#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 0.34 4.08 -0.72 0.00 -1.20 -4.77 105.19 102.91 2rp3 n GLY 2 Ca 0.00 -0.90 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 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 11.65 -1.27 0.04 1.61 4.01 0.48 -4.12 118.16 130.56 2rp3 n LYS 3 Ca 0.00 0.20 -0.11 0.00 -0.51 0.00 0.00 58.31 57.89 2rp3 n LYS 3 Cb 0.00 -3.53 0.02 0.00 -0.51 0.00 0.00 35.03 31.01 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 -2.09 0.61 -0.17 2.13 -0.00 -1.45 -2.97 116.94 113.00 2rp3 h PHE 4 Ca -0.67 -0.27 0.05 0.00 -0.00 0.00 0.00 57.97 57.08 2rp3 h PHE 4 Cb 1.39 -0.09 -0.01 0.00 -0.00 0.00 0.00 35.95 37.24 2rp3 h PHE 4 CO 0.44 1.03 0.23 1.03 -0.00 0.00 0.00 178.31 181.04 2rp3 h SER 5 N 0.31 0.00 0.11 -0.68 0.87 -1.83 0.18 113.55 112.52 2rp3 h SER 5 Ca -0.03 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.50 2rp3 h SER 5 Cb 1.31 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.27 2rp3 h SER 5 CO 0.13 0.00 -0.12 1.56 -0.53 0.00 0.00 176.83 177.87 2rp3 h GLN 6 N 0.00 0.01 0.00 2.24 4.20 -1.89 -3.00 115.11 116.67 2rp3 h GLN 6 Ca 0.08 -0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2rp3 h GLN 6 Cb 0.53 -0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.23 2rp3 h GLN 6 CO -0.00 0.13 -0.48 -2.37 -0.67 0.00 0.00 178.83 175.45 2rp3 n THR 7 N -4.39 0.95 -4.48 -0.54 5.66 0.11 -5.05 114.28 106.53 2rp3 n THR 7 Ca -0.03 -1.47 -0.21 0.00 -3.05 0.00 0.00 64.05 59.30 2rp3 n THR 7 Cb 0.20 0.26 -0.14 0.00 -1.55 0.00 0.00 70.33 69.09 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 -0.59 0.70 -1.25 0.00 1.13 0.49 -4.66 117.35 113.18 2rp3 s TYR 9 Ca 0.03 -1.07 -0.04 0.00 -1.41 0.00 0.00 57.07 54.58 2rp3 s TYR 9 Cb -0.07 -0.33 0.00 0.00 -1.10 0.00 0.00 41.96 40.47 2rp3 s TYR 9 CO 0.00 -0.59 1.07 -1.71 -2.51 0.00 0.00 175.55 171.81 2rp3 n ASN 10 N -0.14 -4.21 -4.85 -0.18 5.15 -1.26 -1.04 115.26 108.73 2rp3 n ASN 10 Ca -0.06 -0.56 -0.32 0.00 -0.60 0.00 0.00 54.58 53.04 2rp3 n ASN 10 Cb 0.63 -4.96 -0.04 0.00 -0.53 0.00 0.00 39.78 34.88 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 -3.81 6.66 -0.06 1.20 1.04 -1.26 -3.84 113.70 113.63 2rp3 s SER 11 Ca 0.29 1.40 -0.28 0.00 0.48 0.00 0.00 55.95 57.84 2rp3 s SER 11 Cb -0.13 -2.43 0.06 0.00 0.10 0.00 0.00 66.02 63.62 2rp3 s SER 11 CO 0.71 -0.43 0.63 0.00 0.98 0.00 0.00 173.24 175.13 2rp3 s ALA 12 N -2.38 -1.64 -0.01 5.32 0.00 0.69 -4.97 121.76 118.78 2rp3 s ALA 12 Ca 0.56 1.24 0.02 0.00 0.00 0.00 0.00 51.96 53.78 2rp3 s ALA 12 Cb -0.10 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.95 2rp3 s ALA 12 CO 0.26 -0.35 -0.06 0.42 0.00 0.00 0.00 175.76 176.03 2rp3 s ILE 13 N -1.09 0.52 -0.33 0.00 1.01 -1.26 -0.78 121.20 119.26 2rp3 s ILE 13 Ca -0.11 -0.25 0.04 0.00 0.00 0.00 0.00 60.65 60.34 2rp3 s ILE 13 Cb -0.01 -0.46 0.17 0.00 0.01 0.00 0.00 42.46 42.17 2rp3 s ILE 13 CO 0.09 0.16 0.46 -1.58 0.00 0.00 0.00 174.94 174.07 2rp3 s GLN 14 N 0.05 0.57 0.00 2.79 -0.44 -1.15 -4.20 119.66 117.28 2rp3 s GLN 14 Ca -0.00 -0.16 0.00 0.00 -2.50 0.00 0.00 55.36 52.70 2rp3 s GLN 14 Cb -0.05 -0.28 0.00 0.00 -1.64 0.00 0.00 33.01 31.05 2rp3 s GLN 14 CO -0.00 -1.11 0.00 0.41 0.50 0.00 0.00 175.29 175.09 2rp3 n GLY 15 N 4.90 2.08 2.15 2.59 0.00 -1.25 -4.02 105.19 111.65 2rp3 n GLY 15 Ca 0.06 -0.40 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 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 4.22 -1.31 -3.70 1.61 3.41 -1.26 -4.69 113.62 111.91 2rp3 n SER 16 Ca 0.00 -2.13 -0.20 0.00 -0.26 0.00 0.00 58.87 56.28 2rp3 n SER 16 Cb 0.00 0.56 -0.18 0.00 -0.26 0.00 0.00 64.21 64.34 2rp3 n SER 16 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2rp3 s VAL 17 N 0.09 -0.03 -0.24 -3.33 1.01 -1.26 -3.08 120.40 113.57 2rp3 s VAL 17 Ca 0.06 0.36 -0.12 0.00 0.00 0.00 0.00 61.98 62.28 2rp3 s VAL 17 Cb 0.31 -0.20 -0.05 0.00 0.00 0.00 0.00 36.38 36.44 2rp3 s VAL 17 CO -0.09 0.18 0.22 -0.22 0.00 0.00 0.00 175.10 175.19 2rp3 s LEU 18 N 2.00 4.12 -0.06 3.92 0.20 -0.96 -2.92 118.68 124.97 2rp3 s LEU 18 Ca 0.03 0.19 0.03 0.00 0.69 0.00 0.00 54.13 55.07 2rp3 s LEU 18 Cb -0.12 -2.20 0.00 0.00 -0.43 0.00 0.00 46.19 43.45 2rp3 s LEU 18 CO -0.03 0.02 -0.17 -0.89 -0.29 0.00 0.00 176.35 174.99 2rp3 s THR 19 N 1.18 1.44 -0.26 3.68 2.01 0.04 -1.24 115.64 122.49 2rp3 s THR 19 Ca 0.10 -0.68 -0.24 0.00 0.31 0.00 0.00 61.69 61.18 2rp3 s THR 19 Cb -0.14 -1.27 0.07 0.00 0.01 0.00 0.00 72.50 71.17 2rp3 s THR 19 CO 0.06 0.42 0.69 -0.55 -0.69 0.00 0.00 174.62 174.55 2rp3 s SER 20 N 0.37 -0.73 -0.12 3.53 0.15 -1.12 -0.22 113.70 115.55 2rp3 s SER 20 Ca -0.12 1.41 -0.29 0.00 0.70 0.00 0.00 55.95 57.65 2rp3 s SER 20 Cb -0.15 1.42 -0.01 0.00 -1.71 0.00 0.00 66.02 65.57 2rp3 s SER 20 CO 0.04 -0.24 0.97 -0.89 1.20 0.00 0.00 173.24 174.32 2rp3 s THR 21 N 0.43 4.80 0.12 6.45 2.01 -0.21 -3.68 115.64 125.56 2rp3 s THR 21 Ca -0.00 1.96 0.09 0.00 0.31 0.00 0.00 61.69 64.04 2rp3 s THR 21 Cb -0.05 -4.28 -0.04 0.00 0.01 0.00 0.00 72.50 68.15 2rp3 s THR 21 CO -0.00 0.00 -0.21 0.00 -0.69 0.00 0.00 174.62 173.72 2rp3 s GLU 23 N -2.12 4.20 0.78 0.00 2.02 -1.10 -1.69 118.70 120.79 2rp3 s GLU 23 Ca 0.10 1.74 -0.12 0.00 0.02 0.00 0.00 54.97 56.71 2rp3 s GLU 23 Cb -0.09 -3.81 0.06 0.00 0.10 0.00 0.00 34.13 30.39 2rp3 s GLU 23 CO 0.05 -0.76 1.11 1.03 0.02 0.00 0.00 175.26 176.72 2rp3 s ARG 24 N 3.64 2.11 -0.09 1.61 0.52 0.12 -3.32 118.95 123.53 2rp3 s ARG 24 Ca 0.58 1.33 0.15 0.00 -0.52 0.00 0.00 55.73 57.26 2rp3 s ARG 24 Cb -0.24 -1.87 -0.24 0.00 0.52 0.00 0.00 34.95 33.13 2rp3 s ARG 24 CO 0.18 -1.78 0.47 2.41 0.02 0.00 0.00 175.30 176.59 2rp3 n THR 25 N -3.40 1.52 -0.07 0.02 -1.04 -1.26 -4.65 114.28 105.40 2rp3 n THR 25 Ca 0.10 -0.81 -0.12 0.00 -2.04 0.00 0.00 64.05 61.18 2rp3 n THR 25 Cb 0.52 -0.83 -0.04 0.00 -1.82 0.00 0.00 70.33 68.16 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 -2.94 1.63 0.00 8.00 5.15 -1.26 -5.05 115.26 120.80 2rp3 n ASN 26 Ca -0.22 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.03 2rp3 n ASN 26 Cb 1.08 -0.63 0.00 0.00 -0.53 0.00 0.00 39.78 39.71 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 1.90 0.97 0.00 8.20 0.00 -1.26 -5.12 105.19 109.88 2rp3 n GLY 27 Ca -0.20 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 0.30 3.56 -0.02 0.00 -1.26 -4.65 105.19 108.11 2rp3 n GLY 28 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 2.81 -0.03 1.61 2.02 -1.26 0.10 117.35 124.01 2rp3 s TYR 29 Ca 0.00 -0.08 0.00 0.00 -0.37 0.00 0.00 57.07 56.62 2rp3 s TYR 29 Cb 0.00 -1.60 0.03 0.00 -0.40 0.00 0.00 41.96 39.99 2rp3 s TYR 29 CO 0.00 0.32 -0.00 1.21 -1.57 0.00 0.00 175.55 175.51 2rp3 s ASN 30 N -1.26 0.51 -0.53 2.29 2.47 -0.68 -4.88 114.94 112.87 2rp3 s ASN 30 Ca 0.15 -0.03 -0.04 0.00 0.42 0.00 0.00 52.86 53.36 2rp3 s ASN 30 Cb -0.11 -0.24 0.14 0.00 -1.45 0.00 0.00 41.25 39.59 2rp3 s ASN 30 CO 0.06 -0.10 0.34 -0.89 -3.72 0.00 0.00 177.10 172.78 2rp3 s THR 31 N 1.07 3.64 0.50 -5.21 2.01 -1.26 -1.06 115.64 115.32 2rp3 s THR 31 Ca -0.09 -2.45 0.05 0.00 0.31 0.00 0.00 61.69 59.51 2rp3 s THR 31 Cb -0.14 -3.42 0.05 0.00 0.01 0.00 0.00 72.50 69.01 2rp3 s THR 31 CO -0.02 -0.79 0.44 -1.20 -0.69 0.00 0.00 174.62 172.36 2rp3 n SER 32 N 4.10 2.45 -3.93 3.53 7.64 -1.24 -4.93 113.62 121.24 2rp3 n SER 32 Ca 0.02 -2.64 -0.09 0.00 1.01 0.00 0.00 58.87 57.17 2rp3 n SER 32 Cb 0.40 -0.11 -0.09 0.00 -1.01 0.00 0.00 64.21 63.40 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 -3.98 0.19 -0.09 6.43 1.04 -1.26 -2.78 113.70 113.25 2rp3 s SER 33 Ca 0.33 -0.56 -0.04 0.00 0.48 0.00 0.00 55.95 56.17 2rp3 s SER 33 Cb -0.03 0.23 0.05 0.00 0.10 0.00 0.00 66.02 66.37 2rp3 s SER 33 CO 0.21 -0.52 0.18 -0.51 0.98 0.00 0.00 173.24 173.58 2rp3 s ILE 34 N -2.71 -0.26 -0.12 -1.02 1.10 -0.37 -4.87 121.20 112.94 2rp3 s ILE 34 Ca -0.04 0.32 -0.29 0.00 -0.51 0.00 0.00 60.65 60.13 2rp3 s ILE 34 Cb -0.01 -0.31 -0.04 0.00 0.15 0.00 0.00 42.46 42.25 2rp3 s ILE 34 CO -0.05 0.14 1.58 1.51 -2.11 0.00 0.00 174.94 176.00 2rp3 s ASP 35 N 2.19 6.63 0.00 4.50 -4.77 -1.26 -2.27 116.67 121.68 2rp3 s ASP 35 Ca 0.01 1.96 0.17 0.00 -3.30 0.00 0.00 52.55 51.40 2rp3 s ASP 35 Cb -0.12 -2.53 0.95 0.00 -1.09 0.00 0.00 42.92 40.13 2rp3 s ASP 35 CO -0.06 -1.00 1.49 0.18 0.70 0.00 0.00 175.17 176.49 2rp3 n LEU 36 N 7.44 0.00 0.17 2.11 4.77 -1.18 -2.46 117.00 127.85 2rp3 n LEU 36 Ca 0.17 0.17 0.13 0.00 -0.03 0.00 0.00 56.01 56.45 2rp3 n LEU 36 Cb 0.44 -0.17 0.39 0.00 -2.33 0.00 0.00 43.42 41.75 2rp3 n LEU 36 CO 0.62 -0.07 0.87 -1.13 -1.33 0.00 0.00 177.39 176.35 2rp3 h ASN 37 N 0.00 0.00 -0.02 -1.43 -0.73 -1.87 -2.17 115.58 109.36 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 0.10 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.69 2rp3 h ASN 37 CO 0.00 0.00 0.00 -0.24 -0.37 0.00 0.00 177.43 176.82 2rp3 n SER 38 N -2.61 1.89 -0.41 1.15 2.88 -1.03 -3.49 113.62 112.00 2rp3 n SER 38 Ca 0.04 -1.63 0.00 0.00 -1.33 0.00 0.00 58.87 55.95 2rp3 n SER 38 Cb 0.41 -0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 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 0.48 0.00 -3.97 2.46 0.24 -0.55 -4.62 118.33 112.37 2rp3 n VAL 39 Ca 0.18 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.34 2rp3 n VAL 39 Cb 0.42 0.53 -0.14 0.00 -1.47 0.00 0.00 33.84 33.17 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 0.14 0.04 1.34 -1.09 0.25 -2.23 121.20 119.65 2rp3 s ILE 40 Ca 0.00 -0.06 0.07 0.00 -2.23 0.00 0.00 60.65 58.43 2rp3 s ILE 40 Cb 0.00 -0.14 -0.02 0.00 -1.58 0.00 0.00 42.46 40.72 2rp3 s ILE 40 CO 0.00 0.05 -0.21 0.00 -1.23 0.00 0.00 174.94 173.55 2rp3 s ALA 41 N 0.04 1.76 -0.40 9.38 0.00 -0.21 -1.05 121.76 131.29 2rp3 s ALA 41 Ca -0.00 -1.06 -0.16 0.00 0.00 0.00 0.00 51.96 50.75 2rp3 s ALA 41 Cb -0.02 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.77 2rp3 s ALA 41 CO -0.00 0.39 0.36 0.00 0.00 0.00 0.00 175.76 176.51 2rp3 s ALA 42 N -0.80 3.46 -0.24 0.00 0.00 -1.26 -2.04 121.76 120.89 2rp3 s ALA 42 Ca 0.07 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.49 2rp3 s ALA 42 Cb -0.09 -2.93 0.06 0.00 0.00 0.00 0.00 23.12 20.17 2rp3 s ALA 42 CO 0.02 -1.42 -0.02 0.54 0.00 0.00 0.00 175.76 174.87 2rp3 s VAL 43 N 1.91 1.33 -1.25 0.00 0.11 -0.78 -4.78 120.40 116.94 2rp3 s VAL 43 Ca 0.09 -1.15 -0.01 0.00 -2.93 0.00 0.00 61.98 57.98 2rp3 s VAL 43 Cb -0.18 -1.68 0.01 0.00 -1.53 0.00 0.00 36.38 33.00 2rp3 s VAL 43 CO 0.12 -0.18 0.08 -0.90 -3.33 0.00 0.00 175.10 170.89 2rp3 n ASP 44 N 4.74 -4.43 -0.59 3.54 5.68 -1.26 -1.85 116.55 122.38 2rp3 n ASP 44 Ca -0.10 0.07 0.00 0.00 -0.50 0.00 0.00 54.79 54.26 2rp3 n ASP 44 Cb 0.44 -3.73 0.00 0.00 -1.14 0.00 0.00 41.12 36.70 2rp3 n ASP 44 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rp3 n GLY 45 N -0.92 0.79 3.08 6.12 0.00 -1.21 -4.52 105.19 108.53 2rp3 n GLY 45 Ca -0.15 -0.54 -0.12 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.23 -0.19 1.61 0.01 -0.77 -4.67 113.70 106.62 2rp3 s SER 46 Ca 0.00 0.58 -0.23 0.00 1.31 0.00 0.00 55.95 57.61 2rp3 s SER 46 Cb 0.00 0.49 -0.02 0.00 0.21 0.00 0.00 66.02 66.70 2rp3 s SER 46 CO 0.00 -0.18 0.74 -0.76 0.41 0.00 0.00 173.24 173.46 2rp3 s LEU 47 N 1.42 4.15 -0.03 2.44 1.43 -1.26 -1.86 118.68 124.97 2rp3 s LEU 47 Ca -0.08 1.01 0.06 0.00 -1.03 0.00 0.00 54.13 54.08 2rp3 s LEU 47 Cb -0.10 -3.08 -0.01 0.00 0.03 0.00 0.00 46.19 43.03 2rp3 s LEU 47 CO -0.09 -0.36 -0.20 -0.54 0.23 0.00 0.00 176.35 175.39 2rp3 s LYS 48 N 2.13 1.82 0.34 1.70 -0.14 -0.87 -4.91 119.74 119.82 2rp3 s LYS 48 Ca 0.34 -0.71 -0.06 0.00 -1.36 0.00 0.00 55.97 54.18 2rp3 s LYS 48 Cb -0.16 -1.66 0.09 0.00 -1.68 0.00 0.00 37.83 34.42 2rp3 s LYS 48 CO 0.11 0.37 0.21 0.91 -0.76 0.00 0.00 175.35 176.19 2rp3 n TRP 49 N 2.82 -2.56 -3.84 3.18 7.02 -1.26 -1.04 117.44 121.76 2rp3 n TRP 49 Ca -0.16 -0.20 -0.26 0.00 -1.02 0.00 0.00 57.50 55.85 2rp3 n TRP 49 Cb 0.53 -0.29 -0.07 0.00 -2.42 0.00 0.00 31.31 29.05 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 -2.82 -0.90 -3.57 -0.99 10.64 -0.95 -4.55 117.38 114.25 2rp3 n GLN 50 Ca 0.03 0.08 -0.13 0.00 -1.83 0.00 0.00 57.00 55.15 2rp3 n GLN 50 Cb 0.14 -2.96 -0.05 0.00 -0.86 0.00 0.00 30.24 26.51 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 -1.79 2.93 3.75 2.61 0.00 -1.19 -4.91 105.19 106.61 2rp3 n GLY 51 Ca -0.14 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 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 -2.70 0.17 -1.30 1.61 1.04 -0.21 0.85 113.70 113.15 2rp3 s SER 52 Ca 0.27 -1.21 -0.02 0.00 0.48 0.00 0.00 55.95 55.47 2rp3 s SER 52 Cb 0.01 0.82 0.01 0.00 0.10 0.00 0.00 66.02 66.96 2rp3 s SER 52 CO 0.19 -1.63 0.86 0.59 0.98 0.00 0.00 173.24 174.23 2rp3 n ASN 53 N -1.43 -2.27 -0.09 7.02 4.13 -1.23 -4.26 115.26 117.14 2rp3 n ASN 53 Ca -0.07 -0.73 -0.12 0.00 1.68 0.00 0.00 54.58 55.34 2rp3 n ASN 53 Cb 0.60 -4.45 -0.11 0.00 -1.54 0.00 0.00 39.78 34.28 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 -4.34 0.00 -0.08 3.10 1.16 -1.24 -4.26 117.46 111.80 2rp3 n PHE 54 Ca -0.23 0.00 -0.00 0.00 -1.87 0.00 0.00 57.45 55.35 2rp3 n PHE 54 Cb 0.65 -0.81 0.28 0.00 -1.61 0.00 0.00 39.48 37.99 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 1.19 -0.99 1.97 6.09 -1.87 -1.02 117.51 122.87 2rp3 h ILE 55 Ca -0.46 -0.60 0.26 0.00 -1.37 0.00 0.00 64.86 62.69 2rp3 h ILE 55 Cb 1.86 0.63 -0.06 0.00 0.47 0.00 0.00 36.82 39.71 2rp3 h ILE 55 CO -0.03 0.23 0.68 -0.33 -3.07 0.00 0.00 178.15 175.63 2rp3 h GLU 56 N 0.69 0.22 -0.20 2.19 4.39 -1.98 0.15 114.58 120.03 2rp3 h GLU 56 Ca 0.17 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2rp3 h GLU 56 Cb 0.16 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2rp3 h GLU 56 CO -0.01 0.14 0.00 0.00 -1.16 0.00 0.00 179.01 177.98 2rp3 n ALA 57 N -2.60 2.49 -2.39 3.43 0.00 -0.50 -5.03 120.51 115.91 2rp3 n ALA 57 Ca 0.22 -1.85 -0.19 0.00 0.00 0.00 0.00 53.44 51.61 2rp3 n ALA 57 Cb 0.92 -0.47 -0.10 0.00 0.00 0.00 0.00 19.45 19.79 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 -3.83 1.97 -1.23 0.00 3.03 -1.04 -4.82 118.95 113.04 2rp3 s ARG 59 Ca 0.31 -1.18 -0.06 0.00 2.03 0.00 0.00 55.73 56.82 2rp3 s ARG 59 Cb 0.06 0.61 -0.01 0.00 -1.03 0.00 0.00 34.95 34.57 2rp3 s ARG 59 CO 0.11 -0.91 0.75 0.09 -1.13 0.00 0.00 175.30 174.21 2rp3 n ASN 60 N -0.91 -3.02 -4.73 -2.89 3.02 -1.26 -1.95 115.26 103.52 2rp3 n ASN 60 Ca -0.06 -0.86 -0.38 0.00 -0.03 0.00 0.00 54.58 53.25 2rp3 n ASN 60 Cb 0.59 -4.02 -0.06 0.00 -0.61 0.00 0.00 39.78 35.69 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 -3.59 5.13 0.28 3.41 -4.23 -1.26 -4.09 115.64 111.29 2rp3 s THR 61 Ca 0.19 1.04 -0.19 0.00 -1.18 0.00 0.00 61.69 61.55 2rp3 s THR 61 Cb -0.05 -3.85 0.02 0.00 1.34 0.00 0.00 72.50 69.96 2rp3 s THR 61 CO 0.82 0.35 0.68 0.00 -0.54 0.00 0.00 174.62 175.92 2rp3 s GLN 62 N 0.43 1.77 -0.08 3.99 -2.07 -0.77 -3.76 119.66 119.18 2rp3 s GLN 62 Ca 0.28 -1.07 -0.22 0.00 -1.82 0.00 0.00 55.36 52.52 2rp3 s GLN 62 Cb -0.16 0.58 -0.04 0.00 -1.09 0.00 0.00 33.01 32.31 2rp3 s GLN 62 CO 0.12 -0.80 0.65 -1.17 -1.32 0.00 0.00 175.29 172.77 2rp3 s LEU 63 N -2.95 4.31 -0.02 2.60 0.20 -1.26 -1.83 118.68 119.72 2rp3 s LEU 63 Ca 0.14 1.10 0.05 0.00 0.69 0.00 0.00 54.13 56.10 2rp3 s LEU 63 Cb -0.05 -2.99 -0.01 0.00 -0.43 0.00 0.00 46.19 42.71 2rp3 s LEU 63 CO 0.08 -0.09 -0.16 0.00 -0.29 0.00 0.00 176.35 175.89 2rp3 s ALA 64 N 0.74 1.38 0.00 5.97 0.00 0.12 -4.86 121.76 125.11 2rp3 s ALA 64 Ca 0.35 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 51.63 2rp3 s ALA 64 Cb -0.17 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.55 2rp3 s ALA 64 CO 0.16 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.64 2rp3 n GLY 65 N 2.86 1.12 0.00 0.00 0.00 -1.26 -2.05 105.19 105.86 2rp3 n GLY 65 Ca -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2rp3 n GLY 65 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2rp3 n SER 66 N 2.53 0.00 -2.51 1.61 7.64 -1.26 -4.97 113.62 116.66 2rp3 n SER 66 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2rp3 n SER 66 Cb 0.00 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.25 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 1.09 -4.03 6.43 3.41 -1.23 -4.96 113.62 114.34 2rp3 n SER 67 Ca 0.00 -2.04 -0.26 0.00 -0.26 0.00 0.00 58.87 56.32 2rp3 n SER 67 Cb 0.00 -0.31 -0.17 0.00 -0.26 0.00 0.00 64.21 63.48 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 -2.57 1.83 -0.39 4.33 2.02 -0.87 0.99 118.70 124.04 2rp3 s GLU 68 Ca 0.26 -0.44 -0.20 0.00 0.02 0.00 0.00 54.97 54.61 2rp3 s GLU 68 Cb 0.34 -1.55 0.01 0.00 0.10 0.00 0.00 34.13 33.03 2rp3 s GLU 68 CO -0.07 -0.01 0.60 -1.17 0.02 0.00 0.00 175.26 174.63 2rp3 s LEU 69 N 0.82 4.40 -0.07 1.80 1.98 -0.24 0.12 118.68 127.48 2rp3 s LEU 69 Ca -0.11 -0.12 -0.13 0.00 -2.89 0.00 0.00 54.13 50.88 2rp3 s LEU 69 Cb -0.15 -2.70 -0.05 0.00 0.66 0.00 0.00 46.19 43.95 2rp3 s LEU 69 CO 0.02 -0.64 0.32 0.00 -1.89 0.00 0.00 176.35 174.16 2rp3 s ALA 70 N 2.65 3.70 0.12 5.97 0.00 -0.76 -2.79 121.76 130.65 2rp3 s ALA 70 Ca 0.22 -0.37 -0.05 0.00 0.00 0.00 0.00 51.96 51.75 2rp3 s ALA 70 Cb -0.15 -2.31 0.02 0.00 0.00 0.00 0.00 23.12 20.69 2rp3 s ALA 70 CO 0.16 0.39 0.28 0.00 0.00 0.00 0.00 175.76 176.59 2rp3 n ALA 71 N 2.41 -0.66 -3.56 0.00 0.00 -0.36 -1.84 120.51 116.50 2rp3 n ALA 71 Ca -0.14 -0.41 -0.29 0.00 0.00 0.00 0.00 53.44 52.60 2rp3 n ALA 71 Cb 0.53 0.31 -0.15 0.00 0.00 0.00 0.00 19.45 20.14 2rp3 n ALA 71 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2rp3 s GLU 72 N -2.03 0.26 -0.01 0.00 2.02 -0.82 -1.51 118.70 116.61 2rp3 s GLU 72 Ca 0.06 -0.61 -0.09 0.00 0.02 0.00 0.00 54.97 54.35 2rp3 s GLU 72 Cb -0.02 -1.26 -0.05 0.00 0.10 0.00 0.00 34.13 32.91 2rp3 s GLU 72 CO 0.04 -1.02 0.30 0.00 0.02 0.00 0.00 175.26 174.59 2rp3 s LYS 74 N -1.49 4.46 0.94 0.00 2.20 -0.35 -2.43 119.74 123.07 2rp3 s LYS 74 Ca 0.25 1.78 -0.12 0.00 -0.36 0.00 0.00 55.97 57.52 2rp3 s LYS 74 Cb -0.14 -3.32 0.16 0.00 -1.51 0.00 0.00 37.83 33.01 2rp3 s LYS 74 CO 0.13 -0.19 1.12 0.95 -0.36 0.00 0.00 175.35 177.00 2rp3 s THR 75 N 0.75 2.05 0.57 3.43 -4.23 0.12 -3.34 115.64 114.98 2rp3 s THR 75 Ca 0.57 0.02 0.25 0.00 -1.18 0.00 0.00 61.69 61.35 2rp3 s THR 75 Cb -0.30 -2.67 0.33 0.00 1.34 0.00 0.00 72.50 71.21 2rp3 s THR 75 CO 0.31 -0.02 2.18 0.00 -0.54 0.00 0.00 174.62 176.54 2rp3 h ALA 76 N -1.64 1.79 0.00 3.99 0.00 -1.89 0.05 119.26 121.56 2rp3 h ALA 76 Ca -0.52 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.25 2rp3 h ALA 76 Cb 1.33 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 2rp3 h ALA 76 CO 0.60 -0.11 -0.79 0.00 0.00 0.00 0.00 179.25 178.96 2rp3 h ALA 77 N 1.93 0.61 0.00 0.00 0.00 -1.96 -3.48 119.26 116.37 2rp3 h ALA 77 Ca 0.04 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2rp3 h ALA 77 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2rp3 h ALA 77 CO -0.00 0.81 0.00 0.41 0.00 0.00 0.00 179.25 180.47 2rp3 n GLY 78 N 1.29 1.94 3.20 0.00 0.00 0.00 -5.13 105.19 106.49 2rp3 n GLY 78 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.35 3.03 -0.21 1.61 -0.21 -1.26 -4.77 119.66 117.50 2rp3 s GLN 79 Ca 0.00 -0.87 -0.29 0.00 0.02 0.00 0.00 55.36 54.22 2rp3 s GLN 79 Cb 0.00 -2.33 0.00 0.00 1.00 0.00 0.00 33.01 31.68 2rp3 s GLN 79 CO 0.00 0.12 1.09 -0.06 -2.12 0.00 0.00 175.29 174.33 2rp3 s PHE 80 N 0.47 3.23 0.32 0.91 0.08 -1.26 0.11 117.98 121.84 2rp3 s PHE 80 Ca -0.16 1.37 0.09 0.00 0.12 0.00 0.00 56.93 58.35 2rp3 s PHE 80 Cb -0.17 -3.32 -0.04 0.00 -0.57 0.00 0.00 43.02 38.91 2rp3 s PHE 80 CO 0.06 -0.76 0.08 0.14 -0.10 0.00 0.00 175.22 174.64 2rp3 s VAL 81 N 3.19 3.12 -0.46 -0.44 -7.23 -1.02 -4.94 120.40 112.63 2rp3 s VAL 81 Ca 0.47 -1.80 -0.28 0.00 -1.81 0.00 0.00 61.98 58.56 2rp3 s VAL 81 Cb -0.17 -2.92 0.03 0.00 0.56 0.00 0.00 36.38 33.88 2rp3 s VAL 81 CO 0.09 -0.25 1.06 -0.94 -0.31 0.00 0.00 175.10 174.75 2rp3 s SER 82 N -3.77 6.62 -0.07 4.85 1.04 -1.26 -3.24 113.70 117.86 2rp3 s SER 82 Ca 0.35 0.41 0.00 0.00 0.48 0.00 0.00 55.95 57.19 2rp3 s SER 82 Cb -0.03 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.54 2rp3 s SER 82 CO 0.21 -1.15 -0.05 0.42 0.98 0.00 0.00 173.24 173.65 2rp3 s THR 83 N 4.16 3.87 0.08 2.02 -4.23 -0.57 -5.00 115.64 115.98 2rp3 s THR 83 Ca 0.44 -0.43 0.01 0.00 -1.18 0.00 0.00 61.69 60.54 2rp3 s THR 83 Cb -0.08 -2.60 -0.04 0.00 1.34 0.00 0.00 72.50 71.12 2rp3 s THR 83 CO 0.29 0.59 -0.06 -1.59 -0.54 0.00 0.00 174.62 173.30 2rp3 s LYS 84 N -0.86 0.75 -0.28 3.99 0.00 -1.26 -1.22 119.74 120.86 2rp3 s LYS 84 Ca 0.13 -1.22 -0.21 0.00 0.00 0.00 0.00 55.97 54.67 2rp3 s LYS 84 Cb -0.11 -0.17 0.09 0.00 0.00 0.00 0.00 37.83 37.64 2rp3 s LYS 84 CO 0.02 -0.02 0.80 -1.50 0.00 0.00 0.00 175.35 174.65 2rp3 s ILE 85 N -3.25 0.00 -0.33 3.79 2.07 -1.12 -4.73 121.20 117.64 2rp3 s ILE 85 Ca 0.07 0.00 -0.29 0.00 -1.41 0.00 0.00 60.65 59.02 2rp3 s ILE 85 Cb 0.03 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.63 2rp3 s ILE 85 CO -0.04 0.00 1.24 0.21 -1.91 0.00 0.00 174.94 174.43 2rp3 s ASN 86 N 0.83 6.71 0.37 4.50 3.04 -1.26 -1.08 114.94 128.05 2rp3 s ASN 86 Ca -0.03 1.09 0.11 0.00 0.04 0.00 0.00 52.86 54.06 2rp3 s ASN 86 Cb -0.05 -2.54 0.72 0.00 -1.54 0.00 0.00 41.25 37.84 2rp3 s ASN 86 CO -0.08 -1.06 1.84 -0.07 -3.04 0.00 0.00 177.10 174.68 2rp3 h LEU 87 N 10.78 0.08 -1.30 3.21 3.38 0.27 -1.94 115.31 129.80 2rp3 h LEU 87 Ca -0.25 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2rp3 h LEU 87 Cb 1.09 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2rp3 h LEU 87 CO 1.04 0.40 0.00 -2.24 0.09 0.00 0.00 178.44 177.73 2rp3 h ASP 88 N 0.08 0.00 -0.76 -0.43 3.04 -1.79 0.13 116.42 116.69 2rp3 h ASP 88 Ca 0.01 0.00 0.07 0.00 -3.24 0.00 0.00 57.03 53.87 2rp3 h ASP 88 Cb 0.59 0.00 -0.06 0.00 -1.04 0.00 0.00 39.33 38.82 2rp3 h ASP 88 CO 0.04 0.00 0.43 -0.78 -2.04 0.00 0.00 179.24 176.89 2rp3 h ASP 89 N 0.00 0.64 0.00 4.15 1.82 -1.68 0.14 116.42 121.49 2rp3 h ASP 89 Ca 0.00 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.68 2rp3 h ASP 89 Cb 0.18 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.11 2rp3 h ASP 89 CO 0.00 0.39 -0.29 1.41 -1.61 0.00 0.00 179.24 179.14 2rp3 n HIS 90 N -4.75 0.00 -1.66 0.28 8.25 -1.13 -4.55 115.22 111.67 2rp3 n HIS 90 Ca 0.11 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.15 2rp3 n HIS 90 Cb 0.21 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.29 2rp3 n HIS 90 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2rp3 s ILE 91 N -1.29 3.01 0.49 1.59 -1.09 0.02 -2.41 121.20 121.52 2rp3 s ILE 91 Ca 0.00 0.01 0.03 0.00 -2.23 0.00 0.00 60.65 58.46 2rp3 s ILE 91 Cb 0.00 -3.01 -0.02 0.00 -1.58 0.00 0.00 42.46 37.86 2rp3 s ILE 91 CO 0.00 -0.00 0.09 0.00 -1.23 0.00 0.00 174.94 173.80 2rp3 s ALA 92 N 5.17 3.99 -0.16 9.38 0.00 0.56 -1.29 121.76 139.42 2rp3 s ALA 92 Ca 0.91 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.91 2rp3 s ALA 92 Cb -0.41 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.60 2rp3 s ALA 92 CO 0.41 -0.12 -0.20 1.21 0.00 0.00 0.00 175.76 177.05 2rp3 s ASN 93 N -3.93 3.17 -0.20 0.00 2.47 -1.26 -2.02 114.94 113.18 2rp3 s ASN 93 Ca 0.18 -0.62 0.01 0.00 0.42 0.00 0.00 52.86 52.86 2rp3 s ASN 93 Cb 0.02 -1.47 0.02 0.00 -1.45 0.00 0.00 41.25 38.37 2rp3 s ASN 93 CO 0.10 0.04 -0.17 -0.63 -3.72 0.00 0.00 177.10 172.72 2rp3 s ILE 94 N 1.05 2.22 -0.81 -5.21 -1.09 0.90 -4.68 121.20 113.58 2rp3 s ILE 94 Ca -0.01 -1.01 -0.05 0.00 -2.23 0.00 0.00 60.65 57.35 2rp3 s ILE 94 Cb -0.14 -2.01 0.05 0.00 -1.58 0.00 0.00 42.46 38.78 2rp3 s ILE 94 CO -0.07 0.43 0.20 -0.90 -1.23 0.00 0.00 174.94 173.37 2rp3 n ASP 95 N 4.61 -2.53 0.00 3.58 5.75 -1.26 0.84 116.55 127.54 2rp3 n ASP 95 Ca -0.20 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.57 2rp3 n ASP 95 Cb 0.49 -2.19 0.00 0.00 -1.03 0.00 0.00 41.12 38.39 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 0.57 3.16 6.12 0.00 -1.21 -4.02 105.19 108.99 2rp3 n GLY 96 Ca -0.03 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 44.95 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 1.31 -0.08 2.61 -4.23 0.25 -4.41 115.64 109.08 2rp3 s THR 97 Ca 0.00 -0.83 -0.27 0.00 -1.18 0.00 0.00 61.69 59.41 2rp3 s THR 97 Cb 0.00 -1.12 -0.02 0.00 1.34 0.00 0.00 72.50 72.70 2rp3 s THR 97 CO 0.00 0.27 0.86 -0.76 -0.54 0.00 0.00 174.62 174.45 2rp3 s LEU 98 N -0.66 4.28 0.07 4.79 1.43 -1.26 -0.07 118.68 127.26 2rp3 s LEU 98 Ca 0.06 1.37 -0.11 0.00 -1.03 0.00 0.00 54.13 54.42 2rp3 s LEU 98 Cb -0.07 -3.34 0.01 0.00 0.03 0.00 0.00 46.19 42.82 2rp3 s LEU 98 CO 0.00 -0.29 0.23 -0.54 0.23 0.00 0.00 176.35 175.99 2rp3 s LYS 99 N 1.42 0.82 -0.07 1.70 1.02 -0.85 -4.74 119.74 119.04 2rp3 s LYS 99 Ca 0.44 -0.76 -0.09 0.00 0.02 0.00 0.00 55.97 55.57 2rp3 s LYS 99 Cb -0.18 0.34 -0.05 0.00 -0.52 0.00 0.00 37.83 37.42 2rp3 s LYS 99 CO 0.19 -0.26 0.24 -0.47 -0.92 0.00 0.00 175.35 174.13 2rp3 s TYR 100 N -3.28 3.64 0.00 3.18 5.04 -1.26 -0.32 117.35 124.35 2rp3 s TYR 100 Ca 0.00 0.68 0.00 0.00 -2.44 0.00 0.00 57.07 55.31 2rp3 s TYR 100 Cb 0.02 -2.06 0.00 0.00 0.35 0.00 0.00 41.96 40.27 2rp3 s TYR 100 CO -0.08 0.70 0.21 0.39 -1.34 0.00 0.00 175.55 175.43