#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nr4 s ARG 8 N 0.00 0.45 0.06 1.61 3.52 -1.26 -5.14 118.95 118.19 1nr4 s ARG 8 Ca 0.00 1.03 0.06 0.00 -0.13 0.00 0.00 55.73 56.69 1nr4 s ARG 8 Cb 0.00 0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.60 1nr4 s ARG 8 CO 0.00 -0.19 -0.10 -1.83 -0.81 0.00 0.00 175.30 172.36 1nr4 s GLU 9 N 2.05 2.25 -0.01 5.12 -1.05 -1.26 -5.15 118.70 120.65 1nr4 s GLU 9 Ca -0.06 -0.93 0.05 0.00 -0.15 0.00 0.00 54.97 53.88 1nr4 s GLU 9 Cb -0.10 -2.35 -0.01 0.00 -0.44 0.00 0.00 34.13 31.24 1nr4 s GLU 9 CO -0.15 0.54 -0.17 0.00 0.95 0.00 0.00 175.26 176.43 1nr4 h LEU 12 N 9.99 0.68 -7.00 0.00 -0.00 -1.94 -3.45 115.31 113.59 1nr4 h LEU 12 Ca -0.25 -0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 57.58 1nr4 h LEU 12 Cb 1.09 -0.17 -0.21 0.00 -0.00 0.00 0.00 40.66 41.37 1nr4 h LEU 12 CO 0.94 0.50 0.24 -0.70 -0.00 0.00 0.00 178.44 179.43 1nr4 s GLU 13 N -6.10 0.86 0.48 1.13 2.12 -1.26 -5.14 118.70 110.78 1nr4 s GLU 13 Ca -0.13 0.56 -0.23 0.00 0.36 0.00 0.00 54.97 55.53 1nr4 s GLU 13 Cb 0.13 0.41 -0.07 0.00 0.26 0.00 0.00 34.13 34.86 1nr4 s GLU 13 CO 0.75 -0.19 1.28 0.71 -0.54 0.00 0.00 175.26 177.27 1nr4 s TYR 14 N -0.42 2.61 0.66 5.30 4.12 -1.26 -4.83 117.35 123.53 1nr4 s TYR 14 Ca -0.04 1.44 -0.17 0.00 0.02 0.00 0.00 57.07 58.32 1nr4 s TYR 14 Cb -0.03 -3.63 0.00 0.00 -1.52 0.00 0.00 41.96 36.79 1nr4 s TYR 14 CO 0.04 -2.23 1.21 0.12 0.02 0.00 0.00 175.55 174.70 1nr4 s PHE 15 N -1.38 2.23 -0.09 2.71 5.36 0.31 -4.96 117.98 122.16 1nr4 s PHE 15 Ca 0.65 1.55 0.03 0.00 -0.96 0.00 0.00 56.93 58.20 1nr4 s PHE 15 Cb -0.36 -3.47 0.01 0.00 -0.34 0.00 0.00 43.02 38.86 1nr4 s PHE 15 CO 0.44 -2.41 -0.17 0.15 -1.46 0.00 0.00 175.22 171.76 1nr4 s LYS 16 N -3.66 2.31 0.00 10.12 1.02 -1.26 -4.73 119.74 123.54 1nr4 s LYS 16 Ca 0.76 -0.61 0.00 0.00 0.02 0.00 0.00 55.97 56.13 1nr4 s LYS 16 Cb -0.30 -1.85 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1nr4 s LYS 16 CO 0.40 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 175.29 1nr4 n GLY 17 N 3.84 0.46 3.64 -3.33 0.00 -1.26 -5.05 105.19 103.48 1nr4 n GLY 17 Ca -0.21 -2.23 -0.31 0.00 0.00 0.00 0.00 46.02 43.28 1nr4 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nr4 s ALA 18 N -1.81 3.15 -0.18 4.61 0.00 -1.26 -5.05 121.76 121.22 1nr4 s ALA 18 Ca 0.00 -1.06 -0.01 0.00 0.00 0.00 0.00 51.96 50.89 1nr4 s ALA 18 Cb 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.96 1nr4 s ALA 18 CO 0.00 0.65 -0.14 0.42 0.00 0.00 0.00 175.76 176.69 1nr4 s ILE 19 N -1.13 2.66 0.29 0.00 1.01 -1.26 -5.09 121.20 117.68 1nr4 s ILE 19 Ca 0.21 -0.75 -0.29 0.00 0.00 0.00 0.00 60.65 59.81 1nr4 s ILE 19 Cb -0.11 -2.15 -0.13 0.00 0.01 0.00 0.00 42.46 40.08 1nr4 s ILE 19 CO 0.12 0.50 1.36 -2.65 0.00 0.00 0.00 174.94 174.26 1nr4 n PRO 20 N 4.47 2.12 0.20 2.79 -0.02 -1.26 -4.85 135.00 138.45 1nr4 n PRO 20 Ca -0.19 0.75 0.12 0.00 -2.02 0.00 0.00 63.50 62.15 1nr4 n PRO 20 Cb 0.51 -2.37 0.68 0.00 -0.02 0.00 0.00 33.50 32.30 1nr4 n PRO 20 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1nr4 h LEU 21 N 3.39 0.00 -1.56 2.45 3.38 -1.98 -1.58 115.31 119.41 1nr4 h LEU 21 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1nr4 h LEU 21 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1nr4 h LEU 21 CO 0.69 0.00 0.00 0.08 0.09 0.00 0.00 178.44 179.30 1nr4 h ARG 22 N 0.00 0.00 -0.00 1.13 0.11 -2.05 -1.95 114.38 111.62 1nr4 h ARG 22 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 1nr4 h ARG 22 Cb 0.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.34 1nr4 h ARG 22 CO -0.00 0.00 -0.36 1.63 0.10 0.00 0.00 179.97 181.34 1nr4 n LYS 23 N -2.92 0.21 -3.22 0.08 5.02 -0.60 -4.87 118.16 111.87 1nr4 n LYS 23 Ca 0.00 -0.11 -0.39 0.00 -2.02 0.00 0.00 58.31 55.80 1nr4 n LYS 23 Cb 0.25 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.71 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 -2.86 4.30 -0.26 -0.35 1.43 -0.73 -0.22 118.68 119.98 1nr4 s LEU 24 Ca 0.15 0.96 -0.14 0.00 -1.03 0.00 0.00 54.13 54.08 1nr4 s LEU 24 Cb 0.18 -2.84 -0.11 0.00 0.03 0.00 0.00 46.19 43.45 1nr4 s LEU 24 CO 0.63 -0.04 -0.34 1.17 0.23 0.00 0.00 176.35 178.00 1nr4 n LYS 25 N 3.67 0.56 -3.91 1.70 4.81 0.30 -4.72 118.16 120.57 1nr4 n LYS 25 Ca -0.05 0.24 -0.12 0.00 -0.87 0.00 0.00 58.31 57.52 1nr4 n LYS 25 Cb 0.51 -1.44 0.00 0.00 0.02 0.00 0.00 35.03 34.13 1nr4 n LYS 25 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1nr4 s THR 26 N -2.52 0.00 0.07 3.15 2.01 -0.93 -5.00 115.64 112.42 1nr4 s THR 26 Ca -0.36 -1.23 -0.09 0.00 0.31 0.00 0.00 61.69 60.32 1nr4 s THR 26 Cb 0.13 -2.88 -0.00 0.00 0.01 0.00 0.00 72.50 69.77 1nr4 s THR 26 CO 0.46 0.00 0.18 -1.66 -0.69 0.00 0.00 174.62 172.91 1nr4 s TRP 27 N -2.41 0.13 0.12 4.92 1.48 -1.26 -0.56 118.94 121.37 1nr4 s TRP 27 Ca 0.22 -0.50 -0.11 0.00 -1.06 0.00 0.00 56.10 54.65 1nr4 s TRP 27 Cb -0.03 -0.06 0.01 0.00 -1.16 0.00 0.00 33.47 32.22 1nr4 s TRP 27 CO 0.16 -0.50 0.28 1.52 -4.06 0.00 0.00 176.95 174.35 1nr4 s TYR 28 N -3.41 0.14 -0.07 1.66 -0.85 -0.44 -4.99 117.35 109.39 1nr4 s TYR 28 Ca 0.02 -0.52 0.05 0.00 -0.52 0.00 0.00 57.07 56.10 1nr4 s TYR 28 Cb 0.03 0.03 -0.01 0.00 0.38 0.00 0.00 41.96 42.39 1nr4 s TYR 28 CO -0.09 -0.65 -0.24 -1.14 -1.52 0.00 0.00 175.55 171.92 1nr4 s GLN 29 N -3.88 2.68 0.07 -3.49 2.00 -1.26 -0.45 119.66 115.33 1nr4 s GLN 29 Ca 0.08 -0.88 0.06 0.00 -2.00 0.00 0.00 55.36 52.62 1nr4 s GLN 29 Cb 0.03 -2.18 -0.03 0.00 0.80 0.00 0.00 33.01 31.64 1nr4 s GLN 29 CO -0.08 0.31 -0.17 -0.08 -0.50 0.00 0.00 175.29 174.78 1nr4 s THR 30 N 0.01 1.33 0.30 -0.34 -1.32 -1.14 -5.03 115.64 109.45 1nr4 s THR 30 Ca -0.09 -1.32 0.04 0.00 -1.21 0.00 0.00 61.69 59.11 1nr4 s THR 30 Cb -0.15 -1.23 -0.01 0.00 -1.51 0.00 0.00 72.50 69.59 1nr4 s THR 30 CO 0.05 -0.11 0.32 -1.54 -2.21 0.00 0.00 174.62 171.13 1nr4 n SER 31 N 1.35 -0.84 -0.46 8.08 3.41 -1.26 -3.57 113.62 120.33 1nr4 n SER 31 Ca -0.20 -2.86 0.04 0.00 -0.26 0.00 0.00 58.87 55.59 1nr4 n SER 31 Cb 0.54 1.77 -0.02 0.00 -0.26 0.00 0.00 64.21 66.24 1nr4 n SER 31 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1nr4 n GLU 32 N -0.55 -1.10 -2.28 4.33 0.28 -1.26 -4.70 120.64 115.36 1nr4 n GLU 32 Ca 0.05 0.89 -0.33 0.00 -0.16 0.00 0.00 57.16 57.60 1nr4 n GLU 32 Cb 0.53 -1.22 -0.01 0.00 1.43 0.00 0.00 31.44 32.17 1nr4 n GLU 32 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 1nr4 s ASP 33 N -4.67 6.07 0.00 -1.84 -4.77 -1.26 -2.15 116.67 108.05 1nr4 s ASP 33 Ca 0.00 1.86 0.00 0.00 -3.30 0.00 0.00 52.55 51.11 1nr4 s ASP 33 Cb 0.00 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.29 1nr4 s ASP 33 CO 0.00 -0.97 0.00 0.00 0.70 0.00 0.00 175.17 174.90 1nr4 h SER 35 N 0.00 0.00 -1.60 0.00 4.64 -1.61 -2.04 113.55 112.93 1nr4 h SER 35 Ca 0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 1nr4 h SER 35 Cb 0.00 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 61.98 1nr4 h SER 35 CO 0.00 0.14 -0.30 0.54 -0.87 0.00 0.00 176.83 176.33 1nr4 n ARG 36 N -3.20 -1.44 -4.28 4.77 1.74 -1.26 -1.73 116.66 111.25 1nr4 n ARG 36 Ca 0.02 0.89 -0.37 0.00 -0.77 0.00 0.00 57.85 57.61 1nr4 n ARG 36 Cb 0.47 -5.23 -0.04 0.00 -1.02 0.00 0.00 32.46 26.64 1nr4 n ARG 36 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1nr4 n ASP 37 N -0.93 -2.65 -4.79 0.55 8.00 -1.26 -4.82 116.55 110.66 1nr4 n ASP 37 Ca -0.16 -1.07 -0.34 0.00 0.71 0.00 0.00 54.79 53.93 1nr4 n ASP 37 Cb 0.53 -2.48 -0.01 0.00 -0.02 0.00 0.00 41.12 39.14 1nr4 n ASP 37 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nr4 s ALA 38 N -3.36 2.77 -0.15 2.24 0.00 -0.71 -4.56 121.76 117.99 1nr4 s ALA 38 Ca 0.69 0.67 -0.21 0.00 0.00 0.00 0.00 51.96 53.11 1nr4 s ALA 38 Cb -0.38 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 1nr4 s ALA 38 CO 0.95 -0.59 0.64 0.42 0.00 0.00 0.00 175.76 177.18 1nr4 s ILE 39 N -1.96 5.04 -0.29 0.00 -1.09 -0.55 -2.89 121.20 119.46 1nr4 s ILE 39 Ca 0.69 1.25 -0.07 0.00 -2.23 0.00 0.00 60.65 60.29 1nr4 s ILE 39 Cb -0.19 -3.97 0.00 0.00 -1.58 0.00 0.00 42.46 36.72 1nr4 s ILE 39 CO 0.25 0.17 0.08 -0.69 -1.23 0.00 0.00 174.94 173.53 1nr4 s VAL 40 N 1.44 4.08 -0.04 2.92 1.01 0.40 0.08 120.40 130.30 1nr4 s VAL 40 Ca 0.31 -0.56 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 1nr4 s VAL 40 Cb -0.16 -3.06 -0.05 0.00 0.00 0.00 0.00 36.38 33.11 1nr4 s VAL 40 CO 0.12 0.13 0.61 -0.36 0.00 0.00 0.00 175.10 175.61 1nr4 s PHE 41 N 1.53 3.63 -0.22 5.22 0.40 -0.64 -1.32 117.98 126.58 1nr4 s PHE 41 Ca 0.04 1.17 -0.10 0.00 -0.60 0.00 0.00 56.93 57.44 1nr4 s PHE 41 Cb -0.17 -2.65 -0.05 0.00 0.51 0.00 0.00 43.02 40.66 1nr4 s PHE 41 CO 0.03 0.25 0.14 0.08 0.70 0.00 0.00 175.22 176.42 1nr4 s VAL 42 N 0.19 5.28 0.49 -0.44 1.01 0.28 -0.84 120.40 126.37 1nr4 s VAL 42 Ca 0.32 0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.42 1nr4 s VAL 42 Cb -0.18 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 1nr4 s VAL 42 CO 0.16 0.38 0.76 0.42 0.00 0.00 0.00 175.10 176.83 1nr4 s THR 43 N 0.80 4.28 0.48 3.92 -4.23 0.12 -0.53 115.64 120.48 1nr4 s THR 43 Ca 0.07 -0.13 0.17 0.00 -1.18 0.00 0.00 61.69 60.62 1nr4 s THR 43 Cb -0.13 -3.63 0.33 0.00 1.34 0.00 0.00 72.50 70.42 1nr4 s THR 43 CO 0.02 -0.55 2.02 0.58 -0.54 0.00 0.00 174.62 176.15 1nr4 h VAL 44 N 0.21 0.88 -0.00 2.29 2.07 -0.88 -1.08 116.25 119.74 1nr4 h VAL 44 Ca -0.47 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1nr4 h VAL 44 Cb 1.24 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1nr4 h VAL 44 CO 0.60 0.04 -0.00 0.00 0.02 0.00 0.00 177.57 178.23 1nr4 n GLN 45 N -4.46 1.10 -0.57 1.57 6.02 -1.26 -4.93 117.38 114.85 1nr4 n GLN 45 Ca 0.07 -0.17 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 1nr4 n GLN 45 Cb 0.36 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.13 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 1.04 0.67 3.93 1.08 0.00 -0.41 -5.07 105.19 106.43 1nr4 n GLY 46 Ca 0.23 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.54 1nr4 n GLY 46 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nr4 s ARG 47 N -0.93 3.40 -0.03 1.61 3.52 -1.26 -4.88 118.95 120.38 1nr4 s ARG 47 Ca 0.00 -0.61 0.03 0.00 -0.13 0.00 0.00 55.73 55.02 1nr4 s ARG 47 Cb 0.00 -2.95 -0.03 0.00 -1.56 0.00 0.00 34.95 30.41 1nr4 s ARG 47 CO 0.00 0.53 -0.09 0.00 -0.81 0.00 0.00 175.30 174.92 1nr4 s ALA 48 N -1.72 2.90 -0.26 6.12 0.00 -1.26 -0.70 121.76 126.83 1nr4 s ALA 48 Ca 0.34 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.34 1nr4 s ALA 48 Cb -0.11 -1.09 0.07 0.00 0.00 0.00 0.00 23.12 21.98 1nr4 s ALA 48 CO 0.28 0.59 -0.07 0.42 0.00 0.00 0.00 175.76 176.98 1nr4 s ILE 49 N -0.88 1.95 0.05 0.00 1.01 -0.02 -4.97 121.20 118.34 1nr4 s ILE 49 Ca 0.14 -1.58 -0.28 0.00 0.00 0.00 0.00 60.65 58.94 1nr4 s ILE 49 Cb -0.11 -2.15 -0.05 0.00 0.01 0.00 0.00 42.46 40.16 1nr4 s ILE 49 CO 0.04 -0.13 0.87 0.00 0.00 0.00 0.00 174.94 175.72 1nr4 s SER 51 N 0.26 0.81 -0.33 0.00 0.01 0.11 -0.53 113.70 114.02 1nr4 s SER 51 Ca 0.44 -0.74 -0.28 0.00 1.31 0.00 0.00 55.95 56.68 1nr4 s SER 51 Cb -0.21 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.09 1nr4 s SER 51 CO 0.26 -0.35 1.73 -0.62 0.41 0.00 0.00 173.24 174.67 1nr4 s ASP 52 N -2.18 5.99 0.57 2.44 2.15 -1.26 -1.48 116.67 122.90 1nr4 s ASP 52 Ca -0.02 1.26 0.28 0.00 0.43 0.00 0.00 52.55 54.50 1nr4 s ASP 52 Cb -0.03 -2.53 1.69 0.00 -0.30 0.00 0.00 42.92 41.75 1nr4 s ASP 52 CO -0.03 -1.63 2.20 1.55 -0.17 0.00 0.00 175.17 177.09 1nr4 h PRO 53 N 12.39 0.00 -0.01 4.34 0.13 -1.88 -2.19 132.00 144.79 1nr4 h PRO 53 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1nr4 h PRO 53 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1nr4 h PRO 53 CO 1.04 0.04 -0.04 0.09 -0.23 0.00 0.00 178.00 178.89 1nr4 n ASN 54 N -3.81 0.96 -4.76 1.44 3.02 -1.26 -4.70 115.26 106.16 1nr4 n ASN 54 Ca -0.03 -1.20 -0.40 0.00 -0.03 0.00 0.00 54.58 52.93 1nr4 n ASN 54 Cb 0.13 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.24 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 -2.12 7.56 0.11 6.41 3.84 -0.82 -4.99 114.94 124.93 1nr4 s ASN 55 Ca 0.38 1.86 -0.16 0.00 0.21 0.00 0.00 52.86 55.15 1nr4 s ASN 55 Cb 0.21 -2.58 -0.05 0.00 -0.55 0.00 0.00 41.25 38.28 1nr4 s ASN 55 CO 0.38 0.15 1.52 0.11 -2.79 0.00 0.00 177.10 176.47 1nr4 h LYS 56 N 4.11 0.64 -0.75 0.43 1.79 -1.90 -1.06 116.57 119.83 1nr4 h LYS 56 Ca -0.46 -0.24 -0.00 0.00 -2.18 0.00 0.00 60.65 57.77 1nr4 h LYS 56 Cb 1.20 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.77 1nr4 h LYS 56 CO 0.67 0.80 0.45 0.00 -1.08 0.00 0.00 179.45 180.30 1nr4 h ARG 57 N 0.43 1.01 -0.24 3.15 3.08 -1.96 -0.44 114.38 119.42 1nr4 h ARG 57 Ca 0.09 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1nr4 h ARG 57 Cb 0.55 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1nr4 h ARG 57 CO 0.03 0.71 0.05 0.28 -1.07 0.00 0.00 179.97 179.97 1nr4 h VAL 58 N 1.03 1.22 -0.65 2.04 2.07 -1.80 -1.73 116.25 118.44 1nr4 h VAL 58 Ca 0.27 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 1nr4 h VAL 58 Cb -0.04 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1nr4 h VAL 58 CO -0.05 0.23 0.34 0.11 0.02 0.00 0.00 177.57 178.22 1nr4 h LYS 59 N 0.20 0.92 0.00 1.57 1.57 -0.78 -1.53 116.57 118.52 1nr4 h LYS 59 Ca 0.07 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 1nr4 h LYS 59 Cb 0.30 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1nr4 h LYS 59 CO 0.00 0.71 -0.25 -0.91 -0.57 0.00 0.00 179.45 178.43 1nr4 h ASN 60 N 0.89 0.00 0.09 0.86 2.35 -0.90 -2.17 115.58 116.70 1nr4 h ASN 60 Ca 0.23 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.77 1nr4 h ASN 60 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1nr4 h ASN 60 CO -0.03 0.25 -0.76 0.00 -1.65 0.00 0.00 177.43 175.24 1nr4 h ALA 61 N 1.75 0.46 -0.72 -0.83 0.00 -0.74 -1.51 119.26 117.67 1nr4 h ALA 61 Ca -0.00 -0.61 0.02 0.00 0.00 0.00 0.00 54.91 54.32 1nr4 h ALA 61 Cb 0.47 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1nr4 h ALA 61 CO 0.03 0.73 0.46 0.28 0.00 0.00 0.00 179.25 180.75 1nr4 h VAL 62 N 0.38 1.13 -0.74 0.00 2.07 -1.02 -1.85 116.25 116.22 1nr4 h VAL 62 Ca -0.04 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.17 1nr4 h VAL 62 Cb 1.36 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 1nr4 h VAL 62 CO 0.14 0.17 0.49 0.11 0.02 0.00 0.00 177.57 178.50 1nr4 h LYS 63 N 0.91 0.98 -0.07 1.57 1.57 -1.19 0.14 116.57 120.49 1nr4 h LYS 63 Ca 0.28 -0.06 0.04 0.00 -1.87 0.00 0.00 60.65 59.04 1nr4 h LYS 63 Cb -0.03 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 32.01 1nr4 h LYS 63 CO -0.09 0.65 -0.26 -0.92 -0.57 0.00 0.00 179.45 178.26 1nr4 h TYR 64 N 1.01 -0.71 -0.21 -1.35 3.20 -0.98 -0.85 116.97 117.08 1nr4 h TYR 64 Ca 0.27 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.12 1nr4 h TYR 64 Cb -0.11 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 1nr4 h TYR 64 CO -0.02 -0.35 -0.09 -0.07 -1.64 0.00 0.00 178.16 175.99 1nr4 h LEU 65 N -0.37 0.30 -0.75 2.82 3.38 -0.66 -0.75 115.31 119.28 1nr4 h LEU 65 Ca 0.08 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1nr4 h LEU 65 Cb 0.49 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1nr4 h LEU 65 CO -0.28 0.43 -0.13 1.56 0.09 0.00 0.00 178.44 180.12 1nr4 h GLN 66 N 0.31 0.82 0.00 1.13 4.20 -0.28 -2.79 115.11 118.50 1nr4 h GLN 66 Ca 0.06 -0.28 -0.17 0.00 0.06 0.00 0.00 58.65 58.32 1nr4 h GLN 66 Cb 0.36 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1nr4 h GLN 66 CO 0.02 0.90 -0.81 0.77 -0.67 0.00 0.00 178.83 179.04 1nr4 h SER 67 N 0.73 0.00 -0.43 1.46 0.02 -0.70 -3.09 113.55 111.55 1nr4 h SER 67 Ca 0.12 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.95 1nr4 h SER 67 Cb 0.62 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 1nr4 h SER 67 CO 0.04 0.81 -0.20 0.25 -1.14 0.00 0.00 176.83 176.59 1nr4 h LEU 68 N 0.00 0.95 0.00 5.07 5.85 -1.02 -3.51 115.31 122.65 1nr4 h LEU 68 Ca -0.01 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1nr4 h LEU 68 Cb 1.53 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1nr4 h LEU 68 CO 0.11 1.11 0.00 1.21 -0.34 0.00 0.00 178.44 180.53