#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bxp s VAL 2 N 0.00 0.08 0.06 7.28 1.01 -1.26 -4.24 120.40 123.33 1bxp s VAL 2 Ca 0.00 -0.67 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 1bxp s VAL 2 Cb 0.00 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1bxp s VAL 2 CO 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 175.10 174.69 1bxp s HIS 4 N -3.80 3.50 -0.12 0.00 3.76 -1.26 -0.87 115.29 116.50 1bxp s HIS 4 Ca 0.08 0.73 -0.03 0.00 -0.15 0.00 0.00 55.06 55.68 1bxp s HIS 4 Cb 0.07 -2.20 0.05 0.00 1.11 0.00 0.00 32.58 31.61 1bxp s HIS 4 CO -0.09 -0.00 0.06 0.95 -0.85 0.00 0.00 174.74 174.81 1bxp s THR 5 N -2.34 0.06 -0.68 1.30 -4.23 -0.96 -1.21 115.64 107.57 1bxp s THR 5 Ca 0.46 -0.02 0.24 0.00 -1.18 0.00 0.00 61.69 61.19 1bxp s THR 5 Cb -0.10 -0.51 -0.04 0.00 1.34 0.00 0.00 72.50 73.18 1bxp s THR 5 CO 0.35 -0.07 1.19 0.35 -0.54 0.00 0.00 174.62 175.90 1bxp n THR 6 N 5.23 0.21 -0.02 3.99 -2.24 -1.26 -2.87 114.28 117.33 1bxp n THR 6 Ca -0.06 -0.22 -0.11 0.00 -2.27 0.00 0.00 64.05 61.39 1bxp n THR 6 Cb 0.49 0.10 -0.14 0.00 -2.10 0.00 0.00 70.33 68.68 1bxp n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bxp n ALA 7 N -1.78 1.36 -1.90 6.98 0.00 -1.26 -4.77 120.51 119.14 1bxp n ALA 7 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.74 1bxp n ALA 7 Cb 0.42 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1bxp n ALA 7 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bxp n THR 8 N -3.14 0.00 -1.12 0.00 -2.24 -1.26 -5.01 114.28 101.51 1bxp n THR 8 Ca -0.20 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.29 1bxp n THR 8 Cb 1.05 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 69.46 1bxp n THR 8 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1bxp s SER 9 N -1.00 2.67 0.43 3.42 1.04 -1.26 -4.92 113.70 114.07 1bxp s SER 9 Ca 0.00 1.29 -0.25 0.00 0.48 0.00 0.00 55.95 57.47 1bxp s SER 9 Cb 0.00 -1.97 -0.08 0.00 0.10 0.00 0.00 66.02 64.07 1bxp s SER 9 CO 0.00 -3.12 1.33 -2.16 0.98 0.00 0.00 173.24 170.27 1bxp s PRO 10 N -4.91 3.82 -0.05 4.02 0.04 -1.26 -4.31 135.00 132.34 1bxp s PRO 10 Ca 0.65 2.21 -0.04 0.00 0.04 0.00 0.00 61.00 63.85 1bxp s PRO 10 Cb -0.19 -2.67 -0.02 0.00 0.04 0.00 0.00 34.50 31.66 1bxp s PRO 10 CO 0.58 -0.64 0.22 1.51 0.04 0.00 0.00 177.00 178.71 1bxp n ILE 11 N -0.09 0.00 -3.60 0.56 3.06 -1.14 -4.79 119.36 113.37 1bxp n ILE 11 Ca 0.05 0.00 -0.12 0.00 -2.50 0.00 0.00 62.75 60.18 1bxp n ILE 11 Cb 0.43 -0.05 -0.06 0.00 0.54 0.00 0.00 39.64 40.50 1bxp n ILE 11 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1bxp s SER 12 N 0.62 -0.51 -0.53 9.51 1.04 -1.26 -4.90 113.70 117.68 1bxp s SER 12 Ca 0.12 0.79 -0.21 0.00 0.48 0.00 0.00 55.95 57.14 1bxp s SER 12 Cb -0.15 0.74 0.05 0.00 0.10 0.00 0.00 66.02 66.77 1bxp s SER 12 CO 0.06 -0.30 0.73 0.00 0.98 0.00 0.00 173.24 174.71 1bxp s ALA 13 N -0.40 3.31 0.01 5.32 0.00 -1.26 -2.27 121.76 126.48 1bxp s ALA 13 Ca -0.01 -1.61 0.05 0.00 0.00 0.00 0.00 51.96 50.39 1bxp s ALA 13 Cb -0.03 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 1bxp s ALA 13 CO 0.00 -2.15 -0.15 0.14 0.00 0.00 0.00 175.76 173.60 1bxp s VAL 14 N 3.05 3.00 1.01 0.00 -7.23 -0.05 -4.68 120.40 115.50 1bxp s VAL 14 Ca 0.20 -0.98 -0.15 0.00 -1.81 0.00 0.00 61.98 59.24 1bxp s VAL 14 Cb -0.17 -2.24 0.04 0.00 0.56 0.00 0.00 36.38 34.56 1bxp s VAL 14 CO 0.14 0.43 0.16 0.41 -0.31 0.00 0.00 175.10 175.93 1bxp n THR 15 N 1.79 0.00 -4.15 5.32 -1.04 -1.26 -2.75 114.28 112.20 1bxp n THR 15 Ca -0.16 -0.24 -0.23 0.00 -2.04 0.00 0.00 64.05 61.38 1bxp n THR 15 Cb 0.52 -0.56 -0.07 0.00 -1.82 0.00 0.00 70.33 68.41 1bxp n THR 15 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bxp s PRO 17 N -3.81 -0.33 -0.32 0.00 0.04 -1.26 -4.92 135.00 124.40 1bxp s PRO 17 Ca 0.36 0.02 -0.29 0.00 0.04 0.00 0.00 61.00 61.13 1bxp s PRO 17 Cb -0.03 -1.69 -0.01 0.00 0.04 0.00 0.00 34.50 32.80 1bxp s PRO 17 CO 0.22 -3.14 1.69 -1.25 0.04 0.00 0.00 177.00 174.56 1bxp s PRO 18 N -5.39 3.49 0.00 0.56 0.04 -1.26 -3.77 135.00 128.66 1bxp s PRO 18 Ca 0.69 1.39 0.00 0.00 0.04 0.00 0.00 61.00 63.13 1bxp s PRO 18 Cb -0.11 -4.13 0.00 0.00 0.04 0.00 0.00 34.50 30.30 1bxp s PRO 18 CO 0.55 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 176.33 1bxp n GLY 19 N 5.19 1.12 3.60 0.56 0.00 -1.26 -5.08 105.19 109.32 1bxp n GLY 19 Ca 0.21 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1bxp n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bxp s GLU 20 N 0.00 3.46 0.18 1.61 8.01 -1.25 -4.18 118.70 126.53 1bxp s GLU 20 Ca 0.00 1.39 0.26 0.00 0.01 0.00 0.00 54.97 56.63 1bxp s GLU 20 Cb 0.00 -4.14 0.85 0.00 -4.31 0.00 0.00 34.13 26.53 1bxp s GLU 20 CO 0.00 -1.70 1.78 0.09 0.01 0.00 0.00 175.26 175.44 1bxp n ASN 21 N 9.68 0.70 -2.55 -0.19 5.03 -0.86 -4.69 115.26 122.39 1bxp n ASN 21 Ca 0.21 0.55 -0.11 0.00 0.87 0.00 0.00 54.58 56.09 1bxp n ASN 21 Cb 0.47 -0.72 -0.02 0.00 -1.02 0.00 0.00 39.78 38.49 1bxp n ASN 21 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bxp n LEU 22 N -2.15 0.00 -5.03 3.41 -0.00 -1.06 -4.95 117.00 107.22 1bxp n LEU 22 Ca 0.06 -2.22 -0.19 0.00 -0.00 0.00 0.00 56.01 53.65 1bxp n LEU 22 Cb 0.42 2.01 0.05 0.00 -0.00 0.00 0.00 43.42 45.90 1bxp n LEU 22 CO 0.30 -0.51 0.30 0.00 -0.00 0.00 0.00 177.39 177.48 1bxp s TYR 24 N -2.62 -0.57 -0.27 0.00 -0.85 0.09 -1.96 117.35 111.16 1bxp s TYR 24 Ca 0.60 1.39 -0.09 0.00 -0.52 0.00 0.00 57.07 58.45 1bxp s TYR 24 Cb -0.06 0.20 -0.04 0.00 0.38 0.00 0.00 41.96 42.43 1bxp s TYR 24 CO 0.37 -0.27 0.14 1.03 -1.52 0.00 0.00 175.55 175.30 1bxp s ARG 25 N 0.28 3.83 0.46 -3.49 3.00 -0.73 0.19 118.95 122.49 1bxp s ARG 25 Ca -0.00 -0.39 0.05 0.00 0.00 0.00 0.00 55.73 55.40 1bxp s ARG 25 Cb -0.04 -3.51 -0.03 0.00 0.00 0.00 0.00 34.95 31.37 1bxp s ARG 25 CO 0.01 -0.17 0.14 0.21 0.00 0.00 0.00 175.30 175.49 1bxp s LYS 26 N 1.67 2.18 -0.15 3.54 2.20 -0.05 0.15 119.74 129.28 1bxp s LYS 26 Ca 0.07 -2.07 -0.30 0.00 -0.36 0.00 0.00 55.97 53.31 1bxp s LYS 26 Cb -0.16 -1.82 0.11 0.00 -1.51 0.00 0.00 37.83 34.45 1bxp s LYS 26 CO 0.08 -0.26 0.92 -1.64 -0.36 0.00 0.00 175.35 174.09 1bxp s MET 27 N -3.93 0.70 0.43 4.03 -1.94 -0.11 -1.28 119.30 117.20 1bxp s MET 27 Ca 0.29 0.23 0.00 0.00 -1.71 0.00 0.00 55.69 54.50 1bxp s MET 27 Cb 0.03 0.33 0.00 0.00 2.01 0.00 0.00 34.83 37.20 1bxp s MET 27 CO 0.16 -0.21 0.00 -2.67 -0.01 0.00 0.00 175.02 172.30 1bxp n TRP 28 N 0.95 -4.08 0.00 -0.03 2.14 -1.26 -2.19 117.44 112.96 1bxp n TRP 28 Ca -0.13 1.27 0.00 0.00 2.07 0.00 0.00 57.50 60.72 1bxp n TRP 28 Cb 0.57 2.96 0.00 0.00 -0.81 0.00 0.00 31.31 34.03 1bxp n TRP 28 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1bxp n ASP 30 N 0.00 0.00 0.00 0.00 2.03 -1.26 -3.45 116.55 113.87 1bxp n ASP 30 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1bxp n ASP 30 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1bxp n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bxp n ALA 31 N -3.00 -0.02 -2.75 -1.67 0.00 -1.26 -4.14 120.51 107.67 1bxp n ALA 31 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1bxp n ALA 31 Cb 0.00 0.34 0.04 0.00 0.00 0.00 0.00 19.45 19.83 1bxp n ALA 31 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1bxp n PHE 32 N -1.91 0.89 -2.31 0.00 3.01 -1.26 -5.08 117.46 110.81 1bxp n PHE 32 Ca 0.00 -1.69 -0.00 0.00 1.01 0.00 0.00 57.45 56.77 1bxp n PHE 32 Cb 0.00 -0.19 -0.00 0.00 -0.01 0.00 0.00 39.48 39.28 1bxp n PHE 32 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1bxp n SER 34 N 1.88 1.13 0.00 0.00 7.64 -1.26 -4.99 113.62 118.03 1bxp n SER 34 Ca -0.00 -0.10 0.09 0.00 1.01 0.00 0.00 58.87 59.87 1bxp n SER 34 Cb 0.00 0.00 0.48 0.00 -1.01 0.00 0.00 64.21 63.68 1bxp n SER 34 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1bxp n SER 35 N -0.18 0.00 -1.42 6.43 7.64 -1.26 -3.05 113.62 121.78 1bxp n SER 35 Ca 0.00 -0.24 -0.08 0.00 1.01 0.00 0.00 58.87 59.56 1bxp n SER 35 Cb 0.00 -0.15 0.07 0.00 -1.01 0.00 0.00 64.21 63.12 1bxp n SER 35 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1bxp n ARG 36 N -1.15 1.51 0.00 1.43 1.74 -1.26 -5.00 116.66 113.92 1bxp n ARG 36 Ca 0.11 -1.08 0.00 0.00 -0.77 0.00 0.00 57.85 56.10 1bxp n ARG 36 Cb 0.10 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 1bxp n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bxp n GLY 37 N -0.07 0.75 3.93 -0.13 0.00 -1.17 -4.57 105.19 103.93 1bxp n GLY 37 Ca 0.21 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 45.24 1bxp n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bxp s LYS 38 N 0.00 3.30 0.37 1.61 3.01 -1.26 -4.51 119.74 122.26 1bxp s LYS 38 Ca 0.00 -0.18 -0.06 0.00 -1.01 0.00 0.00 55.97 54.72 1bxp s LYS 38 Cb 0.00 -2.49 0.09 0.00 -1.01 0.00 0.00 37.83 34.42 1bxp s LYS 38 CO 0.00 -0.19 0.32 0.28 0.51 0.00 0.00 175.35 176.27 1bxp n VAL 39 N -2.12 0.00 -3.51 3.17 0.31 -1.22 -4.85 118.33 110.11 1bxp n VAL 39 Ca -0.00 -0.14 -0.29 0.00 -0.01 0.00 0.00 64.34 63.90 1bxp n VAL 39 Cb 0.56 -1.03 -0.12 0.00 -0.91 0.00 0.00 33.84 32.35 1bxp n VAL 39 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1bxp s VAL 40 N -1.58 0.50 -0.40 2.52 1.01 -1.26 -4.38 120.40 116.81 1bxp s VAL 40 Ca 0.21 -2.08 -0.03 0.00 0.00 0.00 0.00 61.98 60.08 1bxp s VAL 40 Cb -0.02 -1.36 0.10 0.00 0.00 0.00 0.00 36.38 35.10 1bxp s VAL 40 CO 0.16 -1.01 0.18 -1.61 0.00 0.00 0.00 175.10 172.83 1bxp s GLU 41 N 0.72 2.08 0.00 2.72 2.02 -0.40 -4.71 118.70 121.12 1bxp s GLU 41 Ca 0.20 -1.74 0.00 0.00 0.02 0.00 0.00 54.97 53.45 1bxp s GLU 41 Cb -0.19 -3.55 0.00 0.00 0.10 0.00 0.00 34.13 30.49 1bxp s GLU 41 CO -0.03 -1.02 0.00 1.28 0.02 0.00 0.00 175.26 175.52 1bxp n LEU 42 N 4.61 0.00 0.00 1.80 4.32 -1.25 -0.87 117.00 125.61 1bxp n LEU 42 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.95 1bxp n LEU 42 Cb 0.42 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.22 1bxp n LEU 42 CO 0.33 -0.23 0.00 0.61 -1.22 0.00 0.00 177.39 176.88 1bxp n GLY 43 N 5.00 -0.41 3.53 -0.72 0.00 0.13 -4.11 105.19 108.61 1bxp n GLY 43 Ca 0.00 -0.50 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 1bxp n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bxp s ALA 45 N -2.49 -1.93 0.23 0.00 0.00 -0.33 -4.74 121.76 112.51 1bxp s ALA 45 Ca 0.31 1.56 0.16 0.00 0.00 0.00 0.00 51.96 53.99 1bxp s ALA 45 Cb -0.04 -0.65 0.61 0.00 0.00 0.00 0.00 23.12 23.04 1bxp s ALA 45 CO 0.17 -0.33 1.72 0.00 0.00 0.00 0.00 175.76 177.31 1bxp h ALA 46 N 2.53 1.04 -1.71 0.00 0.00 -1.84 -2.22 119.26 117.06 1bxp h ALA 46 Ca -0.18 -0.40 0.03 0.00 0.00 0.00 0.00 54.91 54.36 1bxp h ALA 46 Cb 1.17 -0.07 -0.24 0.00 0.00 0.00 0.00 17.79 18.64 1bxp h ALA 46 CO 0.31 0.55 0.38 0.95 0.00 0.00 0.00 179.25 181.44 1bxp s THR 47 N -3.69 0.00 -0.93 0.00 -4.23 -1.26 -4.15 115.64 101.37 1bxp s THR 47 Ca -0.01 0.00 -0.32 0.00 -1.18 0.00 0.00 61.69 60.19 1bxp s THR 47 Cb 0.12 -1.00 -0.21 0.00 1.34 0.00 0.00 72.50 72.75 1bxp s THR 47 CO 0.71 0.00 2.64 0.00 -0.54 0.00 0.00 174.62 177.43 1bxp s PRO 49 N 8.73 4.26 -0.13 0.00 0.04 -1.26 -5.01 135.00 141.63 1bxp s PRO 49 Ca 1.33 1.57 -0.02 0.00 0.04 0.00 0.00 61.00 63.91 1bxp s PRO 49 Cb -1.22 -3.69 0.04 0.00 0.04 0.00 0.00 34.50 29.67 1bxp s PRO 49 CO 0.49 -0.63 0.02 -1.12 0.04 0.00 0.00 177.00 175.80 1bxp s SER 50 N 1.66 2.16 -0.36 6.66 0.01 -1.26 -4.70 113.70 117.86 1bxp s SER 50 Ca 0.52 -0.41 0.05 0.00 1.31 0.00 0.00 55.95 57.41 1bxp s SER 50 Cb -0.20 -0.48 0.23 0.00 0.21 0.00 0.00 66.02 65.78 1bxp s SER 50 CO 0.13 -0.25 1.21 2.29 0.41 0.00 0.00 173.24 177.04 1bxp n LYS 51 N 5.12 0.54 -3.15 12.44 2.85 -1.26 -5.10 118.16 129.60 1bxp n LYS 51 Ca -0.08 -1.14 0.05 0.00 -1.05 0.00 0.00 58.31 56.09 1bxp n LYS 51 Cb 0.49 -0.18 -0.00 0.00 -0.65 0.00 0.00 35.03 34.69 1bxp n LYS 51 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1bxp s LYS 52 N 0.11 0.27 0.00 -1.58 1.02 -1.26 -5.00 119.74 113.29 1bxp s LYS 52 Ca 0.14 0.26 0.09 0.00 0.02 0.00 0.00 55.97 56.48 1bxp s LYS 52 Cb 0.23 0.12 0.51 0.00 -0.52 0.00 0.00 37.83 38.16 1bxp s LYS 52 CO -0.08 -0.50 1.00 -0.35 -0.92 0.00 0.00 175.35 174.50 1bxp n PRO 53 N 5.20 0.25 0.00 -1.68 -0.04 -1.26 -1.71 135.00 135.76 1bxp n PRO 53 Ca 0.08 0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.60 1bxp n PRO 53 Cb 0.57 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.54 1bxp n PRO 53 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1bxp n TYR 54 N -1.05 0.00 -2.47 0.54 4.11 -1.26 -5.02 117.16 112.02 1bxp n TYR 54 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.96 1bxp n TYR 54 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.38 1bxp n TYR 54 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 1bxp n GLU 55 N 0.01 3.48 -3.13 -3.48 1.02 -0.70 -4.93 120.64 112.92 1bxp n GLU 55 Ca 0.03 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.19 1bxp n GLU 55 Cb 0.12 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.54 1bxp n GLU 55 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1bxp s GLU 56 N 2.06 0.60 0.10 3.49 2.56 -0.93 -4.98 118.70 121.60 1bxp s GLU 56 Ca 0.00 0.03 0.03 0.00 0.00 0.00 0.00 54.97 55.03 1bxp s GLU 56 Cb 0.00 0.13 -0.04 0.00 2.00 0.00 0.00 34.13 36.22 1bxp s GLU 56 CO 0.00 -0.95 0.15 0.08 -0.56 0.00 0.00 175.26 173.99 1bxp s VAL 57 N 2.24 4.85 0.21 3.70 1.01 -1.26 -0.93 120.40 130.22 1bxp s VAL 57 Ca 0.15 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1bxp s VAL 57 Cb -0.05 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 1bxp s VAL 57 CO -0.15 0.05 0.22 0.41 0.00 0.00 0.00 175.10 175.63 1bxp n THR 58 N 0.09 0.00 -4.34 3.92 -1.04 0.40 -4.91 114.28 108.40 1bxp n THR 58 Ca -0.07 -1.34 -0.19 0.00 -2.04 0.00 0.00 64.05 60.40 1bxp n THR 58 Cb 0.52 0.72 -0.09 0.00 -1.82 0.00 0.00 70.33 69.67 1bxp n THR 58 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bxp n SER 61 N 4.91 1.27 -4.07 0.00 3.41 -1.26 -1.51 113.62 116.36 1bxp n SER 61 Ca -0.08 -1.13 -0.30 0.00 -0.26 0.00 0.00 58.87 57.09 1bxp n SER 61 Cb 0.53 0.50 0.20 0.00 -0.26 0.00 0.00 64.21 65.18 1bxp n SER 61 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1bxp s THR 62 N -1.53 1.93 0.03 6.66 2.01 -1.26 -4.95 115.64 118.52 1bxp s THR 62 Ca 0.09 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 1bxp s THR 62 Cb 0.09 -2.91 -0.07 0.00 0.01 0.00 0.00 72.50 69.63 1bxp s THR 62 CO 0.30 0.00 1.47 -1.81 -0.69 0.00 0.00 174.62 173.89 1bxp s ASP 63 N -4.72 6.78 -1.45 3.53 1.11 -1.26 -3.07 116.67 117.58 1bxp s ASP 63 Ca 0.74 2.24 -0.03 0.00 0.18 0.00 0.00 52.55 55.68 1bxp s ASP 63 Cb -0.05 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.38 1bxp s ASP 63 CO 0.54 -0.76 0.25 1.17 1.18 0.00 0.00 175.17 177.54 1bxp n LYS 64 N 5.26 -1.94 -0.56 8.23 4.81 -1.26 -4.79 118.16 127.92 1bxp n LYS 64 Ca 0.14 0.24 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 1bxp n LYS 64 Cb 0.43 -3.95 0.21 0.00 0.02 0.00 0.00 35.03 31.73 1bxp n LYS 64 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1bxp n ASN 66 N 0.20 3.63 -4.53 0.00 5.03 -1.26 -4.78 115.26 113.55 1bxp n ASN 66 Ca 0.20 -3.37 -0.43 0.00 0.87 0.00 0.00 54.58 51.84 1bxp n ASN 66 Cb 0.88 -0.65 -0.01 0.00 -1.02 0.00 0.00 39.78 38.98 1bxp n ASN 66 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1bxp s PRO 67 N -3.05 3.93 0.81 3.52 0.04 -1.26 -4.76 135.00 134.22 1bxp s PRO 67 Ca 0.47 -2.03 -0.17 0.00 0.04 0.00 0.00 61.00 59.32 1bxp s PRO 67 Cb 0.40 -5.31 -0.11 0.00 0.04 0.00 0.00 34.50 29.51 1bxp s PRO 67 CO 0.07 -2.06 -0.28 -2.39 0.04 0.00 0.00 177.00 172.39 1bxp n HIS 68 N 7.46 -3.47 -2.72 0.56 1.44 -1.26 -4.78 115.22 112.45 1bxp n HIS 68 Ca 0.41 0.19 -0.42 0.00 -2.01 0.00 0.00 57.72 55.89 1bxp n HIS 68 Cb 0.46 -1.62 -0.03 0.00 0.12 0.00 0.00 29.99 28.92 1bxp n HIS 68 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 1bxp s PRO 69 N -1.99 3.57 -0.12 -1.40 0.04 -1.26 -4.57 135.00 129.26 1bxp s PRO 69 Ca 0.51 -1.36 0.05 0.00 0.04 0.00 0.00 61.00 60.23 1bxp s PRO 69 Cb -0.30 -5.12 0.15 0.00 0.04 0.00 0.00 34.50 29.26 1bxp s PRO 69 CO 0.73 -2.02 0.96 1.17 0.04 0.00 0.00 177.00 177.87 1bxp n LYS 70 N 7.90 0.49 -0.99 4.56 0.00 -1.26 -4.98 118.16 123.87 1bxp n LYS 70 Ca 0.28 -0.75 -0.14 0.00 0.00 0.00 0.00 58.31 57.70 1bxp n LYS 70 Cb 0.50 0.39 -0.06 0.00 0.00 0.00 0.00 35.03 35.86 1bxp n LYS 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1bxp n GLN 71 N -0.56 1.84 -3.43 1.64 6.02 -1.26 -4.83 117.38 116.80 1bxp n GLN 71 Ca -0.15 -1.24 -0.33 0.00 -0.01 0.00 0.00 57.00 55.27 1bxp n GLN 71 Cb 0.66 -1.73 0.03 0.00 1.02 0.00 0.00 30.24 30.22 1bxp n GLN 71 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1bxp n ARG 72 N 1.41 -1.81 -1.43 -1.09 0.00 -1.26 -4.90 116.66 107.58 1bxp n ARG 72 Ca 0.32 1.42 -0.30 0.00 -0.00 0.00 0.00 57.85 59.29 1bxp n ARG 72 Cb 0.66 -2.20 0.10 0.00 0.00 0.00 0.00 32.46 31.02 1bxp n ARG 72 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1bxp s PRO 73 N -2.31 2.03 0.00 -0.14 0.04 -1.26 -5.31 135.00 128.05 1bxp s PRO 73 Ca 0.34 0.80 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1bxp s PRO 73 Cb -0.04 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1bxp s PRO 73 CO 0.78 -1.70 0.00 0.41 0.04 0.00 0.00 177.00 176.53