#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5s s THR 2 N 0.00 3.74 -0.32 2.61 -4.23 -1.26 -4.93 115.64 111.25 2k5s s THR 2 Ca 0.00 0.57 0.23 0.00 -1.18 0.00 0.00 61.69 61.30 2k5s s THR 2 Cb 0.00 -3.42 0.23 0.00 1.34 0.00 0.00 72.50 70.65 2k5s s THR 2 CO 0.00 -0.74 1.69 1.17 -0.54 0.00 0.00 174.62 176.20 2k5s n LYS 3 N -3.12 0.17 -0.01 3.99 4.81 -1.26 -2.81 118.16 119.93 2k5s n LYS 3 Ca 0.07 0.55 -0.11 0.00 -0.87 0.00 0.00 58.31 57.94 2k5s n LYS 3 Cb 0.55 -1.93 -0.05 0.00 0.02 0.00 0.00 35.03 33.63 2k5s n LYS 3 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 2k5s h THR 4 N 0.00 0.21 -0.94 3.15 1.35 -1.99 0.03 112.91 114.73 2k5s h THR 4 Ca 0.00 0.00 0.16 0.00 -0.55 0.00 0.00 66.41 66.02 2k5s h THR 4 Cb 0.16 0.21 -0.08 0.00 -1.73 0.00 0.00 68.15 66.71 2k5s h THR 4 CO 0.00 0.00 0.60 0.44 -0.25 0.00 0.00 175.52 176.31 2k5s h ASP 5 N -0.43 0.69 0.61 5.36 3.32 -1.91 0.10 116.42 124.16 2k5s h ASP 5 Ca 0.09 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 2k5s h ASP 5 Cb 0.59 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 40.06 2k5s h ASP 5 CO -0.39 0.32 -0.30 1.88 -1.72 0.00 0.00 179.24 179.03 2k5s h TYR 6 N 0.71 -0.77 -0.61 4.55 -1.99 -1.35 -2.15 116.97 115.37 2k5s h TYR 6 Ca 0.49 -0.02 -0.05 0.00 2.00 0.00 0.00 58.73 61.15 2k5s h TYR 6 Cb 0.79 0.25 -0.03 0.00 2.00 0.00 0.00 36.73 39.75 2k5s h TYR 6 CO -0.00 -0.47 0.17 -0.07 -0.00 0.00 0.00 178.16 177.79 2k5s h LEU 7 N -1.21 0.90 0.69 3.88 3.38 -0.85 -0.89 115.31 121.21 2k5s h LEU 7 Ca -0.08 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 2k5s h LEU 7 Cb 0.64 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.16 2k5s h LEU 7 CO 0.14 0.88 -0.33 0.24 0.09 0.00 0.00 178.44 179.46 2k5s h MET 8 N 0.87 -0.90 -0.65 1.13 2.86 -0.90 0.65 114.93 117.99 2k5s h MET 8 Ca 0.19 0.06 0.13 0.00 -2.06 0.00 0.00 59.70 58.03 2k5s h MET 8 Cb 0.32 0.20 -0.10 0.00 0.06 0.00 0.00 31.60 32.08 2k5s h MET 8 CO -0.00 -0.59 0.12 -0.09 1.06 0.00 0.00 176.91 177.42 2k5s h ARG 9 N -1.22 0.23 0.37 1.72 2.43 -1.41 -1.39 114.38 115.12 2k5s h ARG 9 Ca -0.10 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 2k5s h ARG 9 Cb 0.73 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2k5s h ARG 9 CO 0.16 0.15 -0.18 -0.07 -1.51 0.00 0.00 179.97 178.52 2k5s h LEU 10 N 0.24 -0.42 -2.04 3.80 3.38 -1.14 -3.22 115.31 115.92 2k5s h LEU 10 Ca 0.35 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2k5s h LEU 10 Cb 0.56 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2k5s h LEU 10 CO -0.46 -0.03 0.27 -0.09 0.09 0.00 0.00 178.44 178.21 2k5s h ARG 11 N -0.89 0.00 -0.13 1.13 2.43 0.86 0.71 114.38 118.49 2k5s h ARG 11 Ca -0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2k5s h ARG 11 Cb 0.54 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 2k5s h ARG 11 CO 0.08 0.00 0.00 1.63 -1.51 0.00 0.00 179.97 180.17 2k5s n LYS 12 N -2.82 2.09 -0.17 0.20 4.01 -0.57 -4.34 118.16 116.56 2k5s n LYS 12 Ca -0.02 -1.60 -0.03 0.00 -0.51 0.00 0.00 58.31 56.14 2k5s n LYS 12 Cb 0.31 -1.46 0.03 0.00 -0.51 0.00 0.00 35.03 33.40 2k5s n LYS 12 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2k5s n THR 14 N -5.40 0.00 -3.83 0.00 -1.04 -1.26 -5.00 114.28 97.74 2k5s n THR 14 Ca 0.05 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.93 2k5s n THR 14 Cb 0.31 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.68 2k5s n THR 14 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2k5s s THR 15 N -3.08 -0.01 -0.02 12.58 -4.23 -1.26 -5.06 115.64 114.55 2k5s s THR 15 Ca 0.00 0.03 -0.18 0.00 -1.18 0.00 0.00 61.69 60.36 2k5s s THR 15 Cb 0.00 -0.11 -0.10 0.00 1.34 0.00 0.00 72.50 73.63 2k5s s THR 15 CO 0.00 0.01 0.76 0.40 -0.54 0.00 0.00 174.62 175.25 2k5s h ILE 16 N 5.24 0.01 -0.36 2.99 2.04 -1.97 -1.89 117.51 123.57 2k5s h ILE 16 Ca -0.28 -0.53 0.10 0.00 1.00 0.00 0.00 64.86 65.16 2k5s h ILE 16 Cb 1.19 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 2k5s h ILE 16 CO 0.47 0.00 0.55 -2.24 0.00 0.00 0.00 178.15 176.93 2k5s h ASP 17 N -1.17 0.00 0.09 1.72 2.03 -2.02 0.40 116.42 117.47 2k5s h ASP 17 Ca -0.07 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.10 2k5s h ASP 17 Cb 0.50 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.02 2k5s h ASP 17 CO 0.11 0.00 -0.59 0.74 -1.03 0.00 0.00 179.24 178.47 2k5s h THR 18 N 0.00 1.57 -1.28 1.15 2.02 -1.97 -3.30 112.91 111.09 2k5s h THR 18 Ca 0.17 -2.42 0.39 0.00 0.77 0.00 0.00 66.41 65.32 2k5s h THR 18 Cb 1.27 3.16 -0.10 0.00 -1.74 0.00 0.00 68.15 70.74 2k5s h THR 18 CO -0.00 0.67 0.85 0.25 0.37 0.00 0.00 175.52 177.66 2k5s h LEU 19 N -0.48 0.24 0.30 2.58 5.85 0.65 0.84 115.31 125.29 2k5s h LEU 19 Ca -0.10 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2k5s h LEU 19 Cb 1.44 0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.54 2k5s h LEU 19 CO 0.11 -0.07 -0.14 -0.33 -0.34 0.00 0.00 178.44 177.67 2k5s h GLU 20 N 0.15 -0.39 -0.66 1.25 4.39 -1.63 -1.91 114.58 115.79 2k5s h GLU 20 Ca 0.73 0.03 0.14 0.00 0.34 0.00 0.00 59.36 60.60 2k5s h GLU 20 Cb 2.35 0.09 -0.11 0.00 -0.10 0.00 0.00 28.75 30.97 2k5s h GLU 20 CO -0.29 -0.08 0.03 -0.09 -1.16 0.00 0.00 179.01 177.41 2k5s h ARG 21 N -0.71 0.13 0.06 2.33 2.43 0.62 -2.00 114.38 117.23 2k5s h ARG 21 Ca -0.04 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2k5s h ARG 21 Cb 0.49 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2k5s h ARG 21 CO 0.07 0.09 -0.03 0.28 -1.51 0.00 0.00 179.97 178.86 2k5s h VAL 22 N 0.14 1.15 -0.81 0.20 2.07 -1.40 -3.28 116.25 114.31 2k5s h VAL 22 Ca 0.35 -0.72 0.19 0.00 0.82 0.00 0.00 66.70 67.34 2k5s h VAL 22 Cb 0.59 1.62 -0.14 0.00 -1.52 0.00 0.00 31.29 31.83 2k5s h VAL 22 CO -0.55 0.18 -0.01 0.40 0.02 0.00 0.00 177.57 177.60 2k5s h ILE 23 N -0.41 0.26 -0.31 4.57 2.04 -0.58 1.28 117.51 124.36 2k5s h ILE 23 Ca -0.01 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 65.87 2k5s h ILE 23 Cb 0.36 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 2k5s h ILE 23 CO 0.01 0.01 0.21 -0.08 0.00 0.00 0.00 178.15 178.31 2k5s h GLU 24 N 0.08 0.21 0.56 2.37 4.81 -1.57 -1.66 114.58 119.38 2k5s h GLU 24 Ca 0.45 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.64 2k5s h GLU 24 Cb 0.81 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.14 2k5s h GLU 24 CO -0.74 0.14 -0.27 -0.22 -0.73 0.00 0.00 179.01 177.19 2k5s h LYS 25 N 0.21 -0.73 -0.41 1.92 3.64 0.15 -2.55 116.57 118.80 2k5s h LYS 25 Ca 0.13 0.05 0.12 0.00 -1.27 0.00 0.00 60.65 59.68 2k5s h LYS 25 Cb 0.26 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 2k5s h LYS 25 CO -0.02 -0.44 0.46 -0.91 -2.27 0.00 0.00 179.45 176.26 2k5s h ASN 26 N -0.88 0.00 -0.61 4.20 2.35 -0.49 -3.26 115.58 116.89 2k5s h ASN 26 Ca -0.08 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 55.79 2k5s h ASN 26 Cb 0.63 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.88 2k5s h ASN 26 CO 0.13 0.00 -0.21 0.50 -1.65 0.00 0.00 177.43 176.20 2k5s h LYS 27 N 0.00 -0.05 0.00 0.81 3.64 -0.89 -2.37 116.57 117.71 2k5s h LYS 27 Ca 0.20 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.29 2k5s h LYS 27 Cb 1.11 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 2k5s h LYS 27 CO -0.00 -0.04 -1.71 0.66 -2.27 0.00 0.00 179.45 176.09 2k5s n TYR 28 N -5.44 1.00 1.29 1.91 4.02 -1.23 -2.94 117.16 115.77 2k5s n TYR 28 Ca 0.07 0.36 0.12 0.00 -0.01 0.00 0.00 57.90 58.44 2k5s n TYR 28 Cb 0.34 -1.19 0.65 0.00 -0.02 0.00 0.00 39.34 39.13 2k5s n TYR 28 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2k5s n GLU 29 N -3.04 0.50 0.00 -0.72 0.28 -1.15 -4.31 120.64 112.19 2k5s n GLU 29 Ca -0.17 0.04 0.00 0.00 -0.16 0.00 0.00 57.16 56.87 2k5s n GLU 29 Cb 1.05 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 32.42 2k5s n GLU 29 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2k5s n LEU 30 N -1.19 0.00 0.00 -1.84 4.32 -0.90 -5.10 117.00 112.29 2k5s n LEU 30 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.13 2k5s n LEU 30 Cb 0.15 -0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 2k5s n LEU 30 CO 0.17 -0.01 0.00 -1.54 -1.22 0.00 0.00 177.39 174.79 2k5s n SER 31 N -1.07 0.00 -0.29 -1.43 3.41 -1.15 -4.58 113.62 108.51 2k5s n SER 31 Ca 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.62 2k5s n SER 31 Cb 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.01 2k5s n SER 31 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2k5s n ASP 32 N 0.00 -0.42 -0.31 4.04 2.03 -1.26 0.74 116.55 121.37 2k5s n ASP 32 Ca 0.00 1.33 0.15 0.00 0.52 0.00 0.00 54.79 56.79 2k5s n ASP 32 Cb 0.00 -0.34 0.33 0.00 -0.72 0.00 0.00 41.12 40.39 2k5s n ASP 32 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2k5s h ASP 33 N 0.00 0.33 0.00 1.67 1.82 -2.00 -2.65 116.42 115.60 2k5s h ASP 33 Ca 0.30 0.16 -0.09 0.00 -0.39 0.00 0.00 57.03 57.01 2k5s h ASP 33 Cb 0.49 0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.63 2k5s h ASP 33 CO -0.77 -0.03 -0.53 -0.33 -1.61 0.00 0.00 179.24 175.97 2k5s h GLU 34 N 0.38 0.00 0.00 0.28 5.08 -0.07 -3.39 114.58 116.86 2k5s h GLU 34 Ca 0.59 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.95 2k5s h GLU 34 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2k5s h GLU 34 CO -0.55 0.91 0.83 -0.07 -1.00 0.00 0.00 179.01 179.14 2k5s h LEU 35 N -1.00 0.00 -1.01 1.33 -0.00 0.71 0.13 115.31 115.46 2k5s h LEU 35 Ca -0.14 0.00 0.11 0.00 -0.00 0.00 0.00 57.88 57.85 2k5s h LEU 35 Cb 1.06 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 41.64 2k5s h LEU 35 CO -0.09 0.00 0.64 -0.33 -0.00 0.00 0.00 178.44 178.66 2k5s h GLU 36 N 0.00 1.01 -0.02 1.13 5.08 -1.75 0.23 114.58 120.26 2k5s h GLU 36 Ca 0.00 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2k5s h GLU 36 Cb 1.67 -0.23 -0.05 0.00 0.50 0.00 0.00 28.75 30.64 2k5s h GLU 36 CO 0.00 0.67 -0.26 -0.07 -1.00 0.00 0.00 179.01 178.35 2k5s h LEU 37 N 1.04 -0.77 -1.09 1.33 3.38 -1.07 1.00 115.31 119.14 2k5s h LEU 37 Ca 0.48 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.52 2k5s h LEU 37 Cb 0.41 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2k5s h LEU 37 CO -0.24 -0.32 0.16 0.15 0.09 0.00 0.00 178.44 178.27 2k5s h PHE 38 N -0.38 0.82 0.18 1.13 3.57 -1.21 0.88 116.94 121.93 2k5s h PHE 38 Ca 0.07 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2k5s h PHE 38 Cb 0.48 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.98 2k5s h PHE 38 CO -0.30 0.67 -0.09 1.88 -2.23 0.00 0.00 178.31 178.25 2k5s h TYR 39 N 0.78 -0.22 -0.76 0.41 0.05 0.12 0.14 116.97 117.49 2k5s h TYR 39 Ca 0.18 -0.01 0.13 0.00 0.05 0.00 0.00 58.73 59.09 2k5s h TYR 39 Cb 0.24 0.07 -0.05 0.00 1.01 0.00 0.00 36.73 38.01 2k5s h TYR 39 CO 0.01 0.02 0.50 1.03 -1.05 0.00 0.00 178.16 178.68 2k5s h SER 40 N -1.02 0.46 0.00 3.88 0.87 0.99 -3.03 113.55 115.71 2k5s h SER 40 Ca -0.02 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2k5s h SER 40 Cb 0.34 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.23 2k5s h SER 40 CO 0.04 0.25 -0.14 0.00 -0.53 0.00 0.00 176.83 176.45 2k5s h ALA 41 N 1.64 0.01 -0.96 6.23 0.00 -0.88 -3.40 119.26 121.90 2k5s h ALA 41 Ca 0.37 -0.18 0.22 0.00 0.00 0.00 0.00 54.91 55.32 2k5s h ALA 41 Cb 0.73 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 2k5s h ALA 41 CO -0.13 0.12 0.62 0.00 0.00 0.00 0.00 179.25 179.87 2k5s h ALA 42 N -0.91 2.15 -0.18 0.00 0.00 -0.70 -2.69 119.26 116.92 2k5s h ALA 42 Ca -0.01 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.99 2k5s h ALA 42 Cb 0.22 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2k5s h ALA 42 CO -0.01 -0.47 -0.17 0.22 0.00 0.00 0.00 179.25 178.82 2k5s h ASP 43 N 0.46 -0.54 -0.99 0.00 1.82 -1.74 -2.07 116.42 113.36 2k5s h ASP 43 Ca 0.52 0.10 0.34 0.00 -0.39 0.00 0.00 57.03 57.60 2k5s h ASP 43 Cb 1.22 0.26 -0.16 0.00 0.68 0.00 0.00 39.33 41.33 2k5s h ASP 43 CO -0.23 -0.21 0.49 0.45 -1.61 0.00 0.00 179.24 178.13 2k5s h HIS 44 N -0.19 0.78 0.00 0.28 3.86 -1.71 1.66 115.15 119.83 2k5s h HIS 44 Ca 0.12 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 2k5s h HIS 44 Cb 0.36 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.65 2k5s h HIS 44 CO -0.31 -0.29 0.00 -2.13 0.86 0.00 0.00 177.93 176.06 2k5s n ARG 45 N -5.16 0.12 -0.05 2.45 3.00 -0.78 -3.57 116.66 112.66 2k5s n ARG 45 Ca 0.32 0.39 -0.14 0.00 -0.00 0.00 0.00 57.85 58.41 2k5s n ARG 45 Cb 1.03 -1.74 -0.13 0.00 0.00 0.00 0.00 32.46 31.62 2k5s n ARG 45 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2k5s h LEU 46 N 0.00 0.06 -1.19 6.15 6.46 0.25 -3.10 115.31 123.94 2k5s h LEU 46 Ca 0.00 -0.90 0.01 0.00 -0.12 0.00 0.00 57.88 56.87 2k5s h LEU 46 Cb 0.29 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 40.16 2k5s h LEU 46 CO 0.00 0.96 0.55 0.00 -0.62 0.00 0.00 178.44 179.33 2k5s h ALA 47 N 0.10 1.42 0.43 1.25 0.00 -1.63 0.26 119.26 121.10 2k5s h ALA 47 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2k5s h ALA 47 Cb 0.98 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2k5s h ALA 47 CO 0.02 0.53 -0.20 1.05 0.00 0.00 0.00 179.25 180.64 2k5s h GLU 48 N 1.11 -0.55 -0.75 0.00 -0.00 -1.71 -2.40 114.58 110.28 2k5s h GLU 48 Ca 0.31 0.04 0.11 0.00 -0.00 0.00 0.00 59.36 59.81 2k5s h GLU 48 Cb -0.10 0.13 -0.05 0.00 -0.00 0.00 0.00 28.75 28.72 2k5s h GLU 48 CO -0.07 -0.35 0.49 -0.07 -0.00 0.00 0.00 179.01 179.01 2k5s h LEU 49 N -0.60 0.56 -1.49 3.06 3.38 -1.26 -0.12 115.31 118.83 2k5s h LEU 49 Ca -0.06 0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.07 2k5s h LEU 49 Cb 0.46 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 2k5s h LEU 49 CO 0.10 0.32 0.53 0.74 0.09 0.00 0.00 178.44 180.22 2k5s h THR 50 N 0.61 0.81 0.00 0.22 2.02 0.02 -3.37 112.91 113.22 2k5s h THR 50 Ca 0.35 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.36 2k5s h THR 50 Cb 0.54 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 2k5s h THR 50 CO -0.13 0.09 0.00 1.15 0.37 0.00 0.00 175.52 177.00 2k5s n MET 51 N -4.50 0.00 0.00 6.66 -0.00 -0.26 -5.09 117.12 113.92 2k5s n MET 51 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.85 2k5s n MET 51 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 33.22 33.73 2k5s n MET 51 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 2k5s n ASN 52 N 0.00 0.00 0.00 3.17 6.94 -0.22 -5.05 115.26 120.10 2k5s n ASN 52 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 2k5s n ASN 52 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2k5s n ASN 52 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2k5s n LYS 53 N 0.00 2.99 -3.73 -3.83 5.02 -1.21 -5.01 118.16 112.39 2k5s n LYS 53 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 2k5s n LYS 53 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 34.85 2k5s n LYS 53 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2k5s s LEU 54 N 0.00 1.18 0.00 -0.35 2.96 -1.26 -4.69 118.68 116.52 2k5s s LEU 54 Ca 0.00 -0.83 0.00 0.00 -0.22 0.00 0.00 54.13 53.08 2k5s s LEU 54 Cb 0.00 -0.59 0.00 0.00 0.50 0.00 0.00 46.19 46.10 2k5s s LEU 54 CO 0.00 -0.31 0.00 -1.22 -1.32 0.00 0.00 176.35 173.50 2k5s n TYR 55 N 5.05 0.00 0.00 5.38 4.02 -1.26 -5.03 117.16 125.32 2k5s n TYR 55 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.80 2k5s n TYR 55 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 2k5s n TYR 55 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2k5s n ASP 56 N 0.00 0.00 0.00 7.72 2.03 -1.26 -5.07 116.55 119.97 2k5s n ASP 56 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2k5s n ASP 56 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2k5s n ASP 56 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2k5s n LYS 57 N 0.00 0.00 -4.01 -0.67 5.02 -1.26 -5.14 118.16 112.10 2k5s n LYS 57 Ca 0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.95 2k5s n LYS 57 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 34.86 2k5s n LYS 57 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2k5s s ILE 58 N 0.00 2.71 0.82 -0.18 1.09 -1.26 -5.12 121.20 119.26 2k5s s ILE 58 Ca 0.00 -0.79 -0.14 0.00 -1.10 0.00 0.00 60.65 58.62 2k5s s ILE 58 Cb 0.00 -2.23 0.01 0.00 -1.06 0.00 0.00 42.46 39.19 2k5s s ILE 58 CO 0.00 0.43 0.66 -2.65 -0.10 0.00 0.00 174.94 173.28 2k5s n PRO 59 N 4.69 0.09 0.11 2.79 -0.02 -1.26 -4.83 135.00 136.57 2k5s n PRO 59 Ca -0.19 0.08 0.10 0.00 -2.02 0.00 0.00 63.50 61.47 2k5s n PRO 59 Cb 0.50 -1.99 0.44 0.00 -0.02 0.00 0.00 33.50 32.43 2k5s n PRO 59 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2k5s n PRO 60 N -1.66 0.13 -0.31 0.52 -0.04 -1.26 -2.95 135.00 129.44 2k5s n PRO 60 Ca 0.10 0.46 -0.04 0.00 -0.04 0.00 0.00 63.50 63.97 2k5s n PRO 60 Cb 0.51 -1.80 0.08 0.00 -0.04 0.00 0.00 33.50 32.25 2k5s n PRO 60 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2k5s h THR 61 N 0.00 1.24 0.06 0.52 2.02 -2.02 -3.30 112.91 111.43 2k5s h THR 61 Ca 0.00 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 2k5s h THR 61 Cb 0.22 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 2k5s h THR 61 CO 0.00 0.26 -0.03 0.58 0.37 0.00 0.00 175.52 176.71 2k5s h VAL 62 N 1.15 1.18 0.00 3.16 2.07 -1.89 -3.17 116.25 118.75 2k5s h VAL 62 Ca 0.29 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2k5s h VAL 62 Cb 0.01 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2k5s h VAL 62 CO -0.05 0.21 0.12 0.79 0.02 0.00 0.00 177.57 178.66 2k5s n TRP 63 N -4.95 0.50 0.03 1.57 5.03 -1.24 0.23 117.44 118.61 2k5s n TRP 63 Ca -0.08 0.26 -0.04 0.00 3.03 0.00 0.00 57.50 60.67 2k5s n TRP 63 Cb 0.22 -0.83 -0.10 0.00 -1.03 0.00 0.00 31.31 29.57 2k5s n TRP 63 CO 0.00 0.00 0.00 1.96 -0.03 0.00 0.00 177.69 179.62 2k5s h GLN 64 N 0.00 0.00 0.00 -0.99 4.20 -1.68 -3.42 115.11 113.22 2k5s h GLN 64 Ca 0.00 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 2k5s h GLN 64 Cb 0.24 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 2k5s h GLN 64 CO 0.00 0.49 -1.14 0.72 -0.67 0.00 0.00 178.83 178.23 2k5s n HIS 65 N -3.05 0.00 -3.66 2.96 8.25 0.32 -5.03 115.22 115.01 2k5s n HIS 65 Ca -0.10 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.14 2k5s n HIS 65 Cb 0.92 -0.45 0.05 0.00 1.12 0.00 0.00 29.99 31.63 2k5s n HIS 65 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2k5s n VAL 66 N -4.05 -4.29 0.00 1.59 0.31 0.64 -4.80 118.33 107.74 2k5s n VAL 66 Ca -0.19 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 2k5s n VAL 66 Cb 0.49 -3.95 0.00 0.00 -0.91 0.00 0.00 33.84 29.47 2k5s n VAL 66 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2k5s n LYS 67 N -4.39 0.00 -1.36 5.55 5.02 -1.26 -5.03 118.16 116.70 2k5s n LYS 67 Ca -0.21 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.73 2k5s n LYS 67 Cb 0.64 -0.02 0.09 0.00 -0.02 0.00 0.00 35.03 35.72 2k5s n LYS 67 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2k5s n HIS 68 N -2.38 0.93 -3.80 2.13 8.25 -1.26 -5.00 115.22 114.08 2k5s n HIS 68 Ca 0.00 0.40 0.00 0.00 -0.26 0.00 0.00 57.72 57.86 2k5s n HIS 68 Cb 0.00 -2.11 0.00 0.00 1.12 0.00 0.00 29.99 29.01 2k5s n HIS 68 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k5s n HIS 69 N -2.57 -0.39 -3.66 4.41 1.44 -1.26 -5.09 115.22 108.10 2k5s n HIS 69 Ca 0.13 -0.27 -0.11 0.00 -2.01 0.00 0.00 57.72 55.46 2k5s n HIS 69 Cb 0.49 0.12 -0.08 0.00 0.12 0.00 0.00 29.99 30.65 2k5s n HIS 69 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k5s s HIS 70 N -3.35 -0.80 0.62 -1.40 3.76 -1.26 -5.16 115.29 107.70 2k5s s HIS 70 Ca 0.09 1.79 -0.14 0.00 -0.15 0.00 0.00 55.06 56.65 2k5s s HIS 70 Cb -0.00 0.36 -0.03 0.00 1.11 0.00 0.00 32.58 34.02 2k5s s HIS 70 CO 0.00 -0.40 1.05 -1.01 -0.85 0.00 0.00 174.74 173.54 2k5s s HIS 71 N 0.85 3.10 -0.00 1.40 3.76 -1.26 -5.06 115.29 118.08 2k5s s HIS 71 Ca -0.04 1.47 -0.30 0.00 -0.15 0.00 0.00 55.06 56.04 2k5s s HIS 71 Cb -0.05 -2.93 0.10 0.00 1.11 0.00 0.00 32.58 30.81 2k5s s HIS 71 CO -0.07 -1.05 1.10 -3.38 -0.85 0.00 0.00 174.74 170.48 2k5s s HIS 72 N -2.69 -0.15 -1.89 1.40 -3.43 -1.26 -5.35 115.29 101.92 2k5s s HIS 72 Ca 0.61 -0.01 0.00 0.00 -0.80 0.00 0.00 55.06 54.86 2k5s s HIS 72 Cb -0.15 0.56 0.00 0.00 -1.43 0.00 0.00 32.58 31.57 2k5s s HIS 72 CO 0.43 -0.47 0.47 1.58 -2.00 0.00 0.00 174.74 174.75