#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 0.54 0.00 0.03 3.08 -2.01 -3.21 114.38 112.81 2jng h ARG 5 Ca 0.00 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.79 2jng h ARG 5 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2jng h ARG 5 CO 0.00 0.84 0.00 0.43 -1.07 0.00 0.00 179.97 180.17 2jng n SER 6 N -4.04 0.00 0.00 7.04 7.64 -1.26 -3.93 113.62 119.07 2jng n SER 6 Ca -0.01 -0.53 0.00 0.00 1.01 0.00 0.00 58.87 59.33 2jng n SER 6 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2jng n SER 6 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2jng n GLU 7 N -0.94 0.00 0.00 1.43 1.02 -1.21 -4.30 120.64 116.64 2jng n GLU 7 Ca 0.10 0.49 0.00 0.00 -0.02 0.00 0.00 57.16 57.73 2jng n GLU 7 Cb 0.05 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 2jng n GLU 7 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2jng n PHE 8 N -1.98 -0.59 -0.03 -0.32 3.01 -1.25 -0.43 117.46 115.86 2jng n PHE 8 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.32 2jng n PHE 8 Cb 0.00 0.13 -0.10 0.00 -0.01 0.00 0.00 39.48 39.50 2jng n PHE 8 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jng h ALA 9 N -0.69 0.10 0.00 4.37 0.00 -1.97 -3.40 119.26 117.67 2jng h ALA 9 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2jng h ALA 9 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2jng h ALA 9 CO 0.00 0.07 0.00 0.43 0.00 0.00 0.00 179.25 179.75 2jng n SER 10 N -4.54 0.38 0.00 0.00 7.64 -1.25 -4.98 113.62 110.87 2jng n SER 10 Ca -0.08 -1.06 0.00 0.00 1.01 0.00 0.00 58.87 58.74 2jng n SER 10 Cb 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 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 -0.03 1.67 0.18 0.23 0.00 0.42 -4.83 105.19 102.84 2jng n GLY 11 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2jng n GLY 11 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jng h ASN 12 N 0.00 0.00 0.09 1.61 2.35 -1.88 -1.17 115.58 116.59 2jng h ASN 12 Ca 0.00 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.60 2jng h ASN 12 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2jng h ASN 12 CO 0.00 0.41 -0.52 0.74 -1.65 0.00 0.00 177.43 176.41 2jng h THR 13 N 0.00 1.33 -0.42 2.81 2.02 -1.94 -1.62 112.91 115.10 2jng h THR 13 Ca -0.00 -1.77 -0.12 0.00 0.77 0.00 0.00 66.41 65.29 2jng h THR 13 Cb 0.86 1.77 -0.01 0.00 -1.74 0.00 0.00 68.15 69.03 2jng h THR 13 CO 0.05 0.54 -0.21 0.22 0.37 0.00 0.00 175.52 176.50 2jng h TYR 14 N 0.37 1.02 -0.57 3.16 3.20 -1.75 -0.49 116.97 121.91 2jng h TYR 14 Ca 0.01 -0.26 0.07 0.00 3.14 0.00 0.00 58.73 61.70 2jng h TYR 14 Cb 1.04 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 39.04 2jng h TYR 14 CO 0.04 1.04 0.38 0.00 -1.64 0.00 0.00 178.16 177.98 2jng h ALA 15 N 0.82 1.92 -0.14 1.82 0.00 -1.01 0.16 119.26 122.82 2jng h ALA 15 Ca 0.09 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 2jng h ALA 15 Cb 0.78 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.46 2jng h ALA 15 CO 0.06 -0.02 -0.56 1.25 0.00 0.00 0.00 179.25 179.98 2jng h LEU 16 N 0.48 0.74 0.44 0.00 5.85 -0.93 -3.13 115.31 118.75 2jng h LEU 16 Ca 0.25 -0.62 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 2jng h LEU 16 Cb 0.39 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2jng h LEU 16 CO -0.07 1.23 -0.21 0.22 -0.34 0.00 0.00 178.44 179.27 2jng h TYR 17 N 0.29 -0.54 -0.28 1.25 3.20 -0.01 -2.97 116.97 117.90 2jng h TYR 17 Ca -0.03 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.91 2jng h TYR 17 Cb 1.19 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.63 2jng h TYR 17 CO 0.10 -0.28 0.21 -0.39 -1.64 0.00 0.00 178.16 176.16 2jng h VAL 18 N -0.69 0.80 -0.63 1.81 -1.51 -0.85 -2.69 116.25 112.49 2jng h VAL 18 Ca -0.06 0.00 0.13 0.00 -1.23 0.00 0.00 66.70 65.54 2jng h VAL 18 Cb 0.50 0.85 -0.12 0.00 -2.13 0.00 0.00 31.29 30.40 2jng h VAL 18 CO 0.10 0.00 -0.13 0.03 -1.23 0.00 0.00 177.57 176.34 2jng h ARG 19 N 0.00 0.02 0.00 5.19 2.47 -1.46 0.51 114.38 121.11 2jng h ARG 19 Ca 0.13 -0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.79 2jng h ARG 19 Cb 0.56 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.86 2jng h ARG 19 CO -0.00 0.01 -0.88 0.38 0.56 0.00 0.00 179.97 180.05 2jng h ASP 20 N 0.02 0.00 0.92 7.04 3.04 -1.62 -3.35 116.42 122.46 2jng h ASP 20 Ca 0.31 0.00 -0.16 0.00 -3.24 0.00 0.00 57.03 53.94 2jng h ASP 20 Cb 0.49 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.75 2jng h ASP 20 CO -0.63 0.25 -1.17 0.74 -2.04 0.00 0.00 179.24 176.39 2jng h THR 21 N 0.00 0.66 -2.37 1.15 2.02 -1.11 -3.43 112.91 109.83 2jng h THR 21 Ca -0.05 -2.14 -0.54 0.00 0.77 0.00 0.00 66.41 64.46 2jng h THR 21 Cb 1.23 2.18 -0.07 0.00 -1.74 0.00 0.00 68.15 69.75 2jng h THR 21 CO 0.02 0.38 1.10 -0.76 0.37 0.00 0.00 175.52 176.62 2jng s LEU 22 N -6.01 3.20 -0.12 2.58 2.01 0.17 -4.99 118.68 115.53 2jng s LEU 22 Ca -0.01 -0.29 -0.10 0.00 0.01 0.00 0.00 54.13 53.75 2jng s LEU 22 Cb 0.08 -2.61 -0.05 0.00 0.01 0.00 0.00 46.19 43.63 2jng s LEU 22 CO 0.80 -1.89 0.20 -1.10 1.01 0.00 0.00 176.35 175.37 2jng s GLN 23 N 5.86 3.75 -0.69 1.70 1.11 -1.26 -4.97 119.66 125.15 2jng s GLN 23 Ca 0.40 -0.03 -0.30 0.00 0.01 0.00 0.00 55.36 55.45 2jng s GLN 23 Cb -0.09 -3.26 -0.14 0.00 -1.01 0.00 0.00 33.01 28.51 2jng s GLN 23 CO 0.17 0.62 2.50 -2.30 0.01 0.00 0.00 175.29 176.29 2jng n PRO 24 N 2.41 0.57 0.00 2.91 -0.02 -1.26 -0.48 135.00 139.14 2jng n PRO 24 Ca -0.17 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2jng n PRO 24 Cb 0.54 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 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 6.33 0.93 3.70 -1.23 0.00 0.09 -4.99 105.19 110.03 2jng n GLY 25 Ca 0.51 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 4.47 0.27 1.61 0.00 0.37 -4.75 119.30 121.28 2jng s MET 26 Ca 0.00 1.21 -0.29 0.00 0.00 0.00 0.00 55.69 56.62 2jng s MET 26 Cb 0.00 -3.48 -0.09 0.00 0.00 0.00 0.00 34.83 31.26 2jng s MET 26 CO 0.00 -0.09 0.95 0.50 0.00 0.00 0.00 175.02 176.39 2jng s ARG 27 N 1.23 4.74 0.25 4.11 3.52 -1.26 -1.27 118.95 130.27 2jng s ARG 27 Ca 0.46 1.46 0.10 0.00 -0.13 0.00 0.00 55.73 57.61 2jng s ARG 27 Cb -0.19 -3.10 -0.05 0.00 -1.56 0.00 0.00 34.95 30.05 2jng s ARG 27 CO 0.22 0.41 -0.17 0.14 -0.81 0.00 0.00 175.30 175.09 2jng s VAL 28 N -1.33 2.11 -0.07 7.11 -7.23 0.10 -0.54 120.40 120.56 2jng s VAL 28 Ca 0.45 -2.31 0.04 0.00 -1.81 0.00 0.00 61.98 58.35 2jng s VAL 28 Cb -0.24 -2.19 -0.00 0.00 0.56 0.00 0.00 36.38 34.51 2jng s VAL 28 CO 0.30 -0.49 -0.21 -0.60 -0.31 0.00 0.00 175.10 173.79 2jng s ARG 29 N -3.58 2.42 -0.60 4.82 3.52 0.72 -1.55 118.95 124.69 2jng s ARG 29 Ca 0.27 -0.75 -0.28 0.00 -0.13 0.00 0.00 55.73 54.83 2jng s ARG 29 Cb -0.03 -1.95 0.03 0.00 -1.56 0.00 0.00 34.95 31.44 2jng s ARG 29 CO 0.11 0.23 1.23 1.41 -0.81 0.00 0.00 175.30 177.47 2jng s MET 30 N 0.18 3.45 0.01 5.12 -2.45 0.87 -0.42 119.30 126.06 2jng s MET 30 Ca -0.11 0.20 0.23 0.00 -1.25 0.00 0.00 55.69 54.76 2jng s MET 30 Cb -0.15 -4.05 0.08 0.00 1.25 0.00 0.00 34.83 31.96 2jng s MET 30 CO 0.05 -1.78 1.09 1.47 1.05 0.00 0.00 175.02 176.90 2jng n LEU 31 N 8.70 0.72 -4.35 4.11 -0.00 -1.25 -0.30 117.00 124.64 2jng n LEU 31 Ca 0.08 -0.21 -0.31 0.00 -0.00 0.00 0.00 56.01 55.56 2jng n LEU 31 Cb 0.49 -0.11 -0.15 0.00 -0.00 0.00 0.00 43.42 43.65 2jng n LEU 31 CO 0.71 0.16 -0.54 -0.62 -0.00 0.00 0.00 177.39 177.10 2jng s ASP 32 N -3.24 3.30 0.29 1.45 2.15 -1.26 -4.85 116.67 114.51 2jng s ASP 32 Ca 0.08 -0.41 -0.19 0.00 0.43 0.00 0.00 52.55 52.46 2jng s ASP 32 Cb 0.16 -0.54 -0.09 0.00 -0.30 0.00 0.00 42.92 42.15 2jng s ASP 32 CO 0.80 0.31 0.78 -0.62 -0.17 0.00 0.00 175.17 176.27 2jng s ASP 33 N -0.57 6.99 0.03 -0.34 2.15 -1.26 -4.01 116.67 119.66 2jng s ASP 33 Ca 0.08 1.46 -0.19 0.00 0.43 0.00 0.00 52.55 54.33 2jng s ASP 33 Cb -0.11 -2.44 0.04 0.00 -0.30 0.00 0.00 42.92 40.11 2jng s ASP 33 CO -0.00 -0.10 0.42 -0.47 -0.17 0.00 0.00 175.17 174.85 2jng s TYR 34 N -1.75 -0.28 0.00 -5.34 5.04 -0.64 -4.86 117.35 109.51 2jng s TYR 34 Ca 0.50 0.29 0.00 0.00 -2.44 0.00 0.00 57.07 55.42 2jng s TYR 34 Cb -0.14 0.22 0.00 0.00 0.35 0.00 0.00 41.96 42.39 2jng s TYR 34 CO 0.19 -0.56 0.87 0.39 -1.34 0.00 0.00 175.55 175.11 2jng n GLU 35 N 0.61 0.00 0.17 4.97 4.71 -1.26 -3.44 120.64 126.41 2jng n GLU 35 Ca -0.19 0.87 -0.13 0.00 -0.01 0.00 0.00 57.16 57.70 2jng n GLU 35 Cb 0.59 -1.35 -0.08 0.00 -1.01 0.00 0.00 31.44 29.60 2jng n GLU 35 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 2jng h GLU 36 N 0.00 -0.45 -5.69 3.49 3.07 -2.03 -3.43 114.58 109.54 2jng h GLU 36 Ca 0.00 0.03 -0.66 0.00 -0.50 0.00 0.00 59.36 58.23 2jng h GLU 36 Cb 0.00 0.10 -0.15 0.00 -0.84 0.00 0.00 28.75 27.87 2jng h GLU 36 CO 0.00 -0.13 -0.59 0.42 -1.40 0.00 0.00 179.01 177.31 2jng s ILE 37 N -4.59 4.57 0.19 3.13 -1.09 -1.22 -5.00 121.20 117.18 2jng s ILE 37 Ca -0.14 -0.14 0.07 0.00 -2.23 0.00 0.00 60.65 58.22 2jng s ILE 37 Cb 0.02 -2.97 -0.04 0.00 -1.58 0.00 0.00 42.46 37.89 2jng s ILE 37 CO 0.52 0.56 0.03 -0.44 -1.23 0.00 0.00 174.94 174.38 2jng s SER 38 N -0.48 4.89 0.15 3.58 0.01 -1.25 -1.62 113.70 118.97 2jng s SER 38 Ca 0.09 -0.38 -0.32 0.00 1.31 0.00 0.00 55.95 56.66 2jng s SER 38 Cb -0.12 -1.08 -0.11 0.00 0.21 0.00 0.00 66.02 64.92 2jng s SER 38 CO 0.02 0.07 1.78 0.00 0.41 0.00 0.00 173.24 175.52 2jng n ALA 39 N -0.30 2.34 0.00 1.44 0.00 -1.26 -1.34 120.51 121.39 2jng n ALA 39 Ca -0.09 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2jng n ALA 39 Cb 0.56 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.46 2jng n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jng n GLY 40 N 4.08 1.56 3.77 0.00 0.00 0.59 -4.97 105.19 110.22 2jng n GLY 40 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2jng n GLY 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jng s ASP 41 N -1.70 6.53 0.06 1.61 -1.08 -0.45 -4.82 116.67 116.82 2jng s ASP 41 Ca 0.00 2.32 0.05 0.00 -0.52 0.00 0.00 52.55 54.40 2jng s ASP 41 Cb 0.00 -2.61 -0.03 0.00 -1.46 0.00 0.00 42.92 38.82 2jng s ASP 41 CO 0.00 -0.67 -0.13 -1.61 0.52 0.00 0.00 175.17 173.28 2jng s GLU 42 N -2.33 0.78 0.04 4.34 2.02 -1.26 -0.09 118.70 122.20 2jng s GLU 42 Ca 0.57 -0.89 -0.03 0.00 0.02 0.00 0.00 54.97 54.65 2jng s GLU 42 Cb -0.30 -0.75 0.01 0.00 0.10 0.00 0.00 34.13 33.19 2jng s GLU 42 CO 0.38 0.17 0.14 0.41 0.02 0.00 0.00 175.26 176.38 2jng n GLY 43 N 1.41 1.36 3.64 -1.39 0.00 -0.60 -0.51 105.19 109.11 2jng n GLY 43 Ca -0.21 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.53 2jng n GLY 43 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jng s GLU 44 N -2.01 2.46 -0.29 1.61 8.01 0.22 0.02 118.70 128.72 2jng s GLU 44 Ca 0.03 -0.85 -0.23 0.00 0.01 0.00 0.00 54.97 53.93 2jng s GLU 44 Cb -0.00 -2.48 -0.00 0.00 -4.31 0.00 0.00 34.13 27.33 2jng s GLU 44 CO 0.01 0.55 0.77 0.12 0.01 0.00 0.00 175.26 176.72 2jng s PHE 45 N -1.21 3.23 -0.17 1.61 5.36 -0.39 -1.14 117.98 125.26 2jng s PHE 45 Ca 0.23 0.86 -0.14 0.00 -0.96 0.00 0.00 56.93 56.91 2jng s PHE 45 Cb -0.11 -3.14 -0.09 0.00 -0.34 0.00 0.00 43.02 39.33 2jng s PHE 45 CO 0.14 -0.51 -0.05 0.54 -1.46 0.00 0.00 175.22 173.89 2jng n ARG 46 N 6.11 0.50 -3.65 10.12 1.74 -1.05 -0.73 116.66 129.70 2jng n ARG 46 Ca 0.03 0.53 -0.01 0.00 -0.77 0.00 0.00 57.85 57.63 2jng n ARG 46 Cb 0.48 -1.70 -0.01 0.00 -1.02 0.00 0.00 32.46 30.21 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 -2.32 0.66 0.10 5.56 0.00 -1.07 -4.56 119.66 118.03 2jng s GLN 47 Ca -0.21 -0.35 0.08 0.00 -0.00 0.00 0.00 55.36 54.87 2jng s GLN 47 Cb 0.04 0.23 -0.03 0.00 0.00 0.00 0.00 33.01 33.25 2jng s GLN 47 CO 0.37 -0.30 -0.20 -1.12 0.00 0.00 0.00 175.29 174.04 2jng s SER 48 N -2.88 2.45 -0.56 12.60 0.01 -1.26 -0.74 113.70 123.32 2jng s SER 48 Ca 0.13 -0.68 -0.25 0.00 1.31 0.00 0.00 55.95 56.46 2jng s SER 48 Cb 0.02 -0.13 0.04 0.00 0.21 0.00 0.00 66.02 66.16 2jng s SER 48 CO -0.02 0.04 0.98 0.20 0.41 0.00 0.00 173.24 174.85 2jng s ASN 49 N -1.90 6.34 0.56 2.44 0.01 -1.14 -4.90 114.94 116.35 2jng s ASN 49 Ca 0.06 -0.33 0.00 0.00 -0.71 0.00 0.00 52.86 51.87 2jng s ASN 49 Cb -0.10 -2.45 0.00 0.00 0.41 0.00 0.00 41.25 39.11 2jng s ASN 49 CO 0.04 -1.28 0.00 0.59 -1.51 0.00 0.00 177.10 174.94 2jng n ASN 50 N 7.62 0.00 -2.75 -1.22 3.02 -1.26 -2.08 115.26 118.59 2jng n ASN 50 Ca 0.02 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.53 2jng n ASN 50 Cb 0.48 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.70 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 0.00 1.68 3.76 7.41 0.00 -1.26 -5.11 105.19 111.66 2jng n GLY 51 Ca 0.00 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.71 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 -3.03 1.69 0.16 1.61 -7.23 -0.88 -5.07 120.40 107.64 2jng s VAL 52 Ca 0.25 -1.82 -0.18 0.00 -1.81 0.00 0.00 61.98 58.42 2jng s VAL 52 Cb 0.39 -2.51 0.07 0.00 0.56 0.00 0.00 36.38 34.88 2jng s VAL 52 CO -0.02 0.00 1.67 -0.65 -0.31 0.00 0.00 175.10 175.79 2jng h PRO 53 N 1.32 -0.02 -6.27 4.82 0.11 -1.95 -3.43 132.00 126.58 2jng h PRO 53 Ca -0.42 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.07 2jng h PRO 53 Cb 1.28 0.01 0.02 0.00 0.11 0.00 0.00 31.00 32.42 2jng h PRO 53 CO 0.71 -0.02 1.11 -0.35 -0.21 0.00 0.00 178.00 179.24 2jng n PRO 54 N -5.30 2.19 -4.72 1.05 -0.04 -1.26 -4.24 135.00 122.68 2jng n PRO 54 Ca 0.01 0.80 -0.25 0.00 -0.04 0.00 0.00 63.50 64.02 2jng n PRO 54 Cb 0.21 -2.65 -0.16 0.00 -0.04 0.00 0.00 33.50 30.86 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 4.13 1.29 -0.43 0.52 0.11 -1.17 -2.90 120.40 121.95 2jng s VAL 55 Ca 0.93 -0.61 -0.15 0.00 -2.93 0.00 0.00 61.98 59.21 2jng s VAL 55 Cb -0.69 -1.13 0.03 0.00 -1.53 0.00 0.00 36.38 33.06 2jng s VAL 55 CO 0.52 0.38 0.33 -1.58 -3.33 0.00 0.00 175.10 171.42 2jng s GLN 56 N 0.27 2.98 -0.03 1.54 2.00 0.08 -1.54 119.66 124.97 2jng s GLN 56 Ca -0.08 -1.08 0.06 0.00 -2.00 0.00 0.00 55.36 52.26 2jng s GLN 56 Cb -0.13 -4.02 -0.01 0.00 0.80 0.00 0.00 33.01 29.65 2jng s GLN 56 CO 0.03 -0.82 -0.22 0.08 -0.50 0.00 0.00 175.29 173.86 2jng s VAL 57 N 1.69 1.76 -0.27 1.34 1.01 -0.02 -2.52 120.40 123.40 2jng s VAL 57 Ca 0.05 -0.94 -0.13 0.00 0.00 0.00 0.00 61.98 60.97 2jng s VAL 57 Cb -0.20 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2jng s VAL 57 CO 0.09 0.50 0.28 0.12 0.00 0.00 0.00 175.10 176.09 2jng s PHE 58 N -0.37 3.25 -0.21 5.22 2.19 -0.29 -0.26 117.98 127.51 2jng s PHE 58 Ca 0.04 0.29 -0.10 0.00 0.33 0.00 0.00 56.93 57.50 2jng s PHE 58 Cb -0.10 -2.46 -0.05 0.00 -1.31 0.00 0.00 43.02 39.10 2jng s PHE 58 CO 0.00 -0.16 0.12 -1.58 1.83 0.00 0.00 175.22 175.44 2jng s TRP 59 N 1.81 3.33 0.13 10.12 0.52 -0.87 -0.61 118.94 133.37 2jng s TRP 59 Ca 0.11 0.22 -0.12 0.00 0.02 0.00 0.00 56.10 56.34 2jng s TRP 59 Cb -0.16 -2.18 -0.06 0.00 -1.15 0.00 0.00 33.47 29.92 2jng s TRP 59 CO 0.10 0.17 1.44 0.93 0.02 0.00 0.00 176.95 179.61 2jng h GLU 60 N 7.01 0.90 -0.52 4.98 4.39 -1.12 0.54 114.58 130.76 2jng h GLU 60 Ca -0.39 -0.51 -0.12 0.00 0.34 0.00 0.00 59.36 58.68 2jng h GLU 60 Cb 1.16 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.83 2jng h GLU 60 CO 0.71 1.16 -0.13 0.77 -1.16 0.00 0.00 179.01 180.36 2jng h SER 61 N 0.71 1.00 0.76 1.42 0.02 -1.95 -2.83 113.55 112.68 2jng h SER 61 Ca 0.04 -0.34 -0.25 0.00 -0.84 0.00 0.00 61.79 60.41 2jng h SER 61 Cb 1.04 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 2jng h SER 61 CO 0.10 1.12 -1.28 0.74 -1.14 0.00 0.00 176.83 176.38 2jng h THR 62 N 0.88 1.39 -0.71 -2.27 2.02 -1.92 -3.48 112.91 108.83 2jng h THR 62 Ca 0.13 -3.12 -0.17 0.00 0.77 0.00 0.00 66.41 64.03 2jng h THR 62 Cb 0.69 2.73 -0.04 0.00 -1.74 0.00 0.00 68.15 69.79 2jng h THR 62 CO 0.05 0.82 -0.18 0.61 0.37 0.00 0.00 175.52 177.20 2jng n GLY 63 N 1.46 0.61 3.14 2.16 0.00 0.19 -5.02 105.19 107.73 2jng n GLY 63 Ca -0.07 -0.62 -0.17 0.00 0.00 0.00 0.00 46.02 45.15 2jng n GLY 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jng s ARG 64 N -3.40 0.77 0.28 1.61 3.00 -1.16 -4.96 118.95 115.09 2jng s ARG 64 Ca 0.00 -0.87 -0.25 0.00 0.00 0.00 0.00 55.73 54.61 2jng s ARG 64 Cb 0.00 -0.72 -0.09 0.00 0.00 0.00 0.00 34.95 34.13 2jng s ARG 64 CO 0.00 0.16 0.88 0.99 0.00 0.00 0.00 175.30 177.33 2jng s THR 65 N -1.22 4.30 -0.03 0.02 2.01 -1.26 -2.05 115.64 117.41 2jng s THR 65 Ca -0.03 1.70 -0.11 0.00 0.31 0.00 0.00 61.69 63.55 2jng s THR 65 Cb -0.10 -4.00 0.02 0.00 0.01 0.00 0.00 72.50 68.43 2jng s THR 65 CO 0.02 0.20 0.25 -0.47 -0.69 0.00 0.00 174.62 173.93 2jng s TYR 66 N -1.54 -0.14 -0.35 4.92 5.04 0.64 -4.97 117.35 120.96 2jng s TYR 66 Ca 0.47 0.26 -0.16 0.00 -2.44 0.00 0.00 57.07 55.20 2jng s TYR 66 Cb -0.19 0.05 -0.01 0.00 0.35 0.00 0.00 41.96 42.17 2jng s TYR 66 CO 0.24 -0.30 0.38 1.67 -1.34 0.00 0.00 175.55 176.20 2jng s TRP 67 N -0.97 3.20 0.40 4.97 1.48 -1.25 -0.84 118.94 125.94 2jng s TRP 67 Ca -0.10 -0.02 0.08 0.00 -1.06 0.00 0.00 56.10 54.99 2jng s TRP 67 Cb -0.05 -2.71 -0.02 0.00 -1.16 0.00 0.00 33.47 29.53 2jng s TRP 67 CO 0.02 -0.46 0.40 0.08 -4.06 0.00 0.00 176.95 172.94 2jng s VAL 68 N 2.06 2.88 0.04 -0.66 1.01 -0.59 -4.79 120.40 120.35 2jng s VAL 68 Ca 0.12 -1.28 -0.21 0.00 0.00 0.00 0.00 61.98 60.62 2jng s VAL 68 Cb -0.16 -3.04 -0.06 0.00 0.00 0.00 0.00 36.38 33.12 2jng s VAL 68 CO 0.12 -0.03 0.61 -1.00 0.00 0.00 0.00 175.10 174.80 2jng s HIS 69 N -2.42 3.74 0.24 5.22 3.76 -1.26 -3.05 115.29 121.52 2jng s HIS 69 Ca 0.48 1.27 -0.10 0.00 -0.15 0.00 0.00 55.06 56.56 2jng s HIS 69 Cb -0.05 -2.59 0.35 0.00 1.11 0.00 0.00 32.58 31.41 2jng s HIS 69 CO 0.29 0.44 1.61 -1.49 -0.85 0.00 0.00 174.74 174.73 2jng h TRP 70 N 5.18 -0.34 0.00 1.40 4.06 -1.96 0.20 115.95 124.50 2jng h TRP 70 Ca -0.47 0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.55 2jng h TRP 70 Cb 1.21 0.27 0.00 0.00 -1.00 0.00 0.00 29.16 29.64 2jng h TRP 70 CO 0.66 -0.32 0.00 -2.39 -3.56 0.00 0.00 178.44 172.83 2jng n HIS 71 N -5.48 0.00 0.21 0.49 1.44 -1.26 -2.42 115.22 108.19 2jng n HIS 71 Ca 0.12 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.94 2jng n HIS 71 Cb 0.42 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.52 2jng n HIS 71 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 2jng n MET 72 N -0.87 0.53 -4.91 -1.40 2.81 0.71 -4.88 117.12 109.12 2jng n MET 72 Ca 0.12 0.04 -0.33 0.00 -1.81 0.00 0.00 57.70 55.73 2jng n MET 72 Cb 0.06 -1.72 -0.14 0.00 -0.71 0.00 0.00 33.22 30.70 2jng n MET 72 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 2jng s LEU 73 N -4.87 2.59 -0.27 4.03 0.05 -1.02 -3.74 118.68 115.45 2jng s LEU 73 Ca -0.00 -0.33 0.03 0.00 0.05 0.00 0.00 54.13 53.88 2jng s LEU 73 Cb 0.11 -1.55 0.07 0.00 -2.05 0.00 0.00 46.19 42.77 2jng s LEU 73 CO 0.81 0.23 -0.08 -0.70 -0.55 0.00 0.00 176.35 176.06 2jng s GLU 74 N -0.05 2.09 0.14 1.48 2.12 0.44 -4.94 118.70 119.98 2jng s GLU 74 Ca -0.04 -1.44 -0.34 0.00 0.36 0.00 0.00 54.97 53.51 2jng s GLU 74 Cb -0.14 -2.95 -0.16 0.00 0.26 0.00 0.00 34.13 31.15 2jng s GLU 74 CO 0.04 -0.64 1.32 0.44 -0.54 0.00 0.00 175.26 175.88 2jng n ILE 75 N 4.40 0.41 -0.08 -3.70 -5.35 -1.26 -0.20 119.36 113.58 2jng n ILE 75 Ca -0.11 -0.10 -0.09 0.00 -0.27 0.00 0.00 62.75 62.18 2jng n ILE 75 Cb 0.42 -0.99 -0.13 0.00 -1.74 0.00 0.00 39.64 37.20 2jng n ILE 75 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2jng n LEU 76 N 2.42 0.37 0.00 7.28 7.94 -0.41 -4.76 117.00 129.84 2jng n LEU 76 Ca 0.16 -0.01 0.00 0.00 -1.11 0.00 0.00 56.01 55.05 2jng n LEU 76 Cb 0.24 0.26 0.00 0.00 0.53 0.00 0.00 43.42 44.45 2jng n LEU 76 CO 0.62 0.46 0.00 0.61 -1.11 0.00 0.00 177.39 177.97 2jng n GLY 77 N 2.05 1.34 1.13 -3.96 0.00 0.30 -1.78 105.19 104.28 2jng n GLY 77 Ca -0.28 -0.54 0.04 0.00 0.00 0.00 0.00 46.02 45.24 2jng n GLY 77 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jng n PHE 78 N 3.28 0.97 0.95 1.61 3.72 -1.26 -3.91 117.46 122.82 2jng n PHE 78 Ca 0.00 -0.34 0.07 0.00 -0.05 0.00 0.00 57.45 57.13 2jng n PHE 78 Cb 0.00 -0.27 0.22 0.00 -0.94 0.00 0.00 39.48 38.49 2jng n PHE 78 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2jng n GLU 79 N 0.33 1.81 0.00 -1.08 4.71 -0.73 -5.23 120.64 120.45 2jng n GLU 79 Ca 0.13 -1.24 0.05 0.00 -0.01 0.00 0.00 57.16 56.09 2jng n GLU 79 Cb 0.67 -1.31 0.28 0.00 -1.01 0.00 0.00 31.44 30.07 2jng n GLU 79 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61