#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qf3 n SER 39 N 0.00 3.53 -0.29 1.67 3.41 -1.26 -4.56 113.62 116.11 2qf3 n SER 39 Ca 0.00 -1.98 0.07 0.00 -0.26 0.00 0.00 58.87 56.70 2qf3 n SER 39 Cb 0.00 -0.36 0.22 0.00 -0.26 0.00 0.00 64.21 63.81 2qf3 n SER 39 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2qf3 h THR 40 N 3.63 0.71 -0.01 6.66 2.02 -2.10 -2.36 112.91 121.46 2qf3 h THR 40 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2qf3 h THR 40 Cb 0.90 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 2qf3 h THR 40 CO 0.00 0.11 -0.49 0.47 0.37 0.00 0.00 175.52 175.98 2qf3 n ASP 41 N -4.89 1.15 -4.83 4.18 8.00 -1.26 -4.94 116.55 113.95 2qf3 n ASP 41 Ca 0.17 -0.92 -0.31 0.00 0.71 0.00 0.00 54.79 54.44 2qf3 n ASP 41 Cb 0.44 0.39 0.05 0.00 -0.02 0.00 0.00 41.12 41.98 2qf3 n ASP 41 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2qf3 s GLU 42 N -2.69 2.87 -0.20 -1.24 2.02 -0.89 -5.05 118.70 113.52 2qf3 s GLU 42 Ca 0.17 0.78 -0.02 0.00 0.02 0.00 0.00 54.97 55.92 2qf3 s GLU 42 Cb 0.18 -2.00 -0.00 0.00 0.10 0.00 0.00 34.13 32.41 2qf3 s GLU 42 CO 0.63 -1.10 -0.08 0.99 0.02 0.00 0.00 175.26 175.71 2qf3 s THR 43 N -3.13 3.09 0.36 3.63 2.01 -1.26 -5.06 115.64 115.28 2qf3 s THR 43 Ca 0.58 -0.60 -0.28 0.00 0.31 0.00 0.00 61.69 61.70 2qf3 s THR 43 Cb -0.13 -2.38 -0.11 0.00 0.01 0.00 0.00 72.50 69.89 2qf3 s THR 43 CO 0.54 0.46 1.45 -2.65 -0.69 0.00 0.00 174.62 173.74 2qf3 n PRO 44 N 4.54 2.56 -1.96 4.92 -0.02 -1.26 -4.92 135.00 138.86 2qf3 n PRO 44 Ca -0.19 0.90 -0.41 0.00 -2.02 0.00 0.00 63.50 61.78 2qf3 n PRO 44 Cb 0.51 -2.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.37 2qf3 n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qf3 s ALA 45 N -1.03 3.60 -0.04 3.55 0.00 -1.26 -4.98 121.76 121.60 2qf3 s ALA 45 Ca 0.54 1.40 -0.30 0.00 0.00 0.00 0.00 51.96 53.60 2qf3 s ALA 45 Cb -0.50 -3.56 0.07 0.00 0.00 0.00 0.00 23.12 19.13 2qf3 s ALA 45 CO 0.62 -0.82 0.67 0.45 0.00 0.00 0.00 175.76 176.68 2qf3 s SER 46 N 0.04 -0.64 -0.16 0.00 0.15 -1.26 -5.01 113.70 106.81 2qf3 s SER 46 Ca 0.56 0.66 0.18 0.00 0.70 0.00 0.00 55.95 58.04 2qf3 s SER 46 Cb -0.43 0.54 0.45 0.00 -1.71 0.00 0.00 66.02 64.86 2qf3 s SER 46 CO 0.51 -0.63 1.33 -1.22 1.20 0.00 0.00 173.24 174.43 2qf3 n TYR 47 N 0.85 0.61 0.15 3.44 4.02 -1.26 -4.70 117.16 120.27 2qf3 n TYR 47 Ca -0.19 -0.92 0.16 0.00 -0.01 0.00 0.00 57.90 56.94 2qf3 n TYR 47 Cb 0.57 -0.26 0.73 0.00 -0.02 0.00 0.00 39.34 40.37 2qf3 n TYR 47 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 176.86 174.88 2qf3 h ASN 48 N 1.17 0.00 -0.35 7.72 -0.73 -1.96 -1.61 115.58 119.82 2qf3 h ASN 48 Ca 0.00 0.00 -0.08 0.00 1.87 0.00 0.00 56.30 58.09 2qf3 h ASN 48 Cb 1.29 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.87 2qf3 h ASN 48 CO 0.14 0.00 -0.10 0.25 -0.37 0.00 0.00 177.43 177.36 2qf3 h LEU 49 N 0.00 0.69 -0.81 0.34 5.85 -1.90 0.54 115.31 120.02 2qf3 h LEU 49 Ca 0.12 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 2qf3 h LEU 49 Cb 0.53 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 2qf3 h LEU 49 CO -0.00 0.90 0.46 0.00 -0.34 0.00 0.00 178.44 179.46 2qf3 h ALA 50 N 0.81 1.04 -0.02 1.25 0.00 -1.45 -1.69 119.26 119.20 2qf3 h ALA 50 Ca 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2qf3 h ALA 50 Cb 0.61 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2qf3 h ALA 50 CO 0.04 0.53 0.01 0.28 0.00 0.00 0.00 179.25 180.11 2qf3 h VAL 51 N 1.12 1.02 -0.44 0.00 2.07 -1.05 -0.50 116.25 118.48 2qf3 h VAL 51 Ca 0.29 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.73 2qf3 h VAL 51 Cb 0.01 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2qf3 h VAL 51 CO -0.05 0.02 0.14 0.03 0.02 0.00 0.00 177.57 177.72 2qf3 h ARG 52 N 0.01 0.64 0.02 1.57 3.08 -0.63 0.04 114.38 119.11 2qf3 h ARG 52 Ca 0.01 -0.10 -0.24 0.00 0.07 0.00 0.00 59.98 59.71 2qf3 h ARG 52 Cb 0.01 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 29.96 2qf3 h ARG 52 CO -0.00 0.56 -1.01 0.00 -1.07 0.00 0.00 179.97 178.44 2qf3 h ARG 53 N 0.63 0.48 0.00 0.04 3.08 -1.10 -3.42 114.38 114.09 2qf3 h ARG 53 Ca 0.15 -0.55 -0.30 0.00 0.07 0.00 0.00 59.98 59.36 2qf3 h ARG 53 Cb 0.19 0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 2qf3 h ARG 53 CO -0.01 1.19 -2.12 0.00 -1.07 0.00 0.00 179.97 177.95 2qf3 n ALA 54 N -2.58 1.58 -0.03 0.04 0.00 -0.21 -4.60 120.51 114.70 2qf3 n ALA 54 Ca -0.08 -0.87 0.16 0.00 0.00 0.00 0.00 53.44 52.64 2qf3 n ALA 54 Cb 0.87 0.03 0.60 0.00 0.00 0.00 0.00 19.45 20.95 2qf3 n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qf3 h ALA 55 N 0.10 2.25 0.00 0.00 0.00 -1.15 -1.91 119.26 118.55 2qf3 h ALA 55 Ca -0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2qf3 h ALA 55 Cb 1.72 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 2qf3 h ALA 55 CO -0.06 -0.39 -0.07 -1.35 0.00 0.00 0.00 179.25 177.38 2qf3 h PRO 56 N 0.19 0.00 -0.01 0.00 0.11 -1.80 -2.19 132.00 128.30 2qf3 h PRO 56 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 2qf3 h PRO 56 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2qf3 h PRO 56 CO -0.04 0.07 -0.01 0.00 -0.21 0.00 0.00 178.00 177.81 2qf3 n ALA 57 N -2.36 2.63 -2.75 -0.75 0.00 -0.72 -4.51 120.51 112.05 2qf3 n ALA 57 Ca -0.03 -0.37 -0.36 0.00 0.00 0.00 0.00 53.44 52.69 2qf3 n ALA 57 Cb 0.16 -1.27 -0.10 0.00 0.00 0.00 0.00 19.45 18.24 2qf3 n ALA 57 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2qf3 s VAL 58 N -2.03 5.08 0.33 0.00 1.01 -0.82 -0.70 120.40 123.27 2qf3 s VAL 58 Ca 0.40 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.54 2qf3 s VAL 58 Cb 0.21 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 2qf3 s VAL 58 CO 0.35 0.36 0.21 0.68 0.00 0.00 0.00 175.10 176.71 2qf3 s VAL 59 N 1.03 3.37 -0.22 2.92 -7.23 0.77 -4.49 120.40 116.54 2qf3 s VAL 59 Ca 0.06 -1.53 -0.14 0.00 -1.81 0.00 0.00 61.98 58.57 2qf3 s VAL 59 Cb -0.14 -3.10 -0.04 0.00 0.56 0.00 0.00 36.38 33.66 2qf3 s VAL 59 CO 0.04 -0.19 0.33 0.20 -0.31 0.00 0.00 175.10 175.16 2qf3 s ASN 60 N -3.91 6.31 -0.14 4.85 0.01 -0.21 -1.65 114.94 120.20 2qf3 s ASN 60 Ca 0.39 0.36 -0.03 0.00 -0.71 0.00 0.00 52.86 52.87 2qf3 s ASN 60 Cb -0.05 -2.19 -0.03 0.00 0.41 0.00 0.00 41.25 39.39 2qf3 s ASN 60 CO 0.25 -0.05 -0.03 -0.69 -1.51 0.00 0.00 177.10 175.06 2qf3 s VAL 61 N 1.37 4.01 -0.11 1.60 1.01 -0.11 -0.70 120.40 127.47 2qf3 s VAL 61 Ca 0.15 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.83 2qf3 s VAL 61 Cb -0.15 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.51 2qf3 s VAL 61 CO 0.07 0.52 -0.18 -0.31 0.00 0.00 0.00 175.10 175.20 2qf3 s TYR 62 N 0.05 2.16 -0.38 5.22 1.51 0.18 -0.48 117.35 125.62 2qf3 s TYR 62 Ca 0.01 -0.99 -0.16 0.00 -1.01 0.00 0.00 57.07 54.91 2qf3 s TYR 62 Cb -0.13 -1.51 0.00 0.00 -0.11 0.00 0.00 41.96 40.21 2qf3 s TYR 62 CO 0.02 -0.48 0.39 1.21 -1.11 0.00 0.00 175.55 175.59 2qf3 s ASN 63 N 0.81 6.18 0.00 2.29 3.84 0.54 -0.99 114.94 127.61 2qf3 s ASN 63 Ca -0.10 -0.45 0.02 0.00 0.21 0.00 0.00 52.86 52.54 2qf3 s ASN 63 Cb -0.16 -2.20 -0.04 0.00 -0.55 0.00 0.00 41.25 38.30 2qf3 s ASN 63 CO 0.01 -0.44 -0.00 -0.13 -2.79 0.00 0.00 177.10 173.74 2qf3 s ARG 64 N 2.04 2.77 0.15 0.43 0.52 0.23 -1.18 118.95 123.90 2qf3 s ARG 64 Ca 0.11 -0.62 0.11 0.00 -0.52 0.00 0.00 55.73 54.81 2qf3 s ARG 64 Cb -0.17 -2.66 -0.04 0.00 0.52 0.00 0.00 34.95 32.60 2qf3 s ARG 64 CO 0.12 0.62 -0.25 0.20 0.02 0.00 0.00 175.30 176.01 2qf3 s GLY 65 N -1.56 1.58 -0.27 -3.53 0.00 0.88 -0.77 107.32 103.65 2qf3 s GLY 65 Ca 0.19 -1.50 -0.38 0.00 0.00 0.00 0.00 44.72 43.03 2qf3 s GLY 65 CO 0.10 -1.50 1.87 1.04 0.00 0.00 0.00 173.10 174.61 2qf3 n LEU 66 N 0.72 2.47 0.00 0.66 4.77 -1.26 0.65 117.00 125.00 2qf3 n LEU 66 Ca -0.16 0.92 0.00 0.00 -0.03 0.00 0.00 56.01 56.74 2qf3 n LEU 66 Cb 0.54 -1.19 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 2qf3 n LEU 66 CO 0.25 -0.43 0.00 -3.20 -1.33 0.00 0.00 177.39 172.68 2qf3 n ASN 67 N 6.52 0.00 0.00 -1.43 5.15 -1.26 -5.16 115.26 119.08 2qf3 n ASN 67 Ca 0.30 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.28 2qf3 n ASN 67 Cb 0.17 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 2qf3 n ASN 67 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2qf3 n GLU 75 N 0.00 -2.09 -2.10 1.20 1.02 0.21 -5.31 120.64 113.57 2qf3 n GLU 75 Ca 0.00 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.71 2qf3 n GLU 75 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 2qf3 n GLU 75 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2qf3 s ILE 76 N -2.72 3.68 -0.14 -3.67 1.01 -1.26 -0.08 121.20 118.02 2qf3 s ILE 76 Ca 0.00 0.78 0.09 0.00 0.00 0.00 0.00 60.65 61.52 2qf3 s ILE 76 Cb 0.00 -3.67 -0.23 0.00 0.01 0.00 0.00 42.46 38.56 2qf3 s ILE 76 CO 0.00 -0.26 0.28 0.54 0.00 0.00 0.00 174.94 175.50 2qf3 n ARG 77 N 7.59 0.68 -3.56 2.79 1.74 -0.32 -4.92 116.66 120.66 2qf3 n ARG 77 Ca 0.19 0.17 -0.07 0.00 -0.77 0.00 0.00 57.85 57.37 2qf3 n ARG 77 Cb 0.45 -1.65 -0.02 0.00 -1.02 0.00 0.00 32.46 30.22 2qf3 n ARG 77 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2qf3 s THR 78 N -2.54 0.00 0.15 0.55 -1.32 -1.15 -5.04 115.64 106.29 2qf3 s THR 78 Ca -0.14 -0.13 -0.04 0.00 -1.21 0.00 0.00 61.69 60.17 2qf3 s THR 78 Cb 0.07 -1.21 -0.03 0.00 -1.51 0.00 0.00 72.50 69.83 2qf3 s THR 78 CO 0.78 0.00 0.16 -1.48 -2.21 0.00 0.00 174.62 171.87 2qf3 s LEU 79 N -2.56 1.37 0.00 9.08 0.05 -1.26 -0.34 118.68 125.01 2qf3 s LEU 79 Ca 0.07 -1.08 0.00 0.00 0.05 0.00 0.00 54.13 53.17 2qf3 s LEU 79 Cb -0.01 0.70 0.00 0.00 -2.05 0.00 0.00 46.19 44.83 2qf3 s LEU 79 CO -0.07 -0.81 0.00 0.61 -0.55 0.00 0.00 176.35 175.53 2qf3 n GLY 80 N -0.16 2.50 3.45 -3.48 0.00 0.37 -4.38 105.19 103.49 2qf3 n GLY 80 Ca -0.06 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.28 2qf3 n GLY 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qf3 s SER 81 N 2.00 2.32 0.19 1.61 0.01 0.27 -0.93 113.70 119.16 2qf3 s SER 81 Ca 0.00 -1.46 -0.15 0.00 1.31 0.00 0.00 55.95 55.65 2qf3 s SER 81 Cb 0.00 0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.36 2qf3 s SER 81 CO 0.00 -0.72 0.45 -0.83 0.41 0.00 0.00 173.24 172.56 2qf3 s GLY 82 N -3.50 0.08 -0.09 3.44 0.00 -0.66 -3.96 107.32 102.63 2qf3 s GLY 82 Ca 0.33 -0.43 0.01 0.00 0.00 0.00 0.00 44.72 44.63 2qf3 s GLY 82 CO 0.15 -0.43 -0.09 0.14 0.00 0.00 0.00 173.10 172.87 2qf3 s VAL 83 N -3.90 0.99 -0.34 1.40 1.01 0.23 -0.16 120.40 119.63 2qf3 s VAL 83 Ca 0.12 -0.32 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 2qf3 s VAL 83 Cb 0.00 -0.98 0.01 0.00 0.00 0.00 0.00 36.38 35.41 2qf3 s VAL 83 CO -0.02 0.35 1.25 -0.63 0.00 0.00 0.00 175.10 176.05 2qf3 s ILE 84 N 1.28 4.19 -0.11 2.22 1.01 0.13 -0.99 121.20 128.93 2qf3 s ILE 84 Ca -0.03 1.32 0.15 0.00 0.00 0.00 0.00 60.65 62.09 2qf3 s ILE 84 Cb -0.14 -4.28 -0.10 0.00 0.01 0.00 0.00 42.46 37.95 2qf3 s ILE 84 CO -0.03 -0.59 0.98 0.24 0.00 0.00 0.00 174.94 175.54 2qf3 h MET 85 N 9.23 0.00 -3.26 2.79 2.86 -1.36 -1.83 114.93 123.36 2qf3 h MET 85 Ca -0.25 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.35 2qf3 h MET 85 Cb 1.09 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.62 2qf3 h MET 85 CO 1.05 0.40 0.03 0.16 1.06 0.00 0.00 176.91 179.61 2qf3 s ASP 86 N -6.02 -0.34 0.58 1.22 1.47 -1.21 -4.67 116.67 107.69 2qf3 s ASP 86 Ca -0.01 -0.23 0.29 0.00 1.18 0.00 0.00 52.55 53.77 2qf3 s ASP 86 Cb 0.08 0.52 1.47 0.00 -0.34 0.00 0.00 42.92 44.66 2qf3 s ASP 86 CO 0.80 -0.91 1.90 1.56 0.68 0.00 0.00 175.17 179.20 2qf3 h GLN 87 N 2.24 0.00 0.00 2.11 4.20 -1.92 -1.40 115.11 120.33 2qf3 h GLN 87 Ca -0.34 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.37 2qf3 h GLN 87 Cb 1.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.05 2qf3 h GLN 87 CO 0.43 0.00 0.00 0.54 -0.67 0.00 0.00 178.83 179.13 2qf3 n ARG 88 N -3.80 0.12 0.00 1.46 1.74 -1.26 -4.60 116.66 110.31 2qf3 n ARG 88 Ca 0.09 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 2qf3 n ARG 88 Cb 0.70 -1.74 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 2qf3 n ARG 88 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qf3 n GLY 89 N -0.20 1.13 3.72 -0.13 0.00 -0.53 -4.73 105.19 104.45 2qf3 n GLY 89 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2qf3 n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qf3 s TYR 90 N -2.00 3.72 -0.04 1.61 1.51 -1.24 -1.39 117.35 119.53 2qf3 s TYR 90 Ca 0.00 1.72 0.04 0.00 -1.01 0.00 0.00 57.07 57.82 2qf3 s TYR 90 Cb 0.00 -3.07 -0.00 0.00 -0.11 0.00 0.00 41.96 38.78 2qf3 s TYR 90 CO 0.00 0.09 -0.16 0.42 -1.11 0.00 0.00 175.55 174.79 2qf3 s ILE 91 N 0.55 1.32 -0.10 2.71 1.01 0.20 -0.91 121.20 125.97 2qf3 s ILE 91 Ca 0.49 -0.66 -0.06 0.00 0.00 0.00 0.00 60.65 60.41 2qf3 s ILE 91 Cb -0.22 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 2qf3 s ILE 91 CO 0.28 0.38 0.15 -0.63 0.00 0.00 0.00 174.94 175.12 2qf3 s ILE 92 N 0.00 5.50 0.14 2.92 1.01 -0.17 -0.25 121.20 130.36 2qf3 s ILE 92 Ca -0.02 0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.78 2qf3 s ILE 92 Cb -0.10 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 38.95 2qf3 s ILE 92 CO 0.01 0.58 0.19 1.07 0.00 0.00 0.00 174.94 176.79 2qf3 n THR 93 N 1.83 0.00 -3.96 2.92 5.66 -0.34 -0.60 114.28 119.79 2qf3 n THR 93 Ca -0.19 -0.78 -0.34 0.00 -3.05 0.00 0.00 64.05 59.69 2qf3 n THR 93 Cb 0.55 0.46 -0.06 0.00 -1.55 0.00 0.00 70.33 69.73 2qf3 n THR 93 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2qf3 s ASN 94 N -1.91 6.18 0.21 1.09 0.02 -1.26 -1.11 114.94 118.15 2qf3 s ASN 94 Ca 0.13 0.33 -0.09 0.00 -1.02 0.00 0.00 52.86 52.21 2qf3 s ASN 94 Cb -0.00 -1.92 0.28 0.00 0.02 0.00 0.00 41.25 39.63 2qf3 s ASN 94 CO 0.09 0.32 1.75 0.50 0.02 0.00 0.00 177.10 179.78 2qf3 h LYS 95 N 4.29 0.43 0.00 -0.60 3.64 -0.86 -1.99 116.57 121.48 2qf3 h LYS 95 Ca -0.51 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 58.84 2qf3 h LYS 95 Cb 1.20 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2qf3 h LYS 95 CO 0.64 0.29 -0.01 1.12 -2.27 0.00 0.00 179.45 179.22 2qf3 h HIS 96 N 0.45 0.00 -0.45 1.91 2.07 -1.95 -0.75 115.15 116.42 2qf3 h HIS 96 Ca 0.31 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.72 2qf3 h HIS 96 Cb 0.37 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.33 2qf3 h HIS 96 CO -0.15 0.01 -0.16 0.28 -3.07 0.00 0.00 177.93 174.83 2qf3 h VAL 97 N 0.00 1.27 -0.25 6.12 2.07 -1.73 -3.23 116.25 120.50 2qf3 h VAL 97 Ca -0.00 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.24 2qf3 h VAL 97 Cb 0.01 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 2qf3 h VAL 97 CO 0.00 0.44 0.00 2.30 0.02 0.00 0.00 177.57 180.33 2qf3 n ILE 98 N -4.13 0.33 -1.75 4.57 -6.64 -0.60 -4.54 119.36 106.60 2qf3 n ILE 98 Ca 0.01 -0.66 -0.42 0.00 -1.77 0.00 0.00 62.75 59.91 2qf3 n ILE 98 Cb 0.41 1.15 -0.02 0.00 -1.44 0.00 0.00 39.64 39.74 2qf3 n ILE 98 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 2qf3 n ASN 99 N 1.34 3.90 -0.83 7.28 3.02 -0.39 -2.35 115.26 127.23 2qf3 n ASN 99 Ca 0.16 1.15 -0.11 0.00 -0.03 0.00 0.00 54.58 55.75 2qf3 n ASN 99 Cb 0.57 -1.60 -0.05 0.00 -0.61 0.00 0.00 39.78 38.09 2qf3 n ASN 99 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2qf3 n ASP 100 N 2.17 -5.06 -4.76 6.41 8.00 -1.26 -4.97 116.55 117.09 2qf3 n ASP 100 Ca 0.08 0.27 -0.41 0.00 0.71 0.00 0.00 54.79 55.45 2qf3 n ASP 100 Cb 0.37 -3.52 -0.03 0.00 -0.02 0.00 0.00 41.12 37.92 2qf3 n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qf3 s ALA 101 N -2.16 3.48 -0.09 2.24 0.00 -0.99 -4.91 121.76 119.33 2qf3 s ALA 101 Ca 0.00 1.15 -0.01 0.00 0.00 0.00 0.00 51.96 53.10 2qf3 s ALA 101 Cb 0.00 -3.44 -0.25 0.00 0.00 0.00 0.00 23.12 19.43 2qf3 s ALA 101 CO 0.00 -0.50 0.48 -0.44 0.00 0.00 0.00 175.76 175.30 2qf3 h ASP 102 N 3.71 0.29 -3.40 0.00 3.32 -1.31 -3.47 116.42 115.57 2qf3 h ASP 102 Ca -0.48 -0.65 -0.25 0.00 0.02 0.00 0.00 57.03 55.67 2qf3 h ASP 102 Cb 1.22 -0.10 -0.32 0.00 0.22 0.00 0.00 39.33 40.36 2qf3 h ASP 102 CO 0.67 1.59 -0.60 -1.58 -1.72 0.00 0.00 179.24 177.60 2qf3 s GLN 103 N -2.57 0.09 -0.27 3.56 0.74 -0.91 -5.02 119.66 115.28 2qf3 s GLN 103 Ca -0.16 0.39 -0.07 0.00 0.05 0.00 0.00 55.36 55.57 2qf3 s GLN 103 Cb 0.07 -0.19 -0.02 0.00 1.10 0.00 0.00 33.01 33.98 2qf3 s GLN 103 CO 0.79 -0.18 0.08 0.42 -0.55 0.00 0.00 175.29 175.85 2qf3 s ILE 104 N 1.28 4.23 -0.11 -2.34 1.01 -1.26 -0.60 121.20 123.41 2qf3 s ILE 104 Ca -0.08 -0.33 -0.03 0.00 0.00 0.00 0.00 60.65 60.21 2qf3 s ILE 104 Cb -0.12 -3.05 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 2qf3 s ILE 104 CO -0.06 0.25 -0.01 -0.63 0.00 0.00 0.00 174.94 174.49 2qf3 s ILE 105 N 1.58 4.17 -0.16 2.92 1.01 -0.16 -0.19 121.20 130.38 2qf3 s ILE 105 Ca 0.05 -0.28 0.01 0.00 0.00 0.00 0.00 60.65 60.43 2qf3 s ILE 105 Cb -0.16 -2.78 0.01 0.00 0.01 0.00 0.00 42.46 39.54 2qf3 s ILE 105 CO 0.03 0.56 -0.19 -0.69 0.00 0.00 0.00 174.94 174.66 2qf3 s VAL 106 N -0.43 2.31 -0.11 2.92 1.01 0.13 -0.65 120.40 125.58 2qf3 s VAL 106 Ca 0.08 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.19 2qf3 s VAL 106 Cb -0.12 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 2qf3 s VAL 106 CO 0.02 0.53 -0.18 0.00 0.00 0.00 0.00 175.10 175.48 2qf3 s ALA 107 N 0.94 2.44 0.28 5.51 0.00 0.12 -0.73 121.76 130.33 2qf3 s ALA 107 Ca -0.03 -0.93 -0.04 0.00 0.00 0.00 0.00 51.96 50.96 2qf3 s ALA 107 Cb -0.15 -1.04 -0.05 0.00 0.00 0.00 0.00 23.12 21.89 2qf3 s ALA 107 CO -0.04 0.28 0.53 -0.51 0.00 0.00 0.00 175.76 176.03 2qf3 s LEU 108 N 0.30 4.07 0.57 0.00 1.02 0.00 -1.05 118.68 123.60 2qf3 s LEU 108 Ca -0.13 0.65 0.35 0.00 0.02 0.00 0.00 54.13 55.02 2qf3 s LEU 108 Cb -0.16 -3.47 1.68 0.00 0.02 0.00 0.00 46.19 44.26 2qf3 s LEU 108 CO 0.07 -0.19 2.11 1.56 0.02 0.00 0.00 176.35 179.92 2qf3 h GLN 109 N 1.62 0.00 0.00 1.70 1.08 -1.79 -0.69 115.11 117.03 2qf3 h GLN 109 Ca -0.48 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 2qf3 h GLN 109 Cb 1.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.62 2qf3 h GLN 109 CO 0.66 0.04 0.00 -0.40 -0.95 0.00 0.00 178.83 178.18 2qf3 n ASP 110 N -3.23 0.00 0.00 1.46 5.68 -1.26 -4.87 116.55 114.33 2qf3 n ASP 110 Ca -0.01 -1.47 0.00 0.00 -0.50 0.00 0.00 54.79 52.81 2qf3 n ASP 110 Cb 0.23 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 2qf3 n ASP 110 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qf3 n GLY 111 N 0.62 0.77 3.78 6.12 0.00 -0.26 -5.06 105.19 111.16 2qf3 n GLY 111 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 2qf3 n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qf3 s ARG 112 N -0.74 4.15 -0.05 1.61 0.52 -1.26 -4.84 118.95 118.35 2qf3 s ARG 112 Ca 0.00 1.50 0.01 0.00 -0.52 0.00 0.00 55.73 56.73 2qf3 s ARG 112 Cb 0.00 -2.52 0.02 0.00 0.52 0.00 0.00 34.95 32.96 2qf3 s ARG 112 CO 0.00 -0.15 -0.07 0.08 0.02 0.00 0.00 175.30 175.18 2qf3 s VAL 113 N -1.67 0.76 0.18 3.52 1.01 -1.26 -0.82 120.40 122.12 2qf3 s VAL 113 Ca 0.58 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.37 2qf3 s VAL 113 Cb -0.22 -0.74 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 2qf3 s VAL 113 CO 0.27 0.27 -0.11 -0.36 0.00 0.00 0.00 175.10 175.17 2qf3 s PHE 114 N 0.82 1.52 -0.18 5.22 0.40 0.09 -5.00 117.98 120.86 2qf3 s PHE 114 Ca -0.12 -0.68 -0.13 0.00 -0.60 0.00 0.00 56.93 55.39 2qf3 s PHE 114 Cb -0.15 -0.75 -0.05 0.00 0.51 0.00 0.00 43.02 42.59 2qf3 s PHE 114 CO 0.01 0.21 0.27 -2.00 0.70 0.00 0.00 175.22 174.42 2qf3 s GLU 115 N -3.71 4.22 0.13 0.44 2.12 -1.26 -0.70 118.70 119.95 2qf3 s GLU 115 Ca 0.21 0.04 0.04 0.00 0.36 0.00 0.00 54.97 55.61 2qf3 s GLU 115 Cb 0.01 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 2qf3 s GLU 115 CO 0.04 0.19 0.16 0.00 -0.54 0.00 0.00 175.26 175.12 2qf3 s ALA 116 N 0.62 3.70 -0.12 6.30 0.00 0.74 -4.72 121.76 128.28 2qf3 s ALA 116 Ca 0.15 -1.09 -0.06 0.00 0.00 0.00 0.00 51.96 50.96 2qf3 s ALA 116 Cb -0.13 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.44 2qf3 s ALA 116 CO 0.04 0.60 0.09 -1.17 0.00 0.00 0.00 175.76 175.32 2qf3 s LEU 117 N -2.92 4.10 -0.22 0.00 2.96 -0.50 -4.42 118.68 117.70 2qf3 s LEU 117 Ca 0.32 0.34 -0.26 0.00 -0.22 0.00 0.00 54.13 54.30 2qf3 s LEU 117 Cb -0.11 -1.99 -0.00 0.00 0.50 0.00 0.00 46.19 44.59 2qf3 s LEU 117 CO 0.25 0.37 0.91 -0.22 -1.32 0.00 0.00 176.35 176.34 2qf3 s LEU 118 N -0.82 4.11 -0.00 -0.68 2.96 -1.26 -0.75 118.68 122.24 2qf3 s LEU 118 Ca 0.13 1.20 0.13 0.00 -0.22 0.00 0.00 54.13 55.38 2qf3 s LEU 118 Cb -0.12 -3.34 -0.21 0.00 0.50 0.00 0.00 46.19 43.03 2qf3 s LEU 118 CO 0.03 -0.55 0.76 0.58 -1.32 0.00 0.00 176.35 175.85 2qf3 h VAL 119 N 5.39 0.85 0.00 1.68 2.07 -1.13 -3.48 116.25 121.63 2qf3 h VAL 119 Ca -0.23 -2.62 0.00 0.00 0.82 0.00 0.00 66.70 64.67 2qf3 h VAL 119 Cb 1.09 2.38 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2qf3 h VAL 119 CO 0.91 0.49 0.00 0.61 0.02 0.00 0.00 177.57 179.59 2qf3 n GLY 120 N 1.50 1.86 3.51 2.17 0.00 -1.17 -4.86 105.19 108.21 2qf3 n GLY 120 Ca -0.14 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.72 2qf3 n GLY 120 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qf3 s SER 121 N 0.00 -0.11 -0.25 1.61 1.04 -1.26 -0.82 113.70 113.90 2qf3 s SER 121 Ca 0.00 -0.77 -0.03 0.00 0.48 0.00 0.00 55.95 55.64 2qf3 s SER 121 Cb 0.00 0.55 0.11 0.00 0.10 0.00 0.00 66.02 66.78 2qf3 s SER 121 CO 0.00 -1.06 0.22 -0.62 0.98 0.00 0.00 173.24 172.76 2qf3 s ASP 122 N -2.96 2.01 0.53 7.02 2.15 0.18 -4.99 116.67 120.62 2qf3 s ASP 122 Ca 0.17 -0.67 0.19 0.00 0.43 0.00 0.00 52.55 52.67 2qf3 s ASP 122 Cb 0.00 0.23 1.39 0.00 -0.30 0.00 0.00 42.92 44.24 2qf3 s ASP 122 CO 0.03 -0.38 2.16 0.77 -0.17 0.00 0.00 175.17 177.59 2qf3 h SER 123 N 8.32 0.00 0.50 -0.34 4.64 -1.95 0.32 113.55 125.05 2qf3 h SER 123 Ca -0.16 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.14 2qf3 h SER 123 Cb 1.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 2qf3 h SER 123 CO 0.34 0.01 -0.47 -0.07 -0.87 0.00 0.00 176.83 175.77 2qf3 h LEU 124 N 0.00 -1.27 -0.01 5.97 3.38 -1.95 -2.83 115.31 118.60 2qf3 h LEU 124 Ca -0.00 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2qf3 h LEU 124 Cb 0.03 0.41 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2qf3 h LEU 124 CO 0.00 -0.63 0.00 0.35 0.09 0.00 0.00 178.44 178.25 2qf3 n THR 125 N -5.28 0.60 -2.45 0.22 -2.24 -1.12 -4.92 114.28 99.09 2qf3 n THR 125 Ca -0.11 -0.28 -0.16 0.00 -2.27 0.00 0.00 64.05 61.23 2qf3 n THR 125 Cb 0.43 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 2qf3 n THR 125 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2qf3 n ASP 126 N -2.26 -4.70 -4.70 3.42 2.03 0.11 -4.96 116.55 105.49 2qf3 n ASP 126 Ca 0.06 -0.07 -0.33 0.00 0.52 0.00 0.00 54.79 54.96 2qf3 n ASP 126 Cb 0.43 -3.75 -0.09 0.00 -0.72 0.00 0.00 41.12 36.99 2qf3 n ASP 126 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2qf3 s LEU 127 N -4.58 3.61 0.04 -2.67 1.43 -1.04 -0.33 118.68 115.15 2qf3 s LEU 127 Ca 0.07 0.05 0.04 0.00 -1.03 0.00 0.00 54.13 53.26 2qf3 s LEU 127 Cb -0.03 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2qf3 s LEU 127 CO 0.08 0.30 -0.12 0.00 0.23 0.00 0.00 176.35 176.84 2qf3 s ALA 128 N -1.08 0.96 -0.16 4.21 0.00 -0.27 -0.64 121.76 124.78 2qf3 s ALA 128 Ca 0.19 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.35 2qf3 s ALA 128 Cb -0.12 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 2qf3 s ALA 128 CO 0.10 0.14 -0.12 0.08 0.00 0.00 0.00 175.76 175.95 2qf3 s VAL 129 N -1.02 2.97 0.32 0.00 1.01 -0.00 -1.20 120.40 122.48 2qf3 s VAL 129 Ca -0.02 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.37 2qf3 s VAL 129 Cb -0.08 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 2qf3 s VAL 129 CO 0.01 0.50 0.18 -0.76 0.00 0.00 0.00 175.10 175.03 2qf3 s LEU 130 N 0.72 3.41 -0.05 3.92 1.43 0.66 -0.52 118.68 128.25 2qf3 s LEU 130 Ca -0.06 -0.63 -0.00 0.00 -1.03 0.00 0.00 54.13 52.41 2qf3 s LEU 130 Cb -0.15 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.16 2qf3 s LEU 130 CO 0.02 -0.27 -0.00 -0.75 0.23 0.00 0.00 176.35 175.58 2qf3 s LYS 131 N -3.88 0.50 0.12 1.70 2.47 0.07 -0.63 119.74 120.10 2qf3 s LYS 131 Ca 0.38 0.07 0.08 0.00 -1.56 0.00 0.00 55.97 54.94 2qf3 s LYS 131 Cb -0.04 -0.74 -0.04 0.00 -1.46 0.00 0.00 37.83 35.55 2qf3 s LYS 131 CO 0.24 -0.20 -0.13 0.96 0.16 0.00 0.00 175.35 176.38 2qf3 s ILE 132 N 1.43 3.15 -0.29 5.43 -4.36 -0.48 -1.40 121.20 124.67 2qf3 s ILE 132 Ca -0.04 -1.41 -0.00 0.00 -0.26 0.00 0.00 60.65 58.94 2qf3 s ILE 132 Cb -0.13 -2.48 0.05 0.00 1.25 0.00 0.00 42.46 41.16 2qf3 s ILE 132 CO -0.03 0.07 -0.03 0.20 0.24 0.00 0.00 174.94 175.40 2qf3 s ASN 133 N -2.28 4.77 0.08 4.36 0.01 -1.26 -4.40 114.94 116.21 2qf3 s ASN 133 Ca 0.21 -1.34 0.09 0.00 -0.71 0.00 0.00 52.86 51.11 2qf3 s ASN 133 Cb -0.11 -1.67 -0.03 0.00 0.41 0.00 0.00 41.25 39.86 2qf3 s ASN 133 CO 0.13 -0.25 -0.24 0.00 -1.51 0.00 0.00 177.10 175.23 2qf3 s ALA 134 N 1.20 2.07 0.04 0.60 0.00 -1.26 -5.04 121.76 119.37 2qf3 s ALA 134 Ca -0.06 -1.26 -0.15 0.00 0.00 0.00 0.00 51.96 50.49 2qf3 s ALA 134 Cb -0.20 -0.37 -0.34 0.00 0.00 0.00 0.00 23.12 22.21 2qf3 s ALA 134 CO -0.02 0.47 1.03 1.79 0.00 0.00 0.00 175.76 179.02 2qf3 h THR 135 N 4.14 1.30 -3.71 0.00 1.35 -2.02 -3.46 112.91 110.50 2qf3 h THR 135 Ca -0.47 -2.68 -0.49 0.00 -0.55 0.00 0.00 66.41 62.22 2qf3 h THR 135 Cb 1.16 2.98 0.04 0.00 -1.73 0.00 0.00 68.15 70.60 2qf3 h THR 135 CO 0.42 0.81 0.17 -0.83 -0.25 0.00 0.00 175.52 175.83 2qf3 s GLY 136 N -4.58 1.53 0.82 5.82 0.00 -1.26 -5.04 107.32 104.62 2qf3 s GLY 136 Ca -0.09 -0.45 -0.12 0.00 0.00 0.00 0.00 44.72 44.06 2qf3 s GLY 136 CO 0.94 -0.26 1.17 -0.32 0.00 0.00 0.00 173.10 174.64 2qf3 s GLY 137 N -4.14 1.99 -0.07 0.20 0.00 -1.26 -5.02 107.32 99.03 2qf3 s GLY 137 Ca 0.49 0.71 0.04 0.00 0.00 0.00 0.00 44.72 45.97 2qf3 s GLY 137 CO 0.46 1.12 -0.19 1.08 0.00 0.00 0.00 173.10 175.58 2qf3 s LEU 138 N -5.91 2.41 0.33 0.66 1.43 -1.26 -5.10 118.68 111.24 2qf3 s LEU 138 Ca 0.70 -0.38 -0.28 0.00 -1.03 0.00 0.00 54.13 53.14 2qf3 s LEU 138 Cb -0.26 -1.48 -0.10 0.00 0.03 0.00 0.00 46.19 44.38 2qf3 s LEU 138 CO 0.52 0.25 1.23 -2.16 0.23 0.00 0.00 176.35 176.43 2qf3 s PRO 139 N -0.20 4.36 0.19 1.29 0.04 -1.26 -4.72 135.00 134.70 2qf3 s PRO 139 Ca -0.01 2.05 0.10 0.00 0.04 0.00 0.00 61.00 63.17 2qf3 s PRO 139 Cb -0.13 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.34 2qf3 s PRO 139 CO 0.03 -0.12 -0.20 0.95 0.04 0.00 0.00 177.00 177.70 2qf3 s THR 140 N -1.20 2.06 0.18 1.26 -4.23 -1.26 -4.55 115.64 107.90 2qf3 s THR 140 Ca 0.49 -2.01 -0.30 0.00 -1.18 0.00 0.00 61.69 58.70 2qf3 s THR 140 Cb -0.36 -1.98 -0.08 0.00 1.34 0.00 0.00 72.50 71.42 2qf3 s THR 140 CO 0.47 -0.26 1.00 -0.51 -0.54 0.00 0.00 174.62 174.78 2qf3 s ILE 141 N -1.98 4.12 0.15 2.99 1.10 -0.69 -4.75 121.20 122.15 2qf3 s ILE 141 Ca 0.19 1.92 -0.31 0.00 -0.51 0.00 0.00 60.65 61.93 2qf3 s ILE 141 Cb -0.06 -4.22 -0.09 0.00 0.15 0.00 0.00 42.46 38.23 2qf3 s ILE 141 CO 0.08 0.37 1.49 -2.84 -2.11 0.00 0.00 174.94 171.93 2qf3 s PRO 142 N -0.58 4.26 -0.09 3.50 0.02 -1.26 -4.94 135.00 135.91 2qf3 s PRO 142 Ca 0.45 2.24 0.01 0.00 0.02 0.00 0.00 61.00 63.73 2qf3 s PRO 142 Cb -0.26 -3.19 0.02 0.00 0.02 0.00 0.00 34.50 31.09 2qf3 s PRO 142 CO 0.33 -0.52 -0.11 0.42 -0.33 0.00 0.00 177.00 176.79 2qf3 s ILE 143 N 1.02 1.15 -0.42 2.83 1.01 -1.26 -0.88 121.20 124.64 2qf3 s ILE 143 Ca 0.67 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.91 2qf3 s ILE 143 Cb -0.41 -1.09 0.11 0.00 0.01 0.00 0.00 42.46 41.08 2qf3 s ILE 143 CO 0.32 0.37 0.16 0.21 0.00 0.00 0.00 174.94 176.00 2qf3 s ASN 144 N 1.12 4.74 0.40 3.58 3.84 -1.26 -4.97 114.94 122.38 2qf3 s ASN 144 Ca -0.06 -2.44 0.27 0.00 0.21 0.00 0.00 52.86 50.84 2qf3 s ASN 144 Cb -0.14 -1.68 1.43 0.00 -0.55 0.00 0.00 41.25 40.30 2qf3 s ASN 144 CO -0.02 -0.36 1.83 0.00 -2.79 0.00 0.00 177.10 175.76 2qf3 h ALA 145 N 7.31 1.00 -0.01 1.71 0.00 -1.98 -1.06 119.26 126.23 2qf3 h ALA 145 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qf3 h ALA 145 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2qf3 h ALA 145 CO 0.61 0.00 -0.49 0.54 0.00 0.00 0.00 179.25 179.91 2qf3 n ARG 146 N -2.46 0.87 -2.32 0.00 1.74 -1.26 -4.92 116.66 108.31 2qf3 n ARG 146 Ca -0.01 -0.66 -0.42 0.00 -0.77 0.00 0.00 57.85 55.98 2qf3 n ARG 146 Cb 0.07 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.00 2qf3 n ARG 146 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2qf3 s ARG 147 N -2.59 4.36 -0.33 5.56 6.06 -0.40 -5.00 118.95 126.61 2qf3 s ARG 147 Ca 0.18 1.87 -0.11 0.00 -2.50 0.00 0.00 55.73 55.17 2qf3 s ARG 147 Cb 0.18 -3.42 -0.01 0.00 0.06 0.00 0.00 34.95 31.77 2qf3 s ARG 147 CO 0.61 -0.41 0.19 0.08 -2.50 0.00 0.00 175.30 173.27 2qf3 s VAL 148 N 1.60 4.82 0.31 7.11 1.01 -1.26 -5.04 120.40 128.96 2qf3 s VAL 148 Ca 0.61 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.89 2qf3 s VAL 148 Cb -0.31 -3.50 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 2qf3 s VAL 148 CO 0.28 0.00 1.39 -2.84 0.00 0.00 0.00 175.10 173.92 2qf3 s PRO 149 N 1.64 4.28 0.07 2.72 0.02 -1.26 -5.02 135.00 137.45 2qf3 s PRO 149 Ca 0.05 2.31 0.09 0.00 0.02 0.00 0.00 61.00 63.47 2qf3 s PRO 149 Cb -0.17 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.25 2qf3 s PRO 149 CO 0.08 -0.33 -0.25 -1.01 -0.33 0.00 0.00 177.00 175.16 2qf3 s HIS 150 N -0.72 2.38 0.18 6.54 3.76 -1.26 -5.02 115.29 121.15 2qf3 s HIS 150 Ca 0.53 -0.37 -0.32 0.00 -0.15 0.00 0.00 55.06 54.76 2qf3 s HIS 150 Cb -0.42 -1.37 -0.11 0.00 1.11 0.00 0.00 32.58 31.79 2qf3 s HIS 150 CO 0.51 0.21 1.74 0.42 -0.85 0.00 0.00 174.74 176.78 2qf3 s ILE 151 N -0.91 2.20 0.00 0.60 1.01 -1.26 -1.13 121.20 121.71 2qf3 s ILE 151 Ca 0.13 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.83 2qf3 s ILE 151 Cb -0.10 -3.03 0.00 0.00 0.01 0.00 0.00 42.46 39.34 2qf3 s ILE 151 CO 0.04 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.59 2qf3 n GLY 152 N 4.04 2.94 3.74 6.18 0.00 0.88 -4.96 105.19 118.01 2qf3 n GLY 152 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2qf3 n GLY 152 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qf3 n ASP 153 N 0.00 3.12 -4.76 1.61 8.00 -0.28 -4.58 116.55 119.65 2qf3 n ASP 153 Ca 0.00 1.15 -0.40 0.00 0.71 0.00 0.00 54.79 56.25 2qf3 n ASP 153 Cb 0.00 -1.56 -0.04 0.00 -0.02 0.00 0.00 41.12 39.50 2qf3 n ASP 153 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qf3 s VAL 154 N -1.16 3.52 0.03 2.53 1.01 -1.26 -0.39 120.40 124.68 2qf3 s VAL 154 Ca 0.58 1.49 -0.00 0.00 0.00 0.00 0.00 61.98 64.05 2qf3 s VAL 154 Cb -0.49 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 31.91 2qf3 s VAL 154 CO 0.60 0.34 -0.03 0.68 0.00 0.00 0.00 175.10 176.68 2qf3 s VAL 155 N -0.99 0.19 -0.08 2.92 -7.23 -0.46 -3.53 120.40 111.22 2qf3 s VAL 155 Ca 0.46 -1.23 0.04 0.00 -1.81 0.00 0.00 61.98 59.44 2qf3 s VAL 155 Cb -0.32 -0.71 -0.01 0.00 0.56 0.00 0.00 36.38 35.90 2qf3 s VAL 155 CO 0.40 -0.65 -0.23 -0.76 -0.31 0.00 0.00 175.10 173.55 2qf3 s LEU 156 N -1.96 2.17 -0.09 1.32 1.43 0.39 -1.07 118.68 120.88 2qf3 s LEU 156 Ca -0.08 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.42 2qf3 s LEU 156 Cb -0.04 -1.42 -0.05 0.00 0.03 0.00 0.00 46.19 44.71 2qf3 s LEU 156 CO -0.04 0.21 0.25 0.00 0.23 0.00 0.00 176.35 177.00 2qf3 s ALA 157 N 0.07 3.77 -0.09 4.21 0.00 0.59 -1.12 121.76 129.20 2qf3 s ALA 157 Ca -0.10 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.38 2qf3 s ALA 157 Cb -0.16 -2.17 0.02 0.00 0.00 0.00 0.00 23.12 20.81 2qf3 s ALA 157 CO 0.06 0.48 -0.07 0.42 0.00 0.00 0.00 175.76 176.65 2qf3 s ILE 158 N -0.77 0.85 0.00 0.00 1.01 0.02 -1.33 121.20 120.98 2qf3 s ILE 158 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.61 2qf3 s ILE 158 Cb -0.14 -0.88 0.00 0.00 0.01 0.00 0.00 42.46 41.46 2qf3 s ILE 158 CO 0.07 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2qf3 n GLY 159 N 4.65 1.14 2.78 6.18 0.00 -0.95 -2.51 105.19 116.48 2qf3 n GLY 159 Ca -0.15 -0.82 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 2qf3 n GLY 159 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qf3 n ASN 160 N -0.28 4.20 -4.70 1.61 5.15 -1.19 0.77 115.26 120.81 2qf3 n ASN 160 Ca 0.00 -3.60 -0.43 0.00 -0.60 0.00 0.00 54.58 49.94 2qf3 n ASN 160 Cb 0.00 -0.59 -0.02 0.00 -0.53 0.00 0.00 39.78 38.64 2qf3 n ASN 160 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2qf3 n PRO 161 N 0.06 2.36 -1.32 1.20 -0.04 -1.26 -1.87 135.00 134.13 2qf3 n PRO 161 Ca 0.31 0.84 -0.12 0.00 -0.04 0.00 0.00 63.50 64.49 2qf3 n PRO 161 Cb 0.40 -2.57 -0.05 0.00 -0.04 0.00 0.00 33.50 31.24 2qf3 n PRO 161 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qf3 n TYR 162 N 2.20 -0.36 -2.92 0.54 4.02 0.26 -1.34 117.16 119.56 2qf3 n TYR 162 Ca 0.11 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.78 2qf3 n TYR 162 Cb 0.34 -2.45 0.02 0.00 -0.02 0.00 0.00 39.34 37.23 2qf3 n TYR 162 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2qf3 n ASN 163 N -0.39 -5.75 0.07 7.72 5.15 -0.78 -4.86 115.26 116.42 2qf3 n ASN 163 Ca -0.12 -0.23 0.13 0.00 -0.60 0.00 0.00 54.58 53.77 2qf3 n ASN 163 Cb 0.41 -4.68 0.46 0.00 -0.53 0.00 0.00 39.78 35.44 2qf3 n ASN 163 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2qf3 n LEU 164 N -3.76 0.54 0.00 1.20 4.77 -0.45 -5.02 117.00 114.28 2qf3 n LEU 164 Ca -0.13 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 2qf3 n LEU 164 Cb 0.62 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2qf3 n LEU 164 CO 0.43 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2qf3 n GLY 165 N 1.38 3.00 3.55 -0.72 0.00 -1.26 -5.02 105.19 106.12 2qf3 n GLY 165 Ca 0.06 -1.86 -0.52 0.00 0.00 0.00 0.00 46.02 43.71 2qf3 n GLY 165 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2qf3 n GLN 166 N -0.15 0.85 -4.63 1.61 7.27 -1.26 -4.53 117.38 116.54 2qf3 n GLN 166 Ca 0.00 0.30 -0.23 0.00 0.07 0.00 0.00 57.00 57.15 2qf3 n GLN 166 Cb 0.00 -1.80 -0.15 0.00 2.41 0.00 0.00 30.24 30.69 2qf3 n GLN 166 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 2qf3 s THR 167 N -0.03 1.11 -0.15 1.69 2.01 0.23 -4.96 115.64 115.54 2qf3 s THR 167 Ca 0.79 -0.57 -0.03 0.00 0.31 0.00 0.00 61.69 62.19 2qf3 s THR 167 Cb -0.97 -0.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.57 2qf3 s THR 167 CO 0.52 0.32 -0.05 -0.63 -0.69 0.00 0.00 174.62 174.09 2qf3 s ILE 168 N -0.11 3.79 0.10 1.82 -1.09 -1.26 -2.24 121.20 122.21 2qf3 s ILE 168 Ca 0.01 -0.40 0.07 0.00 -2.23 0.00 0.00 60.65 58.10 2qf3 s ILE 168 Cb -0.08 -2.64 -0.03 0.00 -1.58 0.00 0.00 42.46 38.12 2qf3 s ILE 168 CO 0.00 0.51 -0.18 0.42 -1.23 0.00 0.00 174.94 174.46 2qf3 s THR 169 N 0.26 1.53 -0.02 2.92 -4.23 -0.44 -4.95 115.64 110.70 2qf3 s THR 169 Ca -0.04 -1.54 0.06 0.00 -1.18 0.00 0.00 61.69 59.00 2qf3 s THR 169 Cb -0.14 -1.46 -0.02 0.00 1.34 0.00 0.00 72.50 72.22 2qf3 s THR 169 CO 0.03 -0.17 -0.21 -1.58 -0.54 0.00 0.00 174.62 172.16 2qf3 s GLN 170 N -2.04 2.23 0.00 3.99 -0.44 -1.26 -0.30 119.66 121.84 2qf3 s GLN 170 Ca 0.05 -0.86 0.00 0.00 -2.50 0.00 0.00 55.36 52.05 2qf3 s GLN 170 Cb -0.09 -2.18 0.00 0.00 -1.64 0.00 0.00 33.01 29.10 2qf3 s GLN 170 CO 0.04 0.58 0.00 0.41 0.50 0.00 0.00 175.29 176.82 2qf3 n GLY 171 N 2.25 3.38 3.27 2.59 0.00 -0.23 -4.41 105.19 112.04 2qf3 n GLY 171 Ca -0.17 -0.67 -0.15 0.00 0.00 0.00 0.00 46.02 45.04 2qf3 n GLY 171 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qf3 s ILE 172 N -1.85 0.46 -0.29 -0.61 -4.36 -1.26 -1.35 121.20 111.94 2qf3 s ILE 172 Ca 0.00 -1.99 -0.29 0.00 -0.26 0.00 0.00 60.65 58.11 2qf3 s ILE 172 Cb 0.00 -2.48 0.01 0.00 1.25 0.00 0.00 42.46 41.24 2qf3 s ILE 172 CO 0.00 -0.12 1.11 -0.63 0.24 0.00 0.00 174.94 175.54 2qf3 s ILE 173 N -3.82 4.48 -0.25 8.37 1.01 0.48 -3.12 121.20 128.34 2qf3 s ILE 173 Ca 0.35 1.73 0.20 0.00 0.00 0.00 0.00 60.65 62.93 2qf3 s ILE 173 Cb 0.07 -4.34 0.07 0.00 0.01 0.00 0.00 42.46 38.28 2qf3 s ILE 173 CO 0.11 -0.40 1.21 0.28 0.00 0.00 0.00 174.94 176.14 2qf3 h SER 174 N 8.12 0.00 -3.93 3.58 0.02 -0.98 0.25 113.55 120.62 2qf3 h SER 174 Ca -0.21 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 60.85 2qf3 h SER 174 Cb 1.07 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.37 2qf3 h SER 174 CO 1.02 0.19 0.62 0.00 -1.14 0.00 0.00 176.83 177.52 2qf3 s ALA 175 N -3.18 -1.97 -0.64 3.77 0.00 -1.17 -4.91 121.76 113.66 2qf3 s ALA 175 Ca 0.02 1.65 0.05 0.00 0.00 0.00 0.00 51.96 53.67 2qf3 s ALA 175 Cb 0.08 -0.87 0.18 0.00 0.00 0.00 0.00 23.12 22.51 2qf3 s ALA 175 CO 0.76 -0.30 0.51 0.25 0.00 0.00 0.00 175.76 176.98 2qf3 n THR 176 N 0.69 1.21 0.00 0.00 -2.24 -1.26 -1.24 114.28 111.45 2qf3 n THR 176 Ca -0.08 -4.66 0.00 0.00 -2.27 0.00 0.00 64.05 57.03 2qf3 n THR 176 Cb 0.58 -2.08 0.00 0.00 -2.10 0.00 0.00 70.33 66.73 2qf3 n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qf3 n GLY 177 N 1.92 -0.91 2.90 3.38 0.00 -0.19 -4.96 105.19 107.34 2qf3 n GLY 177 Ca 0.23 -1.67 -0.11 0.00 0.00 0.00 0.00 46.02 44.47 2qf3 n GLY 177 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qf3 s ARG 178 N -1.73 0.08 0.02 1.61 1.81 -0.40 -4.94 118.95 115.41 2qf3 s ARG 178 Ca 0.00 -0.12 0.02 0.00 -1.72 0.00 0.00 55.73 53.91 2qf3 s ARG 178 Cb 0.00 0.03 -0.25 0.00 -0.45 0.00 0.00 34.95 34.28 2qf3 s ARG 178 CO 0.00 -0.01 0.93 0.82 -0.68 0.00 0.00 175.30 176.36 2qf3 h ILE 179 N 5.03 1.24 -5.93 1.52 5.03 -1.95 -3.43 117.51 119.02 2qf3 h ILE 179 Ca -0.26 -2.94 -0.52 0.00 -0.12 0.00 0.00 64.86 61.02 2qf3 h ILE 179 Cb 1.21 2.72 -0.03 0.00 -3.03 0.00 0.00 36.82 37.69 2qf3 h ILE 179 CO 0.48 0.80 -0.21 0.61 -0.68 0.00 0.00 178.15 179.15 2qf3 n GLY 180 N 1.57 2.55 3.75 5.37 0.00 -1.26 -5.08 105.19 112.09 2qf3 n GLY 180 Ca -0.12 -2.27 -0.41 0.00 0.00 0.00 0.00 46.02 43.21 2qf3 n GLY 180 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qf3 s LEU 181 N 0.00 4.38 0.26 0.99 1.43 -1.26 -4.93 118.68 119.55 2qf3 s LEU 181 Ca 0.37 2.71 -0.17 0.00 -1.03 0.00 0.00 54.13 56.01 2qf3 s LEU 181 Cb -0.03 -3.63 0.01 0.00 0.03 0.00 0.00 46.19 42.57 2qf3 s LEU 181 CO 0.23 -0.72 0.59 0.54 0.23 0.00 0.00 176.35 177.22 2qf3 s ASN 182 N 0.33 -0.17 0.57 2.29 2.20 -1.26 -5.06 114.94 113.84 2qf3 s ASN 182 Ca 0.59 -0.78 0.29 0.00 -0.94 0.00 0.00 52.86 52.02 2qf3 s ASN 182 Cb -0.43 0.65 1.46 0.00 -2.00 0.00 0.00 41.25 40.94 2qf3 s ASN 182 CO 0.45 -1.24 1.88 -0.65 -2.94 0.00 0.00 177.10 174.60 2qf3 h PRO 183 N 2.14 0.00 0.00 3.55 0.11 -1.94 0.15 132.00 136.00 2qf3 h PRO 183 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2qf3 h PRO 183 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2qf3 h PRO 183 CO 0.30 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 179.88 2qf3 h THR 184 N 0.00 0.00 0.00 -1.15 1.35 -1.98 -3.46 112.91 107.67 2qf3 h THR 184 Ca 0.28 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2qf3 h THR 184 Cb 1.38 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 2qf3 h THR 184 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2qf3 n GLY 185 N 0.94 1.18 3.57 5.82 0.00 0.51 -4.96 105.19 112.25 2qf3 n GLY 185 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 2qf3 n GLY 185 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qf3 s ARG 186 N -0.18 1.90 0.00 1.61 0.52 -1.26 -4.94 118.95 116.60 2qf3 s ARG 186 Ca 0.00 -2.12 0.01 0.00 -0.52 0.00 0.00 55.73 53.10 2qf3 s ARG 186 Cb 0.00 -1.11 -0.01 0.00 0.52 0.00 0.00 34.95 34.35 2qf3 s ARG 186 CO 0.00 -0.27 0.17 1.04 0.02 0.00 0.00 175.30 176.26 2qf3 n GLN 187 N -0.92 4.91 -0.11 3.54 1.13 -1.26 -4.72 117.38 119.94 2qf3 n GLN 187 Ca -0.07 -0.13 0.07 0.00 -1.94 0.00 0.00 57.00 54.92 2qf3 n GLN 187 Cb 0.66 -0.67 0.12 0.00 0.11 0.00 0.00 30.24 30.46 2qf3 n GLN 187 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2qf3 n ASN 188 N -0.79 2.53 -4.77 1.08 3.02 -1.26 -1.27 115.26 113.80 2qf3 n ASN 188 Ca 0.00 -2.72 -0.38 0.00 -0.03 0.00 0.00 54.58 51.45 2qf3 n ASN 188 Cb 0.03 -0.32 -0.03 0.00 -0.61 0.00 0.00 39.78 38.84 2qf3 n ASN 188 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2qf3 s PHE 189 N -2.25 3.30 0.18 3.10 0.08 -1.26 -4.33 117.98 116.80 2qf3 s PHE 189 Ca 0.25 1.63 -0.18 0.00 0.12 0.00 0.00 56.93 58.75 2qf3 s PHE 189 Cb 0.20 -3.27 -0.08 0.00 -0.57 0.00 0.00 43.02 39.31 2qf3 s PHE 189 CO 0.04 -0.84 0.65 -0.51 -0.10 0.00 0.00 175.22 174.45 2qf3 s LEU 190 N -2.21 4.36 0.01 -0.37 1.43 -0.20 -1.02 118.68 120.69 2qf3 s LEU 190 Ca 0.53 1.28 0.07 0.00 -1.03 0.00 0.00 54.13 54.99 2qf3 s LEU 190 Cb -0.28 -3.40 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 2qf3 s LEU 190 CO 0.36 0.08 -0.21 -1.58 0.23 0.00 0.00 176.35 175.23 2qf3 s GLN 191 N -1.88 2.09 0.04 1.70 0.74 -0.37 -1.29 119.66 120.70 2qf3 s GLN 191 Ca 0.40 -0.95 -0.11 0.00 0.05 0.00 0.00 55.36 54.75 2qf3 s GLN 191 Cb -0.16 -2.15 0.01 0.00 1.10 0.00 0.00 33.01 31.81 2qf3 s GLN 191 CO 0.20 0.55 0.23 -0.08 -0.55 0.00 0.00 175.29 175.65 2qf3 s THR 192 N -0.81 0.10 -1.87 -0.34 -1.32 0.38 -0.26 115.64 111.52 2qf3 s THR 192 Ca 0.13 -0.83 0.20 0.00 -1.21 0.00 0.00 61.69 59.98 2qf3 s THR 192 Cb -0.10 -0.93 0.51 0.00 -1.51 0.00 0.00 72.50 70.46 2qf3 s THR 192 CO 0.03 -0.46 1.43 -0.90 -2.21 0.00 0.00 174.62 172.51 2qf3 n ASP 193 N 0.63 3.57 -4.70 8.08 5.75 -1.18 -1.26 116.55 127.43 2qf3 n ASP 193 Ca -0.19 -1.98 -0.42 0.00 -0.01 0.00 0.00 54.79 52.19 2qf3 n ASP 193 Cb 0.59 -0.36 -0.03 0.00 -1.03 0.00 0.00 41.12 40.29 2qf3 n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qf3 s ALA 194 N -1.12 3.78 0.09 2.12 0.00 -1.26 -4.67 121.76 120.70 2qf3 s ALA 194 Ca 0.40 1.40 -0.31 0.00 0.00 0.00 0.00 51.96 53.45 2qf3 s ALA 194 Cb 0.22 -3.70 -0.10 0.00 0.00 0.00 0.00 23.12 19.54 2qf3 s ALA 194 CO 0.29 -1.04 1.90 0.43 0.00 0.00 0.00 175.76 177.34 2qf3 n SER 195 N 4.96 4.13 -4.33 0.00 7.64 -1.26 -4.82 113.62 119.95 2qf3 n SER 195 Ca 0.16 0.95 -0.32 0.00 1.01 0.00 0.00 58.87 60.67 2qf3 n SER 195 Cb 0.38 -1.54 -0.15 0.00 -1.01 0.00 0.00 64.21 61.89 2qf3 n SER 195 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2qf3 s ILE 196 N 3.48 2.53 0.26 0.44 -1.09 -1.26 -4.77 121.20 120.80 2qf3 s ILE 196 Ca 0.85 -0.88 0.02 0.00 -2.23 0.00 0.00 60.65 58.41 2qf3 s ILE 196 Cb -0.45 -1.99 -0.04 0.00 -1.58 0.00 0.00 42.46 38.39 2qf3 s ILE 196 CO 0.39 0.56 0.14 0.20 -1.23 0.00 0.00 174.94 175.00 2qf3 s ASN 197 N -0.02 1.08 0.19 3.58 0.01 -1.26 -4.87 114.94 113.65 2qf3 s ASN 197 Ca -0.06 -1.47 -0.33 0.00 -0.71 0.00 0.00 52.86 50.30 2qf3 s ASN 197 Cb -0.15 0.32 -0.12 0.00 0.41 0.00 0.00 41.25 41.71 2qf3 s ASN 197 CO 0.05 -0.83 1.69 1.41 -1.51 0.00 0.00 177.10 177.90 2qf3 n HIS 198 N -0.47 2.62 0.00 2.20 8.25 -1.26 -1.15 115.22 125.41 2qf3 n HIS 198 Ca 0.01 0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2qf3 n HIS 198 Cb 0.65 -2.64 0.00 0.00 1.12 0.00 0.00 29.99 29.12 2qf3 n HIS 198 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qf3 n GLY 199 N 3.84 2.03 0.21 -1.41 0.00 -1.26 -0.57 105.19 108.02 2qf3 n GLY 199 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 2qf3 n GLY 199 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2qf3 h ASN 200 N 0.52 0.00 -2.17 1.61 4.21 -1.36 -3.10 115.58 115.28 2qf3 h ASN 200 Ca 0.00 0.00 -0.62 0.00 1.21 0.00 0.00 56.30 56.89 2qf3 h ASN 200 Cb 0.00 0.00 0.07 0.00 -1.12 0.00 0.00 38.32 37.27 2qf3 h ASN 200 CO 0.00 0.07 0.50 -1.20 -1.29 0.00 0.00 177.43 175.51 2qf3 n SER 201 N -3.12 2.13 0.00 5.81 7.64 -1.26 -1.57 113.62 123.26 2qf3 n SER 201 Ca 0.04 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.04 2qf3 n SER 201 Cb 0.56 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 2qf3 n SER 201 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qf3 n GLY 202 N 2.40 1.52 2.61 0.23 0.00 0.90 -0.57 105.19 112.29 2qf3 n GLY 202 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 2qf3 n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qf3 n GLY 203 N -2.00 -0.92 3.91 -0.02 0.00 -0.61 -3.36 105.19 102.19 2qf3 n GLY 203 Ca 0.00 -1.77 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 2qf3 n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qf3 s ALA 204 N -3.77 3.94 -0.22 4.61 0.00 -1.04 -1.61 121.76 123.66 2qf3 s ALA 204 Ca 0.50 -0.73 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2qf3 s ALA 204 Cb -0.02 -1.93 0.02 0.00 0.00 0.00 0.00 23.12 21.20 2qf3 s ALA 204 CO 0.34 0.75 -0.11 -1.17 0.00 0.00 0.00 175.76 175.58 2qf3 s LEU 205 N -2.21 2.84 0.23 0.00 2.96 -0.26 -0.80 118.68 121.45 2qf3 s LEU 205 Ca 0.32 -0.80 0.10 0.00 -0.22 0.00 0.00 54.13 53.53 2qf3 s LEU 205 Cb -0.13 -1.60 -0.05 0.00 0.50 0.00 0.00 46.19 44.91 2qf3 s LEU 205 CO 0.22 -0.08 -0.17 0.68 -1.32 0.00 0.00 176.35 175.68 2qf3 s VAL 206 N 1.31 2.09 0.17 1.68 -7.23 -0.27 0.07 120.40 118.22 2qf3 s VAL 206 Ca 0.01 -2.28 -0.00 0.00 -1.81 0.00 0.00 61.98 57.90 2qf3 s VAL 206 Cb -0.16 -2.15 0.03 0.00 0.56 0.00 0.00 36.38 34.67 2qf3 s VAL 206 CO -0.07 -0.48 0.23 -0.46 -0.31 0.00 0.00 175.10 174.01 2qf3 n ASN 207 N -0.42 0.27 0.00 4.85 0.23 -0.63 -0.46 115.26 119.10 2qf3 n ASN 207 Ca -0.07 -1.24 0.06 0.00 -0.53 0.00 0.00 54.58 52.80 2qf3 n ASN 207 Cb 0.60 -0.16 0.26 0.00 -2.08 0.00 0.00 39.78 38.40 2qf3 n ASN 207 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2qf3 n SER 208 N -3.00 0.00 -0.37 0.53 3.41 -1.23 -1.43 113.62 111.53 2qf3 n SER 208 Ca 0.04 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.27 2qf3 n SER 208 Cb 0.13 -0.50 0.25 0.00 -0.26 0.00 0.00 64.21 63.84 2qf3 n SER 208 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qf3 n LEU 209 N -1.50 1.46 0.00 1.04 4.77 -1.26 -4.03 117.00 117.49 2qf3 n LEU 209 Ca 0.03 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.54 2qf3 n LEU 209 Cb 0.14 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2qf3 n LEU 209 CO 0.11 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2qf3 n GLY 210 N 1.36 0.75 3.72 -0.72 0.00 -0.51 -4.74 105.19 105.04 2qf3 n GLY 210 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2qf3 n GLY 210 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qf3 s GLU 211 N -0.51 4.54 0.06 1.61 2.02 -1.26 -4.19 118.70 120.97 2qf3 s GLU 211 Ca 0.00 1.64 -0.31 0.00 0.02 0.00 0.00 54.97 56.33 2qf3 s GLU 211 Cb 0.00 -3.35 -0.08 0.00 0.10 0.00 0.00 34.13 30.79 2qf3 s GLU 211 CO 0.00 -0.06 1.70 -1.17 0.02 0.00 0.00 175.26 175.75 2qf3 s LEU 212 N 0.51 4.37 -0.19 1.80 2.96 -0.06 -1.60 118.68 126.47 2qf3 s LEU 212 Ca 0.53 2.51 0.10 0.00 -0.22 0.00 0.00 54.13 57.06 2qf3 s LEU 212 Cb -0.27 -3.56 -0.19 0.00 0.50 0.00 0.00 46.19 42.67 2qf3 s LEU 212 CO 0.31 -0.92 -0.04 0.23 -1.32 0.00 0.00 176.35 174.61 2qf3 n MET 213 N 5.92 0.93 -3.96 1.98 2.81 0.11 -4.76 117.12 120.15 2qf3 n MET 213 Ca 0.17 0.04 0.03 0.00 -1.81 0.00 0.00 57.70 56.13 2qf3 n MET 213 Cb 0.40 -1.45 0.01 0.00 -0.71 0.00 0.00 33.22 31.48 2qf3 n MET 213 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2qf3 s GLY 214 N -5.54 -0.15 -0.22 3.03 0.00 -0.80 -0.99 107.32 102.65 2qf3 s GLY 214 Ca -0.17 0.09 -0.03 0.00 0.00 0.00 0.00 44.72 44.61 2qf3 s GLY 214 CO 0.64 5.22 -0.05 -0.42 0.00 0.00 0.00 173.10 178.49 2qf3 s ILE 215 N -2.05 3.23 0.30 0.90 -1.09 -0.13 -1.10 121.20 121.25 2qf3 s ILE 215 Ca 0.28 -0.61 -0.29 0.00 -2.23 0.00 0.00 60.65 57.80 2qf3 s ILE 215 Cb -0.00 -2.50 -0.10 0.00 -1.58 0.00 0.00 42.46 38.28 2qf3 s ILE 215 CO -0.01 0.38 1.36 0.20 -1.23 0.00 0.00 174.94 175.65 2qf3 s ASN 216 N 1.45 6.70 0.26 3.58 0.01 -0.63 -0.18 114.94 126.13 2qf3 s ASN 216 Ca 0.05 2.70 0.00 0.00 -0.71 0.00 0.00 52.86 54.90 2qf3 s ASN 216 Cb -0.15 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 38.87 2qf3 s ASN 216 CO -0.04 -0.62 0.00 0.35 -1.51 0.00 0.00 177.10 175.28 2qf3 n THR 217 N 1.36 0.00 -1.28 1.60 -2.24 -0.37 -0.07 114.28 113.28 2qf3 n THR 217 Ca 0.03 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.47 2qf3 n THR 217 Cb 0.41 -1.37 0.11 0.00 -2.10 0.00 0.00 70.33 67.37 2qf3 n THR 217 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2qf3 s LEU 218 N 0.00 3.21 0.16 3.22 2.96 -1.26 -4.12 118.68 122.84 2qf3 s LEU 218 Ca 0.00 2.29 -0.30 0.00 -0.22 0.00 0.00 54.13 55.90 2qf3 s LEU 218 Cb 0.00 -4.58 -0.07 0.00 0.50 0.00 0.00 46.19 42.04 2qf3 s LEU 218 CO 0.00 -2.41 1.13 -0.44 -1.32 0.00 0.00 176.35 173.32 2qf3 s SER 219 N -2.24 7.20 0.00 3.68 0.01 -1.26 -4.72 113.70 116.36 2qf3 s SER 219 Ca 0.72 2.10 0.00 0.00 1.31 0.00 0.00 55.95 60.08 2qf3 s SER 219 Cb -0.27 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.36 2qf3 s SER 219 CO 0.48 -0.30 0.00 0.33 0.41 0.00 0.00 173.24 174.17 2qf3 n PHE 220 N 2.69 0.00 -2.82 2.43 7.35 -1.26 -5.04 117.46 120.82 2qf3 n PHE 220 Ca 0.04 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.30 2qf3 n PHE 220 Cb 0.46 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.25 2qf3 n PHE 220 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 2qf3 s THR 228 N 0.00 4.28 0.58 -2.13 2.01 -1.26 -5.06 115.64 114.06 2qf3 s THR 228 Ca 0.00 -0.05 -0.18 0.00 0.31 0.00 0.00 61.69 61.77 2qf3 s THR 228 Cb 0.00 -4.66 -0.04 0.00 0.01 0.00 0.00 72.50 67.81 2qf3 s THR 228 CO 0.00 -1.39 1.11 -2.16 -0.69 0.00 0.00 174.62 171.50 2qf3 s PRO 229 N 4.22 3.21 -0.04 4.92 0.04 -1.26 -5.03 135.00 141.05 2qf3 s PRO 229 Ca 0.26 1.50 0.03 0.00 0.04 0.00 0.00 61.00 62.84 2qf3 s PRO 229 Cb -0.14 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2qf3 s PRO 229 CO 0.14 -0.95 -0.14 -2.00 0.04 0.00 0.00 177.00 174.10 2qf3 s GLU 230 N -3.58 1.48 -1.07 4.56 2.12 -1.26 -4.79 118.70 116.15 2qf3 s GLU 230 Ca 0.70 -0.47 0.00 0.00 0.36 0.00 0.00 54.97 55.56 2qf3 s GLU 230 Cb -0.22 -1.30 0.00 0.00 0.26 0.00 0.00 34.13 32.87 2qf3 s GLU 230 CO 0.32 0.17 0.00 0.41 -0.54 0.00 0.00 175.26 175.61 2qf3 n GLY 231 N 3.29 0.37 3.00 -1.50 0.00 -1.26 -4.99 105.19 104.09 2qf3 n GLY 231 Ca -0.19 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.09 2qf3 n GLY 231 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qf3 s ILE 232 N -2.53 1.93 0.10 -0.61 1.01 -1.26 -3.63 121.20 116.21 2qf3 s ILE 232 Ca 0.00 -1.68 -0.01 0.00 0.00 0.00 0.00 60.65 58.97 2qf3 s ILE 232 Cb 0.00 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 2qf3 s ILE 232 CO 0.00 -0.23 0.01 -0.83 0.00 0.00 0.00 174.94 173.89 2qf3 s GLY 233 N 1.17 0.76 0.08 6.18 0.00 -0.39 -4.45 107.32 110.67 2qf3 s GLY 233 Ca -0.02 -1.36 0.03 0.00 0.00 0.00 0.00 44.72 43.37 2qf3 s GLY 233 CO -0.07 -1.35 -0.10 -1.36 0.00 0.00 0.00 173.10 170.22 2qf3 s PHE 234 N -3.96 0.97 0.00 1.90 0.08 -1.26 -0.47 117.98 115.23 2qf3 s PHE 234 Ca 0.16 -0.63 -0.06 0.00 0.12 0.00 0.00 56.93 56.52 2qf3 s PHE 234 Cb 0.08 -0.54 0.00 0.00 -0.57 0.00 0.00 43.02 41.98 2qf3 s PHE 234 CO -0.04 -0.03 0.12 0.00 -0.10 0.00 0.00 175.22 175.17 2qf3 s ALA 235 N -2.21 -0.28 -0.15 5.36 0.00 -0.41 -1.24 121.76 122.83 2qf3 s ALA 235 Ca 0.02 -0.14 -0.28 0.00 0.00 0.00 0.00 51.96 51.56 2qf3 s ALA 235 Cb -0.04 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 2qf3 s ALA 235 CO -0.00 -0.19 0.95 0.42 0.00 0.00 0.00 175.76 176.94 2qf3 s ILE 236 N -1.28 4.80 0.40 0.00 -1.09 0.75 -1.04 121.20 123.75 2qf3 s ILE 236 Ca -0.14 1.89 -0.25 0.00 -2.23 0.00 0.00 60.65 59.92 2qf3 s ILE 236 Cb -0.07 -4.25 -0.11 0.00 -1.58 0.00 0.00 42.46 36.45 2qf3 s ILE 236 CO 0.01 -0.03 1.17 -0.81 -1.23 0.00 0.00 174.94 174.06 2qf3 n PRO 237 N 5.36 1.72 0.18 2.79 -0.04 -1.26 -0.96 135.00 142.79 2qf3 n PRO 237 Ca 0.08 0.61 0.08 0.00 -0.04 0.00 0.00 63.50 64.23 2qf3 n PRO 237 Cb 0.48 -2.23 0.59 0.00 -0.04 0.00 0.00 33.50 32.30 2qf3 n PRO 237 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2qf3 h PHE 238 N 1.94 0.12 -0.61 0.54 -5.15 -1.37 -1.82 116.94 110.60 2qf3 h PHE 238 Ca -0.46 0.00 -0.09 0.00 -0.20 0.00 0.00 57.97 57.23 2qf3 h PHE 238 Cb 1.31 -0.04 -0.02 0.00 0.22 0.00 0.00 35.95 37.42 2qf3 h PHE 238 CO 0.47 0.08 0.04 1.96 -2.00 0.00 0.00 178.31 178.85 2qf3 h GLN 239 N 0.13 1.06 -0.25 6.09 7.50 -1.90 -0.55 115.11 127.19 2qf3 h GLN 239 Ca 0.05 -0.32 -0.20 0.00 0.50 0.00 0.00 58.65 58.69 2qf3 h GLN 239 Cb 0.04 -0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.47 2qf3 h GLN 239 CO -0.01 1.01 -0.61 1.25 -1.50 0.00 0.00 178.83 178.97 2qf3 h LEU 240 N 0.96 0.97 -0.82 1.46 5.85 -1.81 -2.57 115.31 119.35 2qf3 h LEU 240 Ca 0.18 -0.55 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 2qf3 h LEU 240 Cb 0.51 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 2qf3 h LEU 240 CO 0.02 1.35 0.37 0.00 -0.34 0.00 0.00 178.44 179.84 2qf3 h ALA 241 N 0.66 1.06 -0.23 1.25 0.00 -1.03 -0.64 119.26 120.32 2qf3 h ALA 241 Ca -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2qf3 h ALA 241 Cb 1.23 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2qf3 h ALA 241 CO 0.13 0.65 0.11 1.15 0.00 0.00 0.00 179.25 181.29 2qf3 h THR 242 N 1.17 1.14 -0.73 0.00 2.02 -1.09 -0.68 112.91 114.73 2qf3 h THR 242 Ca 0.28 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 2qf3 h THR 242 Cb 0.16 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 2qf3 h THR 242 CO -0.03 0.14 0.21 0.11 0.37 0.00 0.00 175.52 176.32 2qf3 h LYS 243 N 0.25 1.16 -0.41 6.66 1.57 -1.15 -2.06 116.57 122.58 2qf3 h LYS 243 Ca 0.08 -0.26 -0.08 0.00 -1.87 0.00 0.00 60.65 58.52 2qf3 h LYS 243 Cb 0.12 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2qf3 h LYS 243 CO -0.01 0.99 -0.06 0.82 -0.57 0.00 0.00 179.45 180.62 2qf3 h ILE 244 N 1.10 1.27 -0.33 1.86 1.08 -0.98 -2.46 117.51 119.06 2qf3 h ILE 244 Ca 0.23 -1.13 0.03 0.00 -0.39 0.00 0.00 64.86 63.60 2qf3 h ILE 244 Cb 0.34 1.17 -0.03 0.00 -3.07 0.00 0.00 36.82 35.22 2qf3 h ILE 244 CO -0.00 0.38 0.14 -0.03 -0.69 0.00 0.00 178.15 177.95 2qf3 h MET 245 N 0.59 0.30 -0.77 2.37 4.05 -0.92 -0.93 114.93 119.62 2qf3 h MET 245 Ca 0.11 -0.02 0.04 0.00 -0.28 0.00 0.00 59.70 59.55 2qf3 h MET 245 Cb 0.57 -0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 31.25 2qf3 h MET 245 CO 0.03 0.20 0.47 -0.44 0.23 0.00 0.00 176.91 177.40 2qf3 h ASP 246 N 0.30 0.76 -0.48 1.39 3.32 -1.28 -0.62 116.42 119.82 2qf3 h ASP 246 Ca 0.14 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 2qf3 h ASP 246 Cb 0.08 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 2qf3 h ASP 246 CO -0.12 0.51 0.01 0.11 -1.72 0.00 0.00 179.24 178.03 2qf3 h LYS 247 N 0.90 0.90 0.00 3.56 1.57 -0.94 -1.44 116.57 121.12 2qf3 h LYS 247 Ca 0.32 -0.25 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 2qf3 h LYS 247 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2qf3 h LYS 247 CO -0.14 0.89 -0.38 -0.07 -0.57 0.00 0.00 179.45 179.18 2qf3 h LEU 248 N 0.83 0.00 0.01 2.94 3.38 -0.58 -1.80 115.31 120.09 2qf3 h LEU 248 Ca 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2qf3 h LEU 248 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2qf3 h LEU 248 CO 0.02 0.38 -0.06 0.40 0.09 0.00 0.00 178.44 179.27 2qf3 h ILE 249 N 0.00 1.68 0.62 1.22 2.04 -0.81 -3.37 117.51 118.90 2qf3 h ILE 249 Ca -0.00 -2.09 -0.03 0.00 1.00 0.00 0.00 64.86 63.74 2qf3 h ILE 249 Cb 0.92 3.09 0.01 0.00 -0.74 0.00 0.00 36.82 40.10 2qf3 h ILE 249 CO 0.05 0.55 -0.30 0.08 0.00 0.00 0.00 178.15 178.53 2qf3 h ARG 250 N -0.82 -0.80 0.00 2.37 0.11 -1.31 -3.52 114.38 110.41 2qf3 h ARG 250 Ca -0.01 0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.13 2qf3 h ARG 250 Cb 0.93 0.18 0.00 0.00 1.11 0.00 0.00 29.97 32.19 2qf3 h ARG 250 CO 0.01 -0.50 0.00 -0.40 0.10 0.00 0.00 179.97 179.19