 2rp3 n SER 32 Cb 0.41 0.21 -0.10 0.00 -0.26 0.00 0.00 64.21 64.47 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 -3.81 0.15 -0.03 4.04 1.04 -1.26 -2.61 113.70 111.21 2rp3 s SER 33 Ca 0.10 -0.42 0.02 0.00 0.48 0.00 0.00 55.95 56.13 2rp3 s SER 33 Cb -0.01 0.18 0.01 0.00 0.10 0.00 0.00 66.02 66.30 2rp3 s SER 33 CO 0.06 -0.40 -0.08 -0.51 0.98 0.00 0.00 173.24 173.30 2rp3 s ILE 34 N -1.87 0.71 -0.32 -1.02 -1.16 -0.15 -4.86 121.20 112.52 2rp3 s ILE 34 Ca -0.11 -0.28 -0.29 0.00 -0.51 0.00 0.00 60.65 59.45 2rp3 s ILE 34 Cb -0.06 -0.66 0.01 0.00 0.61 0.00 0.00 42.46 42.36 2rp3 s ILE 34 CO -0.01 0.24 1.22 -0.62 -2.81 0.00 0.00 174.94 172.95 2rp3 s ASP 35 N 0.46 6.75 0.00 4.50 -1.08 -1.26 -1.09 116.67 124.94 2rp3 s ASP 35 Ca -0.07 1.08 0.20 0.00 -0.52 0.00 0.00 52.55 53.24 2rp3 s ASP 35 Cb -0.11 -2.54 0.97 0.00 -1.46 0.00 0.00 42.92 39.78 2rp3 s ASP 35 CO 0.01 -1.04 1.62 0.18 0.52 0.00 0.00 175.17 176.46 2rp3 n LEU 36 N 7.42 0.00 0.22 -1.34 4.77 -0.74 -2.74 117.00 124.58 2rp3 n LEU 36 Ca 0.14 0.33 0.09 0.00 -0.03 0.00 0.00 56.01 56.53 2rp3 n LEU 36 Cb 0.47 -0.33 0.44 0.00 -2.33 0.00 0.00 43.42 41.67 2rp3 n LEU 36 CO 0.63 -0.11 0.78 -1.13 -1.33 0.00 0.00 177.39 176.23 2rp3 h ASN 37 N 0.00 0.00 -0.04 -1.43 -0.73 -1.86 -1.15 115.58 110.38 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 0.26 0.00 -1.20 -0.37 0.00 0.00 177.43 176.12 2rp3 n SER 38 N -3.45 1.11 -0.11 1.15 7.64 -1.11 -3.51 113.62 115.35 2rp3 n SER 38 Ca -0.00 -1.42 0.00 0.00 1.01 0.00 0.00 58.87 58.46 2rp3 n SER 38 Cb 0.44 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 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 -0.11 0.00 -4.15 0.44 0.24 -0.65 -4.61 118.33 109.48 2rp3 n VAL 39 Ca 0.19 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.32 2rp3 n VAL 39 Cb 0.28 0.83 -0.15 0.00 -1.47 0.00 0.00 33.84 33.33 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 0.45 0.10 1.34 -1.09 0.59 -2.14 121.20 120.45 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 -0.43 -0.03 0.00 -1.58 0.00 0.00 42.46 40.42 2rp3 s ILE 40 CO 0.00 0.16 -0.21 0.00 -1.23 0.00 0.00 174.94 173.66 2rp3 s ALA 41 N 0.32 1.82 -0.33 9.38 0.00 -0.61 -2.22 121.76 130.11 2rp3 s ALA 41 Ca -0.04 -1.24 -0.08 0.00 0.00 0.00 0.00 51.96 50.60 2rp3 s ALA 41 Cb -0.07 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.82 2rp3 s ALA 41 CO -0.00 0.37 0.12 0.00 0.00 0.00 0.00 175.76 176.25 2rp3 s ALA 42 N -1.14 3.12 -0.29 0.00 0.00 -1.25 -2.05 121.76 120.14 2rp3 s ALA 42 Ca 0.07 -1.62 0.01 0.00 0.00 0.00 0.00 51.96 50.42 2rp3 s ALA 42 Cb -0.10 -2.31 0.09 0.00 0.00 0.00 0.00 23.12 20.80 2rp3 s ALA 42 CO 0.04 -1.18 0.03 0.08 0.00 0.00 0.00 175.76 174.74 2rp3 s VAL 43 N 1.48 1.42 -1.38 0.00 1.01 -0.87 -4.78 120.40 117.28 2rp3 s VAL 43 Ca 0.01 -1.54 -0.03 0.00 0.00 0.00 0.00 61.98 60.43 2rp3 s VAL 43 Cb -0.18 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.27 2rp3 s VAL 43 CO 0.04 -0.45 0.33 -0.67 0.00 0.00 0.00 175.10 174.35 2rp3 n ASP 44 N 4.65 -5.33 -0.39 3.32 -0.08 -1.26 -2.78 116.55 114.68 2rp3 n ASP 44 Ca -0.04 -0.16 -0.01 0.00 -1.51 0.00 0.00 54.79 53.07 2rp3 n ASP 44 Cb 0.43 -4.26 0.00 0.00 2.34 0.00 0.00 41.12 39.63 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 -1.27 0.73 2.74 0.27 0.00 -1.18 -4.56 105.19 101.91 2rp3 n GLY 45 Ca -0.14 -0.73 -0.17 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 -3.00 0.62 -0.22 1.61 0.01 -1.12 -4.69 113.70 106.91 2rp3 s SER 46 Ca 0.01 0.10 -0.23 0.00 1.31 0.00 0.00 55.95 57.13 2rp3 s SER 46 Cb -0.00 -0.06 -0.01 0.00 0.21 0.00 0.00 66.02 66.15 2rp3 s SER 46 CO 0.01 -0.20 0.76 -0.76 0.41 0.00 0.00 173.24 173.46 2rp3 s LEU 47 N 1.70 4.11 0.08 2.44 1.43 -1.26 -2.05 118.68 125.13 2rp3 s LEU 47 Ca -0.01 0.97 0.09 0.00 -1.03 0.00 0.00 54.13 54.14 2rp3 s LEU 47 Cb -0.12 -3.08 -0.03 0.00 0.03 0.00 0.00 46.19 42.98 2rp3 s LEU 47 CO -0.03 -0.42 -0.24 -0.54 0.23 0.00 0.00 176.35 175.35 2rp3 s LYS 48 N 2.46 1.42 0.26 1.70 -0.14 -0.87 -4.91 119.74 119.66 2rp3 s LYS 48 Ca 0.33 -1.14 -0.04 0.00 -1.36 0.00 0.00 55.97 53.75 2rp3 s LYS 48 Cb -0.16 -1.69 0.07 0.00 -1.68 0.00 0.00 37.83 34.37 2rp3 s LYS 48 CO 0.09 0.42 0.23 0.91 -0.76 0.00 0.00 175.35 176.24 2rp3 n TRP 49 N 1.40 -3.18 -3.84 3.18 7.02 -1.26 -1.58 117.44 119.18 2rp3 n TRP 49 Ca -0.18 -0.21 -0.24 0.00 -1.02 0.00 0.00 57.50 55.85 2rp3 n TRP 49 Cb 0.53 -0.24 -0.07 0.00 -2.42 0.00 0.00 31.31 29.10 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 -2.22 -0.94 -2.45 -0.99 10.64 -0.91 -4.64 117.38 115.87 2rp3 n GLN 50 Ca 0.03 0.07 -0.05 0.00 -1.83 0.00 0.00 57.00 55.22 2rp3 n GLN 50 Cb 0.13 -2.72 -0.01 0.00 -0.86 0.00 0.00 30.24 26.78 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 -2.08 2.88 3.78 2.61 0.00 -1.18 -4.94 105.19 106.26 2rp3 n GLY 51 Ca -0.22 -1.49 -0.09 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.77 0.03 -1.11 1.61 1.04 -0.94 -0.30 113.70 112.26 2rp3 s SER 52 Ca 0.11 -1.06 -0.02 0.00 0.48 0.00 0.00 55.95 55.46 2rp3 s SER 52 Cb -0.00 0.80 -0.02 0.00 0.10 0.00 0.00 66.02 66.90 2rp3 s SER 52 CO 0.08 -1.56 0.94 0.59 0.98 0.00 0.00 173.24 174.26 2rp3 n ASN 53 N -1.17 -3.27 -0.08 7.02 4.13 -1.23 -4.18 115.26 116.48 2rp3 n ASN 53 Ca -0.06 -0.62 -0.10 0.00 1.68 0.00 0.00 54.58 55.48 2rp3 n ASN 53 Cb 0.60 -4.97 -0.09 0.00 -1.54 0.00 0.00 39.78 33.78 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 -3.77 0.00 0.01 3.10 1.16 -1.23 -3.96 117.46 112.76 2rp3 n PHE 54 Ca -0.22 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.34 2rp3 n PHE 54 Cb 0.65 -0.66 0.25 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 1.23 0.00 1.97 6.09 -1.87 0.11 117.51 125.03 2rp3 h ILE 55 Ca -0.37 -1.00 0.00 0.00 -1.37 0.00 0.00 64.86 62.12 2rp3 h ILE 55 Cb 1.69 1.12 0.00 0.00 0.47 0.00 0.00 36.82 40.10 2rp3 h ILE 55 CO -0.02 0.33 0.20 -0.08 -3.07 0.00 0.00 178.15 175.51 2rp3 h GLU 56 N 0.47 0.00 0.00 2.19 4.22 -1.98 0.10 114.58 119.58 2rp3 h GLU 56 Ca 0.09 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.50 2rp3 h GLU 56 Cb 0.48 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.66 2rp3 h GLU 56 CO 0.03 0.00 -0.49 0.00 -2.18 0.00 0.00 179.01 176.36 2rp3 n ALA 57 N -1.70 2.22 -2.29 2.92 0.00 -0.10 -5.09 120.51 116.48 2rp3 n ALA 57 Ca -0.01 -1.72 -0.15 0.00 0.00 0.00 0.00 53.44 51.56 2rp3 n ALA 57 Cb 0.23 -0.51 -0.10 0.00 0.00 0.00 0.00 19.45 19.07 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 -3.96 1.61 -1.14 0.00 1.70 -0.64 -4.82 118.95 111.70 2rp3 s ARG 59 Ca 0.31 -0.97 -0.16 0.00 -0.47 0.00 0.00 55.73 54.44 2rp3 s ARG 59 Cb 0.07 0.49 -0.02 0.00 -0.57 0.00 0.00 34.95 34.92 2rp3 s ARG 59 CO 0.09 -0.75 0.81 0.09 -1.08 0.00 0.00 175.30 174.46 2rp3 n ASN 60 N -0.90 -5.19 -4.84 -2.89 3.02 -1.26 -2.12 115.26 101.08 2rp3 n ASN 60 Ca -0.05 -0.93 -0.37 0.00 -0.03 0.00 0.00 54.58 53.19 2rp3 n ASN 60 Cb 0.60 -3.84 -0.06 0.00 -0.61 0.00 0.00 39.78 35.86 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 -3.47 5.40 0.27 3.41 -4.23 -1.26 -4.18 115.64 111.57 2rp3 s THR 61 Ca 0.43 0.34 -0.18 0.00 -1.18 0.00 0.00 61.69 61.10 2rp3 s THR 61 Cb -0.13 -3.48 0.01 0.00 1.34 0.00 0.00 72.50 70.24 2rp3 s THR 61 CO 0.83 0.58 0.63 0.00 -0.54 0.00 0.00 174.62 176.11 2rp3 s GLN 62 N -0.77 1.69 -0.15 3.99 1.03 -0.64 -4.18 119.66 120.63 2rp3 s GLN 62 Ca 0.16 -1.09 -0.26 0.00 0.04 0.00 0.00 55.36 54.21 2rp3 s GLN 62 Cb -0.13 0.56 -0.02 0.00 0.03 0.00 0.00 33.01 33.45 2rp3 s GLN 62 CO 0.05 -0.75 0.86 -1.17 -2.54 0.00 0.00 175.29 171.73 2rp3 s LEU 63 N -2.96 4.19 -0.11 2.60 2.96 -1.26 -2.25 118.68 121.86 2rp3 s LEU 63 Ca 0.15 1.23 0.03 0.00 -0.22 0.00 0.00 54.13 55.33 2rp3 s LEU 63 Cb -0.04 -3.28 -0.00 0.00 0.50 0.00 0.00 46.19 43.37 2rp3 s LEU 63 CO 0.08 -0.39 -0.22 0.00 -1.32 0.00 0.00 176.35 174.49 2rp3 s ALA 64 N 2.06 2.24 0.00 5.97 0.00 0.54 -4.82 121.76 127.75 2rp3 s ALA 64 Ca 0.40 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.39 2rp3 s ALA 64 Cb -0.17 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.07 2rp3 s ALA 64 CO 0.13 0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.57 2rp3 n GLY 65 N 3.56 1.17 0.00 0.00 0.00 -1.26 -1.84 105.19 106.82 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 -1.14 0.00 0.00 0.00 173.32 172.18 2rp3 n SER 66 N 2.68 0.00 -0.49 1.61 3.41 -1.26 -4.96 113.62 114.61 2rp3 n SER 66 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.64 2rp3 n SER 66 Cb 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.00 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 0.77 -4.40 4.04 3.41 -1.23 -4.85 113.62 111.37 2rp3 n SER 67 Ca 0.00 -2.36 -0.34 0.00 -0.26 0.00 0.00 58.87 55.91 2rp3 n SER 67 Cb 0.00 -0.28 -0.14 0.00 -0.26 0.00 0.00 64.21 63.53 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 -0.88 3.47 -0.35 4.33 2.02 -0.76 0.57 118.70 127.10 2rp3 s GLU 68 Ca 0.13 -0.62 -0.19 0.00 0.02 0.00 0.00 54.97 54.30 2rp3 s GLU 68 Cb 0.12 -2.80 -0.00 0.00 0.10 0.00 0.00 34.13 31.56 2rp3 s GLU 68 CO -0.01 0.13 0.58 -1.17 0.02 0.00 0.00 175.26 174.81 2rp3 s LEU 69 N 0.60 4.29 -0.13 1.80 1.98 -0.20 -0.34 118.68 126.69 2rp3 s LEU 69 Ca -0.05 0.08 -0.05 0.00 -2.89 0.00 0.00 54.13 51.22 2rp3 s LEU 69 Cb -0.15 -2.70 -0.04 0.00 0.66 0.00 0.00 46.19 43.96 2rp3 s LEU 69 CO 0.03 -0.54 0.04 0.00 -1.89 0.00 0.00 176.35 173.99 2rp3 s ALA 70 N 2.57 3.40 0.26 5.97 0.00 -0.95 -2.49 121.76 130.52 2rp3 s ALA 70 Ca 0.22 -0.76 -0.20 0.00 0.00 0.00 0.00 51.96 51.23 2rp3 s ALA 70 Cb -0.15 -1.71 0.07 0.00 0.00 0.00 0.00 23.12 21.33 2rp3 s ALA 70 CO 0.14 0.44 0.94 0.00 0.00 0.00 0.00 175.76 177.28 2rp3 s ALA 71 N -0.42 -1.26 -0.13 0.00 0.00 -0.56 -1.63 121.76 117.77 2rp3 s ALA 71 Ca 0.09 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 51.55 2rp3 s ALA 71 Cb -0.12 0.73 0.02 0.00 0.00 0.00 0.00 23.12 23.75 2rp3 s ALA 71 CO 0.02 -1.03 -0.15 -1.21 0.00 0.00 0.00 175.76 173.38 2rp3 s GLU 72 N -2.19 2.34 0.05 0.00 2.02 -0.90 -0.90 118.70 119.12 2rp3 s GLU 72 Ca 0.20 -0.59 0.09 0.00 0.02 0.00 0.00 54.97 54.68 2rp3 s GLU 72 Cb -0.04 -2.04 -0.03 0.00 0.10 0.00 0.00 34.13 32.12 2rp3 s GLU 72 CO 0.08 -0.14 -0.24 0.00 0.02 0.00 0.00 175.26 174.98 2rp3 s LYS 74 N -1.34 4.51 0.99 0.00 2.20 -0.51 -1.99 119.74 123.59 2rp3 s LYS 74 Ca 0.13 1.60 -0.16 0.00 -0.36 0.00 0.00 55.97 57.18 2rp3 s LYS 74 Cb -0.10 -3.39 0.20 0.00 -1.51 0.00 0.00 37.83 33.02 2rp3 s LYS 74 CO 0.03 -0.13 1.26 0.95 -0.36 0.00 0.00 175.35 177.10 2rp3 s THR 75 N 0.93 1.93 0.47 3.43 -4.23 0.15 -3.13 115.64 115.19 2rp3 s THR 75 Ca 0.55 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 61.34 2rp3 s THR 75 Cb -0.25 -2.89 0.31 0.00 1.34 0.00 0.00 72.50 71.01 2rp3 s THR 75 CO 0.29 0.00 2.13 0.00 -0.54 0.00 0.00 174.62 176.50 2rp3 h ALA 76 N -1.74 1.37 0.00 3.99 0.00 -1.89 -0.64 119.26 120.35 2rp3 h ALA 76 Ca -0.45 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2rp3 h ALA 76 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2rp3 h ALA 76 CO 0.42 0.10 -0.28 0.00 0.00 0.00 0.00 179.25 179.50 2rp3 h ALA 77 N 1.92 0.84 -0.01 0.00 0.00 -1.96 -3.47 119.26 116.57 2rp3 h ALA 77 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2rp3 h ALA 77 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2rp3 h ALA 77 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2rp3 n GLY 78 N 1.23 1.60 3.22 0.00 0.00 -0.25 -5.11 105.19 105.89 2rp3 n GLY 78 Ca 0.04 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2rp3 n GLY 78 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rp3 s GLN 79 N -0.80 2.23 -0.30 1.61 -2.07 -1.26 -4.80 119.66 114.27 2rp3 s GLN 79 Ca 0.00 -0.80 -0.25 0.00 -1.82 0.00 0.00 55.36 52.49 2rp3 s GLN 79 Cb 0.00 -1.93 0.00 0.00 -1.09 0.00 0.00 33.01 30.00 2rp3 s GLN 79 CO 0.00 0.35 0.84 -0.06 -1.32 0.00 0.00 175.29 175.10 2rp3 s PHE 80 N -0.14 3.21 0.53 9.60 0.08 -1.26 0.35 117.98 130.34 2rp3 s PHE 80 Ca -0.02 0.92 0.07 0.00 0.12 0.00 0.00 56.93 58.02 2rp3 s PHE 80 Cb -0.12 -3.28 0.04 0.00 -0.57 0.00 0.00 43.02 39.09 2rp3 s PHE 80 CO 0.03 -0.58 0.50 0.14 -0.10 0.00 0.00 175.22 175.21 2rp3 s VAL 81 N 3.06 1.99 -0.46 -0.44 -7.23 -0.84 -4.89 120.40 111.59 2rp3 s VAL 81 Ca 0.35 -1.33 -0.19 0.00 -1.81 0.00 0.00 61.98 58.99 2rp3 s VAL 81 Cb -0.14 -2.32 0.03 0.00 0.56 0.00 0.00 36.38 34.51 2rp3 s VAL 81 CO 0.12 0.00 0.57 -0.44 -0.31 0.00 0.00 175.10 175.04 2rp3 s SER 82 N -4.35 6.25 -0.02 4.85 0.01 -1.26 -3.01 113.70 116.16 2rp3 s SER 82 Ca 0.44 -0.64 0.01 0.00 1.31 0.00 0.00 55.95 57.08 2rp3 s SER 82 Cb -0.03 -2.28 -0.03 0.00 0.21 0.00 0.00 66.02 63.88 2rp3 s SER 82 CO 0.27 -0.75 -0.03 0.42 0.41 0.00 0.00 173.24 173.55 2rp3 s THR 83 N 2.54 3.94 0.08 1.44 -4.23 -0.07 -5.01 115.64 114.33 2rp3 s THR 83 Ca 0.17 -0.58 -0.00 0.00 -1.18 0.00 0.00 61.69 60.10 2rp3 s THR 83 Cb -0.17 -2.70 -0.04 0.00 1.34 0.00 0.00 72.50 70.93 2rp3 s THR 83 CO 0.15 0.46 -0.03 -1.59 -0.54 0.00 0.00 174.62 173.07 2rp3 s LYS 84 N -1.28 0.72 -0.28 3.99 0.00 -1.26 -1.50 119.74 120.14 2rp3 s LYS 84 Ca 0.17 -1.29 -0.24 0.00 0.00 0.00 0.00 55.97 54.61 2rp3 s LYS 84 Cb -0.11 0.10 0.12 0.00 0.00 0.00 0.00 37.83 37.94 2rp3 s LYS 84 CO 0.07 -0.11 1.00 -1.50 0.00 0.00 0.00 175.35 174.81 2rp3 s ILE 85 N -3.86 0.00 -0.31 3.79 2.07 -1.04 -4.77 121.20 117.08 2rp3 s ILE 85 Ca 0.11 0.00 -0.29 0.00 -1.41 0.00 0.00 60.65 59.06 2rp3 s ILE 85 Cb 0.07 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.68 2rp3 s ILE 85 CO -0.07 0.00 1.13 0.21 -1.91 0.00 0.00 174.94 174.31 2rp3 s ASN 86 N 0.38 6.87 0.38 4.50 3.04 -1.26 -1.03 114.94 127.82 2rp3 s ASN 86 Ca 0.01 1.09 0.11 0.00 0.04 0.00 0.00 52.86 54.12 2rp3 s ASN 86 Cb -0.05 -2.54 0.77 0.00 -1.54 0.00 0.00 41.25 37.88 2rp3 s ASN 86 CO -0.07 -0.93 1.87 -0.07 -3.04 0.00 0.00 177.10 174.86 2rp3 h LEU 87 N 10.28 0.09 -0.63 3.21 3.38 -0.23 -1.51 115.31 129.89 2rp3 h LEU 87 Ca -0.22 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2rp3 h LEU 87 Cb 1.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2rp3 h LEU 87 CO 1.03 0.37 0.00 0.47 0.09 0.00 0.00 178.44 180.40 2rp3 n ASP 88 N -4.19 0.38 -0.11 -0.43 9.92 -1.23 -0.39 116.55 120.49 2rp3 n ASP 88 Ca -0.02 0.63 0.02 0.00 -0.53 0.00 0.00 54.79 54.89 2rp3 n ASP 88 Cb 0.34 -0.69 0.32 0.00 -0.64 0.00 0.00 41.12 40.45 2rp3 n ASP 88 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 2rp3 h ASP 89 N 0.00 0.68 0.00 -2.24 1.82 -1.61 0.11 116.42 115.17 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 0.17 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.01 2rp3 h ASP 89 CO 0.00 0.50 -0.13 1.41 -1.61 0.00 0.00 179.24 179.42 2rp3 n HIS 90 N -4.44 0.00 -1.68 0.28 8.25 -1.02 -4.63 115.22 111.98 2rp3 n HIS 90 Ca 0.06 0.00 -0.48 0.00 -0.26 0.00 0.00 57.72 57.04 2rp3 n HIS 90 Cb 0.05 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.12 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 0.60 -4.63 1.59 2.08 0.47 -2.28 119.36 115.60 2rp3 n ILE 91 Ca 0.00 -0.11 -0.29 0.00 0.56 0.00 0.00 62.75 62.92 2rp3 n ILE 91 Cb 0.06 -1.93 -0.10 0.00 -0.75 0.00 0.00 39.64 36.93 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 4.10 3.34 -0.24 -1.39 0.00 0.03 -1.53 121.76 126.07 2rp3 s ALA 92 Ca 0.92 -1.53 -0.05 0.00 0.00 0.00 0.00 51.96 51.31 2rp3 s ALA 92 Cb -0.66 0.25 -0.00 0.00 0.00 0.00 0.00 23.12 22.70 2rp3 s ALA 92 CO 0.50 -0.13 -0.00 1.21 0.00 0.00 0.00 175.76 177.34 2rp3 s ASN 93 N -3.72 4.60 -0.40 0.00 2.47 -1.26 -2.30 114.94 114.33 2rp3 s ASN 93 Ca 0.24 -0.48 -0.02 0.00 0.42 0.00 0.00 52.86 53.02 2rp3 s ASN 93 Cb 0.06 -1.79 0.11 0.00 -1.45 0.00 0.00 41.25 38.18 2rp3 s ASN 93 CO 0.12 -0.07 0.19 -0.63 -3.72 0.00 0.00 177.10 172.99 2rp3 s ILE 94 N 1.49 3.22 -1.84 -5.21 -1.09 0.12 -4.63 121.20 113.26 2rp3 s ILE 94 Ca 0.05 -2.04 0.00 0.00 -2.23 0.00 0.00 60.65 56.42 2rp3 s ILE 94 Cb -0.15 -3.20 0.00 0.00 -1.58 0.00 0.00 42.46 37.53 2rp3 s ILE 94 CO -0.01 -0.66 0.00 -0.67 -1.23 0.00 0.00 174.94 172.37 2rp3 n ASP 95 N 4.58 -5.60 0.00 3.58 -0.08 -1.26 -1.31 116.55 116.46 2rp3 n ASP 95 Ca -0.02 0.15 0.00 0.00 -1.51 0.00 0.00 54.79 53.41 2rp3 n ASP 95 Cb 0.41 -4.70 0.00 0.00 2.34 0.00 0.00 41.12 39.17 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 -0.86 0.59 3.79 0.27 0.00 -1.24 -3.75 105.19 103.99 2rp3 n GLY 96 Ca -0.22 0.00 -0.28 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 -2.36 4.49 -0.19 2.61 -4.23 -0.42 -4.13 115.64 111.41 2rp3 s THR 97 Ca 0.00 -0.97 -0.17 0.00 -1.18 0.00 0.00 61.69 59.37 2rp3 s THR 97 Cb 0.00 -3.24 -0.04 0.00 1.34 0.00 0.00 72.50 70.56 2rp3 s THR 97 CO 0.00 -0.02 0.44 -0.76 -0.54 0.00 0.00 174.62 173.74 2rp3 s LEU 98 N -2.84 4.17 0.09 4.79 1.43 -1.26 0.16 118.68 125.21 2rp3 s LEU 98 Ca 0.30 0.60 -0.11 0.00 -1.03 0.00 0.00 54.13 53.90 2rp3 s LEU 98 Cb -0.11 -2.59 0.01 0.00 0.03 0.00 0.00 46.19 43.53 2rp3 s LEU 98 CO 0.23 -0.09 0.25 -0.54 0.23 0.00 0.00 176.35 176.42 2rp3 s LYS 99 N 1.28 0.88 -0.04 1.70 3.01 -0.97 -4.64 119.74 120.95 2rp3 s LYS 99 Ca 0.21 -0.83 -0.19 0.00 -1.01 0.00 0.00 55.97 54.16 2rp3 s LYS 99 Cb -0.15 0.37 -0.05 0.00 -1.01 0.00 0.00 37.83 36.99 2rp3 s LYS 99 CO 0.09 -0.29 0.53 -0.47 0.51 0.00 0.00 175.35 175.72 2rp3 s TYR 100 N -3.60 3.64 -2.96 3.18 5.04 -1.26 -0.79 117.35 120.60 2rp3 s TYR 100 Ca 0.03 1.07 0.24 0.00 -2.44 0.00 0.00 57.07 55.97 2rp3 s TYR 100 Cb 0.03 -2.55 0.26 0.00 0.35 0.00 0.00 41.96 40.06 2rp3 s TYR 100 CO -0.10 0.34 1.30 0.39 -1.34 0.00 0.00 175.55 176.14