#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jn7 s SER 2 N 0.00 3.90 -1.28 3.17 0.01 -1.26 -3.60 113.70 114.65 2jn7 s SER 2 Ca 0.00 2.13 -0.02 0.00 1.31 0.00 0.00 55.95 59.37 2jn7 s SER 2 Cb 0.00 -2.56 -0.00 0.00 0.21 0.00 0.00 66.02 63.67 2jn7 s SER 2 CO 0.00 -2.45 0.73 0.59 0.41 0.00 0.00 173.24 172.52 2jn7 n ASN 3 N -3.43 -1.73 -4.70 2.44 3.02 -1.26 -4.86 115.26 104.74 2jn7 n ASN 3 Ca 0.11 -0.82 -0.43 0.00 -0.03 0.00 0.00 54.58 53.41 2jn7 n ASN 3 Cb 0.52 -4.13 -0.03 0.00 -0.61 0.00 0.00 39.78 35.53 2jn7 n ASN 3 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2jn7 n THR 4 N -4.21 0.06 -4.08 3.41 -1.04 -1.24 -4.99 114.28 102.19 2jn7 n THR 4 Ca -0.28 -0.01 -0.21 0.00 -2.04 0.00 0.00 64.05 61.51 2jn7 n THR 4 Cb 0.67 -1.87 -0.17 0.00 -1.82 0.00 0.00 70.33 67.14 2jn7 n THR 4 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2jn7 s THR 5 N 1.35 0.58 0.06 12.58 2.01 -1.26 -5.07 115.64 125.89 2jn7 s THR 5 Ca 0.77 -0.11 -0.16 0.00 0.31 0.00 0.00 61.69 62.51 2jn7 s THR 5 Cb -0.56 -0.63 -0.06 0.00 0.01 0.00 0.00 72.50 71.27 2jn7 s THR 5 CO 0.35 0.25 1.26 -0.50 -0.69 0.00 0.00 174.62 175.29 2jn7 h TRP 6 N 7.50 -0.78 -1.83 4.92 6.55 -1.93 -3.43 115.95 126.95 2jn7 h TRP 6 Ca -0.33 0.03 -0.17 0.00 0.95 0.00 0.00 58.89 59.37 2jn7 h TRP 6 Cb 1.15 0.35 0.10 0.00 -0.86 0.00 0.00 29.16 29.91 2jn7 h TRP 6 CO 0.49 -0.26 -0.09 0.41 -1.05 0.00 0.00 178.44 177.95 2jn7 n GLY 7 N -1.20 -2.81 3.69 1.49 0.00 -1.26 -4.87 105.19 100.22 2jn7 n GLY 7 Ca -0.03 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.68 2jn7 n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jn7 n LEU 8 N 0.00 4.20 -4.67 0.99 4.77 -1.26 -4.87 117.00 116.16 2jn7 n LEU 8 Ca 0.07 1.01 -0.42 0.00 -0.03 0.00 0.00 56.01 56.64 2jn7 n LEU 8 Cb 0.29 -1.48 -0.03 0.00 -2.33 0.00 0.00 43.42 39.87 2jn7 n LEU 8 CO 0.19 -0.94 1.42 -1.10 -1.33 0.00 0.00 177.39 175.62 2jn7 s GLN 9 N -2.46 4.18 -0.13 3.23 1.11 -1.26 -4.86 119.66 119.46 2jn7 s GLN 9 Ca 0.67 2.36 -0.10 0.00 0.01 0.00 0.00 55.36 58.29 2jn7 s GLN 9 Cb -0.47 -3.88 0.04 0.00 -1.01 0.00 0.00 33.01 27.69 2jn7 s GLN 9 CO 0.54 -0.83 0.33 -0.98 0.01 0.00 0.00 175.29 174.36 2jn7 s ARG 10 N 3.60 0.37 0.09 2.91 1.70 -1.26 -5.05 118.95 121.30 2jn7 s ARG 10 Ca 0.78 0.52 -0.16 0.00 -0.47 0.00 0.00 55.73 56.40 2jn7 s ARG 10 Cb -0.38 0.12 -0.10 0.00 -0.57 0.00 0.00 34.95 34.01 2jn7 s ARG 10 CO 0.34 -0.08 1.39 0.38 -1.08 0.00 0.00 175.30 176.25 2jn7 h ASP 11 N 6.04 0.70 -3.39 -2.89 2.03 -2.00 -3.44 116.42 113.46 2jn7 h ASP 11 Ca -0.30 -0.49 -0.54 0.00 -0.73 0.00 0.00 57.03 54.98 2jn7 h ASP 11 Cb 1.18 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 39.47 2jn7 h ASP 11 CO 0.31 1.05 0.41 0.27 -1.03 0.00 0.00 179.24 180.24 2jn7 s ILE 12 N -4.28 4.64 -0.00 4.15 -4.36 -1.26 -4.98 121.20 115.11 2jn7 s ILE 12 Ca -0.13 1.94 -0.12 0.00 -0.26 0.00 0.00 60.65 62.08 2jn7 s ILE 12 Cb 0.08 -4.24 -0.33 0.00 1.25 0.00 0.00 42.46 39.22 2jn7 s ILE 12 CO 0.82 0.17 0.86 0.74 0.24 0.00 0.00 174.94 177.78 2jn7 h THR 13 N 4.62 1.15 0.00 8.37 2.02 -2.03 -3.33 112.91 123.71 2jn7 h THR 13 Ca -0.41 -2.66 0.00 0.00 0.77 0.00 0.00 66.41 64.10 2jn7 h THR 13 Cb 1.22 2.90 0.00 0.00 -1.74 0.00 0.00 68.15 70.53 2jn7 h THR 13 CO 0.76 0.84 0.00 -2.65 0.37 0.00 0.00 175.52 174.83 2jn7 n PRO 14 N -3.63 0.00 -2.75 6.66 -0.02 -1.26 -1.66 135.00 132.34 2jn7 n PRO 14 Ca -0.19 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.24 2jn7 n PRO 14 Cb 1.08 -0.96 0.04 0.00 -0.02 0.00 0.00 33.50 33.64 2jn7 n PRO 14 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2jn7 n ARG 15 N -0.19 1.52 -1.31 -0.52 0.63 -1.25 -5.05 116.66 110.48 2jn7 n ARG 15 Ca 0.00 -3.42 -0.40 0.00 -0.92 0.00 0.00 57.85 53.11 2jn7 n ARG 15 Cb 0.00 -1.47 0.01 0.00 0.45 0.00 0.00 32.46 31.45 2jn7 n ARG 15 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 2jn7 n LEU 16 N -0.38 -2.45 -4.68 6.15 -0.00 -0.66 -5.00 117.00 109.98 2jn7 n LEU 16 Ca 0.08 0.74 -0.31 0.00 -0.00 0.00 0.00 56.01 56.53 2jn7 n LEU 16 Cb 0.81 -0.93 -0.07 0.00 -0.00 0.00 0.00 43.42 43.23 2jn7 n LEU 16 CO 0.16 -4.18 -0.22 -0.83 -0.00 0.00 0.00 177.39 172.31 2jn7 s GLY 17 N -1.02 2.95 -0.11 1.47 0.00 -1.26 -4.54 107.32 104.80 2jn7 s GLY 17 Ca 0.60 -0.52 -0.27 0.00 0.00 0.00 0.00 44.72 44.53 2jn7 s GLY 17 CO 0.63 -2.05 0.64 0.00 0.00 0.00 0.00 173.10 172.31 2jn7 s ALA 18 N -3.02 -1.62 -0.27 3.20 0.00 -1.23 -4.26 121.76 114.56 2jn7 s ALA 18 Ca 0.10 1.41 -0.10 0.00 0.00 0.00 0.00 51.96 53.36 2jn7 s ALA 18 Cb 0.01 -0.36 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 2jn7 s ALA 18 CO 0.07 -0.34 0.17 1.03 0.00 0.00 0.00 175.76 176.69 2jn7 s ARG 19 N -0.68 3.92 -0.05 0.00 0.52 -1.25 -4.28 118.95 117.14 2jn7 s ARG 19 Ca -0.07 -0.34 0.02 0.00 -0.52 0.00 0.00 55.73 54.82 2jn7 s ARG 19 Cb -0.02 -3.59 0.01 0.00 0.52 0.00 0.00 34.95 31.87 2jn7 s ARG 19 CO 0.06 -0.15 -0.09 -0.51 0.02 0.00 0.00 175.30 174.63 2jn7 s LEU 20 N 1.65 1.60 -0.01 2.53 1.43 -1.23 -4.62 118.68 120.03 2jn7 s LEU 20 Ca 0.07 -0.22 0.08 0.00 -1.03 0.00 0.00 54.13 53.03 2jn7 s LEU 20 Cb -0.16 -0.64 -0.02 0.00 0.03 0.00 0.00 46.19 45.40 2jn7 s LEU 20 CO 0.09 0.02 -0.26 -0.69 0.23 0.00 0.00 176.35 175.75 2jn7 s VAL 21 N 0.57 2.10 0.14 -1.59 1.01 -1.26 -3.11 120.40 118.26 2jn7 s VAL 21 Ca -0.10 -1.16 -0.30 0.00 0.00 0.00 0.00 61.98 60.41 2jn7 s VAL 21 Cb -0.13 -1.74 -0.08 0.00 0.00 0.00 0.00 36.38 34.43 2jn7 s VAL 21 CO 0.02 0.53 1.27 -1.58 0.00 0.00 0.00 175.10 175.34 2jn7 s GLN 22 N -0.75 4.41 -0.29 2.72 0.74 -1.00 -4.20 119.66 121.29 2jn7 s GLN 22 Ca 0.10 1.94 0.02 0.00 0.05 0.00 0.00 55.36 57.47 2jn7 s GLN 22 Cb -0.10 -3.26 0.18 0.00 1.10 0.00 0.00 33.01 30.93 2jn7 s GLN 22 CO -0.00 -0.26 0.54 -2.00 -0.55 0.00 0.00 175.29 173.01 2jn7 s GLU 23 N 0.49 0.51 1.93 1.67 -6.30 -1.25 -5.05 118.70 110.71 2jn7 s GLU 23 Ca 0.58 0.66 0.00 0.00 -2.50 0.00 0.00 54.97 53.71 2jn7 s GLU 23 Cb -0.34 0.19 0.00 0.00 0.00 0.00 0.00 34.13 33.98 2jn7 s GLU 23 CO 0.33 -0.83 0.00 0.41 0.02 0.00 0.00 175.26 175.19 2jn7 n GLY 24 N 5.41 -0.98 1.23 -1.50 0.00 -1.26 -3.38 105.19 104.71 2jn7 n GLY 24 Ca 0.01 -1.15 -0.05 0.00 0.00 0.00 0.00 46.02 44.83 2jn7 n GLY 24 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2jn7 n ASN 25 N -1.21 3.06 -3.78 1.61 0.23 -1.26 -4.78 115.26 109.13 2jn7 n ASN 25 Ca 0.00 -2.34 -0.13 0.00 -0.53 0.00 0.00 54.58 51.58 2jn7 n ASN 25 Cb 0.00 -0.57 -0.10 0.00 -2.08 0.00 0.00 39.78 37.03 2jn7 n ASN 25 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jn7 s GLN 26 N -0.79 0.45 -0.16 -3.83 -2.07 -1.22 -5.08 119.66 106.96 2jn7 s GLN 26 Ca 0.13 0.16 -0.14 0.00 -1.82 0.00 0.00 55.36 53.69 2jn7 s GLN 26 Cb 0.10 0.21 -0.05 0.00 -1.09 0.00 0.00 33.01 32.19 2jn7 s GLN 26 CO 0.03 -0.09 0.28 -0.51 -1.32 0.00 0.00 175.29 173.68 2jn7 s LEU 27 N -0.42 4.24 -0.34 2.60 1.02 -1.26 -3.74 118.68 120.78 2jn7 s LEU 27 Ca -0.05 0.49 -0.24 0.00 0.02 0.00 0.00 54.13 54.34 2jn7 s LEU 27 Cb -0.04 -2.35 0.01 0.00 0.02 0.00 0.00 46.19 43.83 2jn7 s LEU 27 CO 0.02 0.11 0.83 -2.28 0.02 0.00 0.00 176.35 175.04 2jn7 s HIS 28 N 0.45 3.15 -0.44 0.29 2.46 -1.26 -5.02 115.29 114.93 2jn7 s HIS 28 Ca 0.16 0.76 -0.18 0.00 0.47 0.00 0.00 55.06 56.27 2jn7 s HIS 28 Cb -0.13 -3.38 0.03 0.00 -0.13 0.00 0.00 32.58 28.97 2jn7 s HIS 28 CO 0.03 -0.68 0.47 -0.47 -2.47 0.00 0.00 174.74 171.63 2jn7 s TYR 29 N 3.14 3.16 -0.33 3.88 5.04 -1.26 -4.57 117.35 126.40 2jn7 s TYR 29 Ca 0.34 -0.42 -0.18 0.00 -2.44 0.00 0.00 57.07 54.37 2jn7 s TYR 29 Cb -0.13 -3.02 -0.01 0.00 0.35 0.00 0.00 41.96 39.15 2jn7 s TYR 29 CO 0.15 -0.76 0.49 -0.51 -1.34 0.00 0.00 175.55 173.58 2jn7 s LEU 30 N 2.20 4.30 0.24 6.97 2.01 -1.26 -4.95 118.68 128.18 2jn7 s LEU 30 Ca 0.12 0.03 -0.04 0.00 0.01 0.00 0.00 54.13 54.26 2jn7 s LEU 30 Cb -0.18 -2.56 0.27 0.00 0.01 0.00 0.00 46.19 43.74 2jn7 s LEU 30 CO 0.13 -0.42 1.75 0.00 1.01 0.00 0.00 176.35 178.81 2jn7 h ALA 31 N 8.39 1.06 0.00 4.21 0.00 -1.98 -2.13 119.26 128.82 2jn7 h ALA 31 Ca -0.28 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2jn7 h ALA 31 Cb 1.13 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2jn7 h ALA 31 CO 0.75 0.60 0.00 -0.25 0.00 0.00 0.00 179.25 180.35 2jn7 n ASP 32 N -4.22 0.00 -3.50 0.00 8.00 -1.26 -3.49 116.55 112.08 2jn7 n ASP 32 Ca 0.03 0.45 -0.32 0.00 0.71 0.00 0.00 54.79 55.67 2jn7 n ASP 32 Cb 0.29 -0.47 -0.04 0.00 -0.02 0.00 0.00 41.12 40.87 2jn7 n ASP 32 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jn7 n ARG 33 N -1.47 3.37 -3.76 -1.24 3.00 -0.80 -4.97 116.66 110.79 2jn7 n ARG 33 Ca 0.02 -4.68 -0.02 0.00 -0.01 0.00 0.00 57.85 53.17 2jn7 n ARG 33 Cb 0.10 -2.34 -0.00 0.00 0.00 0.00 0.00 32.46 30.22 2jn7 n ARG 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jn7 s ALA 34 N -2.88 -1.82 -0.00 7.54 0.00 -1.23 -3.80 121.76 119.56 2jn7 s ALA 34 Ca 0.39 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.51 2jn7 s ALA 34 Cb 0.15 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.88 2jn7 s ALA 34 CO -0.01 -1.06 0.00 -1.12 0.00 0.00 0.00 175.76 173.57 2jn7 s SER 35 N -3.09 0.04 0.08 0.00 0.01 -1.26 -4.87 113.70 104.61 2jn7 s SER 35 Ca 0.16 0.00 -0.10 0.00 1.31 0.00 0.00 55.95 57.32 2jn7 s SER 35 Cb -0.00 -0.02 -0.06 0.00 0.21 0.00 0.00 66.02 66.16 2jn7 s SER 35 CO 0.01 -0.02 0.41 -0.51 0.41 0.00 0.00 173.24 173.55 2jn7 s ILE 36 N 0.18 5.07 0.06 1.44 1.10 -1.26 -4.86 121.20 122.93 2jn7 s ILE 36 Ca -0.01 0.49 0.05 0.00 -0.51 0.00 0.00 60.65 60.67 2jn7 s ILE 36 Cb -0.02 -3.65 -0.03 0.00 0.15 0.00 0.00 42.46 38.91 2jn7 s ILE 36 CO -0.00 0.29 -0.15 0.42 -2.11 0.00 0.00 174.94 173.39 2jn7 s THR 37 N -1.40 1.18 0.00 4.00 -4.23 -1.26 -5.07 115.64 108.87 2jn7 s THR 37 Ca 0.33 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.64 2jn7 s THR 37 Cb -0.14 -1.10 0.00 0.00 1.34 0.00 0.00 72.50 72.60 2jn7 s THR 37 CO 0.18 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.77 2jn7 n GLY 38 N 1.53 -0.12 2.72 3.99 0.00 -1.26 -4.76 105.19 107.29 2jn7 n GLY 38 Ca -0.20 -1.11 -0.05 0.00 0.00 0.00 0.00 46.02 44.66 2jn7 n GLY 38 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2jn7 n LYS 39 N 3.79 0.43 -1.84 1.61 2.85 -1.26 -5.14 118.16 118.59 2jn7 n LYS 39 Ca 0.00 -1.44 -0.41 0.00 -1.05 0.00 0.00 58.31 55.41 2jn7 n LYS 39 Cb 0.00 -0.89 -0.01 0.00 -0.65 0.00 0.00 35.03 33.48 2jn7 n LYS 39 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2jn7 s PHE 40 N 0.72 2.71 0.93 5.58 0.40 -1.26 -4.98 117.98 122.07 2jn7 s PHE 40 Ca 0.28 1.07 -0.12 0.00 -0.60 0.00 0.00 56.93 57.56 2jn7 s PHE 40 Cb 0.12 -3.99 0.15 0.00 0.51 0.00 0.00 43.02 39.81 2jn7 s PHE 40 CO -0.12 -3.04 1.10 -1.54 0.70 0.00 0.00 175.22 172.32 2jn7 s SER 41 N 0.05 3.28 0.59 1.36 1.04 -1.26 -4.63 113.70 114.13 2jn7 s SER 41 Ca 0.56 1.23 0.37 0.00 0.48 0.00 0.00 55.95 58.58 2jn7 s SER 41 Cb -0.46 -1.89 1.78 0.00 0.10 0.00 0.00 66.02 65.55 2jn7 s SER 41 CO 0.56 -2.72 2.14 0.44 0.98 0.00 0.00 173.24 174.64 2jn7 h ASP 42 N -1.61 0.00 0.39 7.02 3.32 -2.00 0.43 116.42 123.97 2jn7 h ASP 42 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 2jn7 h ASP 42 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 2jn7 h ASP 42 CO 0.58 0.02 -0.54 0.00 -1.72 0.00 0.00 179.24 177.59 2jn7 n ALA 43 N -2.12 3.66 -0.05 3.45 0.00 -1.26 -4.18 120.51 120.01 2jn7 n ALA 43 Ca -0.01 -0.40 -0.06 0.00 0.00 0.00 0.00 53.44 52.98 2jn7 n ALA 43 Cb 0.21 -1.07 -0.08 0.00 0.00 0.00 0.00 19.45 18.51 2jn7 n ALA 43 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2jn7 n GLU 44 N -1.37 2.13 -0.14 0.00 4.07 -0.45 -4.48 120.64 120.40 2jn7 n GLU 44 Ca 0.06 -0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 57.08 2jn7 n GLU 44 Cb 0.34 -1.28 0.00 0.00 -0.06 0.00 0.00 31.44 30.44 2jn7 n GLU 44 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2jn7 h PRO 46 N 0.55 -0.03 -0.38 0.00 0.11 -1.82 -2.34 132.00 128.09 2jn7 h PRO 46 Ca 0.15 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.27 2jn7 h PRO 46 Cb 0.05 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.15 2jn7 h PRO 46 CO -0.02 -0.02 0.23 -0.22 -0.21 0.00 0.00 178.00 177.76 2jn7 h LYS 47 N -0.03 0.46 -0.87 1.05 3.64 -1.77 -2.58 116.57 116.47 2jn7 h LYS 47 Ca 0.02 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2jn7 h LYS 47 Cb 0.05 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 2jn7 h LYS 47 CO -0.04 0.31 0.54 1.25 -2.27 0.00 0.00 179.45 179.23 2jn7 h LEU 48 N 0.48 1.04 -0.72 5.20 6.46 -1.34 0.24 115.31 126.66 2jn7 h LEU 48 Ca 0.15 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.85 2jn7 h LEU 48 Cb -0.02 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 39.65 2jn7 h LEU 48 CO -0.06 0.79 0.00 0.47 -0.62 0.00 0.00 178.44 179.02 2jn7 n ASP 49 N -4.37 0.29 -0.01 1.25 8.00 -0.89 -0.13 116.55 120.69 2jn7 n ASP 49 Ca 0.10 0.63 0.09 0.00 0.71 0.00 0.00 54.79 56.32 2jn7 n ASP 49 Cb 0.05 -0.67 -0.13 0.00 -0.02 0.00 0.00 41.12 40.35 2jn7 n ASP 49 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2jn7 n VAL 50 N -1.89 0.00 -0.01 2.53 0.31 0.02 -4.24 118.33 115.04 2jn7 n VAL 50 Ca -0.01 -0.35 -0.13 0.00 -0.01 0.00 0.00 64.34 63.85 2jn7 n VAL 50 Cb 0.03 0.24 -0.14 0.00 -0.91 0.00 0.00 33.84 33.06 2jn7 n VAL 50 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2jn7 n VAL 51 N -1.99 1.67 0.01 2.52 0.31 0.14 -4.03 118.33 116.96 2jn7 n VAL 51 Ca -0.02 -0.75 -0.12 0.00 -0.01 0.00 0.00 64.34 63.44 2jn7 n VAL 51 Cb 0.42 -1.27 -0.07 0.00 -0.91 0.00 0.00 33.84 32.01 2jn7 n VAL 51 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 2jn7 h PHE 52 N 0.02 0.04 -0.07 3.52 3.57 -0.75 -2.68 116.94 120.59 2jn7 h PHE 52 Ca -0.33 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.19 2jn7 h PHE 52 Cb 2.02 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 40.75 2jn7 h PHE 52 CO 0.03 0.16 0.07 -1.00 -2.23 0.00 0.00 178.31 175.34 2jn7 h PRO 53 N -0.09 0.00 -0.65 6.41 0.13 -1.75 -2.30 132.00 133.76 2jn7 h PRO 53 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2jn7 h PRO 53 Cb 0.14 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.24 2jn7 h PRO 53 CO -0.00 0.00 0.41 1.25 -0.23 0.00 0.00 178.00 179.43 2jn7 h HIS 54 N 0.00 0.83 -0.68 1.56 2.76 -1.61 0.35 115.15 118.36 2jn7 h HIS 54 Ca 0.03 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.15 2jn7 h HIS 54 Cb 0.18 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 28.84 2jn7 h HIS 54 CO 0.00 0.55 0.18 0.74 -1.30 0.00 0.00 177.93 178.09 2jn7 h PHE 55 N 0.88 1.14 -0.41 5.26 0.04 -1.43 -1.83 116.94 120.59 2jn7 h PHE 55 Ca 0.23 -0.13 -0.05 0.00 2.80 0.00 0.00 57.97 60.82 2jn7 h PHE 55 Cb -0.06 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 37.75 2jn7 h PHE 55 CO -0.02 0.93 0.05 0.82 -0.60 0.00 0.00 178.31 179.49 2jn7 h ILE 56 N 1.02 1.25 -0.44 -0.55 2.04 -1.34 0.85 117.51 120.34 2jn7 h ILE 56 Ca 0.22 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 65.19 2jn7 h ILE 56 Cb 0.36 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 2jn7 h ILE 56 CO 0.00 0.31 0.25 -1.28 0.00 0.00 0.00 178.15 177.43 2jn7 h SER 57 N 0.53 0.40 -0.23 1.72 0.87 -0.75 -1.21 113.55 114.89 2jn7 h SER 57 Ca 0.12 0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.52 2jn7 h SER 57 Cb 0.40 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.28 2jn7 h SER 57 CO 0.01 0.28 -0.47 -0.61 -0.53 0.00 0.00 176.83 175.51 2jn7 h GLN 58 N 0.50 0.80 -0.41 2.24 4.15 -1.21 -3.17 115.11 118.01 2jn7 h GLN 58 Ca 0.18 -0.46 -0.00 0.00 0.77 0.00 0.00 58.65 59.13 2jn7 h GLN 58 Cb 0.03 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 2jn7 h GLN 58 CO -0.09 1.09 0.24 0.82 -1.93 0.00 0.00 178.83 178.96 2jn7 h ILE 59 N 0.63 1.14 -0.88 2.39 2.04 -0.52 0.13 117.51 122.44 2jn7 h ILE 59 Ca 0.03 -0.33 0.14 0.00 1.00 0.00 0.00 64.86 65.70 2jn7 h ILE 59 Cb 1.05 0.61 -0.09 0.00 -0.74 0.00 0.00 36.82 37.65 2jn7 h ILE 59 CO 0.10 0.14 0.49 -0.33 0.00 0.00 0.00 178.15 178.55 2jn7 h GLU 60 N 0.54 0.70 0.00 2.37 5.08 -1.23 0.53 114.58 122.57 2jn7 h GLU 60 Ca 0.15 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.30 2jn7 h GLU 60 Cb 0.02 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2jn7 h GLU 60 CO -0.03 0.46 -0.78 0.66 -1.00 0.00 0.00 179.01 178.32 2jn7 h SER 61 N 0.72 0.00 -0.24 1.42 4.64 -1.42 -3.16 113.55 115.51 2jn7 h SER 61 Ca 0.47 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.77 2jn7 h SER 61 Cb 0.60 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.68 2jn7 h SER 61 CO -0.33 0.78 0.11 -0.03 -0.87 0.00 0.00 176.83 176.49 2jn7 h MET 62 N 0.00 0.42 -0.78 4.77 -1.53 0.15 0.34 114.93 118.29 2jn7 h MET 62 Ca -0.01 -0.05 -0.04 0.00 -3.44 0.00 0.00 59.70 56.17 2jn7 h MET 62 Cb 1.40 -0.08 -0.04 0.00 -0.55 0.00 0.00 31.60 32.34 2jn7 h MET 62 CO 0.10 0.36 0.35 -0.07 0.14 0.00 0.00 176.91 177.80 2jn7 h LEU 63 N 0.42 1.05 0.15 3.39 3.38 -1.31 1.29 115.31 123.69 2jn7 h LEU 63 Ca 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2jn7 h LEU 63 Cb 0.11 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2jn7 h LEU 63 CO -0.01 0.91 -0.07 0.71 0.09 0.00 0.00 178.44 180.07 2jn7 h THR 64 N 1.12 0.61 -0.42 0.22 1.35 -1.47 0.23 112.91 114.56 2jn7 h THR 64 Ca 0.27 -1.15 -0.14 0.00 -0.55 0.00 0.00 66.41 64.84 2jn7 h THR 64 Cb 0.16 1.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.63 2jn7 h THR 64 CO -0.03 0.17 -0.28 0.71 -0.25 0.00 0.00 175.52 175.85 2jn7 h THR 65 N -0.96 1.27 0.00 6.82 1.35 -0.98 -2.78 112.91 117.62 2jn7 h THR 65 Ca -0.02 -1.44 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 2jn7 h THR 65 Cb 0.44 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 2jn7 h THR 65 CO 0.03 0.49 -0.07 0.61 -0.25 0.00 0.00 175.52 176.33 2jn7 n GLY 66 N -0.06 -1.68 3.02 5.82 0.00 0.44 -4.99 105.19 107.73 2jn7 n GLY 66 Ca -0.01 -0.05 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 2jn7 n GLY 66 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jn7 n GLU 67 N -2.27 -2.22 -2.85 1.61 2.13 -0.00 -4.93 120.64 112.11 2jn7 n GLU 67 Ca 0.05 1.92 -0.38 0.00 0.66 0.00 0.00 57.16 59.42 2jn7 n GLU 67 Cb 0.43 -3.95 -0.06 0.00 0.27 0.00 0.00 31.44 28.13 2jn7 n GLU 67 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2jn7 s LEU 68 N -1.99 4.44 -0.17 4.31 2.96 -0.74 -5.02 118.68 122.46 2jn7 s LEU 68 Ca 0.16 1.78 -0.10 0.00 -0.22 0.00 0.00 54.13 55.74 2jn7 s LEU 68 Cb -0.03 -3.77 0.06 0.00 0.50 0.00 0.00 46.19 42.94 2jn7 s LEU 68 CO 0.65 0.03 0.43 0.21 -1.32 0.00 0.00 176.35 176.35 2jn7 s ASN 69 N -1.47 -0.53 -0.63 3.68 2.47 -1.26 -5.06 114.94 112.14 2jn7 s ASN 69 Ca 0.45 0.92 -0.27 0.00 0.42 0.00 0.00 52.86 54.38 2jn7 s ASN 69 Cb -0.21 0.81 0.01 0.00 -1.45 0.00 0.00 41.25 40.42 2jn7 s ASN 69 CO 0.25 -0.19 1.47 -2.16 -3.72 0.00 0.00 177.10 172.75 2jn7 s PRO 70 N 1.27 3.12 0.00 0.43 0.04 -1.26 -4.51 135.00 134.08 2jn7 s PRO 70 Ca -0.08 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.20 2jn7 s PRO 70 Cb -0.08 -4.20 0.00 0.00 0.04 0.00 0.00 34.50 30.26 2jn7 s PRO 70 CO -0.11 -2.19 0.00 2.89 0.04 0.00 0.00 177.00 177.63 2jn7 n ARG 71 N 9.03 0.00 -3.52 4.56 1.85 -1.26 -5.00 116.66 122.32 2jn7 n ARG 71 Ca 0.11 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.85 2jn7 n ARG 71 Cb 0.50 -0.34 -0.04 0.00 -1.05 0.00 0.00 32.46 31.53 2jn7 n ARG 71 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 2jn7 s HIS 72 N -1.00 -0.41 0.54 2.89 5.04 -1.26 -5.03 115.29 116.05 2jn7 s HIS 72 Ca 0.00 0.47 -0.22 0.00 -1.54 0.00 0.00 55.06 53.78 2jn7 s HIS 72 Cb 0.00 0.50 -0.05 0.00 0.04 0.00 0.00 32.58 33.06 2jn7 s HIS 72 CO 0.00 -0.51 1.32 0.00 -2.34 0.00 0.00 174.74 173.21 2jn7 s ALA 73 N -2.28 2.82 -0.29 1.58 0.00 -1.26 -4.40 121.76 117.93 2jn7 s ALA 73 Ca 0.00 1.25 0.04 0.00 0.00 0.00 0.00 51.96 53.25 2jn7 s ALA 73 Cb -0.01 -3.53 0.20 0.00 0.00 0.00 0.00 23.12 19.78 2jn7 s ALA 73 CO -0.03 -1.25 0.58 1.14 0.00 0.00 0.00 175.76 176.20 2jn7 s GLN 74 N -2.90 0.56 0.13 0.00 -2.07 -1.26 -4.81 119.66 109.29 2jn7 s GLN 74 Ca 0.71 0.67 -0.26 0.00 -1.82 0.00 0.00 55.36 54.65 2jn7 s GLN 74 Cb -0.38 0.31 -0.07 0.00 -1.09 0.00 0.00 33.01 31.78 2jn7 s GLN 74 CO 0.45 -0.92 0.82 0.00 -1.32 0.00 0.00 175.29 174.32 2jn7 s VAL 76 N -0.60 0.87 -0.28 0.00 -7.23 -0.59 -5.01 120.40 107.57 2jn7 s VAL 76 Ca 0.39 -1.44 -0.01 0.00 -1.81 0.00 0.00 61.98 59.11 2jn7 s VAL 76 Cb -0.23 -1.13 0.09 0.00 0.56 0.00 0.00 36.38 35.67 2jn7 s VAL 76 CO 0.26 -0.46 0.07 0.42 -0.31 0.00 0.00 175.10 175.09 2jn7 s THR 77 N -1.98 0.87 0.11 5.32 -4.23 -1.26 -2.96 115.64 111.51 2jn7 s THR 77 Ca 0.00 -1.20 -0.14 0.00 -1.18 0.00 0.00 61.69 59.17 2jn7 s THR 77 Cb -0.06 -1.55 -0.07 0.00 1.34 0.00 0.00 72.50 72.17 2jn7 s THR 77 CO 0.00 -0.52 0.52 -0.76 -0.54 0.00 0.00 174.62 173.33 2jn7 s LEU 78 N 1.64 4.38 -0.09 4.79 1.02 -1.24 -5.03 118.68 124.16 2jn7 s LEU 78 Ca 0.06 1.06 0.02 0.00 0.02 0.00 0.00 54.13 55.29 2jn7 s LEU 78 Cb -0.17 -3.12 0.01 0.00 0.02 0.00 0.00 46.19 42.93 2jn7 s LEU 78 CO -0.20 0.16 -0.16 -0.31 0.02 0.00 0.00 176.35 175.86 2jn7 s TYR 79 N -1.37 1.91 -0.27 0.29 1.51 -1.26 -3.46 117.35 114.69 2jn7 s TYR 79 Ca 0.35 -0.82 -0.25 0.00 -1.01 0.00 0.00 57.07 55.34 2jn7 s TYR 79 Cb -0.16 -1.36 0.09 0.00 -0.11 0.00 0.00 41.96 40.42 2jn7 s TYR 79 CO 0.18 -0.40 0.84 -1.58 -1.11 0.00 0.00 175.55 173.48 2jn7 s HIS 80 N 0.76 -0.68 -1.31 2.71 2.46 -0.84 -4.92 115.29 113.48 2jn7 s HIS 80 Ca -0.11 1.64 0.00 0.00 0.47 0.00 0.00 55.06 57.06 2jn7 s HIS 80 Cb -0.16 0.31 0.00 0.00 -0.13 0.00 0.00 32.58 32.61 2jn7 s HIS 80 CO 0.02 -0.33 0.00 0.09 -2.47 0.00 0.00 174.74 172.05 2jn7 n ASN 81 N 2.56 -4.07 0.00 9.88 5.03 -1.26 -0.82 115.26 126.58 2jn7 n ASN 81 Ca -0.14 0.23 0.00 0.00 0.87 0.00 0.00 54.58 55.54 2jn7 n ASN 81 Cb 0.55 -3.56 0.00 0.00 -1.02 0.00 0.00 39.78 35.76 2jn7 n ASN 81 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jn7 n GLY 82 N -0.62 2.62 3.78 7.41 0.00 -1.26 -4.99 105.19 112.13 2jn7 n GLY 82 Ca -0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 2jn7 n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jn7 s PHE 83 N -0.41 2.75 -0.07 1.61 0.08 -0.00 -4.79 117.98 117.15 2jn7 s PHE 83 Ca 0.00 1.55 -0.01 0.00 0.12 0.00 0.00 56.93 58.58 2jn7 s PHE 83 Cb 0.00 -3.29 0.03 0.00 -0.57 0.00 0.00 43.02 39.19 2jn7 s PHE 83 CO 0.00 -1.48 0.00 0.99 -0.10 0.00 0.00 175.22 174.63 2jn7 s THR 84 N -1.73 0.36 -0.09 0.64 2.01 -1.26 -1.98 115.64 113.59 2jn7 s THR 84 Ca 0.70 0.12 -0.02 0.00 0.31 0.00 0.00 61.69 62.80 2jn7 s THR 84 Cb -0.24 -0.51 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 2jn7 s THR 84 CO 0.28 0.25 -0.00 0.00 -0.69 0.00 0.00 174.62 174.46 2jn7 s GLU 86 N -0.84 3.11 0.01 0.00 2.12 -1.07 -3.60 118.70 118.44 2jn7 s GLU 86 Ca 0.13 -0.35 -0.07 0.00 0.36 0.00 0.00 54.97 55.04 2jn7 s GLU 86 Cb -0.11 -2.91 0.00 0.00 0.26 0.00 0.00 34.13 31.37 2jn7 s GLU 86 CO 0.02 0.72 0.14 0.00 -0.54 0.00 0.00 175.26 175.60 2jn7 s ALA 87 N -0.97 -0.30 -0.28 6.30 0.00 -1.15 -2.15 121.76 123.21 2jn7 s ALA 87 Ca 0.15 -0.21 -0.25 0.00 0.00 0.00 0.00 51.96 51.66 2jn7 s ALA 87 Cb -0.12 0.15 0.11 0.00 0.00 0.00 0.00 23.12 23.27 2jn7 s ALA 87 CO 0.04 -0.24 0.97 0.34 0.00 0.00 0.00 175.76 176.87 2jn7 s ASP 88 N -1.58 -0.51 0.48 0.00 -1.08 -1.22 -1.54 116.67 111.23 2jn7 s ASP 88 Ca -0.12 0.98 0.27 0.00 -0.52 0.00 0.00 52.55 53.15 2jn7 s ASP 88 Cb -0.06 0.99 0.72 0.00 -1.46 0.00 0.00 42.92 43.12 2jn7 s ASP 88 CO 0.00 -0.17 1.75 0.74 0.52 0.00 0.00 175.17 178.01 2jn7 h THR 89 N 3.70 0.01 -0.04 1.71 2.02 -1.86 -3.33 112.91 115.12 2jn7 h THR 89 Ca -0.28 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.06 2jn7 h THR 89 Cb 1.17 1.82 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 2jn7 h THR 89 CO 0.10 0.00 -0.01 0.18 0.37 0.00 0.00 175.52 176.16 2jn7 n LEU 90 N -3.10 0.78 -0.09 2.58 4.77 -1.26 -0.98 117.00 119.70 2jn7 n LEU 90 Ca 0.03 0.02 -0.01 0.00 -0.03 0.00 0.00 56.01 56.01 2jn7 n LEU 90 Cb 0.45 -2.25 -0.01 0.00 -2.33 0.00 0.00 43.42 39.28 2jn7 n LEU 90 CO 0.31 -0.87 -0.01 0.61 -1.33 0.00 0.00 177.39 176.10 2jn7 n GLY 91 N 0.42 0.50 0.00 -0.72 0.00 -1.26 -4.66 105.19 99.46 2jn7 n GLY 91 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2jn7 n GLY 91 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jn7 n SER 92 N 0.38 0.00 -3.15 1.61 3.41 -0.15 -4.72 113.62 111.00 2jn7 n SER 92 Ca -0.01 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.65 2jn7 n SER 92 Cb 0.10 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.03 2jn7 n SER 92 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jn7 n GLY 94 N 5.40 2.78 3.50 0.00 0.00 -1.26 -4.98 105.19 110.62 2jn7 n GLY 94 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 2jn7 n GLY 94 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jn7 s TYR 95 N -2.94 2.71 -0.02 1.61 2.02 -1.26 -2.36 117.35 117.11 2jn7 s TYR 95 Ca 0.00 -0.15 0.02 0.00 -0.37 0.00 0.00 57.07 56.57 2jn7 s TYR 95 Cb 0.00 -1.59 0.00 0.00 -0.40 0.00 0.00 41.96 39.97 2jn7 s TYR 95 CO 0.00 0.24 -0.07 0.08 -1.57 0.00 0.00 175.55 174.23 2jn7 s VAL 96 N -0.83 0.58 -0.02 0.71 1.01 -1.18 -4.75 120.40 115.92 2jn7 s VAL 96 Ca 0.13 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.90 2jn7 s VAL 96 Cb -0.11 -0.52 -0.01 0.00 0.00 0.00 0.00 36.38 35.74 2jn7 s VAL 96 CO 0.03 0.19 -0.18 -0.31 0.00 0.00 0.00 175.10 174.82 2jn7 s TYR 97 N 0.16 1.70 0.16 5.22 1.51 -1.25 -3.58 117.35 121.26 2jn7 s TYR 97 Ca -0.02 -0.37 0.00 0.00 -1.01 0.00 0.00 57.07 55.67 2jn7 s TYR 97 Cb -0.07 -1.11 -0.04 0.00 -0.11 0.00 0.00 41.96 40.63 2jn7 s TYR 97 CO -0.00 -0.07 0.03 0.96 -1.11 0.00 0.00 175.55 175.36 2jn7 s ILE 98 N -0.30 0.38 -0.24 2.71 -4.36 -1.26 -3.42 121.20 114.72 2jn7 s ILE 98 Ca 0.04 -1.95 -0.02 0.00 -0.26 0.00 0.00 60.65 58.46 2jn7 s ILE 98 Cb -0.09 -2.11 0.13 0.00 1.25 0.00 0.00 42.46 41.64 2jn7 s ILE 98 CO 0.00 -0.44 0.35 0.00 0.24 0.00 0.00 174.94 175.08 2jn7 s ALA 99 N -3.86 -0.90 0.02 2.27 0.00 -0.91 -3.56 121.76 114.82 2jn7 s ALA 99 Ca 0.25 0.65 -0.17 0.00 0.00 0.00 0.00 51.96 52.69 2jn7 s ALA 99 Cb 0.07 -1.65 -0.06 0.00 0.00 0.00 0.00 23.12 21.48 2jn7 s ALA 99 CO 0.03 -1.32 0.47 0.54 0.00 0.00 0.00 175.76 175.48 2jn7 s VAL 100 N 2.49 4.93 -0.12 0.00 0.11 -1.26 -2.58 120.40 123.97 2jn7 s VAL 100 Ca 0.11 0.99 -0.06 0.00 -2.93 0.00 0.00 61.98 60.09 2jn7 s VAL 100 Cb -0.15 -3.79 0.05 0.00 -1.53 0.00 0.00 36.38 30.96 2jn7 s VAL 100 CO -0.17 0.55 0.28 -0.47 -3.33 0.00 0.00 175.10 171.96 2jn7 s TYR 101 N -0.98 -0.39 0.38 1.54 5.04 -1.26 -4.79 117.35 116.89 2jn7 s TYR 101 Ca 0.26 0.90 -0.26 0.00 -2.44 0.00 0.00 57.07 55.53 2jn7 s TYR 101 Cb -0.18 0.09 -0.09 0.00 0.35 0.00 0.00 41.96 42.13 2jn7 s TYR 101 CO 0.15 -0.26 1.16 -1.25 -1.34 0.00 0.00 175.55 174.00 2jn7 s PRO 102 N 1.37 4.16 0.25 4.97 0.04 -1.26 -4.47 135.00 140.05 2jn7 s PRO 102 Ca -0.09 1.82 -0.16 0.00 0.04 0.00 0.00 61.00 62.62 2jn7 s PRO 102 Cb -0.10 -2.75 -0.08 0.00 0.04 0.00 0.00 34.50 31.61 2jn7 s PRO 102 CO -0.09 -0.22 0.67 -0.08 0.04 0.00 0.00 177.00 177.32 2jn7 s THR 103 N -1.39 4.71 -0.37 1.26 -1.32 -1.26 -5.01 115.64 112.26 2jn7 s THR 103 Ca 0.55 0.97 -0.29 0.00 -1.21 0.00 0.00 61.69 61.71 2jn7 s THR 103 Cb -0.30 -3.71 -0.00 0.00 -1.51 0.00 0.00 72.50 66.97 2jn7 s THR 103 CO 0.38 0.03 1.55 -1.10 -2.21 0.00 0.00 174.62 173.28 2jn7 s GLN 104 N -2.46 3.51 0.00 7.08 -0.21 -1.26 -5.05 119.66 121.27 2jn7 s GLN 104 Ca 0.47 1.15 0.00 0.00 0.02 0.00 0.00 55.36 57.00 2jn7 s GLN 104 Cb -0.13 -4.08 0.00 0.00 1.00 0.00 0.00 33.01 29.80 2jn7 s GLN 104 CO 0.19 -1.64 0.00 -2.13 -2.12 0.00 0.00 175.29 169.59