#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nr4 s THR 4 N 0.00 0.47 0.65 2.61 -4.23 -1.26 -5.03 115.64 108.85 1nr4 s THR 4 Ca 0.00 -2.00 0.40 0.00 -1.18 0.00 0.00 61.69 58.91 1nr4 s THR 4 Cb 0.00 -2.61 0.42 0.00 1.34 0.00 0.00 72.50 71.65 1nr4 s THR 4 CO 0.00 0.00 2.32 0.78 -0.54 0.00 0.00 174.62 177.18 1nr4 h ASN 5 N 2.39 0.00 -2.63 3.99 2.35 -2.02 -3.38 115.58 116.27 1nr4 h ASN 5 Ca -0.37 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 54.81 1nr4 h ASN 5 Cb 1.25 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.60 1nr4 h ASN 5 CO 0.59 0.00 1.23 -0.69 -1.65 0.00 0.00 177.43 176.90 1nr4 s VAL 6 N -4.27 3.50 0.00 2.81 1.01 -1.26 -1.44 120.40 120.75 1nr4 s VAL 6 Ca -0.05 0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.47 1nr4 s VAL 6 Cb 0.13 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1nr4 s VAL 6 CO 0.44 -0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.86 1nr4 n GLY 7 N 5.05 0.65 3.73 4.51 0.00 -1.26 -4.94 105.19 112.93 1nr4 n GLY 7 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1nr4 n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nr4 s ARG 8 N -0.00 4.54 -0.17 1.61 3.52 -0.52 -5.05 118.95 122.88 1nr4 s ARG 8 Ca 0.00 1.18 -0.06 0.00 -0.13 0.00 0.00 55.73 56.72 1nr4 s ARG 8 Cb 0.00 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.96 1nr4 s ARG 8 CO 0.00 0.19 0.02 -2.00 -0.81 0.00 0.00 175.30 172.70 1nr4 s GLU 9 N 0.22 3.85 0.10 5.12 2.56 -1.26 -5.04 118.70 124.25 1nr4 s GLU 9 Ca 0.42 -0.42 0.07 0.00 0.00 0.00 0.00 54.97 55.04 1nr4 s GLU 9 Cb -0.21 -3.10 -0.03 0.00 2.00 0.00 0.00 34.13 32.79 1nr4 s GLU 9 CO 0.25 0.25 -0.17 0.00 -0.56 0.00 0.00 175.26 175.02 1nr4 h LEU 12 N 10.47 0.89 -7.68 0.00 5.85 -1.99 -3.40 115.31 119.45 1nr4 h LEU 12 Ca -0.25 -0.71 -0.19 0.00 0.84 0.00 0.00 57.88 57.57 1nr4 h LEU 12 Cb 1.08 -0.27 -0.25 0.00 0.37 0.00 0.00 40.66 41.59 1nr4 h LEU 12 CO 1.01 1.48 -0.58 -1.61 -0.34 0.00 0.00 178.44 178.41 1nr4 s GLU 13 N -3.42 0.23 0.21 1.25 0.41 -1.26 -5.01 118.70 111.10 1nr4 s GLU 13 Ca -0.10 -0.04 -0.30 0.00 -0.41 0.00 0.00 54.97 54.12 1nr4 s GLU 13 Cb 0.07 0.10 -0.08 0.00 -1.78 0.00 0.00 34.13 32.44 1nr4 s GLU 13 CO 0.91 -0.04 1.08 0.71 -0.49 0.00 0.00 175.26 177.43 1nr4 s TYR 14 N -0.40 3.63 0.35 1.61 4.12 -1.26 -4.73 117.35 120.67 1nr4 s TYR 14 Ca -0.05 1.66 -0.29 0.00 0.02 0.00 0.00 57.07 58.41 1nr4 s TYR 14 Cb -0.03 -3.25 -0.11 0.00 -1.52 0.00 0.00 41.96 37.05 1nr4 s TYR 14 CO 0.00 -0.49 1.53 0.12 0.02 0.00 0.00 175.55 176.73 1nr4 s PHE 15 N -0.58 2.65 -0.05 2.71 5.36 0.13 -4.99 117.98 123.22 1nr4 s PHE 15 Ca 0.47 1.02 0.06 0.00 -0.96 0.00 0.00 56.93 57.52 1nr4 s PHE 15 Cb -0.30 -4.04 -0.01 0.00 -0.34 0.00 0.00 43.02 38.33 1nr4 s PHE 15 CO 0.36 -3.22 -0.23 0.15 -1.46 0.00 0.00 175.22 170.82 1nr4 s LYS 16 N -1.51 2.21 0.00 10.12 1.02 -1.26 -4.82 119.74 125.50 1nr4 s LYS 16 Ca 0.57 -0.81 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1nr4 s LYS 16 Cb -0.47 -1.93 0.00 0.00 -0.52 0.00 0.00 37.83 34.91 1nr4 s LYS 16 CO 0.58 0.37 0.00 0.41 -0.92 0.00 0.00 175.35 175.78 1nr4 n GLY 17 N 2.91 2.14 3.70 -3.33 0.00 -1.26 -5.07 105.19 104.29 1nr4 n GLY 17 Ca -0.17 -2.14 -0.43 0.00 0.00 0.00 0.00 46.02 43.27 1nr4 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nr4 n ALA 18 N -1.10 2.31 -2.68 4.61 0.00 -1.26 -4.99 120.51 117.41 1nr4 n ALA 18 Ca 0.00 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.41 1nr4 n ALA 18 Cb 0.00 -2.50 -0.04 0.00 0.00 0.00 0.00 19.45 16.91 1nr4 n ALA 18 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1nr4 s ILE 19 N 1.55 4.85 -1.01 0.00 1.01 -1.26 -5.00 121.20 121.36 1nr4 s ILE 19 Ca 0.78 1.76 -0.23 0.00 0.00 0.00 0.00 60.65 62.95 1nr4 s ILE 19 Cb -0.54 -4.19 0.04 0.00 0.01 0.00 0.00 42.46 37.77 1nr4 s ILE 19 CO 0.35 0.02 1.52 -2.16 0.00 0.00 0.00 174.94 174.68 1nr4 s PRO 20 N 2.08 3.45 0.19 2.79 0.04 -1.26 -4.87 135.00 137.41 1nr4 s PRO 20 Ca 0.41 -1.01 -0.13 0.00 0.04 0.00 0.00 61.00 60.31 1nr4 s PRO 20 Cb -0.17 -5.32 0.19 0.00 0.04 0.00 0.00 34.50 29.24 1nr4 s PRO 20 CO 0.14 -2.38 1.71 1.25 0.04 0.00 0.00 177.00 177.76 1nr4 h LEU 21 N 13.52 -0.03 -2.85 -3.56 5.85 -1.99 -0.20 115.31 126.06 1nr4 h LEU 21 Ca 0.19 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 1nr4 h LEU 21 Cb 1.01 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 1nr4 h LEU 21 CO 1.40 0.01 -0.00 0.08 -0.34 0.00 0.00 178.44 179.59 1nr4 h ARG 22 N 0.21 0.00 0.00 1.25 0.11 -2.05 -2.09 114.38 111.82 1nr4 h ARG 22 Ca 0.25 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.33 1nr4 h ARG 22 Cb 0.34 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.42 1nr4 h ARG 22 CO -0.33 0.00 -0.42 1.63 0.10 0.00 0.00 179.97 180.95 1nr4 n LYS 23 N -3.23 0.11 -2.36 0.08 5.02 -0.09 -4.92 118.16 112.76 1nr4 n LYS 23 Ca -0.03 0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.88 1nr4 n LYS 23 Cb 0.08 -1.58 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 1nr4 n LYS 23 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nr4 s LEU 24 N -3.47 4.39 -0.18 -0.35 1.43 -0.79 -0.54 118.68 119.17 1nr4 s LEU 24 Ca 0.10 2.13 -0.04 0.00 -1.03 0.00 0.00 54.13 55.29 1nr4 s LEU 24 Cb 0.16 -3.59 -0.09 0.00 0.03 0.00 0.00 46.19 42.70 1nr4 s LEU 24 CO 0.67 -0.48 -0.20 1.17 0.23 0.00 0.00 176.35 177.74 1nr4 n LYS 25 N 3.59 0.40 -3.98 1.70 4.81 0.03 -4.77 118.16 119.93 1nr4 n LYS 25 Ca 0.08 0.14 -0.13 0.00 -0.87 0.00 0.00 58.31 57.53 1nr4 n LYS 25 Cb 0.45 -1.23 -0.01 0.00 0.02 0.00 0.00 35.03 34.26 1nr4 n LYS 25 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 1nr4 s THR 26 N -2.33 0.00 0.08 3.15 -1.32 -0.99 -5.01 115.64 109.23 1nr4 s THR 26 Ca -0.24 -1.37 -0.11 0.00 -1.21 0.00 0.00 61.69 58.75 1nr4 s THR 26 Cb 0.08 -2.75 0.01 0.00 -1.51 0.00 0.00 72.50 68.33 1nr4 s THR 26 CO 0.35 0.00 0.26 -1.66 -2.21 0.00 0.00 174.62 171.36 1nr4 s TRP 27 N -2.72 0.01 0.09 9.09 1.48 -1.26 -1.06 118.94 124.56 1nr4 s TRP 27 Ca 0.25 -0.33 -0.12 0.00 -1.06 0.00 0.00 56.10 54.84 1nr4 s TRP 27 Cb -0.02 0.05 0.02 0.00 -1.16 0.00 0.00 33.47 32.35 1nr4 s TRP 27 CO 0.17 -0.56 0.29 1.52 -4.06 0.00 0.00 176.95 174.32 1nr4 s TYR 28 N -3.43 -0.03 -0.20 1.66 -0.85 -0.55 -5.00 117.35 108.95 1nr4 s TYR 28 Ca 0.01 -0.28 -0.12 0.00 -0.52 0.00 0.00 57.07 56.16 1nr4 s TYR 28 Cb 0.02 0.09 -0.05 0.00 0.38 0.00 0.00 41.96 42.40 1nr4 s TYR 28 CO -0.09 -0.59 0.24 -1.14 -1.52 0.00 0.00 175.55 172.45 1nr4 s GLN 29 N -3.50 4.18 0.97 -3.49 0.74 -1.26 -0.62 119.66 116.67 1nr4 s GLN 29 Ca 0.02 -0.05 -0.12 0.00 0.05 0.00 0.00 55.36 55.26 1nr4 s GLN 29 Cb 0.02 -3.47 0.17 0.00 1.10 0.00 0.00 33.01 30.83 1nr4 s GLN 29 CO -0.09 0.16 1.09 0.95 -0.55 0.00 0.00 175.29 176.84 1nr4 s THR 30 N 0.75 2.36 0.32 -0.34 -4.23 -0.76 -4.94 115.64 108.80 1nr4 s THR 30 Ca 0.13 0.12 -0.28 0.00 -1.18 0.00 0.00 61.69 60.47 1nr4 s THR 30 Cb -0.13 -2.39 -0.13 0.00 1.34 0.00 0.00 72.50 71.20 1nr4 s THR 30 CO 0.03 -0.15 1.22 -0.24 -0.54 0.00 0.00 174.62 174.94 1nr4 n SER 31 N -4.24 2.35 0.32 3.99 2.88 -1.26 -4.77 113.62 112.89 1nr4 n SER 31 Ca 0.07 1.20 0.19 0.00 -1.33 0.00 0.00 58.87 59.00 1nr4 n SER 31 Cb 0.54 -1.42 1.03 0.00 -0.75 0.00 0.00 64.21 63.61 1nr4 n SER 31 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1nr4 h GLU 32 N 2.53 0.00 0.00 -1.46 4.11 -1.93 -1.80 114.58 116.02 1nr4 h GLU 32 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 1nr4 h GLU 32 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1nr4 h GLU 32 CO 0.63 0.00 -0.15 -0.25 0.07 0.00 0.00 179.01 179.31 1nr4 n ASP 33 N -3.19 0.47 -4.75 3.06 10.43 -1.26 -4.80 116.55 116.52 1nr4 n ASP 33 Ca -0.02 0.39 -0.38 0.00 2.57 0.00 0.00 54.79 57.35 1nr4 n ASP 33 Cb 0.20 -0.43 0.04 0.00 1.84 0.00 0.00 41.12 42.77 1nr4 n ASP 33 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1nr4 h SER 35 N 1.23 0.63 -3.18 0.00 0.87 -1.88 -3.41 113.55 107.81 1nr4 h SER 35 Ca -0.51 0.02 -0.60 0.00 -1.23 0.00 0.00 61.79 59.46 1nr4 h SER 35 Cb 1.30 -0.11 -0.10 0.00 -0.44 0.00 0.00 62.40 63.05 1nr4 h SER 35 CO 0.56 0.42 -0.39 -0.13 -0.53 0.00 0.00 176.83 176.76 1nr4 s ARG 36 N -6.10 4.11 0.00 2.24 0.52 -1.26 -5.07 118.95 113.38 1nr4 s ARG 36 Ca -0.13 -0.02 -0.30 0.00 -0.52 0.00 0.00 55.73 54.76 1nr4 s ARG 36 Cb 0.16 -3.38 -0.06 0.00 0.52 0.00 0.00 34.95 32.19 1nr4 s ARG 36 CO 0.76 0.36 1.48 0.34 0.02 0.00 0.00 175.30 178.27 1nr4 s ASP 37 N 0.14 6.77 -0.00 0.23 2.15 -1.26 -4.79 116.67 119.91 1nr4 s ASP 37 Ca 0.14 2.19 -0.11 0.00 0.43 0.00 0.00 52.55 55.20 1nr4 s ASP 37 Cb -0.12 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 39.95 1nr4 s ASP 37 CO 0.02 -0.79 0.23 0.00 -0.17 0.00 0.00 175.17 174.47 1nr4 s ALA 38 N 2.73 -0.56 -0.12 3.66 0.00 -1.26 -4.48 121.76 121.72 1nr4 s ALA 38 Ca 0.67 0.09 -0.03 0.00 0.00 0.00 0.00 51.96 52.69 1nr4 s ALA 38 Cb -0.33 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 1nr4 s ALA 38 CO 0.28 -0.24 -0.02 0.42 0.00 0.00 0.00 175.76 176.20 1nr4 s ILE 39 N -1.42 4.13 -0.23 0.00 -1.09 -0.15 -1.83 121.20 120.60 1nr4 s ILE 39 Ca -0.14 -0.29 -0.06 0.00 -2.23 0.00 0.00 60.65 57.93 1nr4 s ILE 39 Cb -0.06 -2.77 -0.02 0.00 -1.58 0.00 0.00 42.46 38.02 1nr4 s ILE 39 CO 0.03 0.54 0.02 -0.69 -1.23 0.00 0.00 174.94 173.61 1nr4 s VAL 40 N -0.24 3.92 0.02 2.92 1.01 0.20 -0.10 120.40 128.13 1nr4 s VAL 40 Ca 0.05 -0.31 -0.16 0.00 0.00 0.00 0.00 61.98 61.56 1nr4 s VAL 40 Cb -0.13 -2.81 -0.06 0.00 0.00 0.00 0.00 36.38 33.39 1nr4 s VAL 40 CO 0.02 0.38 0.45 -0.36 0.00 0.00 0.00 175.10 175.59 1nr4 s PHE 41 N 1.51 3.75 -0.15 5.22 0.40 -0.38 -1.48 117.98 126.85 1nr4 s PHE 41 Ca 0.06 1.07 -0.02 0.00 -0.60 0.00 0.00 56.93 57.43 1nr4 s PHE 41 Cb -0.15 -2.35 -0.02 0.00 0.51 0.00 0.00 43.02 41.01 1nr4 s PHE 41 CO 0.01 0.62 -0.07 0.08 0.70 0.00 0.00 175.22 176.55 1nr4 s VAL 42 N -1.04 3.50 0.70 -0.44 1.01 -0.23 -0.84 120.40 123.06 1nr4 s VAL 42 Ca 0.25 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 1nr4 s VAL 42 Cb -0.17 -2.52 0.05 0.00 0.00 0.00 0.00 36.38 33.74 1nr4 s VAL 42 CO 0.15 0.50 1.02 0.42 0.00 0.00 0.00 175.10 177.19 1nr4 s THR 43 N 0.50 2.54 0.35 3.92 -4.23 0.25 -0.79 115.64 118.17 1nr4 s THR 43 Ca -0.06 -0.14 0.03 0.00 -1.18 0.00 0.00 61.69 60.34 1nr4 s THR 43 Cb -0.15 -3.11 0.28 0.00 1.34 0.00 0.00 72.50 70.86 1nr4 s THR 43 CO 0.03 -0.12 1.98 0.58 -0.54 0.00 0.00 174.62 176.55 1nr4 h VAL 44 N -0.59 1.10 -0.10 2.29 2.07 -1.12 -1.10 116.25 118.79 1nr4 h VAL 44 Ca -0.45 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.78 1nr4 h VAL 44 Cb 1.30 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1nr4 h VAL 44 CO 0.61 0.15 0.00 0.00 0.02 0.00 0.00 177.57 178.36 1nr4 n GLN 45 N -4.46 1.34 -0.89 1.57 6.02 -1.26 -4.93 117.38 114.77 1nr4 n GLN 45 Ca 0.09 -0.52 0.00 0.00 -0.01 0.00 0.00 57.00 56.56 1nr4 n GLN 45 Cb 0.13 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.12 1nr4 n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nr4 n GLY 46 N 0.88 0.49 3.85 1.08 0.00 -0.42 -5.06 105.19 106.01 1nr4 n GLY 46 Ca 0.12 -0.61 -0.32 0.00 0.00 0.00 0.00 46.02 45.21 1nr4 n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nr4 s ARG 47 N -1.15 3.99 -0.05 1.61 0.52 -1.26 -4.83 118.95 117.78 1nr4 s ARG 47 Ca 0.00 0.77 0.04 0.00 -0.52 0.00 0.00 55.73 56.02 1nr4 s ARG 47 Cb 0.00 -2.32 -0.02 0.00 0.52 0.00 0.00 34.95 33.13 1nr4 s ARG 47 CO 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 175.30 175.15 1nr4 s ALA 48 N -2.22 2.54 -0.26 2.13 0.00 -1.26 -0.59 121.76 122.11 1nr4 s ALA 48 Ca 0.56 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 51.52 1nr4 s ALA 48 Cb -0.10 -0.88 0.07 0.00 0.00 0.00 0.00 23.12 22.21 1nr4 s ALA 48 CO 0.22 0.53 -0.01 0.42 0.00 0.00 0.00 175.76 176.92 1nr4 s ILE 49 N -0.63 1.43 -0.07 0.00 1.01 -0.02 -4.98 121.20 117.94 1nr4 s ILE 49 Ca 0.10 -1.35 -0.30 0.00 0.00 0.00 0.00 60.65 59.10 1nr4 s ILE 49 Cb -0.11 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.51 1nr4 s ILE 49 CO 0.01 -0.28 1.12 0.00 0.00 0.00 0.00 174.94 175.79 1nr4 s SER 51 N 1.29 0.88 -0.32 0.00 0.01 0.86 0.21 113.70 116.62 1nr4 s SER 51 Ca 0.53 -0.83 -0.21 0.00 1.31 0.00 0.00 55.95 56.75 1nr4 s SER 51 Cb -0.22 0.09 -0.00 0.00 0.21 0.00 0.00 66.02 66.10 1nr4 s SER 51 CO 0.21 -0.40 0.66 -0.62 0.41 0.00 0.00 173.24 173.50 1nr4 s ASP 52 N -2.46 6.50 0.16 2.44 -1.08 -1.26 -0.98 116.67 119.98 1nr4 s ASP 52 Ca 0.02 0.37 0.15 0.00 -0.52 0.00 0.00 52.55 52.57 1nr4 s ASP 52 Cb -0.00 -2.34 0.70 0.00 -1.46 0.00 0.00 42.92 39.82 1nr4 s ASP 52 CO -0.04 -0.54 1.45 -2.65 0.52 0.00 0.00 175.17 173.91 1nr4 n PRO 53 N 5.99 0.09 0.00 4.34 -0.02 -1.26 -1.79 135.00 142.35 1nr4 n PRO 53 Ca -0.00 0.48 0.11 0.00 -2.02 0.00 0.00 63.50 62.07 1nr4 n PRO 53 Cb 0.49 -1.73 0.12 0.00 -0.02 0.00 0.00 33.50 32.36 1nr4 n PRO 53 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1nr4 n ASN 54 N -1.90 0.67 -4.72 2.55 3.02 -1.26 -4.62 115.26 108.99 1nr4 n ASN 54 Ca 0.01 -0.50 -0.42 0.00 -0.03 0.00 0.00 54.58 53.64 1nr4 n ASN 54 Cb 0.09 0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 39.74 1nr4 n ASN 54 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1nr4 s ASN 55 N -3.03 6.90 0.18 6.41 3.84 -0.74 -4.94 114.94 123.57 1nr4 s ASN 55 Ca 0.10 2.29 -0.12 0.00 0.21 0.00 0.00 52.86 55.33 1nr4 s ASN 55 Cb 0.17 -2.59 0.10 0.00 -0.55 0.00 0.00 41.25 38.37 1nr4 s ASN 55 CO 0.76 -0.57 1.80 0.07 -2.79 0.00 0.00 177.10 176.37 1nr4 h LYS 56 N 6.32 0.87 -0.39 0.43 -0.00 -1.89 -0.66 116.57 121.26 1nr4 h LYS 56 Ca -0.43 -0.10 -0.08 0.00 -0.00 0.00 0.00 60.65 60.04 1nr4 h LYS 56 Cb 1.21 -0.17 -0.02 0.00 -0.00 0.00 0.00 32.23 33.25 1nr4 h LYS 56 CO 0.82 0.66 -0.10 0.00 -0.00 0.00 0.00 179.45 180.83 1nr4 h ARG 57 N 0.85 0.67 -0.30 0.07 3.08 -1.95 -1.30 114.38 115.51 1nr4 h ARG 57 Ca 0.22 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1nr4 h ARG 57 Cb 0.04 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1nr4 h ARG 57 CO -0.04 0.76 0.06 0.28 -1.07 0.00 0.00 179.97 179.97 1nr4 h VAL 58 N 0.62 1.22 -0.97 2.04 2.07 -1.75 -1.14 116.25 118.34 1nr4 h VAL 58 Ca 0.11 -0.75 0.04 0.00 0.82 0.00 0.00 66.70 66.93 1nr4 h VAL 58 Cb 0.54 1.15 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 1nr4 h VAL 58 CO 0.03 0.25 0.63 0.11 0.02 0.00 0.00 177.57 178.61 1nr4 h LYS 59 N 0.31 1.16 -0.64 1.57 1.57 -0.87 -1.20 116.57 118.47 1nr4 h LYS 59 Ca 0.09 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1nr4 h LYS 59 Cb 0.31 -0.26 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 1nr4 h LYS 59 CO 0.00 0.77 0.22 -0.97 -0.57 0.00 0.00 179.45 178.91 1nr4 h ASN 60 N 1.20 0.92 -0.73 0.86 -1.24 -0.94 -1.04 115.58 114.61 1nr4 h ASN 60 Ca 0.39 -0.19 -0.04 0.00 0.71 0.00 0.00 56.30 57.17 1nr4 h ASN 60 Cb 0.05 -0.24 -0.03 0.00 0.73 0.00 0.00 38.32 38.83 1nr4 h ASN 60 CO -0.14 0.87 0.29 0.00 -1.29 0.00 0.00 177.43 177.16 1nr4 h ALA 61 N 1.09 0.95 -0.64 1.57 0.00 -0.64 -0.08 119.26 121.50 1nr4 h ALA 61 Ca 0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1nr4 h ALA 61 Cb 0.26 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1nr4 h ALA 61 CO -0.01 0.57 0.25 0.28 0.00 0.00 0.00 179.25 180.34 1nr4 h VAL 62 N 1.05 1.24 -0.32 0.00 2.07 -1.02 -1.93 116.25 117.33 1nr4 h VAL 62 Ca 0.24 -0.75 -0.11 0.00 0.82 0.00 0.00 66.70 66.90 1nr4 h VAL 62 Cb 0.21 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1nr4 h VAL 62 CO -0.02 0.30 -0.25 0.50 0.02 0.00 0.00 177.57 178.12 1nr4 h LYS 63 N 0.91 0.64 0.30 1.57 3.64 -0.92 0.14 116.57 122.86 1nr4 h LYS 63 Ca 0.21 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1nr4 h LYS 63 Cb 0.21 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 1nr4 h LYS 63 CO -0.02 0.83 -0.40 -0.92 -2.27 0.00 0.00 179.45 176.67 1nr4 h TYR 64 N 0.56 -1.12 -0.88 1.91 3.20 -0.82 -0.39 116.97 119.44 1nr4 h TYR 64 Ca 0.08 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1nr4 h TYR 64 Cb 0.72 0.45 -0.04 0.00 1.54 0.00 0.00 36.73 39.39 1nr4 h TYR 64 CO 0.03 -0.54 0.47 -0.07 -1.64 0.00 0.00 178.16 176.41 1nr4 h LEU 65 N -0.76 1.10 -1.17 2.82 3.38 -0.70 -2.09 115.31 117.89 1nr4 h LEU 65 Ca -0.02 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 1nr4 h LEU 65 Cb 0.71 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1nr4 h LEU 65 CO -0.12 0.89 -0.07 1.56 0.09 0.00 0.00 178.44 180.78 1nr4 h GLN 66 N 1.23 0.50 -0.38 1.13 4.20 -0.63 -2.61 115.11 118.55 1nr4 h GLN 66 Ca 0.31 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 1nr4 h GLN 66 Cb 0.04 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1nr4 h GLN 66 CO -0.05 0.58 0.11 0.66 -0.67 0.00 0.00 178.83 179.46 1nr4 h SER 67 N 0.47 0.50 -0.04 1.46 4.64 -0.37 -1.75 113.55 118.46 1nr4 h SER 67 Ca 0.09 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 1nr4 h SER 67 Cb 0.41 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1nr4 h SER 67 CO 0.02 0.49 0.01 -0.07 -0.87 0.00 0.00 176.83 176.41 1nr4 h LEU 68 N 0.54 0.09 -1.68 5.97 3.38 -1.17 -2.13 115.31 120.31 1nr4 h LEU 68 Ca 0.13 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1nr4 h LEU 68 Cb 0.18 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1nr4 h LEU 68 CO -0.01 0.11 -0.01 -0.33 0.09 0.00 0.00 178.44 178.29 1nr4 h GLU 69 N 0.11 0.00 -0.00 1.13 4.39 -1.34 -2.67 114.58 116.19 1nr4 h GLU 69 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1nr4 h GLU 69 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1nr4 h GLU 69 CO -0.00 0.01 -0.33 2.89 -1.16 0.00 0.00 179.01 180.42 1nr4 n ARG 70 N -3.11 0.47 0.00 2.33 1.85 -0.80 -5.16 116.66 112.24 1nr4 n ARG 70 Ca 0.00 -0.26 0.00 0.00 -1.00 0.00 0.00 57.85 56.59 1nr4 n ARG 70 Cb 0.27 -1.49 0.00 0.00 -1.05 0.00 0.00 32.46 30.19 1nr4 n ARG 70 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07