#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 0.04 0.00 2.12 2.43 -2.00 0.37 114.38 117.33 2jng h ARG 5 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2jng h ARG 5 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 2jng h ARG 5 CO 0.00 0.04 0.00 0.43 -1.51 0.00 0.00 179.97 178.93 2jng n SER 6 N -4.52 0.00 -0.18 -3.80 7.64 -1.26 -2.82 113.62 108.67 2jng n SER 6 Ca -0.03 -0.98 0.13 0.00 1.01 0.00 0.00 58.87 59.01 2jng n SER 6 Cb 0.10 0.00 0.43 0.00 -1.01 0.00 0.00 64.21 63.72 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 -0.97 0.69 -0.96 1.43 1.02 0.12 -4.68 120.64 117.30 2jng n GLU 7 Ca 0.20 -0.37 -0.29 0.00 -0.02 0.00 0.00 57.16 56.69 2jng n GLU 7 Cb 0.09 -1.49 0.19 0.00 -0.02 0.00 0.00 31.44 30.21 2jng n GLU 7 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2jng s PHE 8 N -2.56 1.90 0.25 -0.32 0.08 -1.13 -4.90 117.98 111.31 2jng s PHE 8 Ca 0.24 1.17 -0.04 0.00 0.12 0.00 0.00 56.93 58.42 2jng s PHE 8 Cb 0.19 -3.19 0.49 0.00 -0.57 0.00 0.00 43.02 39.94 2jng s PHE 8 CO 0.53 -3.05 1.68 0.00 -0.10 0.00 0.00 175.22 174.28 2jng h ALA 9 N -2.02 1.00 0.00 5.36 0.00 -1.91 -3.14 119.26 118.55 2jng h ALA 9 Ca -0.54 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2jng h ALA 9 Cb 1.31 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2jng h ALA 9 CO 0.54 -0.34 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 2jng n SER 10 N -5.16 0.37 0.00 0.00 3.41 -1.26 -5.00 113.62 105.98 2jng n SER 10 Ca 0.15 -0.99 0.00 0.00 -0.26 0.00 0.00 58.87 57.77 2jng n SER 10 Cb 0.48 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 2jng n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jng n GLY 11 N 0.01 1.52 0.32 5.00 0.00 -1.19 -4.69 105.19 106.16 2jng n GLY 11 Ca 0.00 -0.15 0.17 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.61 1.61 4.21 -1.92 -2.06 115.58 116.81 2jng h ASN 12 Ca 0.00 0.00 0.18 0.00 1.21 0.00 0.00 56.30 57.69 2jng h ASN 12 Cb 0.00 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.18 2jng h ASN 12 CO 0.00 0.00 0.44 0.74 -1.29 0.00 0.00 177.43 177.32 2jng h THR 13 N 0.00 0.70 -0.22 2.81 2.02 -1.94 0.15 112.91 116.43 2jng h THR 13 Ca 0.03 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.15 2jng h THR 13 Cb 0.17 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 2jng h THR 13 CO -0.00 0.00 -0.06 0.22 0.37 0.00 0.00 175.52 176.05 2jng h TYR 14 N 0.00 0.48 -0.14 3.16 3.20 -1.70 -1.16 116.97 120.81 2jng h TYR 14 Ca 0.29 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 2jng h TYR 14 Cb 1.17 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 2jng h TYR 14 CO -0.00 0.67 0.08 0.00 -1.64 0.00 0.00 178.16 177.27 2jng h ALA 15 N 0.74 1.87 -0.20 1.82 0.00 -0.93 -1.29 119.26 121.28 2jng h ALA 15 Ca 0.05 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 2jng h ALA 15 Cb 0.52 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2jng h ALA 15 CO 0.02 0.11 -0.51 1.25 0.00 0.00 0.00 179.25 180.12 2jng h LEU 16 N 0.19 0.62 0.17 0.00 5.85 -0.76 -1.20 115.31 120.18 2jng h LEU 16 Ca 0.05 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 2jng h LEU 16 Cb 0.01 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.86 2jng h LEU 16 CO -0.01 1.02 -0.08 0.22 -0.34 0.00 0.00 178.44 179.25 2jng h TYR 17 N 0.44 -0.21 -0.33 1.25 3.20 -0.17 -2.28 116.97 118.88 2jng h TYR 17 Ca 0.02 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2jng h TYR 17 Cb 1.04 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.37 2jng h TYR 17 CO 0.04 0.06 0.02 -0.39 -1.64 0.00 0.00 178.16 176.25 2jng h VAL 18 N -0.47 1.18 -0.73 1.81 -1.51 -1.29 0.95 116.25 116.20 2jng h VAL 18 Ca -0.02 -0.71 0.10 0.00 -1.23 0.00 0.00 66.70 64.84 2jng h VAL 18 Cb 0.36 0.91 -0.08 0.00 -2.13 0.00 0.00 31.29 30.36 2jng h VAL 18 CO 0.04 0.25 0.35 -0.09 -1.23 0.00 0.00 177.57 176.89 2jng h ARG 19 N 0.49 0.57 0.07 5.19 1.12 -1.08 -0.58 114.38 120.15 2jng h ARG 19 Ca 0.11 -0.03 -0.00 0.00 -1.11 0.00 0.00 59.98 58.94 2jng h ARG 19 Cb 0.29 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 30.12 2jng h ARG 19 CO 0.01 0.38 -0.03 0.22 -3.11 0.00 0.00 179.97 177.43 2jng h ASP 20 N 0.59 -0.07 0.40 -3.80 3.58 -0.66 -3.41 116.42 113.04 2jng h ASP 20 Ca 0.37 -0.41 -0.31 0.00 0.42 0.00 0.00 57.03 57.09 2jng h ASP 20 Cb 0.42 0.02 -0.04 0.00 1.72 0.00 0.00 39.33 41.45 2jng h ASP 20 CO -0.29 0.59 -1.76 0.74 -2.88 0.00 0.00 179.24 175.65 2jng h THR 21 N -0.97 0.83 -2.13 2.25 2.02 -0.89 -3.43 112.91 110.60 2jng h THR 21 Ca -0.01 -2.63 -0.54 0.00 0.77 0.00 0.00 66.41 64.00 2jng h THR 21 Cb 0.48 2.49 -0.08 0.00 -1.74 0.00 0.00 68.15 69.30 2jng h THR 21 CO 0.01 0.65 1.14 -0.22 0.37 0.00 0.00 175.52 177.48 2jng s LEU 22 N -6.47 3.22 0.41 2.58 0.20 -0.23 -4.98 118.68 113.41 2jng s LEU 22 Ca -0.10 -0.56 0.00 0.00 0.69 0.00 0.00 54.13 54.16 2jng s LEU 22 Cb 0.08 -2.56 -0.02 0.00 -0.43 0.00 0.00 46.19 43.26 2jng s LEU 22 CO 0.81 -1.83 0.62 0.00 -0.29 0.00 0.00 176.35 175.66 2jng s GLN 23 N 5.71 3.25 -0.05 1.98 -2.07 -1.26 -4.78 119.66 122.44 2jng s GLN 23 Ca 0.39 -0.43 -0.34 0.00 -1.82 0.00 0.00 55.36 53.16 2jng s GLN 23 Cb -0.07 -2.60 -0.12 0.00 -1.09 0.00 0.00 33.01 29.13 2jng s GLN 23 CO 0.11 -0.09 1.84 -2.30 -1.32 0.00 0.00 175.29 173.53 2jng n PRO 24 N -1.95 2.20 0.00 9.60 -0.02 -1.26 -1.51 135.00 142.05 2jng n PRO 24 Ca -0.01 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2jng n PRO 24 Cb 0.57 -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 4.26 1.52 3.73 -1.23 0.00 0.20 -4.98 105.19 108.69 2jng n GLY 25 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 2jng n GLY 25 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jng s MET 26 N -0.07 4.64 0.53 1.61 -1.94 -0.57 -4.70 119.30 118.80 2jng s MET 26 Ca 0.00 1.58 -0.21 0.00 -1.71 0.00 0.00 55.69 55.35 2jng s MET 26 Cb 0.00 -3.34 -0.06 0.00 2.01 0.00 0.00 34.83 33.45 2jng s MET 26 CO 0.00 0.13 1.18 0.50 -0.01 0.00 0.00 175.02 176.82 2jng s ARG 27 N -0.07 3.39 0.14 2.03 3.52 -1.26 -1.07 118.95 125.63 2jng s ARG 27 Ca 0.49 1.77 0.08 0.00 -0.13 0.00 0.00 55.73 57.93 2jng s ARG 27 Cb -0.26 -2.15 -0.04 0.00 -1.56 0.00 0.00 34.95 30.94 2jng s ARG 27 CO 0.32 -0.85 -0.18 0.14 -0.81 0.00 0.00 175.30 173.92 2jng s VAL 28 N -1.61 1.67 -0.14 7.11 -7.23 0.16 -1.41 120.40 118.95 2jng s VAL 28 Ca 0.71 -1.79 0.02 0.00 -1.81 0.00 0.00 61.98 59.11 2jng s VAL 28 Cb -0.28 -1.70 0.01 0.00 0.56 0.00 0.00 36.38 34.97 2jng s VAL 28 CO 0.33 -0.29 -0.21 -0.60 -0.31 0.00 0.00 175.10 174.01 2jng s ARG 29 N -2.58 2.96 -0.22 4.82 3.52 0.61 -0.77 118.95 127.28 2jng s ARG 29 Ca 0.12 -0.83 -0.29 0.00 -0.13 0.00 0.00 55.73 54.60 2jng s ARG 29 Cb -0.06 -2.41 0.00 0.00 -1.56 0.00 0.00 34.95 30.92 2jng s ARG 29 CO 0.05 -0.04 1.14 1.41 -0.81 0.00 0.00 175.30 177.06 2jng s MET 30 N 0.87 4.20 -0.16 5.12 -2.45 0.10 0.31 119.30 127.29 2jng s MET 30 Ca -0.06 1.42 0.17 0.00 -1.25 0.00 0.00 55.69 55.97 2jng s MET 30 Cb -0.15 -3.71 0.75 0.00 1.25 0.00 0.00 34.83 32.96 2jng s MET 30 CO -0.03 -0.73 1.66 1.28 1.05 0.00 0.00 175.02 178.25 2jng n LEU 31 N 6.59 5.06 -3.52 4.11 4.77 0.28 -0.31 117.00 133.99 2jng n LEU 31 Ca 0.13 -2.64 -0.16 0.00 -0.03 0.00 0.00 56.01 53.31 2jng n LEU 31 Cb 0.46 -0.61 -0.05 0.00 -2.33 0.00 0.00 43.42 40.88 2jng n LEU 31 CO 0.55 0.74 0.49 -0.62 -1.33 0.00 0.00 177.39 177.23 2jng s ASP 32 N -0.92 -0.60 -0.15 -1.43 2.15 -1.26 -4.85 116.67 109.61 2jng s ASP 32 Ca 0.52 0.56 -0.20 0.00 0.43 0.00 0.00 52.55 53.86 2jng s ASP 32 Cb 0.36 0.51 -0.03 0.00 -0.30 0.00 0.00 42.92 43.45 2jng s ASP 32 CO 0.21 -0.61 0.58 -0.62 -0.17 0.00 0.00 175.17 174.55 2jng s ASP 33 N -1.41 6.71 -0.28 -0.34 -1.08 -1.26 -3.18 116.67 115.83 2jng s ASP 33 Ca -0.08 0.86 0.01 0.00 -0.52 0.00 0.00 52.55 52.82 2jng s ASP 33 Cb -0.00 -2.33 0.16 0.00 -1.46 0.00 0.00 42.92 39.29 2jng s ASP 33 CO 0.05 -0.16 0.44 -0.47 0.52 0.00 0.00 175.17 175.55 2jng s TYR 34 N 1.33 -1.11 0.00 -5.34 5.04 0.14 -4.95 117.35 112.46 2jng s TYR 34 Ca 0.29 0.68 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 2jng s TYR 34 Cb -0.16 0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.16 2jng s TYR 34 CO 0.11 -0.91 0.00 0.39 -1.34 0.00 0.00 175.55 173.80 2jng n GLU 35 N 5.37 0.00 0.00 4.97 -0.58 -1.26 -2.12 120.64 127.02 2jng n GLU 35 Ca -0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2jng n GLU 35 Cb 0.50 -2.49 0.00 0.00 -0.57 0.00 0.00 31.44 28.88 2jng n GLU 35 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2jng n GLU 36 N -1.74 0.00 -3.64 3.49 0.28 -1.26 -5.14 120.64 112.63 2jng n GLU 36 Ca 0.00 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.70 2jng n GLU 36 Cb 0.00 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 32.83 2jng n GLU 36 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2jng s ILE 37 N 0.00 5.16 0.33 3.84 -1.09 -0.90 -5.10 121.20 123.43 2jng s ILE 37 Ca 0.00 -0.07 0.06 0.00 -2.23 0.00 0.00 60.65 58.41 2jng s ILE 37 Cb 0.00 -3.67 -0.07 0.00 -1.58 0.00 0.00 42.46 37.15 2jng s ILE 37 CO 0.00 -0.06 -0.01 -0.94 -1.23 0.00 0.00 174.94 172.70 2jng s SER 38 N -2.72 2.98 0.06 3.58 1.04 -1.26 0.28 113.70 117.67 2jng s SER 38 Ca 0.41 -1.30 -0.31 0.00 0.48 0.00 0.00 55.95 55.23 2jng s SER 38 Cb -0.12 -0.21 -0.06 0.00 0.10 0.00 0.00 66.02 65.73 2jng s SER 38 CO 0.26 -0.45 1.34 0.00 0.98 0.00 0.00 173.24 175.38 2jng s ALA 39 N -3.00 3.54 0.00 5.32 0.00 -1.19 -2.37 121.76 124.05 2jng s ALA 39 Ca 0.33 0.95 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2jng s ALA 39 Cb 0.07 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2jng s ALA 39 CO 0.15 -0.68 0.00 0.41 0.00 0.00 0.00 175.76 175.64 2jng n GLY 40 N 3.47 1.40 3.72 0.00 0.00 0.58 -4.92 105.19 109.44 2jng n GLY 40 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.74 6.70 0.08 1.61 1.01 -1.00 -4.82 116.67 118.51 2jng s ASP 41 Ca 0.00 2.49 0.08 0.00 0.71 0.00 0.00 52.55 55.83 2jng s ASP 41 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 2jng s ASP 41 CO 0.00 -0.74 -0.18 -1.61 0.21 0.00 0.00 175.17 172.84 2jng s GLU 42 N 1.03 1.89 0.02 8.23 2.02 -1.26 0.02 118.70 130.65 2jng s GLU 42 Ca 0.67 -1.10 -0.00 0.00 0.02 0.00 0.00 54.97 54.56 2jng s GLU 42 Cb -0.41 -2.14 0.00 0.00 0.10 0.00 0.00 34.13 31.69 2jng s GLU 42 CO 0.31 0.51 0.03 0.41 0.02 0.00 0.00 175.26 176.54 2jng n GLY 43 N 1.14 2.52 3.25 -1.39 0.00 0.05 -1.69 105.19 109.07 2jng n GLY 43 Ca -0.16 -1.20 -0.24 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.02 1.18 -0.24 1.61 2.12 0.13 0.38 118.70 121.86 2jng s GLU 44 Ca 0.01 -1.03 -0.16 0.00 0.36 0.00 0.00 54.97 54.14 2jng s GLU 44 Cb -0.00 -1.35 -0.03 0.00 0.26 0.00 0.00 34.13 33.00 2jng s GLU 44 CO 0.01 0.33 0.43 0.12 -0.54 0.00 0.00 175.26 175.61 2jng s PHE 45 N -1.01 3.30 -0.16 5.30 2.19 -0.23 -1.32 117.98 126.04 2jng s PHE 45 Ca 0.06 0.56 -0.06 0.00 0.33 0.00 0.00 56.93 57.82 2jng s PHE 45 Cb -0.09 -2.61 -0.08 0.00 -1.31 0.00 0.00 43.02 38.93 2jng s PHE 45 CO 0.03 -0.18 -0.19 0.54 1.83 0.00 0.00 175.22 177.26 2jng n ARG 46 N 5.12 0.34 -3.53 10.12 1.74 -1.19 0.60 116.66 129.87 2jng n ARG 46 Ca -0.07 0.13 -0.11 0.00 -0.77 0.00 0.00 57.85 57.03 2jng n ARG 46 Cb 0.50 -1.12 -0.03 0.00 -1.02 0.00 0.00 32.46 30.79 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 -2.29 1.21 0.11 5.56 0.00 -1.19 -4.68 119.66 118.38 2jng s GLN 47 Ca -0.22 -0.60 0.06 0.00 -0.00 0.00 0.00 55.36 54.61 2jng s GLN 47 Cb 0.08 0.54 -0.04 0.00 0.00 0.00 0.00 33.01 33.59 2jng s GLN 47 CO 0.29 -0.51 -0.14 -1.12 0.00 0.00 0.00 175.29 173.81 2jng s SER 48 N -2.78 1.99 -0.53 12.60 0.01 -1.26 -2.00 113.70 121.72 2jng s SER 48 Ca 0.02 -0.78 -0.22 0.00 1.31 0.00 0.00 55.95 56.29 2jng s SER 48 Cb 0.00 -0.07 0.05 0.00 0.21 0.00 0.00 66.02 66.21 2jng s SER 48 CO -0.12 -0.12 0.79 0.20 0.41 0.00 0.00 173.24 174.40 2jng s ASN 49 N -2.33 6.28 0.00 2.44 0.02 -1.13 -4.94 114.94 115.28 2jng s ASN 49 Ca 0.07 -0.64 0.00 0.00 -1.02 0.00 0.00 52.86 51.28 2jng s ASN 49 Cb -0.06 -2.37 0.00 0.00 0.02 0.00 0.00 41.25 38.85 2jng s ASN 49 CO 0.03 -1.07 0.00 -0.46 0.02 0.00 0.00 177.10 175.62 2jng n ASN 50 N 6.85 0.00 -2.78 -1.22 0.23 -1.26 -1.42 115.26 115.66 2jng n ASN 50 Ca -0.02 0.00 -0.02 0.00 -0.53 0.00 0.00 54.58 54.00 2jng n ASN 50 Cb 0.46 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 38.22 2jng n ASN 50 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2jng n GLY 51 N 0.00 1.73 3.59 4.83 0.00 -1.26 -5.11 105.19 108.97 2jng n GLY 51 Ca 0.00 -1.02 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 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 -3.25 2.25 0.16 1.61 -7.23 -0.51 -5.07 120.40 108.36 2jng s VAL 52 Ca 0.26 -2.07 -0.20 0.00 -1.81 0.00 0.00 61.98 58.15 2jng s VAL 52 Cb 0.36 -2.80 0.07 0.00 0.56 0.00 0.00 36.38 34.58 2jng s VAL 52 CO -0.03 -0.13 1.64 -0.65 -0.31 0.00 0.00 175.10 175.62 2jng h PRO 53 N 1.87 -0.15 -6.13 4.82 0.11 -1.93 -3.43 132.00 127.16 2jng h PRO 53 Ca -0.43 0.01 -0.63 0.00 0.11 0.00 0.00 66.00 65.06 2jng h PRO 53 Cb 1.25 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2jng h PRO 53 CO 0.73 -0.10 1.26 -0.35 -0.21 0.00 0.00 178.00 179.33 2jng n PRO 54 N -5.36 1.79 -4.62 1.05 -0.04 -1.26 -4.48 135.00 122.07 2jng n PRO 54 Ca 0.01 0.59 -0.22 0.00 -0.04 0.00 0.00 63.50 63.84 2jng n PRO 54 Cb 0.28 -2.69 -0.15 0.00 -0.04 0.00 0.00 33.50 30.89 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 5.83 1.07 -0.43 0.52 0.11 -1.22 -2.84 120.40 123.43 2jng s VAL 55 Ca 0.99 -0.57 -0.18 0.00 -2.93 0.00 0.00 61.98 59.30 2jng s VAL 55 Cb -0.68 -0.89 0.03 0.00 -1.53 0.00 0.00 36.38 33.30 2jng s VAL 55 CO 0.48 0.30 0.47 -1.58 -3.33 0.00 0.00 175.10 171.44 2jng s GLN 56 N -0.28 3.10 -0.06 1.54 2.00 -0.85 -2.04 119.66 123.08 2jng s GLN 56 Ca 0.04 -0.79 0.06 0.00 -2.00 0.00 0.00 55.36 52.67 2jng s GLN 56 Cb -0.06 -3.99 -0.01 0.00 0.80 0.00 0.00 33.01 29.75 2jng s GLN 56 CO -0.00 -0.91 -0.23 0.08 -0.50 0.00 0.00 175.29 173.72 2jng s VAL 57 N 2.20 2.26 -0.34 1.34 1.01 -0.76 -3.17 120.40 122.94 2jng s VAL 57 Ca 0.13 -1.00 -0.17 0.00 0.00 0.00 0.00 61.98 60.94 2jng s VAL 57 Cb -0.18 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 2jng s VAL 57 CO 0.13 0.57 0.44 0.12 0.00 0.00 0.00 175.10 176.37 2jng s PHE 58 N -0.26 3.20 -0.39 5.22 5.36 -0.44 -1.42 117.98 129.26 2jng s PHE 58 Ca -0.00 0.12 -0.24 0.00 -0.96 0.00 0.00 56.93 55.85 2jng s PHE 58 Cb -0.13 -2.79 0.01 0.00 -0.34 0.00 0.00 43.02 39.77 2jng s PHE 58 CO 0.03 -0.47 0.81 -1.58 -1.46 0.00 0.00 175.22 172.55 2jng s TRP 59 N 2.21 3.07 0.17 10.12 0.52 -0.50 0.22 118.94 134.75 2jng s TRP 59 Ca 0.16 0.49 -0.07 0.00 0.02 0.00 0.00 56.10 56.70 2jng s TRP 59 Cb -0.16 -3.52 0.04 0.00 -1.15 0.00 0.00 33.47 28.68 2jng s TRP 59 CO 0.12 -0.82 1.50 0.93 0.02 0.00 0.00 176.95 178.70 2jng h GLU 60 N 8.61 0.78 -0.32 4.98 5.08 -1.64 0.58 114.58 132.65 2jng h GLU 60 Ca -0.25 -0.43 -0.08 0.00 -1.00 0.00 0.00 59.36 57.60 2jng h GLU 60 Cb 1.09 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 2jng h GLU 60 CO 0.94 1.06 -0.14 0.66 -1.00 0.00 0.00 179.01 180.53 2jng h SER 61 N 0.62 0.54 0.00 1.42 4.64 -1.87 -3.30 113.55 115.61 2jng h SER 61 Ca 0.04 -0.15 -0.17 0.00 -0.47 0.00 0.00 61.79 61.04 2jng h SER 61 Cb 1.01 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.93 2jng h SER 61 CO 0.10 0.71 -1.09 0.41 -0.87 0.00 0.00 176.83 176.09 2jng n THR 62 N -4.18 1.50 0.00 2.95 -1.04 -1.13 -5.02 114.28 107.36 2jng n THR 62 Ca 0.01 0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 2jng n THR 62 Cb 0.34 -2.15 0.00 0.00 -1.82 0.00 0.00 70.33 66.70 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 1.48 1.34 3.22 3.41 0.00 0.20 -5.08 105.19 109.75 2jng n GLY 63 Ca -0.25 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.23 0.97 0.28 1.61 0.52 -1.21 -4.95 118.95 115.95 2jng s ARG 64 Ca 0.00 -1.20 -0.14 0.00 -0.52 0.00 0.00 55.73 53.87 2jng s ARG 64 Cb 0.00 -0.81 -0.08 0.00 0.52 0.00 0.00 34.95 34.58 2jng s ARG 64 CO 0.00 0.15 0.68 0.95 0.02 0.00 0.00 175.30 177.10 2jng s THR 65 N -2.15 4.73 -0.08 0.02 -4.23 -1.26 -1.41 115.64 111.26 2jng s THR 65 Ca 0.07 0.88 -0.15 0.00 -1.18 0.00 0.00 61.69 61.31 2jng s THR 65 Cb -0.05 -3.65 0.03 0.00 1.34 0.00 0.00 72.50 70.18 2jng s THR 65 CO 0.02 -0.09 0.37 -0.47 -0.54 0.00 0.00 174.62 173.91 2jng s TYR 66 N -1.87 -0.32 -0.35 3.99 5.04 -0.51 -4.97 117.35 118.37 2jng s TYR 66 Ca 0.50 0.66 -0.22 0.00 -2.44 0.00 0.00 57.07 55.58 2jng s TYR 66 Cb -0.11 0.14 0.01 0.00 0.35 0.00 0.00 41.96 42.34 2jng s TYR 66 CO 0.19 -0.32 0.71 -1.58 -1.34 0.00 0.00 175.55 173.21 2jng s TRP 67 N -0.62 3.14 0.53 4.97 0.51 -1.25 -1.83 118.94 124.39 2jng s TRP 67 Ca -0.07 0.48 0.05 0.00 -2.12 0.00 0.00 56.10 54.44 2jng s TRP 67 Cb -0.04 -3.26 0.02 0.00 -0.81 0.00 0.00 33.47 29.39 2jng s TRP 67 CO 0.03 -0.67 0.31 0.08 -0.51 0.00 0.00 176.95 176.19 2jng s VAL 68 N 2.90 1.57 -0.13 4.03 1.01 -0.86 -4.80 120.40 124.11 2jng s VAL 68 Ca 0.28 -1.61 -0.06 0.00 0.00 0.00 0.00 61.98 60.60 2jng s VAL 68 Cb -0.14 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 2jng s VAL 68 CO 0.15 0.00 0.06 -1.00 0.00 0.00 0.00 175.10 174.32 2jng s HIS 69 N -2.79 3.32 0.25 5.22 3.76 -1.26 -3.43 115.29 120.37 2jng s HIS 69 Ca 0.28 0.24 -0.03 0.00 -0.15 0.00 0.00 55.06 55.40 2jng s HIS 69 Cb -0.01 -1.95 0.52 0.00 1.11 0.00 0.00 32.58 32.25 2jng s HIS 69 CO 0.17 0.42 1.70 -1.49 -0.85 0.00 0.00 174.74 174.69 2jng h TRP 70 N 5.73 0.41 0.00 1.40 4.06 -1.92 -2.06 115.95 123.56 2jng h TRP 70 Ca -0.46 0.04 0.00 0.00 2.06 0.00 0.00 58.89 60.53 2jng h TRP 70 Cb 1.19 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 29.29 2jng h TRP 70 CO 0.64 -0.04 0.00 -2.39 -3.56 0.00 0.00 178.44 173.09 2jng n HIS 71 N -5.10 0.00 -0.15 0.49 1.44 -1.26 -1.82 115.22 108.82 2jng n HIS 71 Ca 0.16 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.93 2jng n HIS 71 Cb 0.49 -0.45 0.16 0.00 0.12 0.00 0.00 29.99 30.31 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 -1.45 2.72 -4.47 -1.40 0.00 -0.78 -4.83 117.12 106.91 2jng n MET 72 Ca 0.03 -2.06 -0.34 0.00 0.00 0.00 0.00 57.70 55.33 2jng n MET 72 Cb 0.09 -1.30 -0.11 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 -1.00 3.31 -0.08 3.17 1.02 -0.76 -0.56 118.68 123.79 2jng s LEU 73 Ca 0.25 -0.02 -0.03 0.00 0.02 0.00 0.00 54.13 54.35 2jng s LEU 73 Cb 0.13 -1.76 -0.04 0.00 0.02 0.00 0.00 46.19 44.54 2jng s LEU 73 CO 0.17 0.29 0.08 -0.70 0.02 0.00 0.00 176.35 176.21 2jng s GLU 74 N -0.36 3.19 -0.10 1.70 2.12 0.15 -4.89 118.70 120.51 2jng s GLU 74 Ca 0.06 -0.32 -0.19 0.00 0.36 0.00 0.00 54.97 54.88 2jng s GLU 74 Cb -0.12 -2.97 -0.04 0.00 0.26 0.00 0.00 34.13 31.26 2jng s GLU 74 CO 0.02 0.72 0.50 -1.50 -0.54 0.00 0.00 175.26 174.46 2jng s ILE 75 N -1.03 5.14 -0.52 -3.70 2.07 -1.26 -0.28 121.20 121.62 2jng s ILE 75 Ca 0.17 1.01 0.02 0.00 -1.41 0.00 0.00 60.65 60.45 2jng s ILE 75 Cb -0.12 -3.84 0.44 0.00 0.13 0.00 0.00 42.46 39.07 2jng s ILE 75 CO 0.06 0.34 1.61 0.18 -1.91 0.00 0.00 174.94 175.23 2jng n LEU 76 N 3.49 6.30 -3.65 8.50 4.32 -0.50 -4.84 117.00 130.63 2jng n LEU 76 Ca -0.07 -4.62 -0.41 0.00 -0.02 0.00 0.00 56.01 50.89 2jng n LEU 76 Cb 0.52 -0.69 -0.01 0.00 -1.62 0.00 0.00 43.42 41.62 2jng n LEU 76 CO 0.43 1.83 2.65 0.61 -1.22 0.00 0.00 177.39 181.69 2jng n GLY 77 N -0.75 4.54 3.17 -0.72 0.00 -1.26 -4.46 105.19 105.71 2jng n GLY 77 Ca 0.52 -1.73 -0.18 0.00 0.00 0.00 0.00 46.02 44.63 2jng n GLY 77 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2jng n PHE 78 N 4.64 -1.69 -0.08 1.61 1.16 -1.26 -4.78 117.46 117.05 2jng n PHE 78 Ca 0.56 0.29 -0.18 0.00 -1.87 0.00 0.00 57.45 56.25 2jng n PHE 78 Cb 0.34 -2.04 -0.13 0.00 -1.61 0.00 0.00 39.48 36.03 2jng n PHE 78 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 2jng n GLU 79 N -3.25 0.69 0.00 3.97 4.07 -1.26 -5.30 120.64 119.56 2jng n GLU 79 Ca -0.00 0.18 0.16 0.00 -0.06 0.00 0.00 57.16 57.43 2jng n GLU 79 Cb 0.52 -1.59 0.90 0.00 -0.06 0.00 0.00 31.44 31.21 2jng n GLU 79 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46