#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1knz n SER 3 N 0.00 1.67 0.00 1.61 3.41 -1.26 -2.69 113.62 116.36 1knz n SER 3 Ca 0.00 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.15 1knz n SER 3 Cb 0.00 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1knz n SER 3 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1knz n MET 4 N 0.09 0.00 -0.12 4.33 0.00 -1.26 -0.80 117.12 119.36 1knz n MET 4 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 57.70 57.74 1knz n MET 4 Cb 0.17 -1.12 0.02 0.00 0.00 0.00 0.00 33.22 32.29 1knz n MET 4 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1knz n GLU 5 N -0.62 0.95 -0.29 0.03 1.02 -1.26 -4.81 120.64 115.66 1knz n GLU 5 Ca 0.00 -1.16 0.02 0.00 -0.02 0.00 0.00 57.16 56.00 1knz n GLU 5 Cb 0.00 -0.77 0.09 0.00 -0.02 0.00 0.00 31.44 30.74 1knz n GLU 5 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1knz h SER 6 N 0.00 -0.85 -0.54 1.62 4.64 -1.33 -0.56 113.55 116.53 1knz h SER 6 Ca 0.00 0.25 -0.05 0.00 -0.47 0.00 0.00 61.79 61.52 1knz h SER 6 Cb 0.96 0.54 -0.02 0.00 -0.31 0.00 0.00 62.40 63.56 1knz h SER 6 CO 0.00 -0.28 0.13 0.74 -0.87 0.00 0.00 176.83 176.55 1knz h THR 7 N -0.01 1.24 -0.66 2.95 2.02 -1.86 -1.55 112.91 115.04 1knz h THR 7 Ca 0.38 -0.87 -0.06 0.00 0.77 0.00 0.00 66.41 66.64 1knz h THR 7 Cb 0.60 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1knz h THR 7 CO -0.85 0.32 0.18 -0.61 0.37 0.00 0.00 175.52 174.93 1knz h GLN 8 N 0.76 1.03 0.04 6.66 4.15 -1.44 0.60 115.11 126.91 1knz h GLN 8 Ca 0.17 -0.22 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 1knz h GLN 8 Cb 0.34 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.88 1knz h GLN 8 CO 0.00 0.90 -0.02 1.96 -1.93 0.00 0.00 178.83 179.74 1knz h GLN 9 N 0.99 -0.05 -0.65 1.69 4.20 -0.85 -1.85 115.11 118.59 1knz h GLN 9 Ca 0.21 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.94 1knz h GLN 9 Cb 0.32 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1knz h GLN 9 CO -0.00 0.09 0.43 1.98 -0.67 0.00 0.00 178.83 180.65 1knz h MET 10 N -0.18 0.85 -0.83 1.46 4.05 -1.15 -2.71 114.93 116.42 1knz h MET 10 Ca -0.01 -0.05 0.05 0.00 -0.28 0.00 0.00 59.70 59.41 1knz h MET 10 Cb 0.16 -0.19 -0.06 0.00 -0.80 0.00 0.00 31.60 30.71 1knz h MET 10 CO 0.01 0.56 0.52 0.00 0.23 0.00 0.00 176.91 178.23 1knz h ALA 11 N 1.25 1.12 0.00 0.39 0.00 -0.66 -2.22 119.26 119.14 1knz h ALA 11 Ca 0.24 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1knz h ALA 11 Cb -0.08 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1knz h ALA 11 CO -0.06 0.31 -0.16 0.28 0.00 0.00 0.00 179.25 179.62 1knz h VAL 12 N 0.99 0.66 0.00 0.00 2.07 -1.01 -1.91 116.25 117.05 1knz h VAL 12 Ca 0.35 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1knz h VAL 12 Cb 0.09 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1knz h VAL 12 CO -0.15 0.15 0.00 0.77 0.02 0.00 0.00 177.57 178.37 1knz h SER 13 N 0.00 0.00 -0.09 0.57 4.64 -1.31 0.54 113.55 117.90 1knz h SER 13 Ca -0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 1knz h SER 13 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1knz h SER 13 CO 0.02 0.00 -0.33 0.40 -0.87 0.00 0.00 176.83 176.05 1knz h ILE 14 N 0.00 1.40 0.03 0.95 2.04 -1.42 0.41 117.51 120.92 1knz h ILE 14 Ca 0.00 -1.69 -0.00 0.00 1.00 0.00 0.00 64.86 64.17 1knz h ILE 14 Cb 0.32 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 1knz h ILE 14 CO 0.00 0.49 -0.02 0.40 0.00 0.00 0.00 178.15 179.03 1knz h ILE 15 N -0.07 1.25 -0.53 -0.67 5.03 -1.40 -2.86 117.51 118.26 1knz h ILE 15 Ca -0.02 -0.90 -0.09 0.00 -0.12 0.00 0.00 64.86 63.73 1knz h ILE 15 Cb 0.97 1.85 -0.02 0.00 -3.03 0.00 0.00 36.82 36.59 1knz h ILE 15 CO 0.07 0.23 -0.03 0.78 -0.68 0.00 0.00 178.15 178.52 1knz h ASN 16 N -0.44 0.95 -0.26 1.72 2.35 -1.01 -2.20 115.58 116.69 1knz h ASN 16 Ca -0.00 -0.32 -0.12 0.00 -0.55 0.00 0.00 56.30 55.30 1knz h ASN 16 Cb 0.41 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1knz h ASN 16 CO 0.01 1.04 -0.27 0.28 -1.65 0.00 0.00 177.43 176.84 1knz h SER 17 N 0.83 0.77 -0.49 5.81 0.02 -1.01 -1.21 113.55 118.28 1knz h SER 17 Ca 0.15 -0.29 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1knz h SER 17 Cb 0.57 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 1knz h SER 17 CO 0.03 1.00 0.28 0.28 -1.14 0.00 0.00 176.83 177.28 1knz h SER 18 N 0.65 0.59 -0.84 3.07 0.02 -1.44 0.43 113.55 116.04 1knz h SER 18 Ca 0.08 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1knz h SER 18 Cb 0.78 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.13 1knz h SER 18 CO 0.06 0.49 0.47 0.15 -1.14 0.00 0.00 176.83 176.86 1knz h PHE 19 N 0.65 1.14 -0.11 3.45 3.57 -1.16 -1.62 116.94 122.86 1knz h PHE 19 Ca 0.17 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.54 1knz h PHE 19 Cb 0.01 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.37 1knz h PHE 19 CO -0.03 0.78 -0.42 0.93 -2.23 0.00 0.00 178.31 177.35 1knz h GLU 20 N 1.16 0.24 -0.28 1.11 4.39 -0.77 -2.20 114.58 118.23 1knz h GLU 20 Ca 0.30 -0.12 -0.09 0.00 0.34 0.00 0.00 59.36 59.79 1knz h GLU 20 Cb 0.01 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1knz h GLU 20 CO -0.05 0.63 -0.21 0.00 -1.16 0.00 0.00 179.01 178.22 1knz h ALA 21 N 1.36 1.11 -0.05 3.43 0.00 -0.24 -2.15 119.26 122.71 1knz h ALA 21 Ca 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1knz h ALA 21 Cb 0.84 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1knz h ALA 21 CO 0.07 0.55 -0.00 0.00 0.00 0.00 0.00 179.25 179.86 1knz h ALA 22 N 1.31 0.07 -0.36 0.00 0.00 -0.93 -0.56 119.26 118.77 1knz h ALA 22 Ca 0.07 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1knz h ALA 22 Cb 0.63 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1knz h ALA 22 CO 0.04 -0.25 0.12 0.28 0.00 0.00 0.00 179.25 179.44 1knz h VAL 23 N -0.22 0.88 -0.06 0.00 2.07 -1.30 -1.32 116.25 116.31 1knz h VAL 23 Ca 0.01 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.46 1knz h VAL 23 Cb 0.36 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1knz h VAL 23 CO 0.00 0.05 -0.02 0.58 0.02 0.00 0.00 177.57 178.21 1knz h VAL 24 N 0.26 0.94 0.33 2.57 2.07 -1.32 -0.40 116.25 120.70 1knz h VAL 24 Ca 0.17 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.69 1knz h VAL 24 Cb 0.15 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1knz h VAL 24 CO -0.18 0.00 -0.38 0.00 0.02 0.00 0.00 177.57 177.03 1knz h ALA 25 N 1.05 -0.80 0.45 1.67 0.00 -0.78 0.42 119.26 121.28 1knz h ALA 25 Ca 0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1knz h ALA 25 Cb 0.05 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1knz h ALA 25 CO -0.06 -0.99 -0.29 0.00 0.00 0.00 0.00 179.25 177.90 1knz h ALA 26 N -0.31 -0.72 -0.88 0.00 0.00 -1.13 0.54 119.26 116.76 1knz h ALA 26 Ca -0.02 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1knz h ALA 26 Cb 0.69 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1knz h ALA 26 CO -0.10 -0.92 0.57 1.79 0.00 0.00 0.00 179.25 180.59 1knz h THR 27 N -0.72 1.23 -0.68 0.00 1.35 -1.08 -2.48 112.91 110.53 1knz h THR 27 Ca -0.05 -0.44 -0.04 0.00 -0.55 0.00 0.00 66.41 65.33 1knz h THR 27 Cb 0.60 -0.05 -0.03 0.00 -1.73 0.00 0.00 68.15 66.94 1knz h THR 27 CO 0.04 0.23 0.26 -1.28 -0.25 0.00 0.00 175.52 174.52 1knz h SER 28 N 1.19 0.96 -0.41 5.36 0.87 -0.71 -1.90 113.55 118.91 1knz h SER 28 Ca 0.32 -0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.67 1knz h SER 28 Cb -0.12 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.58 1knz h SER 28 CO -0.07 0.88 0.15 0.00 -0.53 0.00 0.00 176.83 177.26 1knz h ALA 29 N 1.11 0.53 -0.30 6.23 0.00 -0.58 -1.45 119.26 124.81 1knz h ALA 29 Ca 0.23 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1knz h ALA 29 Cb 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1knz h ALA 29 CO -0.02 0.14 -0.15 -0.07 0.00 0.00 0.00 179.25 179.16 1knz h LEU 30 N 0.51 0.51 -0.37 0.00 3.38 -1.39 -2.04 115.31 115.91 1knz h LEU 30 Ca 0.13 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1knz h LEU 30 Cb 0.21 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1knz h LEU 30 CO -0.01 0.68 0.07 -0.08 0.09 0.00 0.00 178.44 179.19 1knz h GLU 31 N 0.48 0.61 0.00 1.13 4.81 -1.01 -1.27 114.58 119.32 1knz h GLU 31 Ca 0.08 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1knz h GLU 31 Cb 0.53 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1knz h GLU 31 CO 0.03 0.66 0.00 -0.91 -0.73 0.00 0.00 179.01 178.06 1knz h ASN 32 N 0.45 0.00 0.70 1.04 2.35 -1.01 0.43 115.58 119.54 1knz h ASN 32 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1knz h ASN 32 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1knz h ASN 32 CO 0.01 0.00 -0.25 0.23 -1.65 0.00 0.00 177.43 175.76 1knz n MET 33 N -3.02 0.06 -0.39 0.81 2.81 -0.79 -4.90 117.12 111.70 1knz n MET 33 Ca -0.00 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 1knz n MET 33 Cb 0.25 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.26 1knz n MET 33 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1knz n GLY 34 N 1.48 1.63 3.69 3.03 0.00 0.14 -5.01 105.19 110.16 1knz n GLY 34 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1knz n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1knz s ILE 35 N -3.18 3.90 0.41 -0.61 1.09 -0.55 -4.97 121.20 117.29 1knz s ILE 35 Ca 0.00 1.28 -0.25 0.00 -1.10 0.00 0.00 60.65 60.59 1knz s ILE 35 Cb 0.00 -3.82 -0.08 0.00 -1.06 0.00 0.00 42.46 37.49 1knz s ILE 35 CO 0.00 0.01 1.17 -1.83 -0.10 0.00 0.00 174.94 174.19 1knz s GLU 36 N 2.12 4.02 0.24 2.79 1.03 -1.26 -4.32 118.70 123.32 1knz s GLU 36 Ca 0.61 1.82 -0.13 0.00 0.03 0.00 0.00 54.97 57.29 1knz s GLU 36 Cb -0.29 -2.63 -0.00 0.00 -0.80 0.00 0.00 34.13 30.40 1knz s GLU 36 CO 0.25 -0.34 0.48 1.52 -1.33 0.00 0.00 175.26 175.84 1knz s TYR 37 N -1.44 0.32 -0.24 4.83 -0.85 -1.26 -5.09 117.35 113.62 1knz s TYR 37 Ca 0.58 -0.68 -0.04 0.00 -0.52 0.00 0.00 57.07 56.40 1knz s TYR 37 Cb -0.30 0.21 -0.00 0.00 0.38 0.00 0.00 41.96 42.25 1knz s TYR 37 CO 0.38 -0.99 -0.02 0.34 -1.52 0.00 0.00 175.55 173.74 1knz s ASP 38 N -3.01 4.46 0.18 -0.18 2.15 -1.26 -5.02 116.67 114.00 1knz s ASP 38 Ca 0.21 -0.48 -0.17 0.00 0.43 0.00 0.00 52.55 52.54 1knz s ASP 38 Cb -0.01 -1.76 0.14 0.00 -0.30 0.00 0.00 42.92 40.99 1knz s ASP 38 CO 0.08 -0.06 1.63 0.22 -0.17 0.00 0.00 175.17 176.88 1knz h TYR 39 N 8.12 -0.43 -0.61 -5.34 3.20 -2.01 -0.25 116.97 119.67 1knz h TYR 39 Ca -0.39 0.05 0.06 0.00 3.14 0.00 0.00 58.73 61.59 1knz h TYR 39 Cb 1.15 0.26 -0.04 0.00 1.54 0.00 0.00 36.73 39.65 1knz h TYR 39 CO 0.59 -0.27 0.40 1.96 -1.64 0.00 0.00 178.16 179.21 1knz h GLN 40 N -0.07 0.59 0.01 1.82 7.50 -1.98 0.14 115.11 123.13 1knz h GLN 40 Ca 0.23 -0.04 -0.00 0.00 0.50 0.00 0.00 58.65 59.34 1knz h GLN 40 Cb 0.42 -0.13 0.00 0.00 0.05 0.00 0.00 27.48 27.82 1knz h GLN 40 CO -0.53 0.39 -0.01 0.22 -1.50 0.00 0.00 178.83 177.40 1knz h ASP 41 N 0.61 -0.02 -0.78 1.46 1.82 -1.51 0.12 116.42 118.12 1knz h ASP 41 Ca 0.26 -0.51 -0.00 0.00 -0.39 0.00 0.00 57.03 56.39 1knz h ASP 41 Cb 0.25 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.23 1knz h ASP 41 CO -0.08 0.50 0.47 0.40 -1.61 0.00 0.00 179.24 178.93 1knz h ILE 42 N -0.54 1.22 -0.16 2.25 1.08 -0.93 -0.61 117.51 119.82 1knz h ILE 42 Ca -0.00 -0.47 0.04 0.00 -0.39 0.00 0.00 64.86 64.03 1knz h ILE 42 Cb 0.52 0.12 -0.04 0.00 -3.07 0.00 0.00 36.82 34.36 1knz h ILE 42 CO 0.00 0.23 -0.09 0.22 -0.69 0.00 0.00 178.15 177.82 1knz h TYR 43 N 1.07 -0.21 -0.37 1.37 3.20 -0.72 -1.45 116.97 119.86 1knz h TYR 43 Ca 0.28 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.12 1knz h TYR 43 Cb -0.05 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 1knz h TYR 43 CO -0.01 -0.14 0.04 1.03 -1.64 0.00 0.00 178.16 177.44 1knz h SER 44 N -0.08 0.53 -0.27 -2.11 0.87 -0.45 -1.92 113.55 110.11 1knz h SER 44 Ca 0.09 -0.09 -0.16 0.00 -1.23 0.00 0.00 61.79 60.40 1knz h SER 44 Cb 0.21 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1knz h SER 44 CO -0.21 0.57 -0.48 0.03 -0.53 0.00 0.00 176.83 176.22 1knz h ARG 45 N 0.55 0.80 -0.29 2.24 3.08 -0.66 -1.57 114.38 118.52 1knz h ARG 45 Ca 0.12 -0.50 -0.02 0.00 0.07 0.00 0.00 59.98 59.66 1knz h ARG 45 Cb 0.29 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1knz h ARG 45 CO 0.00 1.13 0.11 0.28 -1.07 0.00 0.00 179.97 180.43 1knz h VAL 46 N 0.55 1.18 -0.54 2.04 2.07 -1.10 -2.61 116.25 117.84 1knz h VAL 46 Ca 0.02 -0.56 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1knz h VAL 46 Cb 1.08 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 1knz h VAL 46 CO 0.11 0.19 0.32 0.50 0.02 0.00 0.00 177.57 178.71 1knz h LYS 47 N 0.32 0.61 -0.20 1.57 3.64 -1.32 0.11 116.57 121.31 1knz h LYS 47 Ca 0.10 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1knz h LYS 47 Cb 0.19 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 1knz h LYS 47 CO -0.01 0.40 -0.03 -0.91 -2.27 0.00 0.00 179.45 176.64 1knz h ASN 48 N 0.63 -0.15 0.26 4.20 2.35 -1.16 0.43 115.58 122.15 1knz h ASN 48 Ca 0.22 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 56.01 1knz h ASN 48 Cb 0.04 0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1knz h ASN 48 CO -0.11 -0.05 -0.13 0.50 -1.65 0.00 0.00 177.43 176.00 1knz h LYS 49 N 0.02 -0.34 -0.09 0.81 1.63 -1.21 -2.67 116.57 114.73 1knz h LYS 49 Ca 0.10 0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.93 1knz h LYS 49 Cb 0.14 0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 1knz h LYS 49 CO -0.19 0.01 -0.01 0.35 -3.45 0.00 0.00 179.45 176.16 1knz h PHE 50 N -0.77 -0.02 -0.97 1.91 3.57 -0.76 -2.12 116.94 117.79 1knz h PHE 50 Ca -0.04 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.48 1knz h PHE 50 Cb 0.50 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.21 1knz h PHE 50 CO 0.04 -0.02 0.64 -0.44 -2.23 0.00 0.00 178.31 176.31 1knz h ASP 51 N 0.02 1.11 -0.27 0.41 5.19 -0.23 -1.40 116.42 121.25 1knz h ASP 51 Ca 0.04 -0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.40 1knz h ASP 51 Cb 0.05 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.28 1knz h ASP 51 CO -0.08 0.80 0.06 0.15 -3.12 0.00 0.00 179.24 177.05 1knz h PHE 52 N 1.31 0.46 0.07 4.55 3.57 -1.23 -0.87 116.94 124.81 1knz h PHE 52 Ca 0.36 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.80 1knz h PHE 52 Cb -0.14 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 38.47 1knz h PHE 52 CO -0.00 0.52 -0.03 0.28 -2.23 0.00 0.00 178.31 176.85 1knz h VAL 53 N 0.27 1.14 0.06 1.41 2.07 -1.03 -3.24 116.25 116.92 1knz h VAL 53 Ca 0.08 -0.74 -0.28 0.00 0.82 0.00 0.00 66.70 66.59 1knz h VAL 53 Cb 0.30 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1knz h VAL 53 CO 0.00 0.18 -1.47 0.24 0.02 0.00 0.00 177.57 176.55 1knz h MET 54 N -0.43 0.12 -1.66 1.57 2.86 -1.36 -3.37 114.93 112.66 1knz h MET 54 Ca -0.01 -0.20 -0.65 0.00 -2.06 0.00 0.00 59.70 56.78 1knz h MET 54 Cb 0.37 0.08 -0.24 0.00 0.06 0.00 0.00 31.60 31.86 1knz h MET 54 CO 0.02 0.91 0.82 -3.47 1.06 0.00 0.00 176.91 176.25 1knz n ASP 55 N -3.31 7.28 0.00 1.22 2.03 -0.33 -2.08 116.55 121.36 1knz n ASP 55 Ca -0.13 -3.63 0.00 0.00 0.52 0.00 0.00 54.79 51.55 1knz n ASP 55 Cb 1.02 -1.07 0.00 0.00 -0.72 0.00 0.00 41.12 40.35 1knz n ASP 55 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1knz n ASP 56 N -0.30 0.00 0.00 1.67 9.92 -1.22 -4.77 116.55 121.85 1knz n ASP 56 Ca 0.53 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.79 1knz n ASP 56 Cb 0.45 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.93 1knz n ASP 56 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1knz n SER 57 N 0.00 0.00 0.00 -2.24 3.41 -1.26 -4.77 113.62 108.76 1knz n SER 57 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1knz n SER 57 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1knz n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1knz n GLY 58 N 0.00 0.75 2.82 5.00 0.00 -1.25 -4.99 105.19 107.51 1knz n GLY 58 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1knz n GLY 58 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1knz n VAL 59 N -2.24 4.72 0.00 1.61 0.31 -0.88 -1.44 118.33 120.42 1knz n VAL 59 Ca 0.00 -4.71 0.00 0.00 -0.01 0.00 0.00 64.34 59.62 1knz n VAL 59 Cb 0.00 -2.24 0.00 0.00 -0.91 0.00 0.00 33.84 30.69 1knz n VAL 59 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1knz n LYS 60 N 2.94 0.00 -0.28 5.55 4.81 -1.25 -4.52 118.16 125.41 1knz n LYS 60 Ca 0.41 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.79 1knz n LYS 60 Cb 0.34 0.00 0.06 0.00 0.02 0.00 0.00 35.03 35.44 1knz n LYS 60 CO 0.00 0.00 0.00 -0.97 1.17 0.00 0.00 177.40 177.60 1knz h ASN 61 N 0.00 1.03 0.23 3.14 -1.24 -1.83 0.13 115.58 117.04 1knz h ASN 61 Ca 0.00 -0.15 -0.01 0.00 0.71 0.00 0.00 56.30 56.85 1knz h ASN 61 Cb 0.00 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 38.79 1knz h ASN 61 CO 0.00 0.89 -0.11 -1.13 -1.29 0.00 0.00 177.43 175.79 1knz h ASN 62 N 1.09 -0.26 -0.22 1.15 -0.73 -1.59 -0.53 115.58 114.48 1knz h ASN 62 Ca 0.26 -0.18 0.03 0.00 1.87 0.00 0.00 56.30 58.28 1knz h ASN 62 Cb 0.16 0.07 -0.03 0.00 0.27 0.00 0.00 38.32 38.79 1knz h ASN 62 CO -0.03 0.05 0.04 -0.65 -0.37 0.00 0.00 177.43 176.47 1knz h PRO 63 N -0.59 0.12 -0.74 6.67 0.11 -1.74 -1.85 132.00 133.98 1knz h PRO 63 Ca -0.03 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1knz h PRO 63 Cb 0.43 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 31.48 1knz h PRO 63 CO 0.05 0.08 0.47 0.82 -0.21 0.00 0.00 178.00 179.21 1knz h ILE 64 N 0.12 1.20 -0.33 4.15 1.08 -0.75 -1.75 117.51 121.23 1knz h ILE 64 Ca 0.10 -0.40 0.05 0.00 -0.39 0.00 0.00 64.86 64.22 1knz h ILE 64 Cb 0.10 0.14 -0.04 0.00 -3.07 0.00 0.00 36.82 33.95 1knz h ILE 64 CO -0.14 0.20 0.07 1.23 -0.69 0.00 0.00 178.15 178.82 1knz h GLY 65 N 1.01 0.39 0.98 5.37 0.00 -0.61 0.14 103.07 110.34 1knz h GLY 65 Ca 0.27 -0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 1knz h GLY 65 CO -0.05 -0.02 0.23 0.50 0.00 0.00 0.00 176.54 177.20 1knz h LYS 66 N 0.18 0.53 -0.77 4.80 1.57 -1.07 -0.81 116.57 121.01 1knz h LYS 66 Ca 0.16 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1knz h LYS 66 Cb 0.17 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 1knz h LYS 66 CO -0.21 0.41 0.51 0.00 -0.57 0.00 0.00 179.45 179.59 1knz h ALA 67 N 1.10 1.47 -0.08 3.86 0.00 -0.68 -0.79 119.26 124.13 1knz h ALA 67 Ca 0.14 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1knz h ALA 67 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1knz h ALA 67 CO -0.03 0.49 -0.49 0.82 0.00 0.00 0.00 179.25 180.04 1knz h ILE 68 N 1.02 1.34 -0.55 0.00 2.04 -0.14 0.61 117.51 121.85 1knz h ILE 68 Ca 0.29 -1.72 -0.09 0.00 1.00 0.00 0.00 64.86 64.33 1knz h ILE 68 Cb -0.09 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1knz h ILE 68 CO -0.07 0.51 -0.03 0.74 0.00 0.00 0.00 178.15 179.30 1knz h THR 69 N 0.17 1.26 -0.20 -0.27 2.02 -0.08 -2.02 112.91 113.79 1knz h THR 69 Ca 0.01 -1.14 -0.11 0.00 0.77 0.00 0.00 66.41 65.94 1knz h THR 69 Cb 0.93 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1knz h THR 69 CO 0.08 0.41 -0.28 0.40 0.37 0.00 0.00 175.52 176.49 1knz h ILE 70 N 0.88 1.33 -0.72 3.11 2.04 -0.74 -2.67 117.51 120.74 1knz h ILE 70 Ca 0.16 -1.49 0.04 0.00 1.00 0.00 0.00 64.86 64.56 1knz h ILE 70 Cb 0.56 1.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.41 1knz h ILE 70 CO 0.03 0.46 0.48 0.44 0.00 0.00 0.00 178.15 179.56 1knz h ASP 71 N 0.22 0.75 0.06 1.72 3.32 -0.79 -0.78 116.42 120.92 1knz h ASP 71 Ca 0.02 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 1knz h ASP 71 Cb 0.86 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.24 1knz h ASP 71 CO 0.07 0.51 -0.03 1.56 -1.72 0.00 0.00 179.24 179.63 1knz h GLN 72 N 0.87 -0.07 -0.33 3.56 4.20 -1.28 0.19 115.11 122.24 1knz h GLN 72 Ca 0.29 0.01 0.05 0.00 0.06 0.00 0.00 58.65 59.05 1knz h GLN 72 Cb 0.07 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.83 1knz h GLN 72 CO -0.08 0.11 0.06 0.00 -0.67 0.00 0.00 178.83 178.25 1knz h ALA 73 N 0.68 0.34 -0.56 3.87 0.00 -1.08 -2.21 119.26 120.30 1knz h ALA 73 Ca -0.01 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1knz h ALA 73 Cb 0.22 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1knz h ALA 73 CO 0.01 -0.35 0.30 -0.07 0.00 0.00 0.00 179.25 179.15 1knz h LEU 74 N 0.17 0.70-10.11 0.00 3.38 -1.06 -3.52 115.31 104.88 1knz h LEU 74 Ca 0.16 -0.10 -0.50 0.00 0.09 0.00 0.00 57.88 57.53 1knz h LEU 74 Cb 0.18 -0.18 0.07 0.00 0.09 0.00 0.00 40.66 40.82 1knz h LEU 74 CO -0.21 0.59 0.42 0.20 0.09 0.00 0.00 178.44 179.53 1knz s ASN 75 N -5.87 5.66 0.00 -0.43 0.01 0.64 -5.10 114.94 109.86 1knz s ASN 75 Ca -0.13 2.13 0.00 0.00 -0.71 0.00 0.00 52.86 54.15 1knz s ASN 75 Cb 0.12 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 39.21 1knz s ASN 75 CO 0.77 -1.26 0.00 -0.90 -1.51 0.00 0.00 177.10 174.20 1knz n ASP 90 N -1.47 1.08 -0.00 -1.22 5.68 -1.26 -5.06 116.55 114.29 1knz n ASP 90 Ca 0.11 -0.56 0.05 0.00 -0.50 0.00 0.00 54.79 53.89 1knz n ASP 90 Cb 0.51 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.43 1knz n ASP 90 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1knz n THR 91 N -0.26 0.00 0.14 2.12 -1.04 -1.10 -4.68 114.28 109.46 1knz n THR 91 Ca 0.00 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.05 61.63 1knz n THR 91 Cb 0.00 0.51 -0.07 0.00 -1.82 0.00 0.00 70.33 68.94 1knz n THR 91 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1knz h SER 92 N 0.00 -1.15 0.12 8.00 4.64 -2.00 -2.70 113.55 120.46 1knz h SER 92 Ca 0.00 0.12 0.02 0.00 -0.47 0.00 0.00 61.79 61.46 1knz h SER 92 Cb 0.36 0.43 -0.04 0.00 -0.31 0.00 0.00 62.40 62.84 1knz h SER 92 CO 0.00 -0.49 -0.37 -0.09 -0.87 0.00 0.00 176.83 175.02 1knz h ARG 93 N -0.67 -0.58 -6.11 4.77 2.43 -1.99 -3.08 114.38 109.15 1knz h ARG 93 Ca 0.01 0.04 -0.59 0.00 -0.81 0.00 0.00 59.98 58.63 1knz h ARG 93 Cb 0.67 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 30.26 1knz h ARG 93 CO -0.20 -0.38 1.47 -1.25 -1.51 0.00 0.00 179.97 178.09 1knz s PRO 94 N -5.97 3.55 0.00 0.20 0.04 -1.02 -2.31 135.00 129.50 1knz s PRO 94 Ca -0.16 -1.07 0.00 0.00 0.04 0.00 0.00 61.00 59.81 1knz s PRO 94 Cb 0.08 -5.32 0.00 0.00 0.04 0.00 0.00 34.50 29.30 1knz s PRO 94 CO 0.64 -2.24 0.00 0.00 0.04 0.00 0.00 177.00 175.44 1knz n ALA 95 N 9.04 0.00 -0.17 8.56 0.00 -1.18 -4.83 120.51 131.93 1knz n ALA 95 Ca 0.32 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.68 1knz n ALA 95 Cb 0.51 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.97 1knz n ALA 95 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1knz h LYS 96 N 0.00 0.74 -0.25 0.00 1.79 -1.38 0.13 116.57 117.60 1knz h LYS 96 Ca 0.00 -0.15 -0.05 0.00 -2.18 0.00 0.00 60.65 58.27 1knz h LYS 96 Cb 0.00 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.52 1knz h LYS 96 CO 0.00 0.69 -0.06 -0.07 -1.08 0.00 0.00 179.45 178.94 1knz h LEU 97 N 0.65 0.37 -0.26 2.94 3.38 -1.78 0.21 115.31 120.81 1knz h LEU 97 Ca 0.16 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1knz h LEU 97 Cb 0.25 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1knz h LEU 97 CO -0.01 0.48 0.04 -0.78 0.09 0.00 0.00 178.44 178.26 1knz h ASP 98 N 0.38 0.42 -0.52 -0.43 -0.00 -1.61 -2.22 116.42 112.44 1knz h ASP 98 Ca 0.08 -0.26 -0.05 0.00 -0.00 0.00 0.00 57.03 56.80 1knz h ASP 98 Cb 0.34 -0.11 -0.03 0.00 -0.00 0.00 0.00 39.33 39.54 1knz h ASP 98 CO 0.02 0.58 0.16 -0.33 -0.00 0.00 0.00 179.24 179.66 1knz h GLU 99 N 0.25 0.87 -0.10 0.28 5.08 0.22 -2.71 114.58 118.47 1knz h GLU 99 Ca 0.08 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 1knz h GLU 99 Cb 0.34 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1knz h GLU 99 CO 0.01 0.77 -0.31 -0.44 -1.00 0.00 0.00 179.01 178.04 1knz h ASP 100 N 0.84 0.19 -0.47 1.42 3.32 -0.40 -1.97 116.42 119.35 1knz h ASP 100 Ca 0.19 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 1knz h ASP 100 Cb 0.28 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1knz h ASP 100 CO -0.00 0.50 0.19 0.58 -1.72 0.00 0.00 179.24 178.79 1knz h VAL 101 N 0.17 1.20 -0.42 -1.35 2.07 -1.08 0.84 116.25 117.68 1knz h VAL 101 Ca 0.02 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 1knz h VAL 101 Cb 0.63 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1knz h VAL 101 CO 0.05 0.23 0.21 0.78 0.02 0.00 0.00 177.57 178.86 1knz h ASN 102 N 0.61 0.55 -0.04 0.57 2.35 -1.32 -2.02 115.58 116.27 1knz h ASN 102 Ca 0.16 -0.12 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1knz h ASN 102 Cb 0.18 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 1knz h ASN 102 CO -0.01 0.52 0.02 0.50 -1.65 0.00 0.00 177.43 176.80 1knz h LYS 103 N 0.55 0.06 -0.68 0.81 3.64 -1.13 -2.32 116.57 117.50 1knz h LYS 103 Ca 0.15 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1knz h LYS 103 Cb 0.11 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 1knz h LYS 103 CO -0.02 0.19 0.27 -0.07 -2.27 0.00 0.00 179.45 177.55 1knz h LEU 104 N -0.09 0.92 -0.52 5.20 3.38 -0.78 -1.17 115.31 122.26 1knz h LEU 104 Ca 0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1knz h LEU 104 Cb 0.16 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1knz h LEU 104 CO -0.00 0.82 0.17 0.03 0.09 0.00 0.00 178.44 179.55 1knz h ARG 105 N 0.98 0.80 -0.49 1.13 3.08 -1.32 -2.24 114.38 116.33 1knz h ARG 105 Ca 0.23 -0.17 -0.11 0.00 0.07 0.00 0.00 59.98 60.00 1knz h ARG 105 Cb 0.19 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1knz h ARG 105 CO -0.02 0.73 -0.12 0.52 -1.07 0.00 0.00 179.97 180.01 1knz h MET 106 N 0.70 0.94 -0.17 0.04 2.86 -1.06 0.79 114.93 119.03 1knz h MET 106 Ca 0.17 -0.36 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 1knz h MET 106 Cb 0.26 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1knz h MET 106 CO -0.01 1.03 0.08 0.52 1.06 0.00 0.00 176.91 179.59 1knz h MET 107 N 0.80 0.25 -0.15 1.72 2.86 -1.15 0.22 114.93 119.48 1knz h MET 107 Ca 0.12 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1knz h MET 107 Cb 0.68 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 1knz h MET 107 CO 0.05 0.31 0.07 -0.07 1.06 0.00 0.00 176.91 178.32 1knz h LEU 108 N 0.14 0.20 -0.71 1.22 3.38 -1.38 -2.85 115.31 115.32 1knz h LEU 108 Ca 0.06 -0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.01 1knz h LEU 108 Cb 0.14 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 40.75 1knz h LEU 108 CO -0.01 0.29 0.30 -1.28 0.09 0.00 0.00 178.44 177.83 1knz h SER 109 N 0.11 0.31 0.18 -0.43 0.87 -0.62 0.09 113.55 114.06 1knz h SER 109 Ca 0.05 0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1knz h SER 109 Cb 0.14 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1knz h SER 109 CO -0.01 0.15 -0.06 0.77 -0.53 0.00 0.00 176.83 177.15 1knz h SER 110 N 0.48 0.00 0.15 6.23 4.64 -0.72 -2.33 113.55 121.99 1knz h SER 110 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1knz h SER 110 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1knz h SER 110 CO -0.35 0.06 -0.07 0.29 -0.87 0.00 0.00 176.83 175.90 1knz n LYS 111 N -3.78 1.08 -0.09 4.77 5.02 -0.01 -4.90 118.16 120.26 1knz n LYS 111 Ca -0.02 -0.44 0.00 0.00 -2.02 0.00 0.00 58.31 55.82 1knz n LYS 111 Cb 0.16 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 1knz n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1knz n GLY 112 N 1.19 0.91 3.29 0.72 0.00 -0.88 -5.02 105.19 105.40 1knz n GLY 112 Ca 0.18 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.75 1knz n GLY 112 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1knz s ILE 113 N -2.02 5.30 1.09 -0.61 1.01 -1.03 -5.03 121.20 119.90 1knz s ILE 113 Ca 0.00 -2.59 -0.18 0.00 0.00 0.00 0.00 60.65 57.88 1knz s ILE 113 Cb 0.00 -4.29 0.27 0.00 0.01 0.00 0.00 42.46 38.45 1knz s ILE 113 CO 0.00 -1.01 1.07 -0.90 0.00 0.00 0.00 174.94 174.11 1knz n ASP 114 N 3.85 -1.49 -0.17 3.58 5.68 -1.26 -3.30 116.55 123.43 1knz n ASP 114 Ca 0.13 -1.21 -0.06 0.00 -0.50 0.00 0.00 54.79 53.15 1knz n ASP 114 Cb 0.45 -0.94 0.03 0.00 -1.14 0.00 0.00 41.12 39.52 1knz n ASP 114 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 1knz h GLN 115 N 0.00 0.64 -0.46 0.11 3.07 -1.96 -1.86 115.11 114.65 1knz h GLN 115 Ca -0.39 -0.04 0.09 0.00 0.09 0.00 0.00 58.65 58.41 1knz h GLN 115 Cb 1.15 -0.14 -0.09 0.00 0.08 0.00 0.00 27.48 28.48 1knz h GLN 115 CO 0.26 0.42 -0.12 0.87 0.09 0.00 0.00 178.83 180.36 1knz h LYS 116 N 0.66 0.00 -0.17 0.06 1.79 -1.99 0.31 116.57 117.22 1knz h LYS 116 Ca 0.20 -0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.66 1knz h LYS 116 Cb -0.04 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.60 1knz h LYS 116 CO -0.06 0.00 0.09 0.52 -1.08 0.00 0.00 179.45 178.92 1knz h MET 117 N 0.00 0.24 -0.20 3.15 2.86 -1.84 -2.54 114.93 116.60 1knz h MET 117 Ca 0.22 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.82 1knz h MET 117 Cb 0.34 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1knz h MET 117 CO -0.48 0.26 0.08 0.00 1.06 0.00 0.00 176.91 177.83 1knz h ARG 118 N 0.17 0.30 -0.01 1.72 3.08 -0.54 -1.27 114.38 117.83 1knz h ARG 118 Ca 0.06 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1knz h ARG 118 Cb 0.09 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1knz h ARG 118 CO -0.01 0.36 0.00 0.28 -1.07 0.00 0.00 179.97 179.53 1knz h VAL 119 N 0.18 1.00 -0.33 2.04 2.07 -0.44 -2.13 116.25 118.64 1knz h VAL 119 Ca 0.07 -0.01 -0.05 0.00 0.82 0.00 0.00 66.70 67.53 1knz h VAL 119 Cb 0.17 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1knz h VAL 119 CO -0.01 0.00 0.01 -0.07 0.02 0.00 0.00 177.57 177.52 1knz h LEU 120 N 0.01 0.56 -1.57 2.57 3.38 -1.44 -1.23 115.31 117.59 1knz h LEU 120 Ca 0.00 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 1knz h LEU 120 Cb 0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1knz h LEU 120 CO -0.00 0.73 -0.16 -1.13 0.09 0.00 0.00 178.44 177.96 1knz h ASN 121 N 0.38 0.07 1.33 -0.43 -0.73 -1.22 -0.47 115.58 114.51 1knz h ASN 121 Ca 0.09 -0.01 -0.05 0.00 1.87 0.00 0.00 56.30 58.20 1knz h ASN 121 Cb 0.44 -0.02 -0.01 0.00 0.27 0.00 0.00 38.32 39.00 1knz h ASN 121 CO 0.02 0.24 -0.69 0.00 -0.37 0.00 0.00 177.43 176.62 1knz h ALA 122 N 1.77 0.71 0.00 1.57 0.00 -1.26 -3.33 119.26 118.71 1knz h ALA 122 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1knz h ALA 122 Cb 0.33 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1knz h ALA 122 CO 0.02 0.30 -1.03 0.00 0.00 0.00 0.00 179.25 178.54 1knz s PHE 124 N -3.15 0.06 -0.07 0.00 0.40 -0.23 -2.43 117.98 112.57 1knz s PHE 124 Ca 0.05 -0.13 0.02 0.00 -0.60 0.00 0.00 56.93 56.26 1knz s PHE 124 Cb 0.15 -0.07 -0.03 0.00 0.51 0.00 0.00 43.02 43.59 1knz s PHE 124 CO 0.81 -0.18 -0.11 -1.54 0.70 0.00 0.00 175.22 174.90 1knz s SER 125 N -0.94 4.27 -0.03 1.36 1.04 -0.85 -4.64 113.70 113.92 1knz s SER 125 Ca -0.10 -0.15 0.05 0.00 0.48 0.00 0.00 55.95 56.23 1knz s SER 125 Cb -0.06 -1.08 -0.01 0.00 0.10 0.00 0.00 66.02 64.98 1knz s SER 125 CO 0.00 0.33 -0.17 -0.69 0.98 0.00 0.00 173.24 173.69 1knz s VAL 126 N -0.60 1.36 0.09 5.02 1.01 -1.26 -1.81 120.40 124.20 1knz s VAL 126 Ca 0.09 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.43 1knz s VAL 126 Cb -0.11 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 1knz s VAL 126 CO 0.01 0.39 -0.17 -1.59 0.00 0.00 0.00 175.10 173.74 1knz s LYS 127 N -0.17 0.96 0.09 2.72 -2.85 0.15 -4.92 119.74 115.73 1knz s LYS 127 Ca 0.01 -1.06 -0.33 0.00 -1.00 0.00 0.00 55.97 53.60 1knz s LYS 127 Cb -0.09 -1.06 -0.14 0.00 -2.06 0.00 0.00 37.83 34.48 1knz s LYS 127 CO 0.01 0.24 1.60 0.07 0.10 0.00 0.00 175.35 177.36 1knz h ARG 128 N 4.14 -0.80 -3.08 1.78 0.11 -1.89 0.17 114.38 114.82 1knz h ARG 128 Ca -0.43 0.05 0.00 0.00 0.10 0.00 0.00 59.98 59.71 1knz h ARG 128 Cb 1.19 0.18 0.00 0.00 1.11 0.00 0.00 29.97 32.45 1knz h ARG 128 CO 0.41 -0.53 -0.03 -0.89 0.10 0.00 0.00 179.97 179.02 1knz n ILE 129 N -5.50 -2.34 0.00 0.08 5.41 -1.26 -4.00 119.36 111.76 1knz n ILE 129 Ca -0.11 0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.70 1knz n ILE 129 Cb 0.40 -4.11 0.00 0.00 -0.71 0.00 0.00 39.64 35.22 1knz n ILE 129 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1knz n PRO 130 N -0.14 0.00 -0.66 0.38 -0.02 -1.26 -2.70 135.00 130.60 1knz n PRO 130 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.40 1knz n PRO 130 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 33.37 1knz n PRO 130 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1knz n GLY 131 N 0.00 2.34 3.30 -1.23 0.00 -1.26 -4.77 105.19 103.56 1knz n GLY 131 Ca 0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 46.02 45.12 1knz n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1knz s LYS 132 N 1.61 1.00 -0.86 1.61 1.02 -1.10 -5.07 119.74 117.95 1knz s LYS 132 Ca 0.44 -0.68 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1knz s LYS 132 Cb 0.21 0.44 0.34 0.00 -0.52 0.00 0.00 37.83 38.29 1knz s LYS 132 CO 0.00 -0.37 1.65 -1.13 -0.92 0.00 0.00 175.35 174.58 1knz n SER 133 N -0.04 6.67 -3.26 2.83 3.41 -1.26 -4.87 113.62 117.09 1knz n SER 133 Ca -0.16 -3.73 -0.11 0.00 -0.26 0.00 0.00 58.87 54.61 1knz n SER 133 Cb 0.63 -0.98 -0.01 0.00 -0.26 0.00 0.00 64.21 63.59 1knz n SER 133 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1knz s SER 134 N -1.85 0.27 0.15 4.04 1.04 -1.26 -5.18 113.70 110.89 1knz s SER 134 Ca 0.44 -1.18 0.05 0.00 0.48 0.00 0.00 55.95 55.75 1knz s SER 134 Cb 0.28 0.74 -0.04 0.00 0.10 0.00 0.00 66.02 67.10 1knz s SER 134 CO -0.20 -1.46 -0.12 -0.44 0.98 0.00 0.00 173.24 172.00 1knz s SER 135 N -3.10 1.96 -0.20 7.02 0.01 -1.26 -4.25 113.70 113.88 1knz s SER 135 Ca 0.21 -0.95 -0.05 0.00 1.31 0.00 0.00 55.95 56.47 1knz s SER 135 Cb -0.03 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.13 1knz s SER 135 CO 0.14 -0.25 -0.01 0.27 0.41 0.00 0.00 173.24 173.80 1knz s ILE 136 N -2.90 3.82 -0.14 1.44 -0.00 0.59 -4.89 121.20 119.12 1knz s ILE 136 Ca 0.15 -0.36 -0.03 0.00 -0.00 0.00 0.00 60.65 60.41 1knz s ILE 136 Cb -0.00 -2.73 -0.03 0.00 -0.00 0.00 0.00 42.46 39.70 1knz s ILE 136 CO 0.02 0.43 -0.04 -0.63 -0.00 0.00 0.00 174.94 174.72 1knz s ILE 137 N 1.08 3.92 -0.01 8.37 1.01 -1.26 -0.67 121.20 133.65 1knz s ILE 137 Ca 0.02 -0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.32 1knz s ILE 137 Cb -0.14 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.63 1knz s ILE 137 CO 0.01 0.52 -0.03 -0.54 0.00 0.00 0.00 174.94 174.89 1knz s LYS 138 N 0.11 0.35 0.27 2.79 -0.14 -0.75 -4.99 119.74 117.38 1knz s LYS 138 Ca -0.01 -0.10 -0.29 0.00 -1.36 0.00 0.00 55.97 54.21 1knz s LYS 138 Cb -0.14 -0.38 -0.09 0.00 -1.68 0.00 0.00 37.83 35.54 1knz s LYS 138 CO 0.03 0.03 1.26 0.00 -0.76 0.00 0.00 175.35 175.91 1knz n THR 140 N 1.64 0.00 0.11 0.00 -2.24 -1.02 -4.90 114.28 107.87 1knz n THR 140 Ca 0.02 -1.17 0.01 0.00 -2.27 0.00 0.00 64.05 60.64 1knz n THR 140 Cb 0.43 -0.99 0.34 0.00 -2.10 0.00 0.00 70.33 68.00 1knz n THR 140 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1knz h LYS 141 N 0.00 0.24 -0.64 -0.78 1.57 -1.91 -2.42 116.57 112.64 1knz h LYS 141 Ca -0.24 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.39 1knz h LYS 141 Cb 0.89 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 1knz h LYS 141 CO 0.26 0.45 0.09 -0.07 -0.57 0.00 0.00 179.45 179.61 1knz h LEU 142 N 0.22 1.03 -0.24 2.94 3.38 -1.92 -1.91 115.31 118.82 1knz h LEU 142 Ca 0.04 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 1knz h LEU 142 Cb 0.50 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1knz h LEU 142 CO 0.03 1.03 -0.14 -0.03 0.09 0.00 0.00 178.44 179.42 1knz h MET 143 N 1.00 0.51 -0.95 1.13 4.05 -1.74 -2.37 114.93 116.56 1knz h MET 143 Ca 0.20 -0.23 0.09 0.00 -0.28 0.00 0.00 59.70 59.47 1knz h MET 143 Cb 0.45 -0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 31.17 1knz h MET 143 CO 0.01 0.79 0.59 0.00 0.23 0.00 0.00 176.91 178.54 1knz h ARG 144 N 0.22 0.99 -0.02 0.39 2.47 -1.30 0.84 114.38 117.96 1knz h ARG 144 Ca 0.05 -0.06 -0.08 0.00 -1.26 0.00 0.00 59.98 58.63 1knz h ARG 144 Cb 0.65 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.74 1knz h ARG 144 CO 0.04 0.65 -0.37 -0.44 0.56 0.00 0.00 179.97 180.41 1knz h ASP 145 N 1.02 0.05 -0.31 7.04 3.32 -1.23 -0.59 116.42 125.72 1knz h ASP 145 Ca 0.44 -0.02 -0.17 0.00 0.02 0.00 0.00 57.03 57.30 1knz h ASP 145 Cb 0.30 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 1knz h ASP 145 CO -0.22 0.42 -0.48 0.11 -1.72 0.00 0.00 179.24 177.35 1knz h LYS 146 N 0.04 0.89 -0.71 3.56 1.57 -0.43 -2.60 116.57 118.89 1knz h LYS 146 Ca 0.00 -0.52 -0.03 0.00 -1.87 0.00 0.00 60.65 58.23 1knz h LYS 146 Cb 0.68 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 1knz h LYS 146 CO 0.05 1.17 0.33 -0.07 -0.57 0.00 0.00 179.45 180.35 1knz h LEU 147 N 0.70 0.94 -0.59 2.94 3.38 -0.39 2.26 115.31 124.55 1knz h LEU 147 Ca 0.03 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1knz h LEU 147 Cb 1.08 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1knz h LEU 147 CO 0.11 0.82 0.00 -0.62 0.09 0.00 0.00 178.44 178.84 1knz n GLU 148 N -4.42 0.08 0.00 1.13 1.02 -0.28 -4.24 120.64 113.93 1knz n GLU 148 Ca 0.06 0.49 0.00 0.00 -0.02 0.00 0.00 57.16 57.68 1knz n GLU 148 Cb 0.14 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 29.84 1knz n GLU 148 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1knz n ARG 149 N -1.88 0.00 -3.68 3.49 1.74 0.14 -5.08 116.66 111.39 1knz n ARG 149 Ca 0.01 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 1knz n ARG 149 Cb 0.08 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.42 1knz n ARG 149 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1knz s GLY 150 N -0.70 -0.36 -0.05 -0.13 0.00 0.72 -5.05 107.32 101.74 1knz s GLY 150 Ca 0.00 1.59 -0.02 0.00 0.00 0.00 0.00 44.72 46.29 1knz s GLY 150 CO 0.00 1.97 0.10 -0.54 0.00 0.00 0.00 173.10 174.63 1knz s GLU 151 N 1.80 0.00 0.16 2.90 0.41 -1.26 -4.76 118.70 117.94 1knz s GLU 151 Ca -0.07 0.38 -0.31 0.00 -0.41 0.00 0.00 54.97 54.56 1knz s GLU 151 Cb -0.09 -0.30 -0.08 0.00 -1.78 0.00 0.00 34.13 31.88 1knz s GLU 151 CO -0.13 -0.24 1.34 0.14 -0.49 0.00 0.00 175.26 175.87 1knz s VAL 152 N 1.66 3.29 -2.61 2.63 -7.23 -1.26 -5.09 120.40 111.79 1knz s VAL 152 Ca -0.03 0.99 0.27 0.00 -1.81 0.00 0.00 61.98 61.41 1knz s VAL 152 Cb -0.12 -3.64 0.47 0.00 0.56 0.00 0.00 36.38 33.65 1knz s VAL 152 CO -0.04 0.12 1.64 -0.62 -0.31 0.00 0.00 175.10 175.88