#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jng h ARG 5 N 0.00 0.36 -0.38 3.17 9.65 -1.98 -2.42 114.38 122.78 2jng h ARG 5 Ca 0.00 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 58.77 2jng h ARG 5 Cb 0.00 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.54 2jng h ARG 5 CO 0.00 0.53 0.00 0.43 2.80 0.00 0.00 179.97 183.73 2jng n SER 6 N -4.19 0.39 0.25 -3.80 7.64 -1.26 -3.88 113.62 108.76 2jng n SER 6 Ca -0.00 -2.00 0.11 0.00 1.01 0.00 0.00 58.87 57.99 2jng n SER 6 Cb 0.33 -0.19 0.67 0.00 -1.01 0.00 0.00 64.21 64.01 2jng n SER 6 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2jng h GLU 7 N 0.01 0.00 -7.65 1.43 4.81 -1.76 -3.38 114.58 108.04 2jng h GLU 7 Ca 0.00 0.00 -0.45 0.00 -0.13 0.00 0.00 59.36 58.78 2jng h GLU 7 Cb 0.19 0.00 0.13 0.00 0.63 0.00 0.00 28.75 29.70 2jng h GLU 7 CO 0.00 0.14 0.37 -0.06 -0.73 0.00 0.00 179.01 178.73 2jng s PHE 8 N -4.24 1.99 0.25 0.92 0.40 -1.25 -4.92 117.98 111.12 2jng s PHE 8 Ca -0.03 0.35 -0.06 0.00 -0.60 0.00 0.00 56.93 56.59 2jng s PHE 8 Cb 0.13 -3.78 0.46 0.00 0.51 0.00 0.00 43.02 40.35 2jng s PHE 8 CO 0.61 -2.25 1.65 0.00 0.70 0.00 0.00 175.22 175.94 2jng h ALA 9 N -1.29 0.87 0.00 5.36 0.00 -1.95 -2.29 119.26 119.95 2jng h ALA 9 Ca -0.44 0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2jng h ALA 9 Cb 1.27 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2jng h ALA 9 CO 0.46 -0.40 -0.07 0.43 0.00 0.00 0.00 179.25 179.67 2jng n SER 10 N -5.27 1.30 0.00 0.00 7.64 -1.26 -5.02 113.62 111.01 2jng n SER 10 Ca 0.14 -2.01 0.00 0.00 1.01 0.00 0.00 58.87 58.01 2jng n SER 10 Cb 0.48 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2jng n SER 10 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jng n GLY 11 N -0.52 1.38 0.34 0.23 0.00 -0.87 -4.34 105.19 101.42 2jng n GLY 11 Ca 0.04 -0.02 0.18 0.00 0.00 0.00 0.00 46.02 46.22 2jng n GLY 11 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2jng h ASN 12 N 0.00 0.00 -0.79 1.61 -1.07 -1.90 -1.94 115.58 111.48 2jng h ASN 12 Ca 0.00 0.00 0.22 0.00 0.07 0.00 0.00 56.30 56.59 2jng h ASN 12 Cb 0.00 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.21 2jng h ASN 12 CO 0.00 0.00 0.56 0.74 0.07 0.00 0.00 177.43 178.80 2jng h THR 13 N 0.00 0.63 0.02 6.14 2.02 -1.93 0.28 112.91 120.07 2jng h THR 13 Ca 0.06 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 2jng h THR 13 Cb 0.43 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 2jng h THR 13 CO -0.00 0.01 -0.01 0.22 0.37 0.00 0.00 175.52 176.11 2jng h TYR 14 N 0.08 -0.03 -0.18 3.16 3.20 -1.66 0.30 116.97 121.84 2jng h TYR 14 Ca 0.38 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.26 2jng h TYR 14 Cb 1.41 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.68 2jng h TYR 14 CO -0.00 0.24 0.12 0.00 -1.64 0.00 0.00 178.16 176.88 2jng h ALA 15 N 0.68 1.92 -0.24 1.82 0.00 -1.05 -0.42 119.26 121.97 2jng h ALA 15 Ca -0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2jng h ALA 15 Cb 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2jng h ALA 15 CO 0.00 0.06 -0.41 1.25 0.00 0.00 0.00 179.25 180.15 2jng h LEU 16 N 0.20 0.62 -0.07 0.00 5.85 -0.15 -1.76 115.31 119.99 2jng h LEU 16 Ca 0.07 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 2jng h LEU 16 Cb 0.04 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 2jng h LEU 16 CO -0.01 0.95 0.00 0.22 -0.34 0.00 0.00 178.44 179.26 2jng h TYR 17 N 0.47 0.13 -0.59 1.25 3.20 0.73 0.14 116.97 122.30 2jng h TYR 17 Ca 0.04 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2jng h TYR 17 Cb 0.92 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.13 2jng h TYR 17 CO 0.04 0.37 0.24 -0.39 -1.64 0.00 0.00 178.16 176.79 2jng h VAL 18 N -0.15 1.23 -0.86 1.81 -1.51 -1.43 -2.54 116.25 112.79 2jng h VAL 18 Ca 0.02 -0.69 0.05 0.00 -1.23 0.00 0.00 66.70 64.85 2jng h VAL 18 Cb 0.32 0.57 -0.06 0.00 -2.13 0.00 0.00 31.29 30.00 2jng h VAL 18 CO 0.00 0.27 0.55 -0.09 -1.23 0.00 0.00 177.57 177.07 2jng h ARG 19 N 0.82 1.00 -0.64 5.19 2.43 -1.18 0.09 114.38 122.08 2jng h ARG 19 Ca 0.20 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.39 2jng h ARG 19 Cb 0.19 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 2jng h ARG 19 CO -0.02 0.66 0.43 0.22 -1.51 0.00 0.00 179.97 179.75 2jng h ASP 20 N 1.03 0.48 -0.01 -3.80 3.58 -0.29 -2.42 116.42 115.00 2jng h ASP 20 Ca 0.36 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.82 2jng h ASP 20 Cb 0.09 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.04 2jng h ASP 20 CO -0.14 0.30 -0.15 0.41 -2.88 0.00 0.00 179.24 176.77 2jng n THR 21 N -4.48 0.00 -2.60 2.25 -1.04 -0.92 -4.86 114.28 102.63 2jng n THR 21 Ca 0.10 -0.42 -0.41 0.00 -2.04 0.00 0.00 64.05 61.27 2jng n THR 21 Cb 0.31 1.19 -0.03 0.00 -1.82 0.00 0.00 70.33 69.98 2jng n THR 21 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2jng s LEU 22 N -1.48 3.36 0.42 -4.42 1.43 -0.03 -4.99 118.68 112.97 2jng s LEU 22 Ca 0.12 -0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 2jng s LEU 22 Cb 0.10 -2.54 -0.02 0.00 0.03 0.00 0.00 46.19 43.75 2jng s LEU 22 CO 0.24 -1.77 0.65 -1.10 0.23 0.00 0.00 176.35 174.60 2jng s GLN 23 N 5.47 3.35 -0.31 1.70 -0.21 -1.26 -4.95 119.66 123.45 2jng s GLN 23 Ca 0.33 -0.24 -0.34 0.00 0.02 0.00 0.00 55.36 55.13 2jng s GLN 23 Cb -0.09 -2.55 -0.10 0.00 1.00 0.00 0.00 33.01 31.27 2jng s GLN 23 CO 0.14 -0.09 2.18 -2.30 -2.12 0.00 0.00 175.29 173.10 2jng n PRO 24 N -2.01 1.32 0.00 2.91 -0.02 -1.26 -0.33 135.00 135.60 2jng n PRO 24 Ca -0.01 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2jng n PRO 24 Cb 0.56 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2jng n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jng n GLY 25 N 6.26 0.90 3.74 -1.23 0.00 0.12 -5.03 105.19 109.96 2jng n GLY 25 Ca 0.38 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.99 2jng n GLY 25 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2jng s MET 26 N -0.39 4.52 0.39 1.61 1.75 0.55 -4.72 119.30 123.02 2jng s MET 26 Ca 0.00 1.86 -0.17 0.00 -1.25 0.00 0.00 55.69 56.14 2jng s MET 26 Cb 0.00 -3.23 -0.09 0.00 2.84 0.00 0.00 34.83 34.35 2jng s MET 26 CO 0.00 -0.03 0.84 0.50 -0.65 0.00 0.00 175.02 175.69 2jng s ARG 27 N -0.52 4.04 0.06 4.11 3.52 -1.15 -0.06 118.95 128.96 2jng s ARG 27 Ca 0.51 0.83 0.01 0.00 -0.13 0.00 0.00 55.73 56.94 2jng s ARG 27 Cb -0.32 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.72 2jng s ARG 27 CO 0.38 0.01 -0.05 0.14 -0.81 0.00 0.00 175.30 174.97 2jng s VAL 28 N -2.19 0.44 0.02 7.11 -7.23 0.78 -0.80 120.40 118.54 2jng s VAL 28 Ca 0.57 -1.65 0.05 0.00 -1.81 0.00 0.00 61.98 59.14 2jng s VAL 28 Cb -0.10 -1.31 -0.02 0.00 0.56 0.00 0.00 36.38 35.51 2jng s VAL 28 CO 0.20 -0.81 -0.16 -0.60 -0.31 0.00 0.00 175.10 173.42 2jng s ARG 29 N -3.27 1.11 -0.25 4.82 3.52 -0.36 -0.82 118.95 123.71 2jng s ARG 29 Ca 0.04 -0.72 -0.29 0.00 -0.13 0.00 0.00 55.73 54.63 2jng s ARG 29 Cb 0.02 -1.13 0.01 0.00 -1.56 0.00 0.00 34.95 32.30 2jng s ARG 29 CO -0.05 0.29 1.03 1.41 -0.81 0.00 0.00 175.30 177.17 2jng s MET 30 N -0.90 4.22 0.02 5.12 -2.45 0.12 0.49 119.30 125.92 2jng s MET 30 Ca 0.04 1.28 0.16 0.00 -1.25 0.00 0.00 55.69 55.92 2jng s MET 30 Cb -0.07 -3.66 -0.17 0.00 1.25 0.00 0.00 34.83 32.18 2jng s MET 30 CO 0.01 -0.67 0.74 1.28 1.05 0.00 0.00 175.02 177.43 2jng n LEU 31 N 6.39 0.82 -4.72 4.11 4.77 0.47 -0.04 117.00 128.80 2jng n LEU 31 Ca 0.12 0.37 -0.24 0.00 -0.03 0.00 0.00 56.01 56.22 2jng n LEU 31 Cb 0.46 0.12 -0.07 0.00 -2.33 0.00 0.00 43.42 41.60 2jng n LEU 31 CO 0.53 0.22 -0.19 -1.81 -1.33 0.00 0.00 177.39 174.81 2jng s ASP 32 N -5.83 4.43 -0.21 -1.43 1.11 -1.25 -4.71 116.67 108.78 2jng s ASP 32 Ca -0.04 -1.00 -0.12 0.00 0.18 0.00 0.00 52.55 51.57 2jng s ASP 32 Cb 0.08 -0.54 -0.05 0.00 1.07 0.00 0.00 42.92 43.49 2jng s ASP 32 CO 0.82 -0.43 0.22 -0.62 1.18 0.00 0.00 175.17 176.33 2jng s ASP 33 N -3.86 6.25 0.50 0.27 2.15 -1.26 -2.34 116.67 118.38 2jng s ASP 33 Ca 0.39 0.27 0.02 0.00 0.43 0.00 0.00 52.55 53.66 2jng s ASP 33 Cb 0.02 -2.14 -0.02 0.00 -0.30 0.00 0.00 42.92 40.48 2jng s ASP 33 CO 0.22 0.07 0.01 -0.47 -0.17 0.00 0.00 175.17 174.83 2jng s TYR 34 N 0.87 1.88 -0.19 -5.34 5.04 0.19 -4.96 117.35 114.83 2jng s TYR 34 Ca 0.11 -0.98 0.01 0.00 -2.44 0.00 0.00 57.07 53.78 2jng s TYR 34 Cb -0.13 -1.57 0.15 0.00 0.35 0.00 0.00 41.96 40.75 2jng s TYR 34 CO 0.04 0.19 1.14 0.39 -1.34 0.00 0.00 175.55 175.97 2jng n GLU 35 N -1.22 1.34 0.00 4.97 -0.58 -1.26 -3.86 120.64 120.03 2jng n GLU 35 Ca -0.17 -0.65 0.00 0.00 -0.42 0.00 0.00 57.16 55.92 2jng n GLU 35 Cb 0.67 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 30.23 2jng n GLU 35 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2jng n GLU 36 N 0.14 0.00 -4.30 3.49 4.07 -1.26 -5.14 120.64 117.65 2jng n GLU 36 Ca 0.12 0.00 -0.25 0.00 -0.06 0.00 0.00 57.16 56.97 2jng n GLU 36 Cb 0.72 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 32.01 2jng n GLU 36 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 2jng s ILE 37 N -1.11 3.26 0.20 6.31 -1.09 -1.25 -5.10 121.20 122.42 2jng s ILE 37 Ca 0.00 -1.80 0.04 0.00 -2.23 0.00 0.00 60.65 56.66 2jng s ILE 37 Cb 0.00 -2.68 -0.05 0.00 -1.58 0.00 0.00 42.46 38.16 2jng s ILE 37 CO 0.00 -0.23 -0.04 -0.55 -1.23 0.00 0.00 174.94 172.88 2jng s SER 38 N -3.21 1.86 0.18 3.58 0.15 -1.26 0.53 113.70 115.52 2jng s SER 38 Ca 0.28 -1.14 -0.32 0.00 0.70 0.00 0.00 55.95 55.47 2jng s SER 38 Cb -0.08 -0.00 -0.11 0.00 -1.71 0.00 0.00 66.02 64.12 2jng s SER 38 CO 0.17 -0.43 1.71 0.00 1.20 0.00 0.00 173.24 175.88 2jng s ALA 39 N -3.37 3.86 0.00 5.45 0.00 -0.99 -2.18 121.76 124.53 2jng s ALA 39 Ca 0.24 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.70 2jng s ALA 39 Cb 0.04 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2jng s ALA 39 CO 0.06 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.27 2jng n GLY 40 N 3.98 2.68 3.77 0.00 0.00 0.94 -5.00 105.19 111.55 2jng n GLY 40 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2jng n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jng s ASP 41 N -1.39 6.49 0.23 1.61 1.01 -0.93 -4.72 116.67 118.97 2jng s ASP 41 Ca 0.00 2.90 0.10 0.00 0.71 0.00 0.00 52.55 56.26 2jng s ASP 41 Cb 0.00 -2.65 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 2jng s ASP 41 CO 0.00 -0.78 -0.12 -1.61 0.21 0.00 0.00 175.17 172.86 2jng s GLU 42 N -1.46 1.93 0.05 8.23 2.02 -1.26 0.15 118.70 128.36 2jng s GLU 42 Ca 0.55 -1.49 -0.02 0.00 0.02 0.00 0.00 54.97 54.02 2jng s GLU 42 Cb -0.45 -2.00 0.01 0.00 0.10 0.00 0.00 34.13 31.79 2jng s GLU 42 CO 0.55 0.38 0.12 0.41 0.02 0.00 0.00 175.26 176.74 2jng n GLY 43 N -0.37 1.65 3.34 -1.39 0.00 0.00 -1.48 105.19 106.94 2jng n GLY 43 Ca -0.08 -1.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.65 2jng n GLY 43 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jng s GLU 44 N -2.01 1.38 -0.25 1.61 2.12 0.70 -0.15 118.70 122.09 2jng s GLU 44 Ca 0.03 -1.21 -0.19 0.00 0.36 0.00 0.00 54.97 53.96 2jng s GLU 44 Cb -0.01 -1.72 -0.02 0.00 0.26 0.00 0.00 34.13 32.64 2jng s GLU 44 CO 0.01 0.41 0.55 0.12 -0.54 0.00 0.00 175.26 175.82 2jng s PHE 45 N -1.02 3.28 -0.27 5.30 5.36 0.92 -0.75 117.98 130.80 2jng s PHE 45 Ca 0.11 0.70 -0.15 0.00 -0.96 0.00 0.00 56.93 56.63 2jng s PHE 45 Cb -0.10 -2.75 -0.12 0.00 -0.34 0.00 0.00 43.02 39.71 2jng s PHE 45 CO 0.04 -0.28 -0.32 0.54 -1.46 0.00 0.00 175.22 173.74 2jng n ARG 46 N 5.55 0.58 -3.49 10.12 1.74 -1.18 -0.70 116.66 129.28 2jng n ARG 46 Ca -0.03 0.28 -0.09 0.00 -0.77 0.00 0.00 57.85 57.24 2jng n ARG 46 Cb 0.50 -1.51 -0.02 0.00 -1.02 0.00 0.00 32.46 30.41 2jng n ARG 46 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 2jng s GLN 47 N -2.52 0.92 0.33 5.56 -2.07 -1.18 -4.67 119.66 116.03 2jng s GLN 47 Ca -0.38 -0.33 -0.00 0.00 -1.82 0.00 0.00 55.36 52.83 2jng s GLN 47 Cb 0.14 0.43 -0.01 0.00 -1.09 0.00 0.00 33.01 32.47 2jng s GLN 47 CO 0.49 -0.40 0.41 -1.54 -1.32 0.00 0.00 175.29 172.93 2jng s SER 48 N -2.50 1.02 -0.38 12.60 1.04 -1.26 -1.07 113.70 123.14 2jng s SER 48 Ca 0.04 -1.52 -0.05 0.00 0.48 0.00 0.00 55.95 54.90 2jng s SER 48 Cb -0.01 0.62 0.08 0.00 0.10 0.00 0.00 66.02 66.81 2jng s SER 48 CO -0.10 -1.21 0.16 0.20 0.98 0.00 0.00 173.24 173.28 2jng s ASN 49 N -3.26 5.29 -1.30 7.02 0.01 -1.10 -4.95 114.94 116.66 2jng s ASN 49 Ca 0.33 -1.63 -0.17 0.00 -0.71 0.00 0.00 52.86 50.68 2jng s ASN 49 Cb 0.01 -1.85 0.08 0.00 0.41 0.00 0.00 41.25 39.90 2jng s ASN 49 CO 0.21 -0.46 1.74 0.59 -1.51 0.00 0.00 177.10 177.67 2jng n ASN 50 N 4.71 4.90 0.00 -1.22 3.02 -1.26 -2.67 115.26 122.75 2jng n ASN 50 Ca -0.08 -2.92 0.00 0.00 -0.03 0.00 0.00 54.58 51.55 2jng n ASN 50 Cb 0.43 -1.72 0.00 0.00 -0.61 0.00 0.00 39.78 37.88 2jng n ASN 50 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jng n GLY 51 N 5.09 0.27 3.60 7.41 0.00 -1.26 -5.15 105.19 115.15 2jng n GLY 51 Ca 0.47 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.24 2jng n GLY 51 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jng s VAL 52 N 0.00 2.52 0.16 1.61 -7.23 -1.09 -5.08 120.40 111.29 2jng s VAL 52 Ca 0.00 -2.05 -0.16 0.00 -1.81 0.00 0.00 61.98 57.96 2jng s VAL 52 Cb 0.00 -2.74 0.04 0.00 0.56 0.00 0.00 36.38 34.23 2jng s VAL 52 CO 0.00 -0.21 1.73 -0.65 -0.31 0.00 0.00 175.10 175.66 2jng h PRO 53 N 1.88 0.18 -6.15 4.82 0.11 -1.94 -3.44 132.00 127.46 2jng h PRO 53 Ca -0.42 -0.01 -0.66 0.00 0.11 0.00 0.00 66.00 65.01 2jng h PRO 53 Cb 1.25 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.33 2jng h PRO 53 CO 0.68 0.12 1.16 -0.35 -0.21 0.00 0.00 178.00 179.39 2jng n PRO 54 N -5.10 1.62 -4.57 1.05 -0.04 -1.26 -3.73 135.00 122.97 2jng n PRO 54 Ca 0.01 0.56 -0.22 0.00 -0.04 0.00 0.00 63.50 63.81 2jng n PRO 54 Cb 0.16 -2.49 -0.16 0.00 -0.04 0.00 0.00 33.50 30.98 2jng n PRO 54 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2jng s VAL 55 N 5.03 1.04 -0.40 0.52 0.11 -0.81 -2.71 120.40 123.18 2jng s VAL 55 Ca 0.99 -0.51 -0.17 0.00 -2.93 0.00 0.00 61.98 59.35 2jng s VAL 55 Cb -0.81 -0.90 0.01 0.00 -1.53 0.00 0.00 36.38 33.15 2jng s VAL 55 CO 0.54 0.31 0.46 -1.58 -3.33 0.00 0.00 175.10 171.49 2jng s GLN 56 N 0.04 3.30 -0.00 1.54 0.74 -0.23 -0.52 119.66 124.52 2jng s GLN 56 Ca -0.02 -0.55 0.07 0.00 0.05 0.00 0.00 55.36 54.92 2jng s GLN 56 Cb -0.09 -3.91 -0.02 0.00 1.10 0.00 0.00 33.01 30.10 2jng s GLN 56 CO 0.01 -0.77 -0.22 0.08 -0.55 0.00 0.00 175.29 173.83 2jng s VAL 57 N 2.23 1.77 -0.41 1.34 1.01 0.46 -3.12 120.40 123.68 2jng s VAL 57 Ca 0.14 -1.02 -0.18 0.00 0.00 0.00 0.00 61.98 60.93 2jng s VAL 57 Cb -0.16 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.75 2jng s VAL 57 CO 0.14 0.45 0.48 0.12 0.00 0.00 0.00 175.10 176.28 2jng s PHE 58 N -0.58 3.15 -0.39 5.22 5.36 0.07 -0.31 117.98 130.52 2jng s PHE 58 Ca 0.09 -0.22 -0.26 0.00 -0.96 0.00 0.00 56.93 55.57 2jng s PHE 58 Cb -0.09 -2.96 0.02 0.00 -0.34 0.00 0.00 43.02 39.65 2jng s PHE 58 CO -0.00 -0.69 0.96 -1.58 -1.46 0.00 0.00 175.22 172.45 2jng s TRP 59 N 2.29 3.04 -0.29 10.12 0.52 -0.01 -0.21 118.94 134.38 2jng s TRP 59 Ca 0.15 0.76 0.24 0.00 0.02 0.00 0.00 56.10 57.27 2jng s TRP 59 Cb -0.16 -3.78 0.53 0.00 -1.15 0.00 0.00 33.47 28.91 2jng s TRP 59 CO 0.14 -0.90 1.67 1.05 0.02 0.00 0.00 176.95 178.94 2jng h GLU 60 N 8.60 0.00 -0.43 4.98 4.11 -1.55 0.62 114.58 130.90 2jng h GLU 60 Ca -0.23 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.15 2jng h GLU 60 Cb 1.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 2jng h GLU 60 CO 1.01 0.05 0.05 1.03 0.07 0.00 0.00 179.01 181.23 2jng h SER 61 N 0.00 0.70 0.13 3.06 0.87 -1.87 -3.29 113.55 113.15 2jng h SER 61 Ca -0.00 -0.27 -0.36 0.00 -1.23 0.00 0.00 61.79 59.93 2jng h SER 61 Cb 0.93 -0.19 -0.06 0.00 -0.44 0.00 0.00 62.40 62.65 2jng h SER 61 CO 0.01 0.80 -2.21 0.41 -0.53 0.00 0.00 176.83 175.31 2jng n THR 62 N -4.47 1.51 -0.49 2.23 -1.04 -1.18 -5.00 114.28 105.85 2jng n THR 62 Ca -0.00 -0.76 0.00 0.00 -2.04 0.00 0.00 64.05 61.25 2jng n THR 62 Cb 0.25 -0.95 0.00 0.00 -1.82 0.00 0.00 70.33 67.81 2jng n THR 62 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jng n GLY 63 N 1.84 1.02 3.14 3.41 0.00 0.21 -5.08 105.19 109.73 2jng n GLY 63 Ca -0.32 -0.36 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 2jng n GLY 63 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jng s ARG 64 N -1.21 0.73 0.19 1.61 1.70 -0.99 -4.96 118.95 116.02 2jng s ARG 64 Ca 0.00 -0.95 -0.29 0.00 -0.47 0.00 0.00 55.73 54.03 2jng s ARG 64 Cb 0.00 -0.57 -0.08 0.00 -0.57 0.00 0.00 34.95 33.73 2jng s ARG 64 CO 0.00 0.11 0.89 0.99 -1.08 0.00 0.00 175.30 176.21 2jng s THR 65 N -1.64 4.25 -0.03 4.99 2.01 -1.26 -0.83 115.64 123.12 2jng s THR 65 Ca -0.02 1.96 -0.19 0.00 0.31 0.00 0.00 61.69 63.75 2jng s THR 65 Cb -0.08 -4.27 0.03 0.00 0.01 0.00 0.00 72.50 68.20 2jng s THR 65 CO 0.01 0.47 0.40 -0.47 -0.69 0.00 0.00 174.62 174.34 2jng s TYR 66 N -0.93 -0.31 -0.30 4.92 5.04 0.58 -4.95 117.35 121.41 2jng s TYR 66 Ca 0.40 0.51 -0.14 0.00 -2.44 0.00 0.00 57.07 55.40 2jng s TYR 66 Cb -0.25 0.17 -0.03 0.00 0.35 0.00 0.00 41.96 42.21 2jng s TYR 66 CO 0.30 -0.43 0.34 -1.58 -1.34 0.00 0.00 175.55 172.83 2jng s TRP 67 N -1.22 3.23 0.52 4.97 0.51 -1.26 -0.40 118.94 125.28 2jng s TRP 67 Ca -0.12 0.18 0.01 0.00 -2.12 0.00 0.00 56.10 54.05 2jng s TRP 67 Cb -0.04 -2.58 0.01 0.00 -0.81 0.00 0.00 33.47 30.05 2jng s TRP 67 CO 0.05 -0.31 0.12 0.28 -0.51 0.00 0.00 176.95 176.59 2jng n VAL 68 N 5.16 0.00 -4.07 4.03 0.31 0.33 -4.83 118.33 119.26 2jng n VAL 68 Ca -0.10 -2.32 -0.35 0.00 -0.01 0.00 0.00 64.34 61.55 2jng n VAL 68 Cb 0.50 0.33 -0.08 0.00 -0.91 0.00 0.00 33.84 33.68 2jng n VAL 68 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 2jng s HIS 69 N -2.79 3.35 0.38 3.52 3.76 -1.26 -1.92 115.29 120.33 2jng s HIS 69 Ca 0.09 0.28 0.14 0.00 -0.15 0.00 0.00 55.06 55.41 2jng s HIS 69 Cb -0.01 -1.94 0.97 0.00 1.11 0.00 0.00 32.58 32.72 2jng s HIS 69 CO 0.06 0.46 1.84 -1.49 -0.85 0.00 0.00 174.74 174.76 2jng h TRP 70 N 5.61 0.69 0.00 1.40 4.06 -1.93 -2.54 115.95 123.24 2jng h TRP 70 Ca -0.48 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.49 2jng h TRP 70 Cb 1.20 -0.21 0.00 0.00 -1.00 0.00 0.00 29.16 29.14 2jng h TRP 70 CO 0.65 0.19 0.00 -2.39 -3.56 0.00 0.00 178.44 173.33 2jng n HIS 71 N -4.57 0.68 -0.40 0.49 1.44 -1.26 -1.51 115.22 110.09 2jng n HIS 71 Ca 0.20 0.32 0.05 0.00 -2.01 0.00 0.00 57.72 56.28 2jng n HIS 71 Cb 0.64 -1.01 0.11 0.00 0.12 0.00 0.00 29.99 29.85 2jng n HIS 71 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2jng n MET 72 N -2.17 2.66 -4.26 -1.40 0.00 -0.96 -4.89 117.12 106.09 2jng n MET 72 Ca -0.00 -2.08 -0.34 0.00 0.00 0.00 0.00 57.70 55.28 2jng n MET 72 Cb 0.10 -1.31 -0.10 0.00 0.00 0.00 0.00 33.22 31.91 2jng n MET 72 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2jng s LEU 73 N -1.62 3.55 -0.16 3.17 1.43 -0.57 -0.39 118.68 124.09 2jng s LEU 73 Ca 0.20 0.03 -0.08 0.00 -1.03 0.00 0.00 54.13 53.25 2jng s LEU 73 Cb 0.14 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2jng s LEU 73 CO 0.07 0.24 0.13 -0.70 0.23 0.00 0.00 176.35 176.33 2jng s GLU 74 N -0.07 3.80 -0.08 1.70 2.12 0.18 -4.91 118.70 121.44 2jng s GLU 74 Ca 0.04 -0.18 -0.30 0.00 0.36 0.00 0.00 54.97 54.90 2jng s GLU 74 Cb -0.13 -3.30 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 2jng s GLU 74 CO 0.02 0.55 1.17 -1.50 -0.54 0.00 0.00 175.26 174.95 2jng s ILE 75 N -0.36 4.37 -0.72 -3.70 2.07 -1.26 -1.22 121.20 120.38 2jng s ILE 75 Ca 0.12 1.68 0.05 0.00 -1.41 0.00 0.00 60.65 61.08 2jng s ILE 75 Cb -0.12 -4.08 0.17 0.00 0.13 0.00 0.00 42.46 38.57 2jng s ILE 75 CO 0.01 -0.02 0.51 -0.76 -1.91 0.00 0.00 174.94 172.77 2jng s LEU 76 N 2.35 4.88 -0.67 8.50 1.43 0.01 -4.90 118.68 130.29 2jng s LEU 76 Ca 0.54 -3.86 -0.24 0.00 -1.03 0.00 0.00 54.13 49.54 2jng s LEU 76 Cb -0.23 -1.66 0.06 0.00 0.03 0.00 0.00 46.19 44.39 2jng s LEU 76 CO 0.20 -0.09 1.06 -0.83 0.23 0.00 0.00 176.35 176.92 2jng s GLY 77 N -1.40 1.23 0.00 -3.19 0.00 -1.26 -2.91 107.32 99.79 2jng s GLY 77 Ca 0.25 -1.63 0.16 0.00 0.00 0.00 0.00 44.72 43.50 2jng s GLY 77 CO -0.17 2.24 1.50 0.69 0.00 0.00 0.00 173.10 177.37 2jng n PHE 78 N 8.18 0.12 -2.64 1.90 3.01 -1.26 -4.58 117.46 122.19 2jng n PHE 78 Ca -0.01 -0.06 -0.42 0.00 1.01 0.00 0.00 57.45 57.97 2jng n PHE 78 Cb 0.47 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.91 2jng n PHE 78 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2jng s GLU 79 N -1.88 3.64 0.00 -1.08 2.12 -1.26 -5.18 118.70 115.06 2jng s GLU 79 Ca 0.25 -1.36 0.00 0.00 0.36 0.00 0.00 54.97 54.21 2jng s GLU 79 Cb 0.12 -5.28 0.00 0.00 0.26 0.00 0.00 34.13 29.23 2jng s GLU 79 CO 0.19 -2.12 0.00 -0.85 -0.54 0.00 0.00 175.26 171.95