#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qjp n THR 10 N 0.00 1.33 0.09 2.61 5.66 -1.26 -3.72 114.28 118.98 2qjp n THR 10 Ca 0.00 -0.77 -0.02 0.00 -3.05 0.00 0.00 64.05 60.21 2qjp n THR 10 Cb 0.00 -0.14 -0.05 0.00 -1.55 0.00 0.00 70.33 68.59 2qjp n THR 10 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 2qjp h ARG 11 N 2.52 0.00 0.08 1.09 2.43 -2.04 -2.30 114.38 116.16 2qjp h ARG 11 Ca 0.00 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.85 2qjp h ARG 11 Cb 1.14 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 2qjp h ARG 11 CO 0.20 0.63 -1.71 -0.09 -1.51 0.00 0.00 179.97 177.50 2qjp h ARG 12 N 0.00 0.17 0.00 0.20 2.43 -1.98 -1.72 114.38 113.48 2qjp h ARG 12 Ca -0.05 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 2qjp h ARG 12 Cb 1.59 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.25 2qjp h ARG 12 CO 0.08 0.95 0.00 -3.47 -1.51 0.00 0.00 179.97 176.02 2qjp n ASP 13 N -3.33 0.69 -0.02 -3.80 2.03 -1.24 -1.36 116.55 109.53 2qjp n ASP 13 Ca -0.21 0.60 -0.21 0.00 0.52 0.00 0.00 54.79 55.49 2qjp n ASP 13 Cb 1.04 -0.77 -0.13 0.00 -0.72 0.00 0.00 41.12 40.54 2qjp n ASP 13 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2qjp h PHE 14 N 0.00 0.32 -0.84 -0.67 3.57 -1.47 -3.31 116.94 114.54 2qjp h PHE 14 Ca 0.00 -0.23 0.19 0.00 3.53 0.00 0.00 57.97 61.46 2qjp h PHE 14 Cb 0.58 -0.01 -0.12 0.00 2.79 0.00 0.00 35.95 39.20 2qjp h PHE 14 CO 0.00 1.52 0.32 1.25 -2.23 0.00 0.00 178.31 179.17 2qjp h LEU 15 N -0.47 0.23 -0.46 0.59 5.85 -0.88 0.24 115.31 120.41 2qjp h LEU 15 Ca -0.30 0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.62 2qjp h LEU 15 Cb 1.63 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 42.76 2qjp h LEU 15 CO -0.00 0.00 0.17 1.88 -0.34 0.00 0.00 178.44 180.15 2qjp h TYR 16 N 0.37 0.30 -0.08 1.25 -1.99 -1.33 0.12 116.97 115.62 2qjp h TYR 16 Ca 0.50 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 61.24 2qjp h TYR 16 Cb 0.89 -0.07 -0.00 0.00 2.00 0.00 0.00 36.73 39.56 2qjp h TYR 16 CO -0.18 0.11 -0.00 -0.92 -0.00 0.00 0.00 178.16 177.17 2qjp h TYR 17 N 0.34 0.15 -0.65 4.88 3.20 -0.76 0.42 116.97 124.56 2qjp h TYR 17 Ca 0.22 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.09 2qjp h TYR 17 Cb 0.21 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 2qjp h TYR 17 CO -0.15 0.41 0.43 0.00 -1.64 0.00 0.00 178.16 177.20 2qjp h ALA 18 N 0.73 1.65 0.15 1.82 0.00 -0.42 0.25 119.26 123.44 2qjp h ALA 18 Ca 0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qjp h ALA 18 Cb 0.35 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qjp h ALA 18 CO 0.00 0.29 -0.07 1.15 0.00 0.00 0.00 179.25 180.62 2qjp h THR 19 N 0.77 0.00 -1.02 0.00 2.02 -0.55 -2.16 112.91 111.98 2qjp h THR 19 Ca 0.26 -0.32 0.30 0.00 0.77 0.00 0.00 66.41 67.42 2qjp h THR 19 Cb 0.08 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.35 2qjp h THR 19 CO -0.07 0.00 0.59 0.00 0.37 0.00 0.00 175.52 176.41 2qjp h ALA 20 N -1.59 1.95 -0.20 6.16 0.00 -0.06 0.24 119.26 125.77 2qjp h ALA 20 Ca -0.02 0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2qjp h ALA 20 Cb 0.16 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2qjp h ALA 20 CO 0.03 -0.52 -0.10 0.78 0.00 0.00 0.00 179.25 179.44 2qjp h GLY 21 N 0.39 0.46 0.93 0.00 0.00 -0.59 -1.49 103.07 102.78 2qjp h GLY 21 Ca 0.71 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.64 2qjp h GLY 21 CO -0.55 0.38 0.59 0.00 0.00 0.00 0.00 176.54 176.97 2qjp h ALA 22 N 0.69 1.18 0.28 3.60 0.00 0.01 -1.16 119.26 123.86 2qjp h ALA 22 Ca 0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qjp h ALA 22 Cb 0.60 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2qjp h ALA 22 CO 0.03 0.49 -0.17 0.78 0.00 0.00 0.00 179.25 180.38 2qjp h GLY 23 N 1.18 -0.66 -0.62 0.00 0.00 -0.51 -1.89 103.07 100.57 2qjp h GLY 23 Ca 0.35 0.27 0.35 0.00 0.00 0.00 0.00 47.33 48.30 2qjp h GLY 23 CO -0.10 -0.23 0.74 0.00 0.00 0.00 0.00 176.54 176.95 2qjp h ALA 24 N -1.65 2.43 -0.05 3.60 0.00 -1.12 0.33 119.26 122.80 2qjp h ALA 24 Ca -0.04 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2qjp h ALA 24 Cb 0.34 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2qjp h ALA 24 CO 0.04 -0.96 0.02 0.28 0.00 0.00 0.00 179.25 178.63 2qjp h VAL 25 N 0.24 1.13 0.07 0.00 2.07 -0.91 -2.42 116.25 116.43 2qjp h VAL 25 Ca 0.71 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.85 2qjp h VAL 25 Cb 2.01 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 33.06 2qjp h VAL 25 CO -0.38 0.10 -0.03 0.00 0.02 0.00 0.00 177.57 177.28 2qjp h ALA 26 N 0.88 -0.09 -1.23 1.67 0.00 0.33 -1.91 119.26 118.90 2qjp h ALA 26 Ca 0.02 -0.09 0.36 0.00 0.00 0.00 0.00 54.91 55.20 2qjp h ALA 26 Cb 0.15 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 2qjp h ALA 26 CO -0.00 -0.48 0.84 1.15 0.00 0.00 0.00 179.25 180.76 2qjp h THR 27 N -0.24 0.35 0.14 0.00 2.02 -0.77 0.24 112.91 114.65 2qjp h THR 27 Ca -0.01 -0.05 -0.31 0.00 0.77 0.00 0.00 66.41 66.80 2qjp h THR 27 Cb 0.21 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 2qjp h THR 27 CO 0.02 0.03 -1.55 1.23 0.37 0.00 0.00 175.52 175.61 2qjp h GLY 28 N 0.15 0.34 2.00 2.16 0.00 -1.10 -2.46 103.07 104.16 2qjp h GLY 28 Ca 0.66 -0.86 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 2qjp h GLY 28 CO -0.19 0.75 -0.16 0.00 0.00 0.00 0.00 176.54 176.95 2qjp h ALA 29 N 0.41 1.54 0.06 3.60 0.00 0.17 -0.63 119.26 124.41 2qjp h ALA 29 Ca -0.26 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 2qjp h ALA 29 Cb 2.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.80 2qjp h ALA 29 CO 0.17 0.20 -0.03 0.00 0.00 0.00 0.00 179.25 179.59 2qjp h ALA 30 N 1.84 -0.08 0.12 0.00 0.00 -0.96 -3.39 119.26 116.80 2qjp h ALA 30 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2qjp h ALA 30 Cb 0.32 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2qjp h ALA 30 CO 0.02 -0.13 -0.06 0.28 0.00 0.00 0.00 179.25 179.36 2qjp h VAL 31 N -0.90 0.90 -0.83 0.00 2.07 -1.11 -3.27 116.25 113.11 2qjp h VAL 31 Ca -0.01 -0.07 0.18 0.00 0.82 0.00 0.00 66.70 67.62 2qjp h VAL 31 Cb 0.62 0.95 -0.15 0.00 -1.52 0.00 0.00 31.29 31.18 2qjp h VAL 31 CO 0.01 0.02 -0.14 -0.25 0.02 0.00 0.00 177.57 177.23 2qjp h TRP 32 N -0.19 -0.32 0.00 1.57 -0.00 -1.31 0.69 115.95 116.39 2qjp h TRP 32 Ca -0.02 0.07 -0.09 0.00 -0.00 0.00 0.00 58.89 58.86 2qjp h TRP 32 Cb 0.15 0.27 -0.01 0.00 -0.00 0.00 0.00 29.16 29.57 2qjp h TRP 32 CO -0.06 -0.34 -0.42 -1.00 -0.00 0.00 0.00 178.44 176.62 2qjp h PRO 33 N 0.02 0.00 -0.87 2.65 0.13 -1.74 0.63 132.00 132.82 2qjp h PRO 33 Ca 0.42 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.53 2qjp h PRO 33 Cb 0.69 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.78 2qjp h PRO 33 CO -0.82 0.42 0.48 -0.07 -0.23 0.00 0.00 178.00 177.78 2qjp h LEU 34 N 0.00 1.08 -0.01 1.56 3.38 -0.95 -0.71 115.31 119.66 2qjp h LEU 34 Ca -0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2qjp h LEU 34 Cb 0.78 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2qjp h LEU 34 CO 0.05 0.86 -0.06 0.40 0.09 0.00 0.00 178.44 179.79 2qjp h ILE 35 N 1.22 1.52 0.00 1.22 2.04 -0.72 -3.32 117.51 119.46 2qjp h ILE 35 Ca 0.31 -1.60 -0.00 0.00 1.00 0.00 0.00 64.86 64.56 2qjp h ILE 35 Cb 0.02 2.56 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 2qjp h ILE 35 CO -0.05 0.42 -0.01 -1.13 0.00 0.00 0.00 178.15 177.39 2qjp h ASN 36 N -0.58 0.00 0.10 1.72 -0.00 0.55 -2.75 115.58 114.62 2qjp h ASN 36 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.29 2qjp h ASN 36 Cb 0.72 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.04 2qjp h ASN 36 CO 0.01 0.01 -0.05 0.06 -0.00 0.00 0.00 177.43 177.46 2qjp h GLN 37 N 0.00 0.00 -0.00 6.67 -0.00 -1.24 -1.87 115.11 118.67 2qjp h GLN 37 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2qjp h GLN 37 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.69 2qjp h GLN 37 CO 0.00 0.05 -0.01 -1.33 -0.00 0.00 0.00 178.83 177.54 2qjp n MET 38 N -3.98 0.41 -2.78 0.06 2.81 -1.04 -4.83 117.12 107.77 2qjp n MET 38 Ca -0.03 -0.02 -0.33 0.00 -1.81 0.00 0.00 57.70 55.52 2qjp n MET 38 Cb 0.14 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.08 2qjp n MET 38 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2qjp s ASN 39 N -2.61 6.91 -0.16 7.83 0.02 -0.71 -4.90 114.94 121.33 2qjp s ASN 39 Ca 0.27 1.68 -0.24 0.00 -1.02 0.00 0.00 52.86 53.55 2qjp s ASN 39 Cb 0.20 -2.54 -0.11 0.00 0.02 0.00 0.00 41.25 38.83 2qjp s ASN 39 CO 0.47 -0.38 0.75 -2.65 0.02 0.00 0.00 177.10 175.31 2qjp n PRO 40 N -0.73 0.00 -1.93 -0.60 -0.02 -1.26 -4.91 135.00 125.55 2qjp n PRO 40 Ca 0.07 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.25 2qjp n PRO 40 Cb 0.54 -0.82 0.05 0.00 -0.02 0.00 0.00 33.50 33.25 2qjp n PRO 40 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2qjp s SER 41 N 0.96 5.44 0.56 2.55 1.04 -1.26 -4.80 113.70 118.20 2qjp s SER 41 Ca 0.54 1.08 0.32 0.00 0.48 0.00 0.00 55.95 58.38 2qjp s SER 41 Cb -0.76 -1.89 1.46 0.00 0.10 0.00 0.00 66.02 64.93 2qjp s SER 41 CO 0.39 -1.33 1.81 0.00 0.98 0.00 0.00 173.24 175.09 2qjp h ALA 42 N -0.62 2.77 0.00 5.32 0.00 -1.99 -0.33 119.26 124.41 2qjp h ALA 42 Ca -0.45 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 2qjp h ALA 42 Cb 1.26 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2qjp h ALA 42 CO 0.64 -1.18 -0.41 0.38 0.00 0.00 0.00 179.25 178.67 2qjp h ASP 43 N 0.00 0.00 0.00 0.00 2.03 -2.00 -3.34 116.42 113.11 2qjp h ASP 43 Ca 0.42 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.66 2qjp h ASP 43 Cb 1.87 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 40.36 2qjp h ASP 43 CO -0.00 0.33 -0.35 0.58 -1.03 0.00 0.00 179.24 178.77 2qjp h VAL 44 N 0.00 1.55 0.00 4.15 2.07 -1.43 -3.28 116.25 119.31 2qjp h VAL 44 Ca -0.01 -2.30 0.00 0.00 0.82 0.00 0.00 66.70 65.21 2qjp h VAL 44 Cb 1.26 3.06 0.00 0.00 -1.52 0.00 0.00 31.29 34.09 2qjp h VAL 44 CO 0.04 0.52 0.05 0.00 0.02 0.00 0.00 177.57 178.21 2qjp n GLN 45 N -4.56 0.00 -1.54 1.57 1.13 -0.95 -3.82 117.38 109.22 2qjp n GLN 45 Ca -0.16 0.07 -0.40 0.00 -1.94 0.00 0.00 57.00 54.57 2qjp n GLN 45 Cb 0.53 -1.55 -0.02 0.00 0.11 0.00 0.00 30.24 29.31 2qjp n GLN 45 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qjp n ALA 46 N -0.91 6.77 -2.46 -1.58 0.00 -1.24 -4.93 120.51 116.16 2qjp n ALA 46 Ca 0.00 -3.71 -0.43 0.00 0.00 0.00 0.00 53.44 49.30 2qjp n ALA 46 Cb 0.05 -3.38 -0.02 0.00 0.00 0.00 0.00 19.45 16.10 2qjp n ALA 46 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2qjp s LEU 47 N 0.69 4.18 0.00 0.00 0.20 -1.25 -5.03 118.68 117.47 2qjp s LEU 47 Ca 0.60 1.67 0.00 0.00 0.69 0.00 0.00 54.13 57.09 2qjp s LEU 47 Cb 0.16 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.38 2qjp s LEU 47 CO -0.07 -0.73 0.00 0.00 -0.29 0.00 0.00 176.35 175.26 2qjp n ALA 48 N 6.43 0.00 -2.90 5.97 0.00 -1.26 -5.13 120.51 123.62 2qjp n ALA 48 Ca 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.53 2qjp n ALA 48 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.90 2qjp n ALA 48 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qjp s SER 49 N -0.71 -1.32 1.25 0.00 0.01 -1.26 -4.81 113.70 106.86 2qjp s SER 49 Ca 0.00 -1.56 -0.18 0.00 1.31 0.00 0.00 55.95 55.53 2qjp s SER 49 Cb 0.00 1.81 0.27 0.00 0.21 0.00 0.00 66.02 68.31 2qjp s SER 49 CO 0.00 -0.09 0.67 2.30 0.41 0.00 0.00 173.24 176.54 2qjp n ILE 50 N 3.31 0.00 -4.16 1.44 -5.35 -1.26 -4.76 119.36 108.58 2qjp n ILE 50 Ca 0.17 -0.24 -0.16 0.00 -0.27 0.00 0.00 62.75 62.24 2qjp n ILE 50 Cb 0.56 -0.85 -0.12 0.00 -1.74 0.00 0.00 39.64 37.48 2qjp n ILE 50 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2qjp s PHE 51 N -2.23 0.81 -0.06 4.28 0.40 -1.26 -2.16 117.98 117.76 2qjp s PHE 51 Ca 0.61 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.59 2qjp s PHE 51 Cb -0.16 -0.48 0.01 0.00 0.51 0.00 0.00 43.02 42.90 2qjp s PHE 51 CO 0.59 -0.03 -0.11 0.08 0.70 0.00 0.00 175.22 176.45 2qjp s VAL 52 N -0.99 1.04 0.03 -0.44 1.01 0.68 -4.95 120.40 116.77 2qjp s VAL 52 Ca -0.04 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 2qjp s VAL 52 Cb -0.08 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 2qjp s VAL 52 CO 0.01 0.33 0.96 -0.62 0.00 0.00 0.00 175.10 175.77 2qjp s ASP 53 N 0.68 7.39 0.00 3.32 2.15 -1.26 -1.75 116.67 127.20 2qjp s ASP 53 Ca -0.14 1.67 0.01 0.00 0.43 0.00 0.00 52.55 54.52 2qjp s ASP 53 Cb -0.15 -2.57 -0.01 0.00 -0.30 0.00 0.00 42.92 39.89 2qjp s ASP 53 CO 0.03 -0.19 0.09 0.52 -0.17 0.00 0.00 175.17 175.45 2qjp n VAL 54 N 3.53 0.00 -0.52 1.11 0.31 -1.17 -4.74 118.33 116.85 2qjp n VAL 54 Ca 0.04 -0.48 0.43 0.00 -0.01 0.00 0.00 64.34 64.32 2qjp n VAL 54 Cb 0.50 1.00 0.70 0.00 -0.91 0.00 0.00 33.84 35.13 2qjp n VAL 54 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2qjp n SER 55 N -0.93 0.15 -0.03 4.52 3.41 -1.25 -0.70 113.62 118.78 2qjp n SER 55 Ca 0.00 1.23 -0.14 0.00 -0.26 0.00 0.00 58.87 59.70 2qjp n SER 55 Cb 0.02 -0.61 -0.10 0.00 -0.26 0.00 0.00 64.21 63.26 2qjp n SER 55 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2qjp h SER 56 N 0.00 0.23 -0.48 4.04 4.64 -1.95 -3.46 113.55 116.57 2qjp h SER 56 Ca 0.87 -0.66 -0.56 0.00 -0.47 0.00 0.00 61.79 60.96 2qjp h SER 56 Cb 3.01 -0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 64.98 2qjp h SER 56 CO -0.33 0.86 1.61 0.52 -0.87 0.00 0.00 176.83 178.62 2qjp n VAL 57 N -4.57 0.01 -1.69 0.95 0.31 0.12 -4.97 118.33 108.50 2qjp n VAL 57 Ca -0.09 -0.19 -0.31 0.00 -0.01 0.00 0.00 64.34 63.74 2qjp n VAL 57 Cb 0.43 -1.12 0.04 0.00 -0.91 0.00 0.00 33.84 32.28 2qjp n VAL 57 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2qjp s GLU 58 N 7.93 3.17 0.33 5.55 2.02 -1.26 -4.96 118.70 131.48 2qjp s GLU 58 Ca 1.22 0.86 -0.28 0.00 0.02 0.00 0.00 54.97 56.79 2qjp s GLU 58 Cb -1.03 -2.02 -0.09 0.00 0.10 0.00 0.00 34.13 31.08 2qjp s GLU 58 CO 0.47 -0.91 1.18 -1.25 0.02 0.00 0.00 175.26 174.78 2qjp s PRO 59 N -5.10 4.38 0.00 0.39 0.04 -1.26 -2.77 135.00 130.67 2qjp s PRO 59 Ca 0.57 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.55 2qjp s PRO 59 Cb -0.13 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.42 2qjp s PRO 59 CO 0.55 -0.07 0.00 0.41 0.04 0.00 0.00 177.00 177.92 2qjp n GLY 60 N 0.89 0.76 3.43 0.56 0.00 0.59 -4.89 105.19 106.53 2qjp n GLY 60 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 2qjp n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qjp s VAL 61 N -2.18 3.26 0.04 1.61 1.01 -1.12 -4.97 120.40 118.06 2qjp s VAL 61 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2qjp s VAL 61 Cb 0.00 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 2qjp s VAL 61 CO 0.00 0.53 0.15 -1.58 0.00 0.00 0.00 175.10 174.20 2qjp s GLN 62 N 0.11 3.23 -0.13 2.72 0.74 -1.26 -2.02 119.66 123.04 2qjp s GLN 62 Ca -0.05 -0.49 0.01 0.00 0.05 0.00 0.00 55.36 54.88 2qjp s GLN 62 Cb -0.14 -2.94 0.02 0.00 1.10 0.00 0.00 33.01 31.05 2qjp s GLN 62 CO 0.04 0.62 -0.15 -1.17 -0.55 0.00 0.00 175.29 174.08 2qjp s LEU 63 N -2.23 1.74 -0.15 3.68 2.96 -0.47 -4.94 118.68 119.26 2qjp s LEU 63 Ca 0.30 -0.47 -0.07 0.00 -0.22 0.00 0.00 54.13 53.67 2qjp s LEU 63 Cb -0.13 -1.16 -0.04 0.00 0.50 0.00 0.00 46.19 45.36 2qjp s LEU 63 CO 0.22 -0.01 0.09 -0.89 -1.32 0.00 0.00 176.35 174.44 2qjp s THR 64 N 1.20 5.09 0.01 3.68 2.01 -1.26 -0.79 115.64 125.57 2qjp s THR 64 Ca -0.01 0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.06 2qjp s THR 64 Cb -0.14 -3.25 -0.01 0.00 0.01 0.00 0.00 72.50 69.11 2qjp s THR 64 CO -0.06 0.54 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.68 2qjp s VAL 65 N -0.32 0.22 0.31 3.82 1.01 -0.75 -4.95 120.40 119.75 2qjp s VAL 65 Ca 0.10 -0.41 -0.18 0.00 0.00 0.00 0.00 61.98 61.49 2qjp s VAL 65 Cb -0.12 -0.25 -0.09 0.00 0.00 0.00 0.00 36.38 35.92 2qjp s VAL 65 CO 0.01 -0.12 0.79 -0.75 0.00 0.00 0.00 175.10 175.03 2qjp s LYS 66 N -0.56 4.17 -0.30 2.72 2.20 -1.26 -0.53 119.74 126.18 2qjp s LYS 66 Ca -0.04 0.87 -0.16 0.00 -0.36 0.00 0.00 55.97 56.28 2qjp s LYS 66 Cb -0.04 -2.56 0.17 0.00 -1.51 0.00 0.00 37.83 33.89 2qjp s LYS 66 CO -0.00 0.21 1.05 0.12 -0.36 0.00 0.00 175.35 176.36 2qjp s PHE 67 N -1.84 -0.55 -1.66 4.03 5.36 -0.67 -4.92 117.98 117.74 2qjp s PHE 67 Ca 0.52 0.97 0.00 0.00 -0.96 0.00 0.00 56.93 57.45 2qjp s PHE 67 Cb -0.13 0.33 0.00 0.00 -0.34 0.00 0.00 43.02 42.88 2qjp s PHE 67 CO 0.18 -0.27 0.00 1.28 -1.46 0.00 0.00 175.22 174.95 2qjp n LEU 68 N 4.70 -1.63 0.00 6.12 4.77 -1.26 -1.85 117.00 127.86 2qjp n LEU 68 Ca -0.10 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2qjp n LEU 68 Cb 0.54 -2.68 0.00 0.00 -2.33 0.00 0.00 43.42 38.94 2qjp n LEU 68 CO -0.03 -0.36 0.00 0.61 -1.33 0.00 0.00 177.39 176.27 2qjp n GLY 69 N -0.82 0.80 3.41 -0.72 0.00 -1.26 -5.02 105.19 101.59 2qjp n GLY 69 Ca -0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 2qjp n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qjp s LYS 70 N -0.01 1.52 0.43 1.61 1.02 -0.77 -5.13 119.74 118.40 2qjp s LYS 70 Ca 0.00 -1.77 -0.04 0.00 0.02 0.00 0.00 55.97 54.18 2qjp s LYS 70 Cb 0.00 -1.08 -0.04 0.00 -0.52 0.00 0.00 37.83 36.19 2qjp s LYS 70 CO 0.00 0.02 0.71 -1.25 -0.92 0.00 0.00 175.35 173.91 2qjp s PRO 71 N -3.74 3.55 -0.10 -1.68 0.04 -1.26 -1.67 135.00 130.14 2qjp s PRO 71 Ca 0.29 0.06 -0.02 0.00 0.04 0.00 0.00 61.00 61.38 2qjp s PRO 71 Cb 0.04 -2.47 0.03 0.00 0.04 0.00 0.00 34.50 32.14 2qjp s PRO 71 CO 0.11 -0.07 0.01 0.42 0.04 0.00 0.00 177.00 177.51 2qjp s ILE 72 N -2.56 0.40 0.32 0.56 1.01 0.31 -1.31 121.20 119.93 2qjp s ILE 72 Ca 0.45 -0.01 -0.18 0.00 0.00 0.00 0.00 60.65 60.91 2qjp s ILE 72 Cb -0.10 -0.63 -0.09 0.00 0.01 0.00 0.00 42.46 41.64 2qjp s ILE 72 CO 0.41 0.16 0.79 -0.36 0.00 0.00 0.00 174.94 175.94 2qjp s PHE 73 N 1.95 3.45 -0.35 3.97 0.08 0.76 -1.81 117.98 126.03 2qjp s PHE 73 Ca 0.04 1.38 0.00 0.00 0.12 0.00 0.00 56.93 58.47 2qjp s PHE 73 Cb -0.13 -2.65 0.14 0.00 -0.57 0.00 0.00 43.02 39.81 2qjp s PHE 73 CO -0.06 0.12 0.23 0.42 -0.10 0.00 0.00 175.22 175.83 2qjp s ILE 74 N -1.89 0.03 -0.16 0.64 1.01 0.03 -2.29 121.20 118.58 2qjp s ILE 74 Ca 0.53 -1.50 -0.06 0.00 0.00 0.00 0.00 60.65 59.62 2qjp s ILE 74 Cb -0.12 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.28 2qjp s ILE 74 CO 0.18 -0.90 0.04 -0.60 0.00 0.00 0.00 174.94 173.66 2qjp s ARG 75 N 1.23 3.74 -0.46 2.79 3.52 -0.52 -1.37 118.95 127.88 2qjp s ARG 75 Ca 0.17 -0.37 -0.19 0.00 -0.13 0.00 0.00 55.73 55.21 2qjp s ARG 75 Cb -0.21 -3.10 0.04 0.00 -1.56 0.00 0.00 34.95 30.12 2qjp s ARG 75 CO -0.03 0.37 0.57 0.50 -0.81 0.00 0.00 175.30 175.90 2qjp s ARG 76 N 0.07 3.16 0.68 5.12 3.52 -0.86 -1.53 118.95 129.12 2qjp s ARG 76 Ca 0.04 -0.70 -0.12 0.00 -0.13 0.00 0.00 55.73 54.83 2qjp s ARG 76 Cb -0.12 -4.01 0.00 0.00 -1.56 0.00 0.00 34.95 29.26 2qjp s ARG 76 CO 0.01 -1.03 1.06 1.03 -0.81 0.00 0.00 175.30 175.56 2qjp s ARG 77 N 2.51 2.94 0.54 5.12 0.52 -0.03 0.22 118.95 130.77 2qjp s ARG 77 Ca 0.16 1.02 0.03 0.00 -0.52 0.00 0.00 55.73 56.42 2qjp s ARG 77 Cb -0.17 -1.99 0.04 0.00 0.52 0.00 0.00 34.95 33.35 2qjp s ARG 77 CO 0.15 -1.10 0.76 0.95 0.02 0.00 0.00 175.30 176.07 2qjp s THR 78 N -2.92 2.65 0.14 0.02 -4.23 -1.26 -4.42 115.64 105.62 2qjp s THR 78 Ca 0.59 -0.73 -0.20 0.00 -1.18 0.00 0.00 61.69 60.17 2qjp s THR 78 Cb -0.15 -2.92 0.01 0.00 1.34 0.00 0.00 72.50 70.78 2qjp s THR 78 CO 0.52 0.00 1.67 -0.33 -0.54 0.00 0.00 174.62 175.94 2qjp h GLU 79 N 0.12 -0.10 -0.57 3.99 5.08 -1.98 -1.45 114.58 119.68 2qjp h GLU 79 Ca -0.41 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.08 2qjp h GLU 79 Cb 1.29 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 30.46 2qjp h GLU 79 CO 0.49 -0.07 -0.06 0.00 -1.00 0.00 0.00 179.01 178.38 2qjp h ALA 80 N 1.07 0.48 -0.72 3.43 0.00 -1.98 0.71 119.26 122.25 2qjp h ALA 80 Ca 0.12 0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.24 2qjp h ALA 80 Cb 0.28 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2qjp h ALA 80 CO -0.28 -0.41 0.46 -0.44 0.00 0.00 0.00 179.25 178.58 2qjp h ASP 81 N 0.07 0.78 0.25 0.00 3.32 -1.73 -0.80 116.42 118.31 2qjp h ASP 81 Ca 0.29 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.19 2qjp h ASP 81 Cb 0.45 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2qjp h ASP 81 CO -0.52 0.55 -0.51 0.40 -1.72 0.00 0.00 179.24 177.44 2qjp h ILE 82 N 0.93 1.35 0.08 0.35 2.04 -0.15 -2.16 117.51 119.94 2qjp h ILE 82 Ca 0.27 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.37 2qjp h ILE 82 Cb -0.05 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 2qjp h ILE 82 CO -0.08 0.53 -0.04 -0.08 0.00 0.00 0.00 178.15 178.48 2qjp h GLU 83 N 0.23 -0.11 -1.01 2.37 4.57 0.12 -1.85 114.58 118.91 2qjp h GLU 83 Ca 0.01 0.01 0.20 0.00 -1.18 0.00 0.00 59.36 58.39 2qjp h GLU 83 Cb 0.98 0.02 -0.11 0.00 -0.16 0.00 0.00 28.75 29.49 2qjp h GLU 83 CO 0.08 -0.07 0.61 -0.07 -1.18 0.00 0.00 179.01 178.38 2qjp h LEU 84 N -0.11 0.78 0.20 1.64 4.07 -1.27 -1.32 115.31 119.30 2qjp h LEU 84 Ca -0.01 0.10 0.01 0.00 0.08 0.00 0.00 57.88 58.06 2qjp h LEU 84 Cb 0.08 -0.03 -0.03 0.00 1.08 0.00 0.00 40.66 41.76 2qjp h LEU 84 CO 0.02 0.25 -0.30 1.23 -1.08 0.00 0.00 178.44 178.56 2qjp h GLY 85 N 0.74 -0.63 1.98 0.83 0.00 -1.33 -2.82 103.07 101.84 2qjp h GLY 85 Ca 0.59 0.36 -0.07 0.00 0.00 0.00 0.00 47.33 48.20 2qjp h GLY 85 CO -0.40 -0.25 -0.33 3.21 0.00 0.00 0.00 176.54 178.77 2qjp h ARG 86 N -0.57 0.03 0.00 4.80 3.08 -0.45 -3.06 114.38 118.21 2qjp h ARG 86 Ca 0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qjp h ARG 86 Cb 0.57 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 2qjp h ARG 86 CO -0.13 0.36 0.00 -1.13 -1.07 0.00 0.00 179.97 178.00 2qjp n SER 87 N -4.14 0.00 -4.87 7.04 3.41 -0.58 -4.78 113.62 109.70 2qjp n SER 87 Ca -0.02 -0.56 -0.33 0.00 -0.26 0.00 0.00 58.87 57.70 2qjp n SER 87 Cb 0.38 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.27 2qjp n SER 87 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2qjp s VAL 88 N -2.00 4.96 -0.22 -3.33 1.01 -1.15 -5.07 120.40 114.60 2qjp s VAL 88 Ca 0.25 0.46 -0.07 0.00 0.00 0.00 0.00 61.98 62.63 2qjp s VAL 88 Cb 0.11 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 2qjp s VAL 88 CO 0.19 0.01 0.05 -1.10 0.00 0.00 0.00 175.10 174.25 2qjp s GLN 89 N -2.62 3.71 0.17 2.72 -0.21 -1.26 -4.96 119.66 117.21 2qjp s GLN 89 Ca 0.44 -0.46 0.09 0.00 0.02 0.00 0.00 55.36 55.45 2qjp s GLN 89 Cb -0.12 -3.22 0.61 0.00 1.00 0.00 0.00 33.01 31.29 2qjp s GLN 89 CO 0.21 -0.02 0.73 -0.11 -2.12 0.00 0.00 175.29 173.98 2qjp n LEU 90 N 4.38 0.15 0.01 2.90 7.94 -1.26 0.49 117.00 131.62 2qjp n LEU 90 Ca -0.17 0.77 0.13 0.00 -1.11 0.00 0.00 56.01 55.64 2qjp n LEU 90 Cb 0.52 -0.37 0.57 0.00 0.53 0.00 0.00 43.42 44.66 2qjp n LEU 90 CO 0.32 -0.86 0.93 0.61 -1.11 0.00 0.00 177.39 177.29 2qjp n GLY 91 N -1.12 -1.48 0.21 -3.96 0.00 -1.26 -3.14 105.19 94.44 2qjp n GLY 91 Ca 0.17 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.23 2qjp n GLY 91 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qjp n GLN 92 N -1.60 0.68 -2.19 1.61 6.02 1.83 -4.95 117.38 118.79 2qjp n GLN 92 Ca 0.06 -0.43 -0.27 0.00 -0.01 0.00 0.00 57.00 56.36 2qjp n GLN 92 Cb 0.34 -1.49 0.14 0.00 1.02 0.00 0.00 30.24 30.25 2qjp n GLN 92 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2qjp s LEU 93 N -2.61 2.81 -0.10 1.08 1.43 -1.18 -4.96 118.68 115.15 2qjp s LEU 93 Ca 0.21 0.08 0.13 0.00 -1.03 0.00 0.00 54.13 53.52 2qjp s LEU 93 Cb 0.19 -2.30 -0.19 0.00 0.03 0.00 0.00 46.19 43.92 2qjp s LEU 93 CO 0.57 -2.29 0.14 0.52 0.23 0.00 0.00 176.35 175.52 2qjp n VAL 94 N -3.34 0.64 -3.68 -1.59 0.31 -1.25 -4.88 118.33 104.54 2qjp n VAL 94 Ca 0.14 -0.51 -0.25 0.00 -0.01 0.00 0.00 64.34 63.71 2qjp n VAL 94 Cb 0.60 -0.37 -0.17 0.00 -0.91 0.00 0.00 33.84 32.99 2qjp n VAL 94 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2qjp s ASP 95 N -4.39 2.16 0.11 4.52 2.15 -1.26 -5.02 116.67 114.94 2qjp s ASP 95 Ca -0.06 -0.46 0.25 0.00 0.43 0.00 0.00 52.55 52.71 2qjp s ASP 95 Cb 0.06 -0.36 0.61 0.00 -0.30 0.00 0.00 42.92 42.93 2qjp s ASP 95 CO 0.59 -0.29 1.54 0.35 -0.17 0.00 0.00 175.17 177.18 2qjp n THR 96 N 5.20 0.33 -2.42 1.71 -2.24 -1.26 -4.72 114.28 110.87 2qjp n THR 96 Ca -0.07 -0.20 -0.41 0.00 -2.27 0.00 0.00 64.05 61.10 2qjp n THR 96 Cb 0.49 -0.24 -0.04 0.00 -2.10 0.00 0.00 70.33 68.44 2qjp n THR 96 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2qjp s ASN 97 N -3.98 7.15 0.29 3.42 3.84 -1.26 0.32 114.94 124.73 2qjp s ASN 97 Ca 0.09 2.24 0.25 0.00 0.21 0.00 0.00 52.86 55.64 2qjp s ASN 97 Cb 0.14 -2.61 1.03 0.00 -0.55 0.00 0.00 41.25 39.26 2qjp s ASN 97 CO 0.66 -0.29 1.74 0.00 -2.79 0.00 0.00 177.10 176.42 2qjp h ALA 98 N 4.76 1.00 -6.74 1.71 0.00 -1.68 -3.36 119.26 114.95 2qjp h ALA 98 Ca -0.45 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 53.91 2qjp h ALA 98 Cb 1.21 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.82 2qjp h ALA 98 CO 0.72 0.00 -0.86 0.54 0.00 0.00 0.00 179.25 179.65 2qjp n ARG 99 N -2.33 -2.92 -3.94 0.00 5.12 -1.26 -4.82 116.66 106.51 2qjp n ARG 99 Ca 0.02 0.35 -0.35 0.00 -1.93 0.00 0.00 57.85 55.94 2qjp n ARG 99 Cb 0.23 -4.85 -0.14 0.00 -1.16 0.00 0.00 32.46 26.54 2qjp n ARG 99 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2qjp s ASN 100 N -3.60 4.36 0.22 0.55 3.84 -1.26 -2.12 114.94 116.93 2qjp s ASN 100 Ca 0.53 -0.81 0.24 0.00 0.21 0.00 0.00 52.86 53.03 2qjp s ASN 100 Cb -0.29 -1.69 0.93 0.00 -0.55 0.00 0.00 41.25 39.65 2qjp s ASN 100 CO 0.93 -0.12 1.71 0.00 -2.79 0.00 0.00 177.10 176.83 2qjp n ALA 101 N 4.70 1.80 -0.07 1.71 0.00 -1.15 -3.26 120.51 124.24 2qjp n ALA 101 Ca -0.16 0.05 -0.13 0.00 0.00 0.00 0.00 53.44 53.19 2qjp n ALA 101 Cb 0.47 -1.39 -0.12 0.00 0.00 0.00 0.00 19.45 18.41 2qjp n ALA 101 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2qjp h ASN 102 N 0.00 0.00 -2.94 0.00 2.35 -1.84 -3.46 115.58 109.70 2qjp h ASN 102 Ca 0.00 -0.95 -0.05 0.00 -0.55 0.00 0.00 56.30 54.75 2qjp h ASN 102 Cb 0.43 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.82 2qjp h ASN 102 CO 0.00 0.98 0.03 2.30 -1.65 0.00 0.00 177.43 179.09 2qjp n ILE 103 N -4.62 0.00 -1.82 2.81 -5.35 -1.20 -5.03 119.36 104.15 2qjp n ILE 103 Ca -0.10 -0.15 -0.37 0.00 -0.27 0.00 0.00 62.75 61.86 2qjp n ILE 103 Cb 0.46 -1.60 0.05 0.00 -1.74 0.00 0.00 39.64 36.81 2qjp n ILE 103 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2qjp s ASP 104 N -1.50 5.04 0.40 7.28 2.15 -1.26 -4.89 116.67 123.89 2qjp s ASP 104 Ca 0.08 2.65 0.08 0.00 0.43 0.00 0.00 52.55 55.79 2qjp s ASP 104 Cb -0.00 -2.62 0.86 0.00 -0.30 0.00 0.00 42.92 40.85 2qjp s ASP 104 CO 0.05 -1.71 2.02 0.00 -0.17 0.00 0.00 175.17 175.36 2qjp h ALA 105 N 1.06 1.76 -0.18 3.66 0.00 -1.96 -2.57 119.26 121.03 2qjp h ALA 105 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2qjp h ALA 105 Cb 1.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2qjp h ALA 105 CO 0.55 0.18 0.00 0.41 0.00 0.00 0.00 179.25 180.39 2qjp n GLY 106 N -1.48 0.74 3.23 0.00 0.00 -1.26 -4.81 105.19 101.60 2qjp n GLY 106 Ca 0.06 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.19 2qjp n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjp n ALA 107 N 0.77 -4.42 -2.61 4.61 0.00 -0.97 -4.84 120.51 113.04 2qjp n ALA 107 Ca 0.17 -1.26 -0.31 0.00 0.00 0.00 0.00 53.44 52.05 2qjp n ALA 107 Cb 0.45 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.42 2qjp n ALA 107 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2qjp s GLU 108 N -3.14 2.40 0.00 0.00 2.02 -1.26 -2.59 118.70 116.12 2qjp s GLU 108 Ca 0.52 -0.86 0.00 0.00 0.02 0.00 0.00 54.97 54.65 2qjp s GLU 108 Cb -0.08 -2.44 0.00 0.00 0.10 0.00 0.00 34.13 31.71 2qjp s GLU 108 CO 0.67 0.55 0.14 0.00 0.02 0.00 0.00 175.26 176.63 2qjp n ALA 109 N 0.99 1.27 -2.28 5.21 0.00 0.97 -4.26 120.51 122.41 2qjp n ALA 109 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.93 2qjp n ALA 109 Cb 0.52 -1.94 -0.06 0.00 0.00 0.00 0.00 19.45 17.97 2qjp n ALA 109 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qjp s THR 110 N 2.14 4.75 0.60 0.00 -4.23 -1.26 -4.90 115.64 112.74 2qjp s THR 110 Ca 0.00 1.14 0.29 0.00 -1.18 0.00 0.00 61.69 61.94 2qjp s THR 110 Cb 0.00 -3.86 0.40 0.00 1.34 0.00 0.00 72.50 70.37 2qjp s THR 110 CO 0.00 0.47 1.70 -0.78 -0.54 0.00 0.00 174.62 175.47 2qjp h ASP 111 N 4.27 0.00 0.82 3.99 1.82 -1.87 1.13 116.42 126.57 2qjp h ASP 111 Ca -0.49 0.00 -0.24 0.00 -0.39 0.00 0.00 57.03 55.91 2qjp h ASP 111 Cb 1.21 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.20 2qjp h ASP 111 CO 0.64 0.00 -1.14 1.56 -1.61 0.00 0.00 179.24 178.69 2qjp h GLN 112 N 0.00 0.12 0.00 0.28 7.50 -1.93 -3.21 115.11 117.87 2qjp h GLN 112 Ca 0.33 -0.20 0.00 0.00 0.50 0.00 0.00 58.65 59.27 2qjp h GLN 112 Cb 1.83 0.08 0.00 0.00 0.05 0.00 0.00 27.48 29.43 2qjp h GLN 112 CO -0.00 1.08 0.00 0.09 -1.50 0.00 0.00 178.83 178.50 2qjp n ASN 113 N -3.42 0.00 -0.00 1.46 4.13 0.39 -3.42 115.26 114.40 2qjp n ASN 113 Ca -0.04 -1.15 0.01 0.00 1.68 0.00 0.00 54.58 55.08 2qjp n ASN 113 Cb 0.98 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 39.20 2qjp n ASN 113 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2qjp n ARG 114 N -0.86 3.38 -3.44 3.52 5.12 -1.00 -4.81 116.66 118.57 2qjp n ARG 114 Ca 0.16 -0.01 -0.19 0.00 -1.93 0.00 0.00 57.85 55.87 2qjp n ARG 114 Cb 0.07 -0.83 -0.01 0.00 -1.16 0.00 0.00 32.46 30.53 2qjp n ARG 114 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2qjp s THR 115 N -1.69 3.90 -0.03 0.55 -4.23 -1.22 -4.49 115.64 108.43 2qjp s THR 115 Ca 0.00 -1.03 0.02 0.00 -1.18 0.00 0.00 61.69 59.50 2qjp s THR 115 Cb 0.02 -3.34 -0.25 0.00 1.34 0.00 0.00 72.50 70.26 2qjp s THR 115 CO 0.12 -0.14 0.73 -0.07 -0.54 0.00 0.00 174.62 174.73 2qjp h LEU 116 N 0.89 0.25-10.56 4.79 3.38 -1.46 -3.48 115.31 109.12 2qjp h LEU 116 Ca -0.45 -0.42 -0.47 0.00 0.09 0.00 0.00 57.88 56.64 2qjp h LEU 116 Cb 1.26 -0.08 0.02 0.00 0.09 0.00 0.00 40.66 41.95 2qjp h LEU 116 CO 0.52 1.36 -0.16 1.51 0.09 0.00 0.00 178.44 181.76 2qjp s ASP 117 N -6.70 5.29 -0.05 -0.43 -4.77 -1.26 -5.02 116.67 103.73 2qjp s ASP 117 Ca -0.09 -0.70 0.05 0.00 -3.30 0.00 0.00 52.55 48.50 2qjp s ASP 117 Cb 0.07 -0.05 -0.24 0.00 -1.09 0.00 0.00 42.92 41.61 2qjp s ASP 117 CO 0.83 -1.12 0.63 -0.33 0.70 0.00 0.00 175.17 175.87 2qjp h GLU 118 N 0.36 0.11 0.00 2.11 3.07 -1.94 -3.22 114.58 115.08 2qjp h GLU 118 Ca -0.34 -0.19 0.00 0.00 -0.50 0.00 0.00 59.36 58.34 2qjp h GLU 118 Cb 1.29 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 2qjp h GLU 118 CO 0.43 0.80 0.00 0.00 -1.40 0.00 0.00 179.01 178.84 2qjp n ALA 119 N -2.69 1.33 -2.80 3.43 0.00 -1.26 -4.78 120.51 113.74 2qjp n ALA 119 Ca -0.20 -0.02 -0.18 0.00 0.00 0.00 0.00 53.44 53.04 2qjp n ALA 119 Cb 1.05 -1.05 0.02 0.00 0.00 0.00 0.00 19.45 19.47 2qjp n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjp n GLY 120 N -1.02 -0.29 0.08 0.00 0.00 -1.22 -4.93 105.19 97.81 2qjp n GLY 120 Ca 0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 2qjp n GLY 120 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qjp n GLU 121 N -3.29 0.66 -3.53 1.61 2.13 -1.26 -4.74 120.64 112.22 2qjp n GLU 121 Ca -0.10 0.02 -0.41 0.00 0.66 0.00 0.00 57.16 57.33 2qjp n GLU 121 Cb 0.60 -1.61 -0.08 0.00 0.27 0.00 0.00 31.44 30.63 2qjp n GLU 121 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2qjp s TRP 122 N -2.84 3.42 -0.30 4.31 0.52 -1.26 -0.85 118.94 121.95 2qjp s TRP 122 Ca -0.07 -1.86 -0.17 0.00 0.02 0.00 0.00 56.10 54.02 2qjp s TRP 122 Cb 0.09 -3.52 -0.02 0.00 -1.15 0.00 0.00 33.47 28.86 2qjp s TRP 122 CO 0.84 -0.99 0.46 -1.17 0.02 0.00 0.00 176.95 176.11 2qjp s LEU 123 N 1.32 4.16 -0.15 2.99 2.96 -0.58 -1.15 118.68 128.24 2qjp s LEU 123 Ca 0.06 0.23 0.00 0.00 -0.22 0.00 0.00 54.13 54.20 2qjp s LEU 123 Cb -0.26 -2.54 0.03 0.00 0.50 0.00 0.00 46.19 43.92 2qjp s LEU 123 CO -0.01 -0.31 -0.11 -0.69 -1.32 0.00 0.00 176.35 173.91 2qjp s VAL 124 N 2.23 1.38 0.20 1.68 1.01 -1.26 -1.44 120.40 124.20 2qjp s VAL 124 Ca 0.18 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.40 2qjp s VAL 124 Cb -0.16 -1.36 0.03 0.00 0.00 0.00 0.00 36.38 34.89 2qjp s VAL 124 CO 0.11 0.37 0.54 0.00 0.00 0.00 0.00 175.10 176.12 2qjp s MET 125 N 1.55 1.39 0.06 2.72 0.23 -0.97 -4.55 119.30 119.73 2qjp s MET 125 Ca 0.04 -0.84 -0.31 0.00 -1.03 0.00 0.00 55.69 53.55 2qjp s MET 125 Cb -0.13 0.53 -0.06 0.00 -1.53 0.00 0.00 34.83 33.63 2qjp s MET 125 CO -0.09 -0.59 1.34 -1.58 -2.03 0.00 0.00 175.02 172.06 2qjp s TRP 126 N -3.87 3.15 -0.10 3.16 0.52 0.49 -0.17 118.94 122.12 2qjp s TRP 126 Ca 0.09 0.99 -0.01 0.00 0.02 0.00 0.00 56.10 57.19 2qjp s TRP 126 Cb -0.01 -3.61 0.02 0.00 -1.15 0.00 0.00 33.47 28.72 2qjp s TRP 126 CO -0.03 -2.11 2.27 0.41 0.02 0.00 0.00 176.95 177.51 2qjp n GLY 127 N 3.48 3.05 3.13 0.98 0.00 -0.43 -4.49 105.19 110.92 2qjp n GLY 127 Ca 0.11 -0.53 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 2qjp n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qjp s VAL 128 N -0.53 3.25 0.27 1.61 1.01 -1.26 -4.03 120.40 120.72 2qjp s VAL 128 Ca 0.20 -1.93 -0.26 0.00 0.00 0.00 0.00 61.98 59.99 2qjp s VAL 128 Cb 0.12 -3.17 -0.16 0.00 0.00 0.00 0.00 36.38 33.17 2qjp s VAL 128 CO -0.01 -0.59 0.52 0.00 0.00 0.00 0.00 175.10 175.02 2qjp n THR 130 N -0.23 0.00 0.00 0.00 -2.24 -1.26 -2.77 114.28 107.78 2qjp n THR 130 Ca 0.15 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2qjp n THR 130 Cb 0.30 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2qjp n THR 130 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2qjp n HIS 131 N -1.10 0.00 -1.16 4.78 -0.00 -1.26 -4.42 115.22 112.06 2qjp n HIS 131 Ca 0.12 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.86 2qjp n HIS 131 Cb 0.29 -0.21 0.03 0.00 -0.00 0.00 0.00 29.99 30.09 2qjp n HIS 131 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2qjp n LEU 132 N -1.14 0.84 0.00 0.27 4.77 -1.26 -4.96 117.00 115.52 2qjp n LEU 132 Ca 0.00 -1.31 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 2qjp n LEU 132 Cb 0.00 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2qjp n LEU 132 CO 0.00 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2qjp n GLY 133 N -0.38 2.45 3.15 -0.72 0.00 -1.11 -5.03 105.19 103.54 2qjp n GLY 133 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 2qjp n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjp s VAL 135 N -2.15 3.96 0.38 0.00 1.01 -1.26 -0.55 120.40 121.79 2qjp s VAL 135 Ca 0.48 -1.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.04 2qjp s VAL 135 Cb -0.08 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.92 2qjp s VAL 135 CO 0.52 -0.24 1.44 -2.16 0.00 0.00 0.00 175.10 174.65 2qjp s PRO 136 N 1.42 4.11 0.02 2.72 0.04 -1.26 -4.77 135.00 137.29 2qjp s PRO 136 Ca -0.00 2.47 -0.29 0.00 0.04 0.00 0.00 61.00 63.21 2qjp s PRO 136 Cb -0.20 -2.95 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 2qjp s PRO 136 CO 0.03 -0.49 0.95 0.42 0.04 0.00 0.00 177.00 177.96 2qjp s ILE 137 N -1.14 4.80 0.00 0.56 1.01 0.79 -4.76 121.20 122.45 2qjp s ILE 137 Ca 0.53 2.01 0.00 0.00 0.00 0.00 0.00 60.65 63.19 2qjp s ILE 137 Cb -0.44 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 37.73 2qjp s ILE 137 CO 0.60 0.20 0.00 0.61 0.00 0.00 0.00 174.94 176.35 2qjp n GLY 138 N 2.76 1.93 1.67 6.18 0.00 -1.26 -1.25 105.19 115.22 2qjp n GLY 138 Ca 0.05 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.05 2qjp n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjp n GLY 139 N 5.00 0.64 2.97 -0.02 0.00 -1.26 -4.09 105.19 108.42 2qjp n GLY 139 Ca 0.00 -0.74 -0.08 0.00 0.00 0.00 0.00 46.02 45.20 2qjp n GLY 139 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qjp n VAL 140 N -3.44-10.33 -4.76 1.61 0.31 -1.19 -5.02 118.33 95.49 2qjp n VAL 140 Ca 0.00 0.50 -0.31 0.00 -0.01 0.00 0.00 64.34 64.52 2qjp n VAL 140 Cb 0.43 -6.93 -0.13 0.00 -0.91 0.00 0.00 33.84 26.30 2qjp n VAL 140 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2qjp s SER 141 N -2.68 3.80 0.00 4.52 0.01 0.57 -4.78 113.70 115.14 2qjp s SER 141 Ca 0.18 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2qjp s SER 141 Cb -0.05 -0.65 0.00 0.00 0.21 0.00 0.00 66.02 65.53 2qjp s SER 141 CO 0.77 0.28 0.00 0.61 0.41 0.00 0.00 173.24 175.31 2qjp n GLY 142 N 1.79 -1.47 1.93 3.44 0.00 -1.26 -2.30 105.19 107.32 2qjp n GLY 142 Ca -0.16 -2.16 -0.09 0.00 0.00 0.00 0.00 46.02 43.60 2qjp n GLY 142 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qjp n ASP 143 N 0.00 4.33 -1.25 1.61 8.00 -1.26 -4.29 116.55 123.69 2qjp n ASP 143 Ca 0.00 -3.36 -0.02 0.00 0.71 0.00 0.00 54.79 52.12 2qjp n ASP 143 Cb 0.00 -0.75 -0.03 0.00 -0.02 0.00 0.00 41.12 40.32 2qjp n ASP 143 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2qjp n PHE 144 N -0.50 -0.01 -3.16 1.24 3.72 -1.26 -5.02 117.46 112.47 2qjp n PHE 144 Ca 0.44 -0.52 -0.22 0.00 -0.05 0.00 0.00 57.45 57.10 2qjp n PHE 144 Cb 1.41 0.21 0.01 0.00 -0.94 0.00 0.00 39.48 40.17 2qjp n PHE 144 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qjp n GLY 145 N 0.21 -0.50 0.00 1.37 0.00 -1.26 -3.32 105.19 101.69 2qjp n GLY 145 Ca -0.12 0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2qjp n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjp n GLY 146 N -1.27 2.06 3.33 -0.02 0.00 -1.03 -3.28 105.19 104.98 2qjp n GLY 146 Ca -0.06 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 2qjp n GLY 146 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qjp s TRP 147 N 1.40 1.81 -0.08 1.61 0.51 -0.17 -0.32 118.94 123.70 2qjp s TRP 147 Ca 0.00 -0.48 0.01 0.00 -2.12 0.00 0.00 56.10 53.51 2qjp s TRP 147 Cb 0.00 -0.90 0.02 0.00 -0.81 0.00 0.00 33.47 31.78 2qjp s TRP 147 CO 0.00 0.33 -0.08 0.12 -0.51 0.00 0.00 176.95 176.82 2qjp s PHE 148 N -2.12 1.26 -0.35 -1.98 5.36 -0.38 -1.24 117.98 118.53 2qjp s PHE 148 Ca 0.16 -0.52 -0.19 0.00 -0.96 0.00 0.00 56.93 55.42 2qjp s PHE 148 Cb -0.05 -1.04 -0.00 0.00 -0.34 0.00 0.00 43.02 41.59 2qjp s PHE 148 CO 0.07 -0.37 0.55 0.00 -1.46 0.00 0.00 175.22 174.01 2qjp h PRO 150 N 8.46 0.00 -0.37 0.00 0.13 -1.88 -1.37 132.00 136.97 2qjp h PRO 150 Ca -0.27 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.81 2qjp h PRO 150 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 2qjp h PRO 150 CO 0.79 0.00 0.03 0.00 -0.23 0.00 0.00 178.00 178.59 2qjp n HIS 152 N -4.52 0.00 -1.81 0.00 8.25 -1.24 -5.06 115.22 110.84 2qjp n HIS 152 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2qjp n HIS 152 Cb 0.25 0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.38 2qjp n HIS 152 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qjp n GLY 153 N 0.00 0.52 3.84 -1.41 0.00 -0.52 -4.70 105.19 102.92 2qjp n GLY 153 Ca 0.00 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.23 2qjp n GLY 153 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qjp s SER 154 N -2.90 6.15 0.04 1.61 0.01 -1.18 -4.18 113.70 113.25 2qjp s SER 154 Ca 0.00 0.38 0.07 0.00 1.31 0.00 0.00 55.95 57.71 2qjp s SER 154 Cb 0.00 -1.94 -0.03 0.00 0.21 0.00 0.00 66.02 64.26 2qjp s SER 154 CO 0.00 0.38 -0.16 -1.00 0.41 0.00 0.00 173.24 172.87 2qjp s HIS 155 N -1.04 2.60 0.01 2.43 0.09 0.62 -0.96 115.29 119.05 2qjp s HIS 155 Ca 0.16 -0.23 0.04 0.00 -0.00 0.00 0.00 55.06 55.03 2qjp s HIS 155 Cb -0.12 -1.47 -0.01 0.00 -0.00 0.00 0.00 32.58 30.98 2qjp s HIS 155 CO 0.06 0.28 -0.11 0.71 -0.00 0.00 0.00 174.74 175.68 2qjp s TYR 156 N -0.96 0.97 0.87 1.40 1.51 -0.37 -1.57 117.35 119.21 2qjp s TYR 156 Ca 0.15 -0.25 -0.12 0.00 -1.01 0.00 0.00 57.07 55.85 2qjp s TYR 156 Cb -0.11 -0.61 0.15 0.00 -0.11 0.00 0.00 41.96 41.29 2qjp s TYR 156 CO 0.06 -0.01 1.22 0.16 -1.11 0.00 0.00 175.55 175.87 2qjp s ASP 157 N -0.59 3.72 0.00 2.29 1.47 -0.08 -1.00 116.67 122.49 2qjp s ASP 157 Ca 0.02 0.29 0.00 0.00 1.18 0.00 0.00 52.55 54.04 2qjp s ASP 157 Cb -0.05 -0.53 0.00 0.00 -0.34 0.00 0.00 42.92 42.00 2qjp s ASP 157 CO 0.00 -2.34 0.13 -1.54 0.68 0.00 0.00 175.17 172.11 2qjp n SER 158 N -3.46 0.00 0.00 2.11 3.41 -1.21 0.16 113.62 114.63 2qjp n SER 158 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2qjp n SER 158 Cb 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 2qjp n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qjp n ALA 159 N -0.56 2.15 -1.78 7.33 0.00 -1.26 -4.87 120.51 121.51 2qjp n ALA 159 Ca 0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 53.44 53.00 2qjp n ALA 159 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2qjp n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjp n GLY 160 N 0.03 0.35 3.84 0.00 0.00 0.41 -4.92 105.19 104.90 2qjp n GLY 160 Ca 0.00 -0.87 -0.38 0.00 0.00 0.00 0.00 46.02 44.78 2qjp n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qjp s ARG 161 N -3.59 3.80 -0.01 1.61 0.52 -1.25 -1.80 118.95 118.22 2qjp s ARG 161 Ca 0.00 0.20 -0.30 0.00 -0.52 0.00 0.00 55.73 55.11 2qjp s ARG 161 Cb 0.00 -3.23 -0.05 0.00 0.52 0.00 0.00 34.95 32.18 2qjp s ARG 161 CO 0.00 0.67 1.42 -1.50 0.02 0.00 0.00 175.30 175.91 2qjp s ILE 162 N -0.90 3.72 0.00 1.52 1.10 -1.26 -0.91 121.20 124.48 2qjp s ILE 162 Ca 0.20 1.08 0.00 0.00 -0.51 0.00 0.00 60.65 61.42 2qjp s ILE 162 Cb -0.15 -3.69 0.00 0.00 0.15 0.00 0.00 42.46 38.77 2qjp s ILE 162 CO 0.09 -0.01 0.36 0.54 -2.11 0.00 0.00 174.94 173.81 2qjp n ARG 163 N 5.58 0.64 0.00 3.50 5.12 -0.61 -3.77 116.66 127.14 2qjp n ARG 163 Ca 0.14 -0.36 0.00 0.00 -1.93 0.00 0.00 57.85 55.70 2qjp n ARG 163 Cb 0.44 -0.85 0.00 0.00 -1.16 0.00 0.00 32.46 30.89 2qjp n ARG 163 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2qjp n LYS 164 N -0.19 0.00 0.00 5.56 4.81 -1.24 -4.95 118.16 122.15 2qjp n LYS 164 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2qjp n LYS 164 Cb 0.02 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.07 2qjp n LYS 164 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qjp n GLY 165 N -0.36 0.41 0.00 3.14 0.00 -1.26 -0.27 105.19 106.85 2qjp n GLY 165 Ca 0.00 -2.22 0.10 0.00 0.00 0.00 0.00 46.02 43.90 2qjp n GLY 165 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qjp n PRO 166 N 0.00 0.09 -1.67 1.61 -0.02 -1.26 -4.94 135.00 128.81 2qjp n PRO 166 Ca 0.00 -0.02 -0.46 0.00 -2.02 0.00 0.00 63.50 61.00 2qjp n PRO 166 Cb 0.00 -1.51 -0.04 0.00 -0.02 0.00 0.00 33.50 31.94 2qjp n PRO 166 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qjp n ALA 167 N -1.60 1.33 0.11 3.55 0.00 -1.26 -4.81 120.51 117.83 2qjp n ALA 167 Ca 0.03 0.44 0.11 0.00 0.00 0.00 0.00 53.44 54.02 2qjp n ALA 167 Cb 0.36 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.45 2qjp n ALA 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2qjp n PRO 168 N 3.09 0.60 -4.38 0.00 -0.04 -1.26 -4.91 135.00 128.09 2qjp n PRO 168 Ca 0.16 0.06 -0.24 0.00 -0.04 0.00 0.00 63.50 63.43 2qjp n PRO 168 Cb 0.29 -1.76 -0.07 0.00 -0.04 0.00 0.00 33.50 31.92 2qjp n PRO 168 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2qjp n GLU 169 N -2.56 0.54 -3.35 0.54 1.02 -1.26 -4.72 120.64 110.85 2qjp n GLU 169 Ca -0.01 -3.45 -0.33 0.00 -0.02 0.00 0.00 57.16 53.35 2qjp n GLU 169 Cb 0.55 2.07 -0.06 0.00 -0.02 0.00 0.00 31.44 33.99 2qjp n GLU 169 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2qjp s ASN 170 N -3.49 6.72 -0.01 1.62 0.01 -1.26 -4.21 114.94 114.32 2qjp s ASN 170 Ca 0.25 1.04 -0.37 0.00 -0.71 0.00 0.00 52.86 53.06 2qjp s ASN 170 Cb 0.01 -2.27 -0.16 0.00 0.41 0.00 0.00 41.25 39.24 2qjp s ASN 170 CO 0.18 -0.04 1.51 0.18 -1.51 0.00 0.00 177.10 177.41 2qjp n LEU 171 N 0.12 2.13 -4.75 0.60 4.77 -0.75 -4.87 117.00 114.25 2qjp n LEU 171 Ca -0.01 1.09 -0.34 0.00 -0.03 0.00 0.00 56.01 56.72 2qjp n LEU 171 Cb 0.52 -1.22 0.05 0.00 -2.33 0.00 0.00 43.42 40.44 2qjp n LEU 171 CO 0.44 -0.73 0.79 -2.84 -1.33 0.00 0.00 177.39 173.71 2qjp s PRO 172 N 1.55 2.78 -0.12 3.23 0.02 -1.26 -4.78 135.00 136.42 2qjp s PRO 172 Ca 0.88 1.63 -0.00 0.00 0.02 0.00 0.00 61.00 63.53 2qjp s PRO 172 Cb -0.93 -1.93 -0.02 0.00 0.02 0.00 0.00 34.50 31.64 2qjp s PRO 172 CO 0.51 -1.31 -0.12 0.42 -0.33 0.00 0.00 177.00 176.17 2qjp s ILE 173 N -1.96 3.16 0.61 2.83 1.01 -0.90 -0.38 121.20 125.58 2qjp s ILE 173 Ca 0.72 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.77 2qjp s ILE 173 Cb -0.26 -2.33 0.08 0.00 0.01 0.00 0.00 42.46 39.96 2qjp s ILE 173 CO 0.38 0.53 0.85 -2.16 0.00 0.00 0.00 174.94 174.54 2qjp s PRO 174 N 0.22 2.18 -0.34 2.79 0.04 -1.26 -2.91 135.00 135.72 2qjp s PRO 174 Ca -0.08 -1.06 -0.27 0.00 0.04 0.00 0.00 61.00 59.63 2qjp s PRO 174 Cb -0.15 -2.46 -0.05 0.00 0.04 0.00 0.00 34.50 31.88 2qjp s PRO 174 CO 0.05 -1.00 2.19 -0.51 0.04 0.00 0.00 177.00 177.77 2qjp s LEU 175 N -4.88 3.43 -0.01 -3.56 1.43 -1.26 -4.63 118.68 109.19 2qjp s LEU 175 Ca 0.61 1.46 0.01 0.00 -1.03 0.00 0.00 54.13 55.18 2qjp s LEU 175 Cb -0.08 -3.15 0.01 0.00 0.03 0.00 0.00 46.19 43.00 2qjp s LEU 175 CO 0.41 -2.23 -0.01 0.00 0.23 0.00 0.00 176.35 174.74 2qjp s ALA 176 N 9.34 0.23 -0.07 4.21 0.00 -1.26 -2.53 121.76 131.68 2qjp s ALA 176 Ca 0.94 0.00 -0.24 0.00 0.00 0.00 0.00 51.96 52.67 2qjp s ALA 176 Cb -0.25 -0.15 0.05 0.00 0.00 0.00 0.00 23.12 22.77 2qjp s ALA 176 CO 0.31 0.00 0.54 -1.59 0.00 0.00 0.00 175.76 175.02 2qjp s LYS 177 N 0.34 0.86 -0.09 0.00 -2.85 -1.13 -4.97 119.74 111.90 2qjp s LYS 177 Ca -0.03 0.20 -0.30 0.00 -1.00 0.00 0.00 55.97 54.84 2qjp s LYS 177 Cb -0.06 0.40 -0.03 0.00 -2.06 0.00 0.00 37.83 36.08 2qjp s LYS 177 CO -0.01 -0.24 1.30 -0.06 0.10 0.00 0.00 175.35 176.45 2qjp s PHE 178 N -0.98 2.88 -0.75 1.78 0.40 -1.26 -0.53 117.98 119.51 2qjp s PHE 178 Ca -0.10 0.96 0.25 0.00 -0.60 0.00 0.00 56.93 57.44 2qjp s PHE 178 Cb -0.02 -3.55 0.54 0.00 0.51 0.00 0.00 43.02 40.49 2qjp s PHE 178 CO 0.06 -1.92 1.47 -0.89 0.70 0.00 0.00 175.22 174.65 2qjp n ILE 179 N 5.00 0.30 0.00 0.64 2.08 0.20 -4.91 119.36 122.67 2qjp n ILE 179 Ca 0.13 -0.20 0.00 0.00 0.56 0.00 0.00 62.75 63.24 2qjp n ILE 179 Cb 0.45 -0.18 0.00 0.00 -0.75 0.00 0.00 39.64 39.16 2qjp n ILE 179 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 2qjp n ASP 180 N -1.98 0.00 -0.10 4.38 5.68 -1.20 -4.97 116.55 118.36 2qjp n ASP 180 Ca 0.04 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.41 2qjp n ASP 180 Cb 0.41 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.53 2qjp n ASP 180 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 2qjp n GLU 181 N -0.16 -0.02 -2.74 0.11 4.07 -1.26 -2.28 120.64 118.36 2qjp n GLU 181 Ca 0.00 0.41 -0.09 0.00 -0.06 0.00 0.00 57.16 57.42 2qjp n GLU 181 Cb 0.00 -0.70 0.06 0.00 -0.06 0.00 0.00 31.44 30.73 2qjp n GLU 181 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 2qjp n THR 182 N -3.88 0.45 -3.35 6.31 5.66 -1.26 -4.99 114.28 113.22 2qjp n THR 182 Ca 0.09 -2.57 0.02 0.00 -3.05 0.00 0.00 64.05 58.54 2qjp n THR 182 Cb 0.31 0.75 -0.02 0.00 -1.55 0.00 0.00 70.33 69.81 2qjp n THR 182 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2qjp s THR 183 N -1.65 -0.92 -0.03 1.09 2.01 -0.97 -3.02 115.64 112.16 2qjp s THR 183 Ca 0.26 0.00 -0.16 0.00 0.31 0.00 0.00 61.69 62.11 2qjp s THR 183 Cb 0.41 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.87 2qjp s THR 183 CO -0.02 0.00 0.42 -0.63 -0.69 0.00 0.00 174.62 173.70 2qjp s ILE 184 N 2.85 5.06 -0.39 1.82 1.01 -0.72 0.61 121.20 131.44 2qjp s ILE 184 Ca 0.08 0.86 -0.10 0.00 0.00 0.00 0.00 60.65 61.49 2qjp s ILE 184 Cb -0.13 -3.74 0.05 0.00 0.01 0.00 0.00 42.46 38.65 2qjp s ILE 184 CO -0.19 0.51 0.22 -1.58 0.00 0.00 0.00 174.94 173.90 2qjp s GLN 185 N -0.62 2.74 0.00 2.79 0.74 0.30 -0.23 119.66 125.39 2qjp s GLN 185 Ca 0.24 -1.23 0.00 0.00 0.05 0.00 0.00 55.36 54.42 2qjp s GLN 185 Cb -0.16 -3.75 0.00 0.00 1.10 0.00 0.00 33.01 30.20 2qjp s GLN 185 CO 0.12 -0.80 0.00 1.28 -0.55 0.00 0.00 175.29 175.35 2qjp n LEU 186 N 4.97 0.00 0.00 3.68 4.77 -0.92 -2.84 117.00 126.66 2qjp n LEU 186 Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 2qjp n LEU 186 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2qjp n LEU 186 CO 0.37 -0.33 0.00 0.61 -1.33 0.00 0.00 177.39 176.71