#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h57 s LEU 2 N 0.00 3.99 -0.06 1.08 1.43 -1.26 -4.98 118.68 118.87 1h57 s LEU 2 Ca 0.00 2.14 -0.05 0.00 -1.03 0.00 0.00 54.13 55.19 1h57 s LEU 2 Cb 0.00 -4.33 0.02 0.00 0.03 0.00 0.00 46.19 41.91 1h57 s LEU 2 CO 0.00 -0.80 0.15 0.28 0.23 0.00 0.00 176.35 176.21 1h57 s THR 3 N -1.69 -0.00 0.58 5.49 -1.32 -0.08 -4.71 115.64 113.91 1h57 s THR 3 Ca 0.64 0.00 0.32 0.00 -1.21 0.00 0.00 61.69 61.45 1h57 s THR 3 Cb -0.24 -0.22 0.37 0.00 -1.51 0.00 0.00 72.50 70.90 1h57 s THR 3 CO 0.29 0.00 2.26 -0.65 -2.21 0.00 0.00 174.62 174.31 1h57 h PRO 4 N 5.94 0.00 -0.45 7.08 0.11 -1.84 0.11 132.00 142.95 1h57 h PRO 4 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1h57 h PRO 4 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1h57 h PRO 4 CO 0.41 0.01 0.00 0.25 -0.21 0.00 0.00 178.00 178.47 1h57 n THR 5 N -3.67 0.59 -0.34 -1.15 -2.24 -1.26 -4.60 114.28 101.61 1h57 n THR 5 Ca -0.03 -0.63 0.23 0.00 -2.27 0.00 0.00 64.05 61.36 1h57 n THR 5 Cb 0.10 0.38 0.47 0.00 -2.10 0.00 0.00 70.33 69.18 1h57 n THR 5 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1h57 h PHE 6 N 2.92 0.92 -0.46 4.78 3.57 -1.77 -1.18 116.94 125.73 1h57 h PHE 6 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1h57 h PHE 6 Cb 0.66 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.16 1h57 h PHE 6 CO 0.30 -0.13 0.00 0.66 -2.23 0.00 0.00 178.31 176.91 1h57 n TYR 7 N -4.99 0.79 0.33 0.41 4.01 -1.26 -4.62 117.16 111.83 1h57 n TYR 7 Ca 0.31 -0.57 0.22 0.00 -0.16 0.00 0.00 57.90 57.70 1h57 n TYR 7 Cb 0.96 -0.10 1.19 0.00 -0.31 0.00 0.00 39.34 41.08 1h57 n TYR 7 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1h57 h ASP 8 N 2.74 0.00 0.00 7.72 3.32 -1.48 0.51 116.42 129.24 1h57 h ASP 8 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 1h57 h ASP 8 Cb 1.00 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.50 1h57 h ASP 8 CO 0.07 0.00 -2.05 0.59 -1.72 0.00 0.00 179.24 176.13 1h57 n ASN 9 N -3.15 1.98 0.12 6.45 5.03 -1.26 -4.25 115.26 120.17 1h57 n ASN 9 Ca -0.03 0.07 -0.01 0.00 0.87 0.00 0.00 54.58 55.48 1h57 n ASN 9 Cb 0.08 -0.43 0.04 0.00 -1.02 0.00 0.00 39.78 38.45 1h57 n ASN 9 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 1h57 h SER 10 N -0.35 0.00 0.00 6.41 4.64 -1.82 -3.41 113.55 119.03 1h57 h SER 10 Ca -0.45 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.65 1h57 h SER 10 Cb 1.53 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.47 1h57 h SER 10 CO -0.18 0.68 -0.47 0.00 -0.87 0.00 0.00 176.83 175.99 1h57 h PRO 12 N 3.76 0.00 -0.54 0.00 0.13 -1.57 -2.40 132.00 131.37 1h57 h PRO 12 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1h57 h PRO 12 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1h57 h PRO 12 CO 0.28 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.14 1h57 n ASN 13 N -3.96 2.97 -0.11 1.44 3.02 -1.26 -4.53 115.26 112.83 1h57 n ASN 13 Ca 0.01 -2.07 -0.07 0.00 -0.03 0.00 0.00 54.58 52.42 1h57 n ASN 13 Cb 0.29 -0.38 0.01 0.00 -0.61 0.00 0.00 39.78 39.09 1h57 n ASN 13 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1h57 h VAL 14 N 3.03 0.98 -0.54 2.41 3.04 -1.79 -1.57 116.25 121.81 1h57 h VAL 14 Ca 0.00 -0.13 -0.02 0.00 -1.01 0.00 0.00 66.70 65.55 1h57 h VAL 14 Cb 0.79 0.58 -0.03 0.00 -2.01 0.00 0.00 31.29 30.62 1h57 h VAL 14 CO 0.04 0.07 0.26 -1.28 -1.01 0.00 0.00 177.57 175.64 1h57 h SER 15 N 0.37 0.68 -0.32 3.17 0.87 -1.85 -1.13 113.55 115.35 1h57 h SER 15 Ca 0.15 -0.06 -0.15 0.00 -1.23 0.00 0.00 61.79 60.50 1h57 h SER 15 Cb 0.07 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1h57 h SER 15 CO -0.11 0.58 -0.39 0.78 -0.53 0.00 0.00 176.83 177.16 1h57 h ASN 16 N 0.76 0.93 -0.56 6.23 4.21 -1.77 -0.54 115.58 124.83 1h57 h ASN 16 Ca 0.19 -0.42 -0.09 0.00 1.21 0.00 0.00 56.30 57.19 1h57 h ASN 16 Cb 0.08 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.00 1h57 h ASN 16 CO -0.03 1.20 -0.00 0.40 -1.29 0.00 0.00 177.43 177.71 1h57 h ILE 17 N 0.71 1.26 -0.16 2.81 2.04 -0.85 -0.28 117.51 123.04 1h57 h ILE 17 Ca 0.06 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.78 1h57 h ILE 17 Cb 0.96 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 1h57 h ILE 17 CO 0.09 0.40 0.06 0.58 0.00 0.00 0.00 178.15 179.28 1h57 h VAL 18 N 0.88 1.17 -0.19 1.67 2.07 -1.10 -1.93 116.25 118.82 1h57 h VAL 18 Ca 0.16 -0.53 0.02 0.00 0.82 0.00 0.00 66.70 67.17 1h57 h VAL 18 Cb 0.55 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1h57 h VAL 18 CO 0.03 0.16 0.05 -0.09 0.02 0.00 0.00 177.57 177.74 1h57 h ARG 19 N 0.10 0.12 -0.98 1.57 2.43 -0.93 -2.14 114.38 114.54 1h57 h ARG 19 Ca 0.05 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.29 1h57 h ARG 19 Cb 0.20 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.65 1h57 h ARG 19 CO -0.00 0.08 0.63 -0.44 -1.51 0.00 0.00 179.97 178.73 1h57 h ASP 20 N 0.13 0.98 -0.44 -3.80 3.32 -0.93 -0.02 116.42 115.66 1h57 h ASP 20 Ca 0.08 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 1h57 h ASP 20 Cb 0.07 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1h57 h ASP 20 CO -0.11 0.60 0.16 0.74 -1.72 0.00 0.00 179.24 178.92 1h57 h THR 21 N 1.10 1.21 -0.47 0.35 2.02 -0.89 -2.21 112.91 114.02 1h57 h THR 21 Ca 0.44 -0.67 -0.13 0.00 0.77 0.00 0.00 66.41 66.82 1h57 h THR 21 Cb 0.25 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1h57 h THR 21 CO -0.20 0.24 -0.23 0.40 0.37 0.00 0.00 175.52 176.11 1h57 h ILE 22 N 0.58 1.27 -0.61 3.11 2.04 -0.76 -1.96 117.51 121.18 1h57 h ILE 22 Ca 0.15 -1.39 0.02 0.00 1.00 0.00 0.00 64.86 64.64 1h57 h ILE 22 Cb 0.22 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 1h57 h ILE 22 CO -0.01 0.48 0.39 0.58 0.00 0.00 0.00 178.15 179.59 1h57 h VAL 23 N 0.83 1.11 -0.51 1.67 2.07 -0.91 -0.40 116.25 120.12 1h57 h VAL 23 Ca 0.11 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 1h57 h VAL 23 Cb 0.80 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 1h57 h VAL 23 CO 0.07 0.14 0.06 -1.13 0.02 0.00 0.00 177.57 176.73 1h57 h ASN 24 N 0.78 0.84 0.07 0.57 -1.24 -1.27 -3.08 115.58 112.25 1h57 h ASN 24 Ca 0.24 -0.28 -0.12 0.00 0.71 0.00 0.00 56.30 56.85 1h57 h ASN 24 Cb -0.03 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 38.79 1h57 h ASN 24 CO -0.08 0.91 -0.40 -0.08 -1.29 0.00 0.00 177.43 176.49 1h57 h GLU 25 N 0.74 0.42 -0.02 6.67 4.57 -1.01 -3.01 114.58 122.94 1h57 h GLU 25 Ca 0.15 -0.21 0.01 0.00 -1.18 0.00 0.00 59.36 58.13 1h57 h GLU 25 Cb 0.44 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.03 1h57 h GLU 25 CO 0.02 0.76 0.02 -0.07 -1.18 0.00 0.00 179.01 178.55 1h57 h LEU 26 N 0.35 0.00 -1.23 1.64 3.38 -0.98 0.97 115.31 119.44 1h57 h LEU 26 Ca 0.03 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1h57 h LEU 26 Cb 0.86 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1h57 h LEU 26 CO 0.07 0.00 -0.38 0.03 0.09 0.00 0.00 178.44 178.25 1h57 h ARG 27 N 0.00 0.00 0.00 1.13 3.08 -1.56 -3.16 114.38 113.87 1h57 h ARG 27 Ca 0.01 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1h57 h ARG 27 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1h57 h ARG 27 CO -0.00 0.38 -1.76 -1.13 -1.07 0.00 0.00 179.97 176.38 1h57 n SER 28 N -3.98 1.51 -3.54 7.04 3.41 -0.71 -4.84 113.62 112.52 1h57 n SER 28 Ca -0.02 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.30 1h57 n SER 28 Cb 0.42 1.49 -0.13 0.00 -0.26 0.00 0.00 64.21 65.73 1h57 n SER 28 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1h57 s ASP 29 N -4.00 3.30 0.00 4.04 2.15 0.25 -4.99 116.67 117.42 1h57 s ASP 29 Ca -0.06 -1.95 0.10 0.00 0.43 0.00 0.00 52.55 51.07 1h57 s ASP 29 Cb 0.08 -0.51 0.50 0.00 -0.30 0.00 0.00 42.92 42.70 1h57 s ASP 29 CO 0.62 -0.35 1.25 -0.81 -0.17 0.00 0.00 175.17 175.71 1h57 n PRO 30 N 4.37 0.11 0.01 4.34 -0.04 -1.19 -2.43 135.00 140.17 1h57 n PRO 30 Ca 0.06 0.22 0.11 0.00 -0.04 0.00 0.00 63.50 63.85 1h57 n PRO 30 Cb 0.38 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.36 1h57 n PRO 30 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1h57 n ARG 31 N -1.34 0.12 -0.03 0.54 0.63 -1.26 -4.52 116.66 110.80 1h57 n ARG 31 Ca 0.04 -0.01 0.10 0.00 -0.92 0.00 0.00 57.85 57.07 1h57 n ARG 31 Cb 0.09 -1.53 0.51 0.00 0.45 0.00 0.00 32.46 31.99 1h57 n ARG 31 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 1h57 h ILE 32 N 0.00 0.94 -0.32 5.15 6.09 -1.84 -1.60 117.51 125.92 1h57 h ILE 32 Ca 0.00 -0.13 -0.03 0.00 -1.37 0.00 0.00 64.86 63.33 1h57 h ILE 32 Cb 0.59 0.54 -0.01 0.00 0.47 0.00 0.00 36.82 38.40 1h57 h ILE 32 CO 0.00 0.07 0.08 0.00 -3.07 0.00 0.00 178.15 175.23 1h57 h ALA 33 N 1.74 0.42 -0.34 0.18 0.00 -1.83 -0.66 119.26 118.78 1h57 h ALA 33 Ca 0.22 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1h57 h ALA 33 Cb 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1h57 h ALA 33 CO -0.05 0.08 0.14 0.00 0.00 0.00 0.00 179.25 179.42 1h57 h ALA 34 N 0.92 0.44 -0.86 0.00 0.00 -1.74 -2.38 119.26 115.63 1h57 h ALA 34 Ca 0.10 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.92 1h57 h ALA 34 Cb 0.29 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1h57 h ALA 34 CO 0.00 0.03 0.55 0.77 0.00 0.00 0.00 179.25 180.61 1h57 h SER 35 N 0.40 0.91 -0.50 0.00 0.02 -1.09 -2.07 113.55 111.22 1h57 h SER 35 Ca 0.11 -0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.93 1h57 h SER 35 Cb 0.18 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1h57 h SER 35 CO -0.01 0.61 -0.19 0.40 -1.14 0.00 0.00 176.83 176.50 1h57 h ILE 36 N 1.06 1.27 -0.82 3.27 2.04 -0.97 -1.96 117.51 121.40 1h57 h ILE 36 Ca 0.35 -1.36 -0.02 0.00 1.00 0.00 0.00 64.86 64.83 1h57 h ILE 36 Cb 0.04 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 1h57 h ILE 36 CO -0.13 0.47 0.44 0.25 0.00 0.00 0.00 178.15 179.18 1h57 h LEU 37 N 0.88 1.04 -1.09 1.44 5.85 -1.09 -2.24 115.31 120.10 1h57 h LEU 37 Ca 0.12 -0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 1h57 h LEU 37 Cb 0.77 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 1h57 h LEU 37 CO 0.06 0.85 -0.14 -0.09 -0.34 0.00 0.00 178.44 178.78 1h57 h ARG 38 N 1.15 0.48 -0.79 1.25 2.43 -1.17 -2.23 114.38 115.50 1h57 h ARG 38 Ca 0.29 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 59.27 1h57 h ARG 38 Cb 0.05 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 1h57 h ARG 38 CO -0.04 0.61 0.32 -0.07 -1.51 0.00 0.00 179.97 179.28 1h57 h LEU 39 N 0.44 1.08 -0.50 3.80 3.38 -0.77 -0.27 115.31 122.48 1h57 h LEU 39 Ca 0.08 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1h57 h LEU 39 Cb 0.51 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1h57 h LEU 39 CO 0.03 0.96 0.15 -0.74 0.09 0.00 0.00 178.44 178.93 1h57 h HIS 40 N 1.14 0.81 0.05 1.13 2.76 -1.13 0.22 115.15 120.13 1h57 h HIS 40 Ca 0.26 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1h57 h HIS 40 Cb 0.21 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 28.93 1h57 h HIS 40 CO 0.02 0.71 -0.06 0.35 -1.30 0.00 0.00 177.93 177.65 1h57 h PHE 41 N 0.67 -0.15 0.00 5.26 3.57 -1.04 -0.32 116.94 124.94 1h57 h PHE 41 Ca 0.16 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1h57 h PHE 41 Cb 0.29 0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.09 1h57 h PHE 41 CO 0.02 -0.09 0.00 0.45 -2.23 0.00 0.00 178.31 176.45 1h57 h HIS 42 N -0.13 0.00 0.02 0.41 3.86 -0.86 -2.10 115.15 116.35 1h57 h HIS 42 Ca 0.01 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1h57 h HIS 42 Cb 0.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.60 1h57 h HIS 42 CO -0.10 0.00 -0.01 0.22 0.86 0.00 0.00 177.93 178.90 1h57 h ASP 43 N 0.00 -0.02 -0.14 2.45 3.58 -0.15 -3.36 116.42 118.78 1h57 h ASP 43 Ca 0.00 -0.67 -0.00 0.00 0.42 0.00 0.00 57.03 56.78 1h57 h ASP 43 Cb 0.36 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 1h57 h ASP 43 CO 0.00 0.78 0.09 0.00 -2.88 0.00 0.00 179.24 177.23 1h57 n PHE 45 N -4.51 0.00 -3.74 0.00 3.01 -0.81 -2.88 117.46 108.53 1h57 n PHE 45 Ca -0.01 -0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.15 1h57 n PHE 45 Cb 0.09 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.41 1h57 n PHE 45 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1h57 s VAL 46 N -2.00 0.90 -1.73 -4.37 1.01 -0.93 -4.68 120.40 108.61 1h57 s VAL 46 Ca 0.38 -1.41 0.00 0.00 0.00 0.00 0.00 61.98 60.96 1h57 s VAL 46 Cb 0.18 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.88 1h57 s VAL 46 CO 0.30 -0.66 0.00 -3.20 0.00 0.00 0.00 175.10 171.53 1h57 n ASN 47 N 4.84 -5.20 0.00 3.32 5.15 -1.26 -4.74 115.26 117.37 1h57 n ASN 47 Ca -0.02 0.40 0.00 0.00 -0.60 0.00 0.00 54.58 54.36 1h57 n ASN 47 Cb 0.42 -4.13 0.00 0.00 -0.53 0.00 0.00 39.78 35.54 1h57 n ASN 47 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h57 n GLY 48 N -0.67 -0.64 3.57 8.20 0.00 -1.14 -4.64 105.19 109.87 1h57 n GLY 48 Ca -0.16 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 1h57 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h57 n ASP 50 N 8.61 1.57 -1.62 0.00 5.75 -1.26 -4.75 116.55 124.84 1h57 n ASP 50 Ca 0.41 -2.47 -0.20 0.00 -0.01 0.00 0.00 54.79 52.51 1h57 n ASP 50 Cb 0.48 -0.26 -0.08 0.00 -1.03 0.00 0.00 41.12 40.23 1h57 n ASP 50 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1h57 n ALA 51 N -0.83 -0.32 0.12 2.12 0.00 -1.26 -1.20 120.51 119.14 1h57 n ALA 51 Ca 0.08 0.32 0.03 0.00 0.00 0.00 0.00 53.44 53.88 1h57 n ALA 51 Cb 0.57 -2.02 0.43 0.00 0.00 0.00 0.00 19.45 18.43 1h57 n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1h57 h SER 52 N 0.00 0.24 0.52 0.00 4.64 -1.86 -2.20 113.55 114.88 1h57 h SER 52 Ca -0.42 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 1h57 h SER 52 Cb 1.33 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1h57 h SER 52 CO 0.61 0.33 -0.05 -0.29 -0.87 0.00 0.00 176.83 176.55 1h57 h ILE 53 N 0.26 0.23 0.00 0.95 2.10 -1.89 -2.73 117.51 116.43 1h57 h ILE 53 Ca 0.06 -0.42 0.00 0.00 1.08 0.00 0.00 64.86 65.58 1h57 h ILE 53 Cb 0.25 1.33 0.00 0.00 -1.09 0.00 0.00 36.82 37.31 1h57 h ILE 53 CO 0.01 0.05 -0.02 -0.07 -1.08 0.00 0.00 178.15 177.05 1h57 h LEU 54 N 0.00 0.00 -9.81 2.19 3.38 -1.66 -3.42 115.31 105.99 1h57 h LEU 54 Ca -0.00 -0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1h57 h LEU 54 Cb 0.33 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.12 1h57 h LEU 54 CO 0.01 0.00 0.61 -0.76 0.09 0.00 0.00 178.44 178.39 1h57 s LEU 55 N -5.14 4.45 0.63 1.67 1.43 -1.03 -4.07 118.68 116.61 1h57 s LEU 55 Ca 0.09 2.52 -0.01 0.00 -1.03 0.00 0.00 54.13 55.70 1h57 s LEU 55 Cb 0.10 -3.63 0.06 0.00 0.03 0.00 0.00 46.19 42.75 1h57 s LEU 55 CO 0.63 -0.45 0.89 -1.81 0.23 0.00 0.00 176.35 175.83 1h57 s ASP 56 N -0.33 4.91 0.60 2.29 1.01 -0.35 -4.46 116.67 120.33 1h57 s ASP 56 Ca 0.50 0.02 -0.19 0.00 0.71 0.00 0.00 52.55 53.58 1h57 s ASP 56 Cb -0.37 -0.72 -0.04 0.00 1.01 0.00 0.00 42.92 42.80 1h57 s ASP 56 CO 0.46 -1.44 1.19 0.59 0.21 0.00 0.00 175.17 176.18 1h57 n ASN 57 N -2.61 1.77 -4.14 0.27 3.02 -1.26 -4.65 115.26 107.65 1h57 n ASN 57 Ca 0.10 0.87 -0.10 0.00 -0.03 0.00 0.00 54.58 55.41 1h57 n ASN 57 Cb 0.60 -1.50 -0.10 0.00 -0.61 0.00 0.00 39.78 38.18 1h57 n ASN 57 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1h57 s THR 58 N -1.40 0.07 -0.75 3.41 -4.23 -0.96 -4.98 115.64 106.80 1h57 s THR 58 Ca 0.77 -1.87 0.22 0.00 -1.18 0.00 0.00 61.69 59.62 1h57 s THR 58 Cb -0.41 -2.17 0.22 0.00 1.34 0.00 0.00 72.50 71.48 1h57 s THR 58 CO 0.45 -0.30 1.68 0.35 -0.54 0.00 0.00 174.62 176.27 1h57 n THR 59 N -0.17 0.73 -0.05 3.99 -2.24 -1.26 -3.33 114.28 111.94 1h57 n THR 59 Ca -0.03 0.11 -0.02 0.00 -2.27 0.00 0.00 64.05 61.84 1h57 n THR 59 Cb 0.64 -0.92 -0.15 0.00 -2.10 0.00 0.00 70.33 67.80 1h57 n THR 59 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1h57 n SER 60 N -1.93 0.13 -3.82 3.42 3.41 -1.26 -4.99 113.62 108.59 1h57 n SER 60 Ca 0.04 0.06 -0.12 0.00 -0.26 0.00 0.00 58.87 58.58 1h57 n SER 60 Cb 0.26 1.18 -0.11 0.00 -0.26 0.00 0.00 64.21 65.29 1h57 n SER 60 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1h57 s PHE 61 N -2.87 -0.12 0.41 7.33 -0.12 -1.21 -5.14 117.98 116.25 1h57 s PHE 61 Ca -0.08 0.27 -0.15 0.00 -0.05 0.00 0.00 56.93 56.92 1h57 s PHE 61 Cb 0.09 0.04 -0.08 0.00 -0.63 0.00 0.00 43.02 42.43 1h57 s PHE 61 CO 0.85 -0.22 0.83 1.03 -0.05 0.00 0.00 175.22 177.66 1h57 s ARG 62 N -0.67 3.94 0.33 1.99 1.81 -1.26 -2.26 118.95 122.84 1h57 s ARG 62 Ca -0.08 0.73 -0.26 0.00 -1.72 0.00 0.00 55.73 54.40 1h57 s ARG 62 Cb -0.04 -2.31 -0.10 0.00 -0.45 0.00 0.00 34.95 32.05 1h57 s ARG 62 CO 0.01 -0.03 0.97 -0.08 -0.68 0.00 0.00 175.30 175.49 1h57 s THR 63 N -2.29 4.09 -0.83 0.02 -1.32 -1.26 -4.15 115.64 109.89 1h57 s THR 63 Ca 0.55 1.73 0.18 0.00 -1.21 0.00 0.00 61.69 62.94 1h57 s THR 63 Cb -0.10 -3.96 0.16 0.00 -1.51 0.00 0.00 72.50 67.09 1h57 s THR 63 CO 0.25 0.14 1.55 -0.62 -2.21 0.00 0.00 174.62 173.73 1h57 n GLU 64 N 0.51 0.06 0.22 7.08 1.02 -1.26 -2.53 120.64 125.74 1h57 n GLU 64 Ca 0.02 0.30 0.15 0.00 -0.02 0.00 0.00 57.16 57.62 1h57 n GLU 64 Cb 0.50 -1.62 0.72 0.00 -0.02 0.00 0.00 31.44 31.02 1h57 n GLU 64 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1h57 h LYS 65 N 0.00 0.00 -0.67 3.49 1.57 -1.85 -1.51 116.57 117.60 1h57 h LYS 65 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h57 h LYS 65 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1h57 h LYS 65 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 1h57 n ASP 66 N -2.61 4.83 -4.81 0.86 8.00 -1.05 -2.52 116.55 119.25 1h57 n ASP 66 Ca -0.00 -2.44 -0.32 0.00 0.71 0.00 0.00 54.79 52.73 1h57 n ASP 66 Cb 0.16 -0.59 0.01 0.00 -0.02 0.00 0.00 41.12 40.68 1h57 n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h57 s ALA 67 N -1.83 2.78 0.52 2.24 0.00 -0.57 -4.70 121.76 120.19 1h57 s ALA 67 Ca 0.52 0.31 0.18 0.00 0.00 0.00 0.00 51.96 52.97 1h57 s ALA 67 Cb 0.33 -3.21 1.29 0.00 0.00 0.00 0.00 23.12 21.54 1h57 s ALA 67 CO 0.25 -0.80 2.11 0.74 0.00 0.00 0.00 175.76 178.06 1h57 h PHE 68 N 0.31 0.01 0.00 0.00 0.04 -1.90 0.21 116.94 115.61 1h57 h PHE 68 Ca -0.46 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.31 1h57 h PHE 68 Cb 1.21 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.36 1h57 h PHE 68 CO 0.60 0.01 -0.36 0.41 -0.60 0.00 0.00 178.31 178.37 1h57 n GLY 69 N -1.56 -1.38 0.05 -1.45 0.00 -1.26 -4.35 105.19 95.24 1h57 n GLY 69 Ca 0.00 -0.24 -0.07 0.00 0.00 0.00 0.00 46.02 45.71 1h57 n GLY 69 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h57 n ASN 70 N -1.67 3.07 -4.66 1.61 3.02 -0.47 -4.59 115.26 111.58 1h57 n ASN 70 Ca 0.05 -0.05 -0.47 0.00 -0.03 0.00 0.00 54.58 54.09 1h57 n ASN 70 Cb 0.36 -0.01 -0.04 0.00 -0.61 0.00 0.00 39.78 39.48 1h57 n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h57 n ALA 71 N -2.73 1.03 -4.01 5.41 0.00 0.62 -0.39 120.51 120.44 1h57 n ALA 71 Ca -0.19 0.46 -0.32 0.00 0.00 0.00 0.00 53.44 53.39 1h57 n ALA 71 Cb 0.73 -2.31 0.01 0.00 0.00 0.00 0.00 19.45 17.88 1h57 n ALA 71 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1h57 n ASN 72 N 3.24 -4.38 0.21 0.00 5.15 -1.26 -4.68 115.26 113.53 1h57 n ASN 72 Ca 0.17 -0.85 0.00 0.00 -0.60 0.00 0.00 54.58 53.30 1h57 n ASN 72 Cb 0.27 -3.56 0.00 0.00 -0.53 0.00 0.00 39.78 35.96 1h57 n ASN 72 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1h57 n SER 73 N -2.78 -2.93 -4.77 1.20 2.88 -0.67 -5.11 113.62 101.44 1h57 n SER 73 Ca 0.05 0.79 -0.41 0.00 -1.33 0.00 0.00 58.87 57.97 1h57 n SER 73 Cb 0.52 2.80 -0.01 0.00 -0.75 0.00 0.00 64.21 66.77 1h57 n SER 73 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h57 s ALA 74 N -1.99 3.49 0.26 -1.46 0.00 0.48 -5.00 121.76 117.53 1h57 s ALA 74 Ca 0.00 1.42 -0.13 0.00 0.00 0.00 0.00 51.96 53.26 1h57 s ALA 74 Cb 0.00 -3.55 -0.00 0.00 0.00 0.00 0.00 23.12 19.57 1h57 s ALA 74 CO 0.00 -0.90 0.50 -0.98 0.00 0.00 0.00 175.76 174.38 1h57 s ARG 75 N -2.03 1.61 0.00 0.00 1.70 -1.26 -4.95 118.95 114.01 1h57 s ARG 75 Ca 0.52 -1.28 0.00 0.00 -0.47 0.00 0.00 55.73 54.50 1h57 s ARG 75 Cb -0.43 0.48 0.00 0.00 -0.57 0.00 0.00 34.95 34.43 1h57 s ARG 75 CO 0.58 -0.68 0.00 0.41 -1.08 0.00 0.00 175.30 174.53 1h57 n GLY 76 N -0.40 0.62 0.32 3.88 0.00 -1.26 -4.59 105.19 103.76 1h57 n GLY 76 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 1h57 n GLY 76 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1h57 h PHE 77 N 0.00 0.90 0.00 1.61 0.04 -1.98 -1.28 116.94 116.22 1h57 h PHE 77 Ca 0.00 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.74 1h57 h PHE 77 Cb 0.00 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 37.87 1h57 h PHE 77 CO 0.00 0.30 -0.31 -1.35 -0.60 0.00 0.00 178.31 176.35 1h57 h PRO 78 N 0.77 0.00 -0.33 1.51 0.11 -1.99 -1.88 132.00 130.19 1h57 h PRO 78 Ca 0.46 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.45 1h57 h PRO 78 Cb 0.54 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 1h57 h PRO 78 CO -0.31 0.31 -0.29 0.28 -0.21 0.00 0.00 178.00 177.78 1h57 h VAL 79 N 0.00 1.28 -0.49 3.15 2.07 -1.67 -0.96 116.25 119.63 1h57 h VAL 79 Ca -0.00 -1.41 -0.11 0.00 0.82 0.00 0.00 66.70 66.00 1h57 h VAL 79 Cb 0.54 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1h57 h VAL 79 CO 0.04 0.46 -0.11 0.40 0.02 0.00 0.00 177.57 178.38 1h57 h ILE 80 N 0.58 1.26 -0.82 4.57 1.08 -1.00 -1.97 117.51 121.22 1h57 h ILE 80 Ca 0.07 -1.23 -0.01 0.00 -0.39 0.00 0.00 64.86 63.30 1h57 h ILE 80 Cb 0.79 1.00 -0.04 0.00 -3.07 0.00 0.00 36.82 35.50 1h57 h ILE 80 CO 0.06 0.43 0.48 0.44 -0.69 0.00 0.00 178.15 178.88 1h57 h ASP 81 N 0.82 1.00 -0.06 1.72 3.32 -0.89 -0.55 116.42 121.78 1h57 h ASP 81 Ca 0.13 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1h57 h ASP 81 Cb 0.64 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 1h57 h ASP 81 CO 0.04 0.79 0.03 -0.09 -1.72 0.00 0.00 179.24 178.29 1h57 h ARG 82 N 1.14 0.08 -0.17 3.56 2.43 -0.79 -1.25 114.38 119.38 1h57 h ARG 82 Ca 0.29 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.35 1h57 h ARG 82 Cb -0.02 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1h57 h ARG 82 CO -0.05 0.19 -0.35 0.00 -1.51 0.00 0.00 179.97 178.25 1h57 h MET 83 N -0.04 0.36 -0.41 0.20 -0.00 -1.21 -2.24 114.93 111.60 1h57 h MET 83 Ca 0.02 -0.16 -0.01 0.00 -0.00 0.00 0.00 59.70 59.55 1h57 h MET 83 Cb 0.13 -0.01 -0.02 0.00 -0.00 0.00 0.00 31.60 31.70 1h57 h MET 83 CO -0.00 0.67 0.20 -0.22 -0.00 0.00 0.00 176.91 177.55 1h57 h LYS 84 N 0.31 0.59 -0.89 -0.10 1.63 -0.90 -0.06 116.57 117.15 1h57 h LYS 84 Ca 0.04 -0.09 -0.02 0.00 -0.85 0.00 0.00 60.65 59.73 1h57 h LYS 84 Cb 0.76 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.25 1h57 h LYS 84 CO 0.06 0.51 0.47 0.00 -3.45 0.00 0.00 179.45 177.04 1h57 h ALA 85 N 1.04 1.15 -0.52 5.00 0.00 -1.06 0.16 119.26 125.03 1h57 h ALA 85 Ca 0.14 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1h57 h ALA 85 Cb 0.12 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1h57 h ALA 85 CO -0.02 0.67 -0.02 0.00 0.00 0.00 0.00 179.25 179.88 1h57 h ALA 86 N 1.26 0.71 -0.21 0.00 0.00 -1.05 -1.33 119.26 118.64 1h57 h ALA 86 Ca 0.31 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1h57 h ALA 86 Cb 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1h57 h ALA 86 CO -0.05 0.54 -0.47 0.28 0.00 0.00 0.00 179.25 179.55 1h57 h VAL 87 N 0.81 1.31 -0.20 0.00 2.07 -0.62 -1.85 116.25 117.77 1h57 h VAL 87 Ca 0.15 -1.68 -0.06 0.00 0.82 0.00 0.00 66.70 65.93 1h57 h VAL 87 Cb 0.55 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 1h57 h VAL 87 CO 0.03 0.52 -0.14 -0.33 0.02 0.00 0.00 177.57 177.68 1h57 h GLU 88 N 0.45 0.33 -0.22 1.57 4.39 -0.48 0.47 114.58 121.09 1h57 h GLU 88 Ca 0.03 -0.09 -0.12 0.00 0.34 0.00 0.00 59.36 59.52 1h57 h GLU 88 Cb 0.99 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.60 1h57 h GLU 88 CO 0.09 0.48 -0.33 1.03 -1.16 0.00 0.00 179.01 179.12 1h57 h SER 89 N 0.31 0.68 -0.13 1.42 0.87 -0.95 -1.97 113.55 113.78 1h57 h SER 89 Ca 0.06 -0.52 -0.22 0.00 -1.23 0.00 0.00 61.79 59.88 1h57 h SER 89 Cb 0.44 -0.19 0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1h57 h SER 89 CO 0.03 1.06 -0.76 0.00 -0.53 0.00 0.00 176.83 176.62 1h57 h ALA 90 N 0.63 0.34 -2.12 6.23 0.00 -0.95 -3.41 119.26 119.98 1h57 h ALA 90 Ca 0.02 -0.60 -0.48 0.00 0.00 0.00 0.00 54.91 53.86 1h57 h ALA 90 Cb 0.91 -0.02 -0.34 0.00 0.00 0.00 0.00 17.79 18.35 1h57 h ALA 90 CO 0.08 0.69 -0.82 0.00 0.00 0.00 0.00 179.25 179.20 1h57 n PRO 92 N 3.42 0.96 -4.25 0.00 -0.02 -0.74 -3.05 135.00 131.33 1h57 n PRO 92 Ca 0.20 0.34 -0.34 0.00 -2.02 0.00 0.00 63.50 61.69 1h57 n PRO 92 Cb 0.46 -1.83 -0.05 0.00 -0.02 0.00 0.00 33.50 32.06 1h57 n PRO 92 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1h57 n ARG 93 N 1.77 -2.23 -0.01 -0.52 1.74 -1.26 -4.86 116.66 111.30 1h57 n ARG 93 Ca 0.16 0.27 -0.03 0.00 -0.77 0.00 0.00 57.85 57.49 1h57 n ARG 93 Cb 0.22 -4.56 -0.01 0.00 -1.02 0.00 0.00 32.46 27.09 1h57 n ARG 93 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1h57 n THR 94 N -4.37 0.27 -3.28 0.55 -1.04 -1.17 -5.00 114.28 100.25 1h57 n THR 94 Ca -0.10 0.01 -0.39 0.00 -2.04 0.00 0.00 64.05 61.53 1h57 n THR 94 Cb 0.57 -1.55 -0.07 0.00 -1.82 0.00 0.00 70.33 67.46 1h57 n THR 94 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1h57 s VAL 95 N -2.06 5.12 0.70 12.58 1.01 -1.26 -5.03 120.40 131.45 1h57 s VAL 95 Ca -0.04 0.86 -0.13 0.00 0.00 0.00 0.00 61.98 62.68 1h57 s VAL 95 Cb 0.01 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.61 1h57 s VAL 95 CO 0.05 0.16 1.10 -0.94 0.00 0.00 0.00 175.10 175.47 1h57 s SER 96 N 1.28 4.93 0.29 3.32 1.04 -1.26 -4.80 113.70 118.49 1h57 s SER 96 Ca 0.22 1.90 0.03 0.00 0.48 0.00 0.00 55.95 58.57 1h57 s SER 96 Cb -0.15 -2.54 0.43 0.00 0.10 0.00 0.00 66.02 63.86 1h57 s SER 96 CO 0.09 -1.75 1.73 0.00 0.98 0.00 0.00 173.24 174.29 1h57 h ALA 98 N 1.33 0.65 -0.27 0.00 0.00 -1.86 -0.31 119.26 118.80 1h57 h ALA 98 Ca 0.07 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 1h57 h ALA 98 Cb 0.64 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1h57 h ALA 98 CO 0.05 0.13 -0.45 -0.44 0.00 0.00 0.00 179.25 178.53 1h57 h ASP 99 N 0.69 0.87 -0.45 0.00 3.32 -1.74 -2.64 116.42 116.47 1h57 h ASP 99 Ca 0.18 -0.52 0.05 0.00 0.02 0.00 0.00 57.03 56.77 1h57 h ASP 99 Cb -0.03 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.23 1h57 h ASP 99 CO -0.04 1.23 0.17 0.25 -1.72 0.00 0.00 179.24 179.13 1h57 h LEU 100 N 0.54 0.19 -1.25 1.55 5.85 -0.77 -0.41 115.31 121.01 1h57 h LEU 100 Ca 0.02 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.72 1h57 h LEU 100 Cb 1.05 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1h57 h LEU 100 CO 0.10 0.14 -0.28 0.25 -0.34 0.00 0.00 178.44 178.31 1h57 h LEU 101 N 0.35 0.15 -0.20 2.25 5.85 -1.05 -0.26 115.31 122.39 1h57 h LEU 101 Ca 0.21 -0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 1h57 h LEU 101 Cb 0.19 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1h57 h LEU 101 CO -0.20 0.43 -0.14 0.74 -0.34 0.00 0.00 178.44 178.93 1h57 h THR 102 N 0.13 1.32 -0.69 1.05 2.02 -0.93 -1.45 112.91 114.37 1h57 h THR 102 Ca 0.02 -1.25 -0.06 0.00 0.77 0.00 0.00 66.41 65.88 1h57 h THR 102 Cb 0.58 1.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.67 1h57 h THR 102 CO 0.04 0.38 0.17 0.40 0.37 0.00 0.00 175.52 176.89 1h57 h ILE 103 N 0.13 1.26 -0.81 3.11 2.04 -0.87 -2.14 117.51 120.22 1h57 h ILE 103 Ca 0.04 -0.95 -0.00 0.00 1.00 0.00 0.00 64.86 64.95 1h57 h ILE 103 Cb 0.65 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 1h57 h ILE 103 CO 0.04 0.36 0.50 0.00 0.00 0.00 0.00 178.15 179.05 1h57 h ALA 104 N 1.08 1.35 -0.24 1.87 0.00 -0.95 0.65 119.26 123.03 1h57 h ALA 104 Ca 0.22 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1h57 h ALA 104 Cb 0.36 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1h57 h ALA 104 CO 0.00 0.57 0.01 0.00 0.00 0.00 0.00 179.25 179.83 1h57 h ALA 105 N 1.44 0.32 -0.28 0.00 0.00 -0.88 0.06 119.26 119.92 1h57 h ALA 105 Ca 0.29 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1h57 h ALA 105 Cb -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1h57 h ALA 105 CO -0.06 0.03 0.10 0.37 0.00 0.00 0.00 179.25 179.69 1h57 h GLN 106 N 0.19 0.42 -0.55 0.00 -0.00 -0.98 -1.72 115.11 112.47 1h57 h GLN 106 Ca 0.07 -0.09 -0.03 0.00 -0.00 0.00 0.00 58.65 58.60 1h57 h GLN 106 Cb 0.38 -0.06 -0.03 0.00 0.00 0.00 0.00 27.48 27.77 1h57 h GLN 106 CO 0.01 0.47 0.20 1.96 0.00 0.00 0.00 178.83 181.47 1h57 h GLN 107 N 0.29 0.81 -0.42 1.69 1.08 -0.84 -1.25 115.11 116.46 1h57 h GLN 107 Ca 0.09 -0.13 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 1h57 h GLN 107 Cb 0.22 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 1h57 h GLN 107 CO -0.00 0.67 0.22 0.77 -0.95 0.00 0.00 178.83 179.54 1h57 h SER 108 N 0.79 0.54 -0.35 1.46 0.02 -0.68 0.11 113.55 115.44 1h57 h SER 108 Ca 0.19 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1h57 h SER 108 Cb 0.18 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 1h57 h SER 108 CO -0.02 0.50 0.19 0.58 -1.14 0.00 0.00 176.83 176.94 1h57 h VAL 109 N 0.54 1.14 -0.38 2.27 2.07 -0.81 -2.14 116.25 118.94 1h57 h VAL 109 Ca 0.15 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1h57 h VAL 109 Cb 0.09 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1h57 h VAL 109 CO -0.02 0.14 0.17 0.74 0.02 0.00 0.00 177.57 178.62 1h57 h THR 110 N 0.44 1.18 -0.02 2.57 2.02 -0.99 0.93 112.91 119.03 1h57 h THR 110 Ca 0.12 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 1h57 h THR 110 Cb 0.06 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1h57 h THR 110 CO -0.02 0.19 -0.02 -0.07 0.37 0.00 0.00 175.52 175.97 1h57 h LEU 111 N 0.47 0.02 -0.37 2.58 3.38 -0.66 -0.63 115.31 120.11 1h57 h LEU 111 Ca 0.13 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1h57 h LEU 111 Cb 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1h57 h LEU 111 CO -0.01 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1h57 n ALA 112 N -2.53 2.58 0.00 1.53 0.00 -0.82 -4.86 120.51 116.41 1h57 n ALA 112 Ca -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1h57 n ALA 112 Cb 0.12 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.35 1h57 n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h57 n GLY 113 N 0.89 0.75 0.51 0.00 0.00 -0.25 -0.64 105.19 106.46 1h57 n GLY 113 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 1h57 n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h57 n GLY 114 N -1.82 -0.69 3.74 -0.02 0.00 0.29 -4.79 105.19 101.90 1h57 n GLY 114 Ca 0.00 -1.75 -0.32 0.00 0.00 0.00 0.00 46.02 43.95 1h57 n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h57 s PRO 115 N -3.22 2.06 -0.11 1.61 0.04 -1.26 -4.47 135.00 129.64 1h57 s PRO 115 Ca 0.10 1.37 0.02 0.00 0.04 0.00 0.00 61.00 62.53 1h57 s PRO 115 Cb -0.00 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.67 1h57 s PRO 115 CO 0.07 -1.82 -0.19 0.45 0.04 0.00 0.00 177.00 175.54 1h57 s SER 116 N -2.91 3.47 0.21 6.66 0.15 -1.26 -3.96 113.70 116.06 1h57 s SER 116 Ca 0.65 -0.46 -0.22 0.00 0.70 0.00 0.00 55.95 56.62 1h57 s SER 116 Cb -0.20 -1.49 0.05 0.00 -1.71 0.00 0.00 66.02 62.66 1h57 s SER 116 CO 0.52 0.16 0.64 -1.66 1.20 0.00 0.00 173.24 174.10 1h57 s TRP 117 N 0.35 -0.37 -0.30 3.44 -2.14 -1.26 -5.13 118.94 113.52 1h57 s TRP 117 Ca -0.16 0.05 -0.13 0.00 2.66 0.00 0.00 56.10 58.53 1h57 s TRP 117 Cb -0.17 0.60 -0.03 0.00 -3.10 0.00 0.00 33.47 30.77 1h57 s TRP 117 CO 0.07 -1.01 0.26 1.03 -2.66 0.00 0.00 176.95 174.65 1h57 s ARG 118 N -3.83 3.78 0.43 3.25 0.52 -1.26 -4.98 118.95 116.87 1h57 s ARG 118 Ca 0.05 -0.36 -0.22 0.00 -0.52 0.00 0.00 55.73 54.68 1h57 s ARG 118 Cb -0.03 -3.72 -0.10 0.00 0.52 0.00 0.00 34.95 31.62 1h57 s ARG 118 CO -0.04 -0.32 1.00 0.14 0.02 0.00 0.00 175.30 176.09 1h57 s VAL 119 N 1.84 4.04 0.43 3.52 -7.23 -1.26 -4.82 120.40 116.91 1h57 s VAL 119 Ca 0.09 1.37 -0.25 0.00 -1.81 0.00 0.00 61.98 61.37 1h57 s VAL 119 Cb -0.16 -3.61 -0.08 0.00 0.56 0.00 0.00 36.38 33.08 1h57 s VAL 119 CO 0.11 -0.18 1.33 -2.84 -0.31 0.00 0.00 175.10 173.22 1h57 s PRO 120 N -2.94 3.84 0.30 4.82 0.02 -1.26 -4.11 135.00 135.66 1h57 s PRO 120 Ca 0.62 2.22 0.03 0.00 0.02 0.00 0.00 61.00 63.88 1h57 s PRO 120 Cb -0.15 -2.69 -0.06 0.00 0.02 0.00 0.00 34.50 31.62 1h57 s PRO 120 CO 0.19 -0.62 0.08 -0.51 -0.33 0.00 0.00 177.00 175.81 1h57 s LEU 121 N -2.60 1.93 0.00 -5.54 1.43 0.34 -4.76 118.68 109.49 1h57 s LEU 121 Ca 0.59 -1.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.31 1h57 s LEU 121 Cb -0.39 -0.20 0.00 0.00 0.03 0.00 0.00 46.19 45.63 1h57 s LEU 121 CO 0.50 -0.67 0.00 0.61 0.23 0.00 0.00 176.35 177.03 1h57 n GLY 122 N -0.59 1.03 3.79 -3.19 0.00 -1.26 -0.90 105.19 104.06 1h57 n GLY 122 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1h57 n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h57 s ARG 123 N 0.00 3.32 0.32 1.61 0.52 -1.26 -4.49 118.95 118.97 1h57 s ARG 123 Ca 0.00 1.34 0.08 0.00 -0.52 0.00 0.00 55.73 56.63 1h57 s ARG 123 Cb 0.00 -2.02 -0.06 0.00 0.52 0.00 0.00 34.95 33.38 1h57 s ARG 123 CO 0.00 -0.83 -0.07 1.03 0.02 0.00 0.00 175.30 175.45 1h57 s ARG 124 N -3.78 1.71 0.11 3.54 0.52 0.26 -4.49 118.95 116.83 1h57 s ARG 124 Ca 0.67 -1.89 -0.21 0.00 -0.52 0.00 0.00 55.73 53.78 1h57 s ARG 124 Cb -0.18 -1.45 -0.07 0.00 0.52 0.00 0.00 34.95 33.77 1h57 s ARG 124 CO 0.33 0.08 0.64 -0.51 0.02 0.00 0.00 175.30 175.85 1h57 s ASP 125 N -3.54 7.14 0.83 0.23 1.01 0.56 -4.43 116.67 118.46 1h57 s ASP 125 Ca 0.32 1.37 -0.11 0.00 0.71 0.00 0.00 52.55 54.84 1h57 s ASP 125 Cb 0.04 -2.40 0.09 0.00 1.01 0.00 0.00 42.92 41.66 1h57 s ASP 125 CO 0.15 0.23 1.13 -0.94 0.21 0.00 0.00 175.17 175.95 1h57 s SER 126 N -1.19 3.79 0.00 0.27 1.04 -0.34 -1.89 113.70 115.38 1h57 s SER 126 Ca 0.32 2.05 0.19 0.00 0.48 0.00 0.00 55.95 58.99 1h57 s SER 126 Cb -0.20 -2.55 0.43 0.00 0.10 0.00 0.00 66.02 63.80 1h57 s SER 126 CO 0.21 -2.52 1.35 0.18 0.98 0.00 0.00 173.24 173.44 1h57 n LEU 127 N -3.72 3.34 -3.72 2.42 4.77 -1.26 -4.81 117.00 114.02 1h57 n LEU 127 Ca 0.11 -1.70 -0.05 0.00 -0.03 0.00 0.00 56.01 54.34 1h57 n LEU 127 Cb 0.52 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.31 1h57 n LEU 127 CO 0.51 0.77 0.66 0.00 -1.33 0.00 0.00 177.39 178.00 1h57 s GLN 128 N -1.19 1.25 0.24 3.23 -2.07 -1.26 -4.99 119.66 114.87 1h57 s GLN 128 Ca 0.36 -0.66 0.09 0.00 -1.82 0.00 0.00 55.36 53.33 1h57 s GLN 128 Cb 0.20 0.45 -0.04 0.00 -1.09 0.00 0.00 33.01 32.52 1h57 s GLN 128 CO 0.27 -0.57 -0.00 0.00 -1.32 0.00 0.00 175.29 173.67 1h57 s ALA 129 N -3.40 3.16 -0.55 2.60 0.00 -1.26 -4.75 121.76 117.56 1h57 s ALA 129 Ca 0.10 -1.58 0.04 0.00 0.00 0.00 0.00 51.96 50.53 1h57 s ALA 129 Cb -0.02 -0.83 0.16 0.00 0.00 0.00 0.00 23.12 22.43 1h57 s ALA 129 CO 0.01 0.32 0.39 -0.06 0.00 0.00 0.00 175.76 176.41 1h57 s PHE 130 N -2.16 2.45 0.05 0.00 0.40 -1.26 -4.80 117.98 112.67 1h57 s PHE 130 Ca 0.30 -2.83 -0.23 0.00 -0.60 0.00 0.00 56.93 53.57 1h57 s PHE 130 Cb -0.07 -1.98 -0.16 0.00 0.51 0.00 0.00 43.02 41.32 1h57 s PHE 130 CO 0.19 -0.69 1.57 1.25 0.70 0.00 0.00 175.22 178.24 1h57 h LEU 131 N 5.77 0.05 -0.88 -0.37 5.85 -1.84 -1.21 115.31 122.68 1h57 h LEU 131 Ca 0.15 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1h57 h LEU 131 Cb 0.84 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 1h57 h LEU 131 CO 0.56 0.23 0.58 0.44 -0.34 0.00 0.00 178.44 179.90 1h57 h ASP 132 N -0.13 1.02 -0.28 1.25 3.32 -1.93 -1.04 116.42 118.64 1h57 h ASP 132 Ca 0.01 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 56.95 1h57 h ASP 132 Cb 0.19 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1h57 h ASP 132 CO -0.00 0.75 -0.06 0.25 -1.72 0.00 0.00 179.24 178.46 1h57 h LEU 133 N 1.20 0.63 -0.58 1.55 5.85 -1.95 -1.82 115.31 120.19 1h57 h LEU 133 Ca 0.32 -0.16 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 1h57 h LEU 133 Cb -0.12 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1h57 h LEU 133 CO -0.07 0.74 0.04 0.00 -0.34 0.00 0.00 178.44 178.81 1h57 h ALA 134 N 1.33 0.77 -0.08 1.25 0.00 -0.38 0.28 119.26 122.43 1h57 h ALA 134 Ca 0.12 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1h57 h ALA 134 Cb 0.47 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1h57 h ALA 134 CO 0.02 0.57 -0.24 -0.91 0.00 0.00 0.00 179.25 178.69 1h57 h ASN 135 N 0.88 0.13 0.35 0.00 2.35 -0.82 -2.01 115.58 116.46 1h57 h ASN 135 Ca 0.17 -0.03 -0.32 0.00 -0.55 0.00 0.00 56.30 55.56 1h57 h ASN 135 Cb 0.49 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1h57 h ASN 135 CO 0.02 0.38 -1.60 0.00 -1.65 0.00 0.00 177.43 174.58 1h57 h ALA 136 N 1.63 0.19 0.00 -0.83 0.00 -0.94 -3.40 119.26 115.91 1h57 h ALA 136 Ca 0.02 -1.10 -0.19 0.00 0.00 0.00 0.00 54.91 53.65 1h57 h ALA 136 Cb 0.50 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1h57 h ALA 136 CO 0.03 1.06 -1.45 -0.91 0.00 0.00 0.00 179.25 177.98 1h57 h ASN 137 N 0.09 0.00 -3.13 0.00 4.21 -0.39 -3.46 115.58 112.90 1h57 h ASN 137 Ca -0.28 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.68 1h57 h ASN 137 Cb 2.06 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 39.23 1h57 h ASN 137 CO 0.18 0.65 0.67 -0.76 -1.29 0.00 0.00 177.43 176.88 1h57 s LEU 138 N -5.84 4.27 0.65 1.61 1.43 -0.76 -4.94 118.68 115.10 1h57 s LEU 138 Ca -0.03 1.76 -0.15 0.00 -1.03 0.00 0.00 54.13 54.67 1h57 s LEU 138 Cb 0.09 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 1h57 s LEU 138 CO 0.81 -0.55 1.12 -2.16 0.23 0.00 0.00 176.35 175.80 1h57 s PRO 139 N 2.15 2.82 0.16 1.29 0.04 -1.26 -4.96 135.00 135.23 1h57 s PRO 139 Ca 0.54 1.43 0.08 0.00 0.04 0.00 0.00 61.00 63.09 1h57 s PRO 139 Cb -0.23 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1h57 s PRO 139 CO 0.21 -1.24 -0.07 0.00 0.04 0.00 0.00 177.00 175.94 1h57 s ALA 140 N -2.27 3.02 0.64 8.56 0.00 -1.26 -5.00 121.76 125.45 1h57 s ALA 140 Ca 0.68 -1.39 0.39 0.00 0.00 0.00 0.00 51.96 51.65 1h57 s ALA 140 Cb -0.21 -0.85 2.21 0.00 0.00 0.00 0.00 23.12 24.27 1h57 s ALA 140 CO 0.40 0.52 2.32 -1.00 0.00 0.00 0.00 175.76 178.00 1h57 h PRO 141 N 3.03 0.00 -0.25 0.00 0.13 -1.96 -1.85 132.00 131.09 1h57 h PRO 141 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1h57 h PRO 141 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h57 h PRO 141 CO 0.55 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.29 1h57 n PHE 142 N -3.33 0.33 -2.14 1.56 1.16 -1.26 -1.91 117.46 111.86 1h57 n PHE 142 Ca -0.03 -0.16 -0.38 0.00 -1.87 0.00 0.00 57.45 55.01 1h57 n PHE 142 Cb 0.09 0.00 -0.00 0.00 -1.61 0.00 0.00 39.48 37.96 1h57 n PHE 142 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 1h57 s PHE 143 N -1.67 2.79 0.78 2.97 0.40 -0.70 -4.97 117.98 117.59 1h57 s PHE 143 Ca 0.31 1.49 -0.10 0.00 -0.60 0.00 0.00 56.93 58.03 1h57 s PHE 143 Cb 0.17 -3.51 0.08 0.00 0.51 0.00 0.00 43.02 40.27 1h57 s PHE 143 CO 0.25 -1.83 1.13 0.95 0.70 0.00 0.00 175.22 176.41 1h57 s THR 144 N -1.42 2.09 0.18 0.64 -4.23 -1.26 -4.39 115.64 107.25 1h57 s THR 144 Ca 0.62 -0.10 -0.13 0.00 -1.18 0.00 0.00 61.69 60.90 1h57 s THR 144 Cb -0.33 -2.99 0.08 0.00 1.34 0.00 0.00 72.50 70.60 1h57 s THR 144 CO 0.40 0.00 1.82 0.25 -0.54 0.00 0.00 174.62 176.55 1h57 h LEU 145 N -0.93 0.68 -1.35 4.79 5.85 -1.96 -0.27 115.31 122.12 1h57 h LEU 145 Ca -0.45 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.26 1h57 h LEU 145 Cb 1.32 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 1h57 h LEU 145 CO 0.62 0.53 0.47 -0.65 -0.34 0.00 0.00 178.44 179.07 1h57 h PRO 146 N 0.77 0.81 -0.25 5.25 0.11 -1.94 -0.00 132.00 136.76 1h57 h PRO 146 Ca 0.21 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.13 1h57 h PRO 146 Cb -0.03 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 30.89 1h57 h PRO 146 CO -0.04 0.54 -0.43 1.96 -0.21 0.00 0.00 178.00 179.82 1h57 h GLN 147 N 0.84 0.61 -0.36 1.05 4.20 -1.72 -0.53 115.11 119.20 1h57 h GLN 147 Ca 0.29 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1h57 h GLN 147 Cb 0.11 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1h57 h GLN 147 CO -0.09 0.92 0.07 -0.07 -0.67 0.00 0.00 178.83 179.00 1h57 h LEU 148 N 0.50 0.55 -0.74 1.46 3.38 -0.16 -0.82 115.31 119.48 1h57 h LEU 148 Ca 0.04 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1h57 h LEU 148 Cb 0.95 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1h57 h LEU 148 CO 0.09 0.66 0.38 0.11 0.09 0.00 0.00 178.44 179.77 1h57 h LYS 149 N 0.43 1.05 -0.53 1.13 1.57 -0.90 -2.11 116.57 117.21 1h57 h LYS 149 Ca 0.11 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1h57 h LYS 149 Cb 0.33 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1h57 h LYS 149 CO 0.00 0.80 0.35 -0.44 -0.57 0.00 0.00 179.45 179.60 1h57 h ASP 150 N 1.04 0.61 -0.70 0.86 3.32 -0.83 -0.92 116.42 119.80 1h57 h ASP 150 Ca 0.26 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 1h57 h ASP 150 Cb 0.08 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1h57 h ASP 150 CO -0.04 0.45 0.42 0.77 -1.72 0.00 0.00 179.24 179.12 1h57 h SER 151 N 0.72 0.84 -0.22 6.45 4.64 -0.72 0.25 113.55 125.51 1h57 h SER 151 Ca 0.19 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 61.38 1h57 h SER 151 Cb -0.08 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 61.80 1h57 h SER 151 CO -0.04 0.65 -0.16 -0.26 -0.87 0.00 0.00 176.83 176.14 1h57 h PHE 152 N 0.95 0.58 -0.70 4.77 -1.00 -1.18 -3.09 116.94 117.28 1h57 h PHE 152 Ca 0.25 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 60.86 1h57 h PHE 152 Cb -0.03 -0.13 -0.03 0.00 3.61 0.00 0.00 35.95 39.37 1h57 h PHE 152 CO -0.01 0.81 0.41 0.00 -1.61 0.00 0.00 178.31 177.91 1h57 h ARG 153 N 0.18 0.95 -0.62 1.51 3.08 -0.94 -0.58 114.38 117.97 1h57 h ARG 153 Ca 0.04 -0.09 0.08 0.00 0.07 0.00 0.00 59.98 60.08 1h57 h ARG 153 Cb 0.69 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 1h57 h ARG 153 CO 0.04 0.68 0.41 -0.97 -1.07 0.00 0.00 179.97 179.06 1h57 h ASN 154 N 0.97 0.47 0.10 7.04 -1.24 -0.86 -1.59 115.58 120.46 1h57 h ASN 154 Ca 0.25 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.27 1h57 h ASN 154 Cb -0.02 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 38.94 1h57 h ASN 154 CO -0.05 0.29 -0.31 1.33 -1.29 0.00 0.00 177.43 177.41 1h57 n VAL 155 N -4.48 0.00 0.00 2.57 0.24 -0.94 -4.96 118.33 110.77 1h57 n VAL 155 Ca 0.09 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1h57 n VAL 155 Cb 0.30 0.81 0.00 0.00 -1.47 0.00 0.00 33.84 33.48 1h57 n VAL 155 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h57 n GLY 156 N 1.36 0.97 3.30 7.63 0.00 -0.60 -4.86 105.19 112.99 1h57 n GLY 156 Ca 0.12 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 1h57 n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h57 s LEU 157 N 0.00 6.35 0.32 0.99 1.43 -0.27 -4.91 118.68 122.59 1h57 s LEU 157 Ca 0.00 -2.28 0.17 0.00 -1.03 0.00 0.00 54.13 50.99 1h57 s LEU 157 Cb 0.00 -2.17 0.13 0.00 0.03 0.00 0.00 46.19 44.18 1h57 s LEU 157 CO 0.00 -0.68 1.49 0.78 0.23 0.00 0.00 176.35 178.16 1h57 h ASN 158 N 8.23 0.00 -3.62 2.29 2.35 -1.87 -2.88 115.58 120.09 1h57 h ASN 158 Ca -0.09 0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 55.15 1h57 h ASN 158 Cb 1.06 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.41 1h57 h ASN 158 CO 0.87 0.38 0.37 -0.13 -1.65 0.00 0.00 177.43 177.27 1h57 s ARG 159 N -3.02 4.74 0.50 0.81 0.52 -1.26 -4.94 118.95 116.30 1h57 s ARG 159 Ca 0.05 1.48 0.23 0.00 -0.52 0.00 0.00 55.73 56.97 1h57 s ARG 159 Cb 0.07 -3.34 1.32 0.00 0.52 0.00 0.00 34.95 33.51 1h57 s ARG 159 CO 0.73 0.29 2.05 0.77 0.02 0.00 0.00 175.30 179.15 1h57 h SER 160 N 5.15 0.00 -0.09 0.23 0.02 -1.96 -0.39 113.55 116.52 1h57 h SER 160 Ca -0.44 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.44 1h57 h SER 160 Cb 1.21 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 1h57 h SER 160 CO 0.71 0.14 -0.16 -1.28 -1.14 0.00 0.00 176.83 175.10 1h57 h SER 161 N 0.00 0.44 0.15 3.07 0.87 -1.93 0.24 113.55 116.39 1h57 h SER 161 Ca -0.00 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.43 1h57 h SER 161 Cb 0.33 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1h57 h SER 161 CO 0.02 0.62 -0.07 0.44 -0.53 0.00 0.00 176.83 177.31 1h57 h ASP 162 N 0.41 -0.17 -0.12 6.23 3.32 -1.45 0.61 116.42 125.26 1h57 h ASP 162 Ca 0.07 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1h57 h ASP 162 Cb 0.52 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 1h57 h ASP 162 CO 0.03 -0.09 0.06 0.25 -1.72 0.00 0.00 179.24 177.77 1h57 h LEU 163 N -0.24 0.15 -0.38 1.55 5.85 -1.25 -1.39 115.31 119.60 1h57 h LEU 163 Ca -0.02 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 1h57 h LEU 163 Cb 0.18 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1h57 h LEU 163 CO 0.03 0.22 -0.13 0.58 -0.34 0.00 0.00 178.44 178.80 1h57 h VAL 164 N 0.07 1.28 -0.15 1.05 2.07 -0.91 -2.17 116.25 117.48 1h57 h VAL 164 Ca 0.04 -1.23 -0.05 0.00 0.82 0.00 0.00 66.70 66.27 1h57 h VAL 164 Cb 0.11 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1h57 h VAL 164 CO -0.01 0.41 -0.10 0.00 0.02 0.00 0.00 177.57 177.89 1h57 h ALA 165 N 0.82 0.22 0.00 1.67 0.00 -0.88 -3.14 119.26 117.94 1h57 h ALA 165 Ca 0.09 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1h57 h ALA 165 Cb 0.66 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1h57 h ALA 165 CO 0.05 0.06 -0.30 -0.07 0.00 0.00 0.00 179.25 178.98 1h57 h LEU 166 N -0.00 0.00 -2.18 0.00 3.38 -1.31 -0.98 115.31 114.21 1h57 h LEU 166 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1h57 h LEU 166 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1h57 h LEU 166 CO 0.03 0.30 0.00 0.28 0.09 0.00 0.00 178.44 179.14 1h57 h SER 167 N 0.00 0.00 0.11 -0.43 0.02 -1.34 -0.81 113.55 111.10 1h57 h SER 167 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1h57 h SER 167 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1h57 h SER 167 CO 0.04 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 1h57 n GLY 168 N -0.63 -0.52 0.15 -3.77 0.00 -0.37 -1.30 105.19 98.74 1h57 n GLY 168 Ca -0.01 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.11 1h57 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h57 n GLY 169 N -0.98 -1.09 1.06 -0.02 0.00 -0.31 -1.34 105.19 102.51 1h57 n GLY 169 Ca 0.02 0.14 0.01 0.00 0.00 0.00 0.00 46.02 46.19 1h57 n GLY 169 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1h57 n HIS 170 N -2.26 0.79 1.23 1.61 8.25 -0.42 -3.65 115.22 120.77 1h57 n HIS 170 Ca 0.00 -0.36 0.14 0.00 -0.26 0.00 0.00 57.72 57.25 1h57 n HIS 170 Cb 0.14 -0.28 0.69 0.00 1.12 0.00 0.00 29.99 31.66 1h57 n HIS 170 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1h57 n THR 171 N 0.18 0.00 -4.00 1.59 5.66 -0.45 -3.96 114.28 113.30 1h57 n THR 171 Ca 0.11 -0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.98 1h57 n THR 171 Cb 0.63 -0.48 -0.02 0.00 -1.55 0.00 0.00 70.33 68.91 1h57 n THR 171 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1h57 s PHE 172 N -2.77 0.78 0.00 1.09 -0.71 -1.24 -4.49 117.98 110.65 1h57 s PHE 172 Ca 0.22 -1.14 0.00 0.00 -1.04 0.00 0.00 56.93 54.96 1h57 s PHE 172 Cb 0.20 0.19 0.00 0.00 -1.21 0.00 0.00 43.02 42.20 1h57 s PHE 172 CO 0.50 -1.27 0.00 0.41 -1.34 0.00 0.00 175.22 173.52 1h57 n GLY 173 N -0.56 0.06 3.54 1.99 0.00 -1.12 -4.67 105.19 104.43 1h57 n GLY 173 Ca -0.02 -1.91 -0.24 0.00 0.00 0.00 0.00 46.02 43.85 1h57 n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h57 s LYS 174 N -1.34 1.93 -0.03 1.61 -0.14 -1.26 -2.27 119.74 118.24 1h57 s LYS 174 Ca 0.00 -1.57 -0.01 0.00 -1.36 0.00 0.00 55.97 53.03 1h57 s LYS 174 Cb 0.00 -1.96 0.02 0.00 -1.68 0.00 0.00 37.83 34.21 1h57 s LYS 174 CO 0.00 0.36 0.06 1.21 -0.76 0.00 0.00 175.35 176.22 1h57 s ASN 175 N -3.43 -0.03 0.36 2.83 2.47 0.22 -4.87 114.94 112.50 1h57 s ASN 175 Ca 0.29 0.12 -0.26 0.00 0.42 0.00 0.00 52.86 53.44 1h57 s ASN 175 Cb -0.06 0.07 -0.09 0.00 -1.45 0.00 0.00 41.25 39.71 1h57 s ASN 175 CO 0.16 -0.08 1.06 -1.10 -3.72 0.00 0.00 177.10 173.42 1h57 s GLN 176 N 0.55 4.32 0.41 0.43 -0.21 -1.26 -0.43 119.66 123.47 1h57 s GLN 176 Ca -0.04 1.58 0.17 0.00 0.02 0.00 0.00 55.36 57.08 1h57 s GLN 176 Cb -0.06 -2.74 1.06 0.00 1.00 0.00 0.00 33.01 32.27 1h57 s GLN 176 CO -0.02 -0.02 1.84 0.00 -2.12 0.00 0.00 175.29 174.97 1h57 h ARG 178 N 0.44 0.27 0.00 0.00 2.43 -1.30 -1.12 114.38 115.11 1h57 h ARG 178 Ca 0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.64 1h57 h ARG 178 Cb 1.18 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1h57 h ARG 178 CO -0.20 0.18 0.00 1.19 -1.51 0.00 0.00 179.97 179.63 1h57 n PHE 179 N -5.12 0.00 -0.30 2.20 3.72 -0.69 -3.63 117.46 113.64 1h57 n PHE 179 Ca 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.67 1h57 n PHE 179 Cb 0.86 -0.23 0.00 0.00 -0.94 0.00 0.00 39.48 39.16 1h57 n PHE 179 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1h57 n ILE 180 N -1.23 0.07 -0.31 4.37 -5.35 -0.46 -4.79 119.36 111.67 1h57 n ILE 180 Ca 0.15 -0.39 0.11 0.00 -0.27 0.00 0.00 62.75 62.35 1h57 n ILE 180 Cb 0.20 1.23 0.34 0.00 -1.74 0.00 0.00 39.64 39.66 1h57 n ILE 180 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 1h57 h MET 181 N 0.00 0.76 -0.40 6.28 2.86 -1.53 -1.06 114.93 121.83 1h57 h MET 181 Ca 0.00 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 1h57 h MET 181 Cb 0.20 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1h57 h MET 181 CO 0.00 0.50 0.04 0.38 1.06 0.00 0.00 176.91 178.89 1h57 h ASP 182 N 0.78 0.65 -0.21 1.22 2.03 -1.84 -1.59 116.42 117.45 1h57 h ASP 182 Ca 0.48 -0.28 -0.02 0.00 -0.73 0.00 0.00 57.03 56.48 1h57 h ASP 182 Cb 0.69 -0.17 -0.01 0.00 -0.83 0.00 0.00 39.33 39.01 1h57 h ASP 182 CO -0.24 0.76 0.09 0.03 -1.03 0.00 0.00 179.24 178.85 1h57 h ARG 183 N 0.51 0.38 0.08 4.15 3.08 -1.49 -0.76 114.38 120.34 1h57 h ARG 183 Ca 0.12 -0.05 -0.26 0.00 0.07 0.00 0.00 59.98 59.86 1h57 h ARG 183 Cb 0.40 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1h57 h ARG 183 CO 0.01 0.34 -1.25 -0.07 -1.07 0.00 0.00 179.97 177.94 1h57 h LEU 184 N 0.38 0.26 0.00 3.04 3.38 -1.00 0.14 115.31 121.51 1h57 h LEU 184 Ca 0.10 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1h57 h LEU 184 Cb 0.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1h57 h LEU 184 CO -0.01 1.24 -0.61 -1.22 0.09 0.00 0.00 178.44 177.93 1h57 n TYR 185 N -3.43 0.00 -3.15 1.13 4.01 -0.63 -4.43 117.16 110.66 1h57 n TYR 185 Ca -0.08 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.60 1h57 n TYR 185 Cb 1.00 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 40.01 1h57 n TYR 185 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1h57 s ASN 186 N -2.07 -0.69 -0.16 7.72 2.47 -0.42 -3.74 114.94 118.05 1h57 s ASN 186 Ca 0.00 -1.36 -0.21 0.00 0.42 0.00 0.00 52.86 51.70 1h57 s ASN 186 Cb 0.00 1.46 -0.03 0.00 -1.45 0.00 0.00 41.25 41.23 1h57 s ASN 186 CO 0.00 -0.16 0.64 0.12 -3.72 0.00 0.00 177.10 173.98 1h57 s PHE 187 N 1.38 3.44 -1.52 0.43 5.36 0.61 -4.20 117.98 123.49 1h57 s PHE 187 Ca 0.21 1.02 -0.08 0.00 -0.96 0.00 0.00 56.93 57.12 1h57 s PHE 187 Cb -0.05 -2.79 0.07 0.00 -0.34 0.00 0.00 43.02 39.91 1h57 s PHE 187 CO -0.06 -0.08 0.65 0.45 -1.46 0.00 0.00 175.22 174.72 1h57 n SER 188 N 4.60 -2.05 -2.19 6.13 2.88 -1.26 -1.21 113.62 120.52 1h57 n SER 188 Ca -0.02 -0.96 -0.15 0.00 -1.33 0.00 0.00 58.87 56.41 1h57 n SER 188 Cb 0.50 -3.16 -0.02 0.00 -0.75 0.00 0.00 64.21 60.78 1h57 n SER 188 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1h57 n ASN 189 N -2.86 -4.44 0.04 -3.46 3.02 -1.26 -4.83 115.26 101.47 1h57 n ASN 189 Ca -0.13 0.19 0.12 0.00 -0.03 0.00 0.00 54.58 54.72 1h57 n ASN 189 Cb 0.60 -3.81 0.14 0.00 -0.61 0.00 0.00 39.78 36.10 1h57 n ASN 189 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1h57 n THR 190 N -3.21 0.22 -1.00 3.41 -2.24 -0.35 -4.93 114.28 106.18 1h57 n THR 190 Ca -0.17 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1h57 n THR 190 Cb 0.60 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1h57 n THR 190 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h57 n GLY 191 N 1.38 0.38 3.25 3.38 0.00 -1.26 -4.95 105.19 107.37 1h57 n GLY 191 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 1h57 n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h57 s LEU 192 N 0.00 2.48 0.86 0.99 1.43 -1.25 -4.73 118.68 118.47 1h57 s LEU 192 Ca 0.00 -1.04 -0.11 0.00 -1.03 0.00 0.00 54.13 51.95 1h57 s LEU 192 Cb 0.00 -0.32 0.11 0.00 0.03 0.00 0.00 46.19 46.01 1h57 s LEU 192 CO 0.00 -0.36 1.09 -2.16 0.23 0.00 0.00 176.35 175.15 1h57 s PRO 193 N -3.77 1.55 -0.04 1.29 0.04 -1.26 -0.29 135.00 132.53 1h57 s PRO 193 Ca 0.18 0.89 -0.30 0.00 0.04 0.00 0.00 61.00 61.81 1h57 s PRO 193 Cb 0.03 -1.84 -0.07 0.00 0.04 0.00 0.00 34.50 32.67 1h57 s PRO 193 CO 0.01 -2.06 1.82 0.34 0.04 0.00 0.00 177.00 177.15 1h57 s ASP 194 N -3.45 6.48 0.37 6.66 -1.08 0.47 -4.75 116.67 121.38 1h57 s ASP 194 Ca 0.63 2.35 0.26 0.00 -0.52 0.00 0.00 52.55 55.27 1h57 s ASP 194 Cb -0.18 -2.53 1.32 0.00 -1.46 0.00 0.00 42.92 40.07 1h57 s ASP 194 CO 0.57 -1.07 1.80 1.55 0.52 0.00 0.00 175.17 178.53 1h57 h PRO 195 N 10.40 0.00 -0.11 4.34 0.13 -1.91 -1.95 132.00 142.90 1h57 h PRO 195 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1h57 h PRO 195 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1h57 h PRO 195 CO 0.95 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.97 1h57 n THR 196 N -2.42 0.14 -3.66 1.56 -2.24 -1.26 -4.76 114.28 101.64 1h57 n THR 196 Ca -0.01 -0.22 -0.37 0.00 -2.27 0.00 0.00 64.05 61.18 1h57 n THR 196 Cb 0.10 0.13 -0.10 0.00 -2.10 0.00 0.00 70.33 68.36 1h57 n THR 196 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1h57 s LEU 197 N -1.53 4.01 0.06 3.22 2.96 -0.74 -4.71 118.68 121.95 1h57 s LEU 197 Ca 0.29 0.04 -0.37 0.00 -0.22 0.00 0.00 54.13 53.88 1h57 s LEU 197 Cb 0.15 -2.09 -0.16 0.00 0.50 0.00 0.00 46.19 44.59 1h57 s LEU 197 CO 0.23 0.02 1.41 -3.20 -1.32 0.00 0.00 176.35 173.49 1h57 n ASN 198 N 4.59 1.89 0.26 3.68 2.85 0.01 -4.78 115.26 123.76 1h57 n ASN 198 Ca -0.15 1.11 0.12 0.00 -0.11 0.00 0.00 54.58 55.55 1h57 n ASN 198 Cb 0.52 -1.21 0.71 0.00 1.24 0.00 0.00 39.78 41.04 1h57 n ASN 198 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1h57 h THR 199 N 3.54 0.64 -0.01 -0.44 1.35 -1.93 0.18 112.91 116.24 1h57 h THR 199 Ca -0.47 -0.50 -0.20 0.00 -0.55 0.00 0.00 66.41 64.69 1h57 h THR 199 Cb 1.32 1.31 0.02 0.00 -1.73 0.00 0.00 68.15 69.07 1h57 h THR 199 CO 0.81 0.12 -0.77 0.74 -0.25 0.00 0.00 175.52 176.16 1h57 h THR 200 N 0.00 1.36 -0.05 6.82 2.02 -1.99 -2.99 112.91 118.08 1h57 h THR 200 Ca -0.00 -2.12 -0.10 0.00 0.77 0.00 0.00 66.41 64.95 1h57 h THR 200 Cb 0.30 2.47 -0.01 0.00 -1.74 0.00 0.00 68.15 69.17 1h57 h THR 200 CO 0.02 0.64 -0.44 0.22 0.37 0.00 0.00 175.52 176.32 1h57 h TYR 201 N 0.12 0.13 -0.58 3.16 3.20 -1.83 -2.69 116.97 118.48 1h57 h TYR 201 Ca -0.09 -0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.78 1h57 h TYR 201 Cb 1.45 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 39.65 1h57 h TYR 201 CO 0.13 0.53 0.33 1.25 -1.64 0.00 0.00 178.16 178.76 1h57 h LEU 202 N 0.09 0.52 -0.52 2.82 5.85 -0.63 0.24 115.31 123.68 1h57 h LEU 202 Ca 0.01 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1h57 h LEU 202 Cb 0.82 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1h57 h LEU 202 CO 0.06 0.36 0.29 1.56 -0.34 0.00 0.00 178.44 180.37 1h57 h GLN 203 N 0.64 0.73 -0.27 1.25 7.50 -1.33 -0.19 115.11 123.43 1h57 h GLN 203 Ca 0.24 -0.08 -0.01 0.00 0.50 0.00 0.00 58.65 59.31 1h57 h GLN 203 Cb 0.08 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.46 1h57 h GLN 203 CO -0.13 0.56 0.15 1.15 -1.50 0.00 0.00 178.83 179.05 1h57 h THR 204 N 0.70 1.12 -0.53 -0.54 2.02 -1.20 -2.02 112.91 112.47 1h57 h THR 204 Ca 0.19 -0.33 -0.07 0.00 0.77 0.00 0.00 66.41 66.96 1h57 h THR 204 Cb 0.04 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1h57 h THR 204 CO -0.03 0.12 0.03 -0.07 0.37 0.00 0.00 175.52 175.94 1h57 h LEU 205 N 0.32 0.84 -1.60 2.58 3.38 -0.77 -1.96 115.31 118.10 1h57 h LEU 205 Ca 0.09 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1h57 h LEU 205 Cb 0.07 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1h57 h LEU 205 CO -0.01 0.88 -0.20 0.03 0.09 0.00 0.00 178.44 179.23 1h57 h ARG 206 N 0.81 0.00 -0.09 1.13 3.08 -0.82 0.31 114.38 118.81 1h57 h ARG 206 Ca 0.16 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.05 1h57 h ARG 206 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 1h57 h ARG 206 CO 0.02 0.20 -0.64 0.78 -1.07 0.00 0.00 179.97 179.26 1h57 h GLY 207 N 0.62 0.36 1.75 0.04 0.00 -0.64 -2.47 103.07 102.72 1h57 h GLY 207 Ca -0.00 -0.46 -0.19 0.00 0.00 0.00 0.00 47.33 46.68 1h57 h GLY 207 CO 0.03 0.41 -1.01 1.41 0.00 0.00 0.00 176.54 177.38 1h57 h LEU 208 N 0.24 0.00 -6.19 3.11 3.38 -0.82 -3.39 115.31 111.64 1h57 h LEU 208 Ca -0.01 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.37 1h57 h LEU 208 Cb 1.17 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.52 1h57 h LEU 208 CO 0.10 0.82 -0.84 0.00 0.09 0.00 0.00 178.44 178.62 1h57 s PRO 210 N -1.67 2.60 0.34 0.00 0.04 -0.94 -4.64 135.00 130.73 1h57 s PRO 210 Ca 0.36 1.61 -0.29 0.00 0.04 0.00 0.00 61.00 62.73 1h57 s PRO 210 Cb 0.14 -1.91 -0.11 0.00 0.04 0.00 0.00 34.50 32.66 1h57 s PRO 210 CO -0.08 -1.45 1.50 1.28 0.04 0.00 0.00 177.00 178.29 1h57 n LEU 211 N -2.34 4.44 -0.90 -3.56 4.77 -1.26 -1.12 117.00 117.03 1h57 n LEU 211 Ca 0.12 1.20 -0.12 0.00 -0.03 0.00 0.00 56.01 57.18 1h57 n LEU 211 Cb 0.51 -1.59 -0.05 0.00 -2.33 0.00 0.00 43.42 39.96 1h57 n LEU 211 CO 0.47 0.06 -0.11 0.59 -1.33 0.00 0.00 177.39 177.06 1h57 n ASN 212 N 1.10 -4.86 -1.90 -1.43 5.03 -1.26 -4.99 115.26 106.94 1h57 n ASN 212 Ca 0.04 0.29 0.00 0.00 0.87 0.00 0.00 54.58 55.78 1h57 n ASN 212 Cb 0.38 -3.40 0.00 0.00 -1.02 0.00 0.00 39.78 35.74 1h57 n ASN 212 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1h57 n GLY 213 N -0.94 0.51 3.57 7.41 0.00 -0.27 -4.97 105.19 110.50 1h57 n GLY 213 Ca -0.12 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 1h57 n GLY 213 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1h57 s ASN 214 N -1.00 5.65 0.58 1.61 3.04 -1.26 -4.85 114.94 118.71 1h57 s ASN 214 Ca 0.00 0.70 0.37 0.00 0.04 0.00 0.00 52.86 53.97 1h57 s ASN 214 Cb 0.00 -2.53 1.70 0.00 -1.54 0.00 0.00 41.25 38.88 1h57 s ASN 214 CO 0.00 -2.01 2.10 -0.07 -3.04 0.00 0.00 177.10 174.08 1h57 h LEU 215 N 14.84 0.00 -0.67 3.21 3.38 -1.94 -2.48 115.31 131.65 1h57 h LEU 215 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1h57 h LEU 215 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1h57 h LEU 215 CO 1.14 0.00 -0.09 -1.20 0.09 0.00 0.00 178.44 178.38 1h57 n SER 216 N -3.07 1.13 -4.76 -0.43 7.64 -1.26 -0.88 113.62 111.98 1h57 n SER 216 Ca -0.01 -1.17 -0.40 0.00 1.01 0.00 0.00 58.87 58.31 1h57 n SER 216 Cb 0.23 0.03 0.02 0.00 -1.01 0.00 0.00 64.21 63.49 1h57 n SER 216 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h57 s ALA 217 N -2.21 3.18 -0.12 -0.43 0.00 -0.94 -4.71 121.76 116.53 1h57 s ALA 217 Ca 0.33 1.48 -0.06 0.00 0.00 0.00 0.00 51.96 53.71 1h57 s ALA 217 Cb 0.20 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1h57 s ALA 217 CO 0.41 -1.27 0.11 -0.51 0.00 0.00 0.00 175.76 174.50 1h57 s LEU 218 N -2.87 4.19 0.08 0.00 1.43 -1.26 -0.91 118.68 119.34 1h57 s LEU 218 Ca 0.63 0.37 0.07 0.00 -1.03 0.00 0.00 54.13 54.17 1h57 s LEU 218 Cb -0.44 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.73 1h57 s LEU 218 CO 0.56 0.37 -0.19 -0.69 0.23 0.00 0.00 176.35 176.63 1h57 s VAL 219 N -0.79 1.54 0.19 -1.59 1.01 0.42 -4.91 120.40 116.28 1h57 s VAL 219 Ca 0.13 -1.37 -0.30 0.00 0.00 0.00 0.00 61.98 60.44 1h57 s VAL 219 Cb -0.12 -1.40 -0.08 0.00 0.00 0.00 0.00 36.38 34.78 1h57 s VAL 219 CO 0.03 -0.02 1.16 -1.81 0.00 0.00 0.00 175.10 174.46 1h57 s ASP 220 N -1.64 7.15 0.28 3.32 1.01 -1.26 -0.61 116.67 124.92 1h57 s ASP 220 Ca 0.05 2.19 0.01 0.00 0.71 0.00 0.00 52.55 55.51 1h57 s ASP 220 Cb -0.09 -2.61 0.40 0.00 1.01 0.00 0.00 42.92 41.63 1h57 s ASP 220 CO 0.03 -0.31 1.75 -0.26 0.21 0.00 0.00 175.17 176.59 1h57 h PHE 221 N 5.09 0.66 -3.75 4.23 0.04 -1.72 -3.40 116.94 118.08 1h57 h PHE 221 Ca -0.45 -0.11 -0.68 0.00 2.80 0.00 0.00 57.97 59.54 1h57 h PHE 221 Cb 1.21 -0.17 -0.36 0.00 2.20 0.00 0.00 35.95 38.83 1h57 h PHE 221 CO 0.62 0.71 -0.72 0.34 -0.60 0.00 0.00 178.31 178.66 1h57 s ASP 222 N -6.75 4.77 0.44 2.17 2.15 -1.25 -4.37 116.67 113.83 1h57 s ASP 222 Ca -0.08 -1.57 0.30 0.00 0.43 0.00 0.00 52.55 51.63 1h57 s ASP 222 Cb 0.14 -1.66 1.29 0.00 -0.30 0.00 0.00 42.92 42.39 1h57 s ASP 222 CO 0.80 -0.29 1.89 0.17 -0.17 0.00 0.00 175.17 177.56 1h57 h LEU 223 N 7.86 0.00 0.00 -1.34 -0.00 -1.90 -2.62 115.31 117.30 1h57 h LEU 223 Ca -0.16 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.72 1h57 h LEU 223 Cb 1.04 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.70 1h57 h LEU 223 CO 0.53 0.00 -0.05 0.03 -0.00 0.00 0.00 178.44 178.95 1h57 h ARG 224 N 0.00 0.00 -2.68 0.17 3.08 -1.93 -3.43 114.38 109.60 1h57 h ARG 224 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1h57 h ARG 224 Cb 0.40 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.05 1h57 h ARG 224 CO 0.00 0.14 -0.82 0.95 -1.07 0.00 0.00 179.97 179.17 1h57 s THR 225 N -1.69 1.20 0.49 2.04 -4.23 -1.24 -5.01 115.64 107.20 1h57 s THR 225 Ca -0.04 -3.03 0.33 0.00 -1.18 0.00 0.00 61.69 57.77 1h57 s THR 225 Cb -0.00 -1.82 0.53 0.00 1.34 0.00 0.00 72.50 72.55 1h57 s THR 225 CO 0.11 -1.10 1.73 -0.65 -0.54 0.00 0.00 174.62 174.16 1h57 h PRO 226 N 5.83 0.11 0.00 3.99 0.11 -1.71 -2.90 132.00 137.42 1h57 h PRO 226 Ca 0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1h57 h PRO 226 Cb 0.87 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1h57 h PRO 226 CO 0.48 0.07 0.00 0.25 -0.21 0.00 0.00 178.00 178.59 1h57 n THR 227 N -4.36 0.28 -3.87 -1.15 -2.24 -1.26 -2.81 114.28 98.87 1h57 n THR 227 Ca 0.31 -0.57 -0.35 0.00 -2.27 0.00 0.00 64.05 61.16 1h57 n THR 227 Cb 1.31 0.95 -0.08 0.00 -2.10 0.00 0.00 70.33 70.41 1h57 n THR 227 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1h57 s ILE 228 N -0.28 5.23 -0.63 2.28 1.01 -1.10 -4.87 121.20 122.84 1h57 s ILE 228 Ca 0.00 0.12 -0.25 0.00 0.00 0.00 0.00 60.65 60.52 1h57 s ILE 228 Cb 0.00 -3.34 0.04 0.00 0.01 0.00 0.00 42.46 39.17 1h57 s ILE 228 CO 0.00 0.50 1.08 0.12 0.00 0.00 0.00 174.94 176.65 1h57 s PHE 229 N -0.10 2.59 0.20 3.97 2.19 0.19 -4.54 117.98 122.49 1h57 s PHE 229 Ca 0.09 -0.08 -0.02 0.00 0.33 0.00 0.00 56.93 57.25 1h57 s PHE 229 Cb -0.12 -4.36 0.01 0.00 -1.31 0.00 0.00 43.02 37.24 1h57 s PHE 229 CO 0.00 -1.67 0.30 -0.40 1.83 0.00 0.00 175.22 175.29 1h57 n ASP 230 N 8.22 -0.84 -0.63 6.13 5.68 -1.26 -3.62 116.55 130.22 1h57 n ASP 230 Ca 0.02 -2.06 0.05 0.00 -0.50 0.00 0.00 54.79 52.30 1h57 n ASP 230 Cb 0.48 1.54 0.15 0.00 -1.14 0.00 0.00 41.12 42.14 1h57 n ASP 230 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1h57 n ASN 231 N -1.78 1.82 0.27 -1.12 6.94 -1.26 -4.24 115.26 115.89 1h57 n ASN 231 Ca -0.00 -2.02 0.11 0.00 -0.02 0.00 0.00 54.58 52.65 1h57 n ASN 231 Cb 0.34 -0.24 0.76 0.00 -2.36 0.00 0.00 39.78 38.27 1h57 n ASN 231 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 1h57 h LYS 232 N 1.90 0.00 -0.94 -3.83 1.79 -1.94 -1.94 116.57 111.62 1h57 h LYS 232 Ca 0.00 0.00 0.17 0.00 -2.18 0.00 0.00 60.65 58.64 1h57 h LYS 232 Cb 0.48 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.03 1h57 h LYS 232 CO 0.01 0.00 0.54 -0.92 -1.08 0.00 0.00 179.45 178.00 1h57 h TYR 233 N 0.00 0.95 -0.00 -1.35 3.20 -1.90 -1.12 116.97 116.74 1h57 h TYR 233 Ca 0.01 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.72 1h57 h TYR 233 Cb 0.04 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 1h57 h TYR 233 CO 0.00 0.23 -0.86 1.88 -1.64 0.00 0.00 178.16 177.77 1h57 h TYR 234 N 0.72 0.31 -0.60 -3.82 0.05 -1.69 -2.76 116.97 109.18 1h57 h TYR 234 Ca 0.53 -0.17 -0.05 0.00 0.05 0.00 0.00 58.73 59.09 1h57 h TYR 234 Cb 0.77 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 38.44 1h57 h TYR 234 CO -0.04 0.97 0.18 0.28 -1.05 0.00 0.00 178.16 178.50 1h57 h VAL 235 N 0.12 1.23 -0.36 -2.88 2.07 -1.31 -2.25 116.25 112.88 1h57 h VAL 235 Ca -0.04 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 1h57 h VAL 235 Cb 1.48 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1h57 h VAL 235 CO 0.13 0.30 0.19 0.78 0.02 0.00 0.00 177.57 179.00 1h57 h ASN 236 N 0.88 0.45 -0.96 0.57 2.35 -1.09 -2.74 115.58 115.03 1h57 h ASN 236 Ca 0.20 -0.09 0.06 0.00 -0.55 0.00 0.00 56.30 55.91 1h57 h ASN 236 Cb 0.26 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.45 1h57 h ASN 236 CO -0.01 0.41 0.62 -0.07 -1.65 0.00 0.00 177.43 176.73 1h57 h LEU 237 N 0.45 1.00 -2.37 1.61 3.38 -1.17 0.23 115.31 118.44 1h57 h LEU 237 Ca 0.12 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1h57 h LEU 237 Cb 0.07 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1h57 h LEU 237 CO -0.02 0.64 -0.04 -0.33 0.09 0.00 0.00 178.44 178.79 1h57 h GLU 238 N 1.14 0.00 -0.54 1.13 5.08 -1.12 -0.98 114.58 119.29 1h57 h GLU 238 Ca 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 1h57 h GLU 238 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1h57 h GLU 238 CO -0.16 0.04 0.00 0.39 -1.00 0.00 0.00 179.01 178.27 1h57 n GLU 239 N -3.56 3.53 -2.73 2.33 1.02 -0.21 -4.93 120.64 116.08 1h57 n GLU 239 Ca -0.02 -2.77 -0.18 0.00 -0.02 0.00 0.00 57.16 54.16 1h57 n GLU 239 Cb 0.14 -1.81 0.02 0.00 -0.02 0.00 0.00 31.44 29.77 1h57 n GLU 239 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1h57 n GLN 240 N 0.74 -3.35 -0.54 3.49 1.13 -0.37 -4.59 117.38 113.88 1h57 n GLN 240 Ca 0.23 0.79 0.04 0.00 -1.94 0.00 0.00 57.00 56.13 1h57 n GLN 240 Cb 0.84 -5.33 0.23 0.00 0.11 0.00 0.00 30.24 26.09 1h57 n GLN 240 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1h57 n LYS 241 N -3.27 2.44 -2.17 -1.09 5.02 0.64 -0.81 118.16 118.91 1h57 n LYS 241 Ca -0.13 -2.94 -0.41 0.00 -2.02 0.00 0.00 58.31 52.82 1h57 n LYS 241 Cb 0.62 -1.82 -0.02 0.00 -0.02 0.00 0.00 35.03 33.79 1h57 n LYS 241 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1h57 s GLY 242 N -2.19 2.96 -0.03 0.72 0.00 -1.25 -4.70 107.32 102.82 1h57 s GLY 242 Ca 0.42 1.20 -0.23 0.00 0.00 0.00 0.00 44.72 46.12 1h57 s GLY 242 CO 0.06 1.87 1.01 -2.00 0.00 0.00 0.00 173.10 174.04 1h57 h LEU 243 N 3.61 -0.22-10.18 0.66 5.85 -1.93 -3.43 115.31 109.67 1h57 h LEU 243 Ca -0.48 -0.32 -0.46 0.00 0.84 0.00 0.00 57.88 57.46 1h57 h LEU 243 Cb 1.22 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1h57 h LEU 243 CO 0.67 0.28 -0.42 0.27 -0.34 0.00 0.00 178.44 178.90 1h57 s ILE 244 N -3.84 4.77 0.18 4.05 -4.36 -1.26 -4.95 121.20 115.79 1h57 s ILE 244 Ca -0.13 -1.06 -0.16 0.00 -0.26 0.00 0.00 60.65 59.04 1h57 s ILE 244 Cb 0.01 -3.66 0.14 0.00 1.25 0.00 0.00 42.46 40.20 1h57 s ILE 244 CO 0.51 -0.28 1.65 -0.61 0.24 0.00 0.00 174.94 176.46 1h57 h GLN 245 N 1.14 -0.00 0.00 0.37 4.15 -1.87 -0.85 115.11 118.05 1h57 h GLN 245 Ca -0.50 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 58.92 1h57 h GLN 245 Cb 1.24 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.93 1h57 h GLN 245 CO 0.59 -0.00 -0.01 0.66 -1.93 0.00 0.00 178.83 178.13 1h57 h SER 246 N -0.00 0.00 0.16 -0.69 4.64 -1.59 -1.15 113.55 114.93 1h57 h SER 246 Ca 0.23 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 1h57 h SER 246 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1h57 h SER 246 CO -0.49 0.01 -0.08 0.44 -0.87 0.00 0.00 176.83 175.85 1h57 h ASP 247 N 0.00 -0.18 0.28 4.97 3.32 -1.48 -3.33 116.42 119.99 1h57 h ASP 247 Ca -0.00 -0.32 -0.03 0.00 0.02 0.00 0.00 57.03 56.70 1h57 h ASP 247 Cb 0.04 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 1h57 h ASP 247 CO 0.00 0.39 -0.15 -0.61 -1.72 0.00 0.00 179.24 177.15 1h57 h GLN 248 N -0.93 0.00 0.00 3.56 5.75 -1.15 -2.64 115.11 119.70 1h57 h GLN 248 Ca -0.02 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1h57 h GLN 248 Cb 0.49 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.04 1h57 h GLN 248 CO 0.04 0.15 -0.00 0.93 -2.65 0.00 0.00 178.83 177.30 1h57 h GLU 249 N 0.00 0.00 0.00 1.69 4.39 -1.33 -0.04 114.58 119.30 1h57 h GLU 249 Ca -0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 1h57 h GLU 249 Cb 0.34 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1h57 h GLU 249 CO 0.02 0.00 -0.09 -0.07 -1.16 0.00 0.00 179.01 177.71 1h57 h LEU 250 N 0.00 0.00 0.00 1.33 3.38 -1.60 -2.08 115.31 116.34 1h57 h LEU 250 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1h57 h LEU 250 Cb 0.01 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1h57 h LEU 250 CO 0.00 0.09 -1.72 0.33 0.09 0.00 0.00 178.44 177.23 1h57 n PHE 251 N -3.95 0.00 0.64 1.13 7.35 -0.63 -3.56 117.46 118.44 1h57 n PHE 251 Ca -0.02 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.74 1h57 n PHE 251 Cb 0.18 -0.52 -0.08 0.00 0.35 0.00 0.00 39.48 39.41 1h57 n PHE 251 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1h57 n SER 252 N -2.43 0.75 -4.76 -2.13 7.64 -0.12 -4.86 113.62 107.72 1h57 n SER 252 Ca -0.18 -0.78 -0.38 0.00 1.01 0.00 0.00 58.87 58.54 1h57 n SER 252 Cb 0.84 1.05 0.02 0.00 -1.01 0.00 0.00 64.21 65.10 1h57 n SER 252 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1h57 s SER 253 N -2.47 5.71 0.64 6.43 0.15 -0.78 -4.88 113.70 118.50 1h57 s SER 253 Ca 0.05 2.61 0.42 0.00 0.70 0.00 0.00 55.95 59.72 1h57 s SER 253 Cb 0.11 -2.63 2.20 0.00 -1.71 0.00 0.00 66.02 64.00 1h57 s SER 253 CO 0.60 -1.26 2.30 -0.65 1.20 0.00 0.00 173.24 175.43 1h57 h PRO 254 N 1.82 0.00 -0.65 5.44 0.11 -1.95 -0.34 132.00 136.43 1h57 h PRO 254 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1h57 h PRO 254 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1h57 h PRO 254 CO 0.59 0.00 0.00 -1.71 -0.21 0.00 0.00 178.00 176.67 1h57 n ASN 255 N -3.15 4.16 -1.11 -2.05 4.05 -1.26 -4.53 115.26 111.38 1h57 n ASN 255 Ca -0.02 -2.32 0.03 0.00 0.45 0.00 0.00 54.58 52.72 1h57 n ASN 255 Cb 0.11 -0.53 0.19 0.00 1.23 0.00 0.00 39.78 40.78 1h57 n ASN 255 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1h57 n ALA 256 N 1.09 3.09 -0.21 5.20 0.00 -0.14 -4.42 120.51 125.12 1h57 n ALA 256 Ca 0.23 -0.86 0.10 0.00 0.00 0.00 0.00 53.44 52.90 1h57 n ALA 256 Cb 0.76 -1.05 0.38 0.00 0.00 0.00 0.00 19.45 19.54 1h57 n ALA 256 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1h57 h THR 257 N 1.87 0.92 0.00 0.00 2.02 -1.82 -0.43 112.91 115.47 1h57 h THR 257 Ca 0.00 -0.24 -0.14 0.00 0.77 0.00 0.00 66.41 66.80 1h57 h THR 257 Cb 1.13 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1h57 h THR 257 CO 0.21 0.13 -1.12 -2.24 0.37 0.00 0.00 175.52 172.86 1h57 h ASP 258 N 0.69 0.00 0.65 4.18 2.03 -1.97 -3.38 116.42 118.62 1h57 h ASP 258 Ca 0.37 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.45 1h57 h ASP 258 Cb 0.50 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.97 1h57 h ASP 258 CO -0.14 0.54 -1.50 0.71 -1.03 0.00 0.00 179.24 177.82 1h57 h THR 259 N 0.00 0.71 -0.29 1.15 1.35 -1.67 -3.38 112.91 110.78 1h57 h THR 259 Ca -0.11 -2.37 0.05 0.00 -0.55 0.00 0.00 66.41 63.43 1h57 h THR 259 Cb 1.50 2.25 -0.05 0.00 -1.73 0.00 0.00 68.15 70.13 1h57 h THR 259 CO 0.05 0.41 0.01 0.40 -0.25 0.00 0.00 175.52 176.13 1h57 h ILE 260 N 0.00 0.80 -0.05 6.82 2.04 -1.15 -0.41 117.51 125.56 1h57 h ILE 260 Ca -0.21 -0.03 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 1h57 h ILE 260 Cb 1.78 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1h57 h ILE 260 CO 0.06 0.02 -0.08 1.55 0.00 0.00 0.00 178.15 179.70 1h57 h PRO 261 N 0.09 0.07 -0.18 2.37 0.13 -1.78 -1.14 132.00 131.56 1h57 h PRO 261 Ca 0.14 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 65.15 1h57 h PRO 261 Cb 0.18 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.30 1h57 h PRO 261 CO -0.23 0.16 -0.29 -0.07 -0.23 0.00 0.00 178.00 177.34 1h57 h LEU 262 N 0.07 0.58 -0.39 1.56 3.38 -1.54 -1.04 115.31 117.92 1h57 h LEU 262 Ca 0.02 -0.53 0.03 0.00 0.09 0.00 0.00 57.88 57.49 1h57 h LEU 262 Cb 0.19 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1h57 h LEU 262 CO 0.01 0.99 0.20 0.58 0.09 0.00 0.00 178.44 180.32 1h57 h VAL 263 N 0.18 0.99 -0.45 1.22 2.07 -0.56 -1.13 116.25 118.57 1h57 h VAL 263 Ca 0.02 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1h57 h VAL 263 Cb 0.87 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1h57 h VAL 263 CO 0.07 0.08 0.19 0.03 0.02 0.00 0.00 177.57 177.95 1h57 h ARG 264 N 0.41 0.66 -0.71 1.57 3.08 -1.19 -1.24 114.38 116.96 1h57 h ARG 264 Ca 0.16 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1h57 h ARG 264 Cb 0.06 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 1h57 h ARG 264 CO -0.11 0.60 0.39 0.66 -1.07 0.00 0.00 179.97 180.45 1h57 h SER 265 N 0.58 0.88 0.93 7.04 4.64 -0.84 0.10 113.55 126.88 1h57 h SER 265 Ca 0.15 -0.07 -0.14 0.00 -0.47 0.00 0.00 61.79 61.26 1h57 h SER 265 Cb 0.18 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 1h57 h SER 265 CO -0.01 0.71 -0.66 -0.26 -0.87 0.00 0.00 176.83 175.73 1h57 h PHE 266 N 0.99 0.00 0.00 4.77 0.04 -1.01 -2.46 116.94 119.28 1h57 h PHE 266 Ca 0.25 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.84 1h57 h PHE 266 Cb 0.02 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 1h57 h PHE 266 CO 0.01 0.66 -0.86 0.00 -0.60 0.00 0.00 178.31 177.51 1h57 h ALA 267 N 1.34 0.57 0.00 2.45 0.00 -0.65 -3.29 119.26 119.67 1h57 h ALA 267 Ca -0.01 -0.79 -0.17 0.00 0.00 0.00 0.00 54.91 53.94 1h57 h ALA 267 Cb 1.30 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1h57 h ALA 267 CO 0.09 1.08 -0.83 -0.91 0.00 0.00 0.00 179.25 178.68 1h57 h ASN 268 N 0.00 0.00 -3.32 0.00 2.35 -0.90 -3.46 115.58 110.25 1h57 h ASN 268 Ca -0.01 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.39 1h57 h ASN 268 Cb 1.54 0.00 -0.38 0.00 0.05 0.00 0.00 38.32 39.53 1h57 h ASN 268 CO 0.11 0.83 -0.73 -0.55 -1.65 0.00 0.00 177.43 175.44 1h57 s SER 269 N -6.62 0.92 0.21 5.81 0.15 -0.94 -5.01 113.70 108.22 1h57 s SER 269 Ca 0.02 0.10 -0.08 0.00 0.70 0.00 0.00 55.95 56.69 1h57 s SER 269 Cb 0.09 -0.09 0.16 0.00 -1.71 0.00 0.00 66.02 64.47 1h57 s SER 269 CO 0.79 -0.23 1.80 0.74 1.20 0.00 0.00 173.24 177.55 1h57 h THR 270 N 6.41 1.25 -0.58 6.45 2.02 -1.88 -2.05 112.91 124.54 1h57 h THR 270 Ca -0.18 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.29 1h57 h THR 270 Cb 1.12 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1h57 h THR 270 CO 0.20 0.30 0.35 -0.61 0.37 0.00 0.00 175.52 176.13 1h57 h GLN 271 N 1.12 0.78 -0.57 6.66 4.15 -1.95 0.20 115.11 125.50 1h57 h GLN 271 Ca 0.27 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 1h57 h GLN 271 Cb 0.13 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.63 1h57 h GLN 271 CO -0.03 0.56 0.31 1.15 -1.93 0.00 0.00 178.83 178.89 1h57 h THR 272 N 0.78 1.19 0.19 2.39 2.02 -1.81 -0.64 112.91 117.03 1h57 h THR 272 Ca 0.21 -0.50 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 1h57 h THR 272 Cb -0.02 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 1h57 h THR 272 CO -0.04 0.21 -0.09 0.15 0.37 0.00 0.00 175.52 176.12 1h57 h PHE 273 N 0.77 -0.23 -0.83 3.16 3.57 -0.92 -1.96 116.94 120.51 1h57 h PHE 273 Ca 0.20 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.77 1h57 h PHE 273 Cb 0.06 0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.81 1h57 h PHE 273 CO -0.01 0.06 0.49 0.74 -2.23 0.00 0.00 178.31 177.36 1h57 h PHE 274 N -0.53 0.89 -0.47 0.41 -1.00 -0.55 0.29 116.94 115.99 1h57 h PHE 274 Ca -0.03 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 1h57 h PHE 274 Cb 0.40 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.66 1h57 h PHE 274 CO 0.01 0.41 0.23 -0.91 -1.61 0.00 0.00 178.31 176.44 1h57 h ASN 275 N 0.85 0.61 -0.07 2.17 2.35 -1.07 -1.61 115.58 118.81 1h57 h ASN 275 Ca 0.38 -0.12 -0.10 0.00 -0.55 0.00 0.00 56.30 55.91 1h57 h ASN 275 Cb 0.28 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 1h57 h ASN 275 CO -0.21 0.56 -0.26 0.00 -1.65 0.00 0.00 177.43 175.87 1h57 h ALA 276 N 1.07 1.07 -0.30 -0.83 0.00 -0.51 -2.03 119.26 117.73 1h57 h ALA 276 Ca 0.16 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 1h57 h ALA 276 Cb 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1h57 h ALA 276 CO -0.02 0.57 -0.08 0.35 0.00 0.00 0.00 179.25 180.07 1h57 h PHE 277 N 0.45 0.66 -0.43 0.00 3.57 -0.18 0.01 116.94 121.01 1h57 h PHE 277 Ca 0.06 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.40 1h57 h PHE 277 Cb 0.69 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1h57 h PHE 277 CO 0.02 0.78 0.19 0.28 -2.23 0.00 0.00 178.31 177.35 1h57 h VAL 278 N 0.35 1.19 -0.23 1.41 2.07 -1.21 0.27 116.25 120.10 1h57 h VAL 278 Ca 0.07 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1h57 h VAL 278 Cb 0.57 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1h57 h VAL 278 CO 0.03 0.21 0.15 -0.08 0.02 0.00 0.00 177.57 177.91 1h57 h GLU 279 N 0.56 0.31 -0.39 1.57 4.81 -1.26 -1.23 114.58 118.94 1h57 h GLU 279 Ca 0.15 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.24 1h57 h GLU 279 Cb 0.16 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1h57 h GLU 279 CO -0.01 0.21 -0.23 0.00 -0.73 0.00 0.00 179.01 178.24 1h57 h ALA 280 N 1.08 0.86 -0.63 2.92 0.00 -0.79 -2.16 119.26 120.54 1h57 h ALA 280 Ca 0.09 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1h57 h ALA 280 Cb -0.03 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1h57 h ALA 280 CO -0.02 0.63 0.31 0.52 0.00 0.00 0.00 179.25 180.69 1h57 h MET 281 N 0.68 0.91 -0.12 0.00 2.86 -0.20 -0.25 114.93 118.82 1h57 h MET 281 Ca 0.09 -0.13 -0.11 0.00 -2.06 0.00 0.00 59.70 57.49 1h57 h MET 281 Cb 0.75 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 1h57 h MET 281 CO 0.06 0.73 -0.43 -0.44 1.06 0.00 0.00 176.91 177.89 1h57 h ASP 282 N 0.87 0.28 -0.37 1.22 3.32 -1.11 0.61 116.42 121.24 1h57 h ASP 282 Ca 0.22 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1h57 h ASP 282 Cb 0.11 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1h57 h ASP 282 CO -0.03 0.68 -0.13 0.03 -1.72 0.00 0.00 179.24 178.07 1h57 h ARG 283 N 0.22 0.75 -0.57 3.56 3.08 -0.97 -2.28 114.38 118.17 1h57 h ARG 283 Ca 0.02 -0.30 -0.08 0.00 0.07 0.00 0.00 59.98 59.68 1h57 h ARG 283 Cb 0.85 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1h57 h ARG 283 CO 0.07 0.91 0.03 1.98 -1.07 0.00 0.00 179.97 181.89 1h57 h MET 284 N 0.54 0.97 0.00 0.04 4.05 -0.80 -1.98 114.93 117.75 1h57 h MET 284 Ca 0.09 -0.28 0.00 0.00 -0.28 0.00 0.00 59.70 59.23 1h57 h MET 284 Cb 0.66 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 1h57 h MET 284 CO 0.04 0.94 0.00 0.41 0.23 0.00 0.00 176.91 178.53 1h57 n GLY 285 N -0.55 -0.88 1.20 1.39 0.00 0.19 -2.21 105.19 104.32 1h57 n GLY 285 Ca 0.03 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.10 1h57 n GLY 285 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1h57 n ASN 286 N -1.39 3.70 -4.66 1.61 5.15 -0.75 -4.82 115.26 114.09 1h57 n ASN 286 Ca 0.05 -1.99 -0.43 0.00 -0.60 0.00 0.00 54.58 51.62 1h57 n ASN 286 Cb 0.14 -0.40 -0.02 0.00 -0.53 0.00 0.00 39.78 38.96 1h57 n ASN 286 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1h57 s ILE 287 N -1.08 4.12 -0.27 -1.44 1.01 -0.94 -4.36 121.20 118.23 1h57 s ILE 287 Ca 0.43 1.36 -0.07 0.00 0.00 0.00 0.00 60.65 62.37 1h57 s ILE 287 Cb 0.23 -3.88 0.01 0.00 0.01 0.00 0.00 42.46 38.83 1h57 s ILE 287 CO 0.30 -0.11 0.16 0.35 0.00 0.00 0.00 174.94 175.64 1h57 n THR 288 N 5.34 -0.64 -2.49 2.92 -2.24 -1.26 -3.08 114.28 112.83 1h57 n THR 288 Ca 0.14 -0.12 -0.33 0.00 -2.27 0.00 0.00 64.05 61.48 1h57 n THR 288 Cb 0.44 -0.55 -0.04 0.00 -2.10 0.00 0.00 70.33 68.09 1h57 n THR 288 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1h57 s PRO 289 N -5.12 3.93 -0.05 -0.78 0.04 -1.26 -4.50 135.00 127.26 1h57 s PRO 289 Ca 0.10 1.08 -0.17 0.00 0.04 0.00 0.00 61.00 62.05 1h57 s PRO 289 Cb -0.06 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 1h57 s PRO 289 CO 0.23 -0.29 0.46 -0.51 0.04 0.00 0.00 177.00 176.93 1h57 s LEU 290 N -3.81 4.38 0.30 -3.56 1.43 -1.26 -4.98 118.68 111.18 1h57 s LEU 290 Ca 0.61 0.92 0.05 0.00 -1.03 0.00 0.00 54.13 54.68 1h57 s LEU 290 Cb -0.11 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.40 1h57 s LEU 290 CO 0.26 0.16 0.22 0.42 0.23 0.00 0.00 176.35 177.63 1h57 s THR 291 N -0.22 0.10 0.00 5.49 -4.23 -1.26 -0.58 115.64 114.94 1h57 s THR 291 Ca 0.25 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 1h57 s THR 291 Cb -0.16 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1h57 s THR 291 CO 0.12 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.81 1h57 n GLY 292 N -0.56 1.38 0.55 3.99 0.00 -1.26 -1.34 105.19 107.94 1h57 n GLY 292 Ca 0.04 0.29 0.06 0.00 0.00 0.00 0.00 46.02 46.41 1h57 n GLY 292 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h57 n THR 293 N 0.00 0.33 -2.46 2.61 -2.24 -1.26 -5.00 114.28 106.27 1h57 n THR 293 Ca 0.00 -0.67 -0.40 0.00 -2.27 0.00 0.00 64.05 60.71 1h57 n THR 293 Cb 0.00 1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.19 1h57 n THR 293 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1h57 s GLN 294 N -1.00 4.63 2.38 -0.78 -0.21 -0.45 -4.81 119.66 119.42 1h57 s GLN 294 Ca 0.18 1.82 0.00 0.00 0.02 0.00 0.00 55.36 57.37 1h57 s GLN 294 Cb 0.11 -3.19 0.00 0.00 1.00 0.00 0.00 33.01 30.93 1h57 s GLN 294 CO 0.16 0.19 0.00 0.41 -2.12 0.00 0.00 175.29 173.92 1h57 n GLY 295 N 1.23 -0.27 3.29 3.09 0.00 -1.26 -4.39 105.19 106.87 1h57 n GLY 295 Ca -0.01 -1.03 -0.21 0.00 0.00 0.00 0.00 46.02 44.77 1h57 n GLY 295 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1h57 n GLN 296 N -0.39 0.45 -3.54 1.61 6.02 -0.79 -4.87 117.38 115.87 1h57 n GLN 296 Ca 0.00 -3.41 -0.41 0.00 -0.01 0.00 0.00 57.00 53.17 1h57 n GLN 296 Cb 0.00 2.53 -0.07 0.00 1.02 0.00 0.00 30.24 33.72 1h57 n GLN 296 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1h57 s ILE 297 N -3.30 4.44 0.25 5.09 -1.09 -1.26 -0.32 121.20 125.00 1h57 s ILE 297 Ca 0.35 -2.34 -0.30 0.00 -2.23 0.00 0.00 60.65 56.13 1h57 s ILE 297 Cb 0.02 -3.86 -0.11 0.00 -1.58 0.00 0.00 42.46 36.94 1h57 s ILE 297 CO 0.25 -0.88 1.52 -0.60 -1.23 0.00 0.00 174.94 174.00 1h57 s ARG 298 N 0.59 4.21 -0.02 2.79 3.52 -1.26 -4.93 118.95 123.84 1h57 s ARG 298 Ca 0.12 2.41 -0.03 0.00 -0.13 0.00 0.00 55.73 58.10 1h57 s ARG 298 Cb -0.20 -3.09 -0.27 0.00 -1.56 0.00 0.00 34.95 29.82 1h57 s ARG 298 CO -0.04 -0.53 0.75 -0.07 -0.81 0.00 0.00 175.30 174.60 1h57 h LEU 299 N 5.36 0.39 -7.91 -0.88 4.07 -1.95 -3.42 115.31 110.97 1h57 h LEU 299 Ca -0.46 -0.60 -0.67 0.00 0.08 0.00 0.00 57.88 56.24 1h57 h LEU 299 Cb 1.22 -0.13 -0.37 0.00 1.08 0.00 0.00 40.66 42.46 1h57 h LEU 299 CO 0.81 1.51 -0.81 0.21 -1.08 0.00 0.00 178.44 179.08 1h57 s ASN 300 N -6.94 4.19 0.42 -0.43 3.84 -1.26 -4.91 114.94 109.85 1h57 s ASN 300 Ca -0.11 -1.25 0.25 0.00 0.21 0.00 0.00 52.86 51.96 1h57 s ASN 300 Cb 0.07 -1.54 1.37 0.00 -0.55 0.00 0.00 41.25 40.60 1h57 s ASN 300 CO 0.84 -0.15 1.75 0.00 -2.79 0.00 0.00 177.10 176.75 1h57 h ARG 302 N 0.00 0.00 -4.51 0.00 3.08 -1.95 -3.29 114.38 107.70 1h57 h ARG 302 Ca 0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.79 1h57 h ARG 302 Cb 0.16 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.00 1h57 h ARG 302 CO 0.00 0.00 -0.73 0.14 -1.07 0.00 0.00 179.97 178.31 1h57 s VAL 303 N -3.27 0.50 0.41 2.04 -7.23 -0.74 -1.22 120.40 110.90 1h57 s VAL 303 Ca 0.04 -1.09 -0.24 0.00 -1.81 0.00 0.00 61.98 58.88 1h57 s VAL 303 Cb 0.08 -0.60 -0.09 0.00 0.56 0.00 0.00 36.38 36.33 1h57 s VAL 303 CO 0.72 -0.41 1.08 -0.69 -0.31 0.00 0.00 175.10 175.50 1h57 s VAL 304 N -1.45 3.55 0.45 1.32 1.01 -1.26 -4.50 120.40 119.52 1h57 s VAL 304 Ca -0.10 1.19 -0.24 0.00 0.00 0.00 0.00 61.98 62.83 1h57 s VAL 304 Cb -0.10 -3.62 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 1h57 s VAL 304 CO 0.00 0.01 1.28 0.20 0.00 0.00 0.00 175.10 176.60 1h57 s ASN 305 N -1.48 6.02 0.00 3.32 0.01 -1.26 -5.05 114.94 116.50 1h57 s ASN 305 Ca 0.59 2.59 0.00 0.00 -0.71 0.00 0.00 52.86 55.33 1h57 s ASN 305 Cb -0.24 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.79 1h57 s ASN 305 CO 0.30 -1.04 0.47 -1.54 -1.51 0.00 0.00 177.10 173.77