#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bng s THR 11 N 0.00 4.84 0.39 2.62 -1.32 -1.26 -5.00 115.64 115.92 2bng s THR 11 Ca 0.00 2.03 -0.26 0.00 -1.21 0.00 0.00 61.69 62.25 2bng s THR 11 Cb 0.00 -4.31 -0.09 0.00 -1.51 0.00 0.00 72.50 66.60 2bng s THR 11 CO 0.00 0.11 1.21 -2.16 -2.21 0.00 0.00 174.62 171.57 2bng s PRO 12 N 1.37 4.09 0.62 7.08 0.04 -1.26 -4.89 135.00 142.05 2bng s PRO 12 Ca 0.50 1.95 0.27 0.00 0.04 0.00 0.00 61.00 63.75 2bng s PRO 12 Cb -0.20 -2.76 1.31 0.00 0.04 0.00 0.00 34.50 32.90 2bng s PRO 12 CO 0.24 -0.32 1.74 0.93 0.04 0.00 0.00 177.00 179.63 2bng h GLU 13 N 2.78 0.00 0.17 4.56 4.39 -1.95 -0.44 114.58 124.09 2bng h GLU 13 Ca -0.49 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.20 2bng h GLU 13 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2bng h GLU 13 CO 0.63 0.00 -0.08 1.15 -1.16 0.00 0.00 179.01 179.55 2bng h THR 14 N 0.00 0.90 -0.66 1.13 2.02 -1.90 0.16 112.91 114.56 2bng h THR 14 Ca 0.19 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 2bng h THR 14 Cb 1.41 1.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.88 2bng h THR 14 CO -0.00 0.07 0.25 0.74 0.37 0.00 0.00 175.52 176.95 2bng h THR 15 N -0.37 1.24 -0.28 3.16 2.02 -1.45 -2.22 112.91 115.01 2bng h THR 15 Ca -0.02 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.39 2bng h THR 15 Cb 0.29 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2bng h THR 15 CO 0.04 0.31 0.15 -0.33 0.37 0.00 0.00 175.52 176.05 2bng h GLU 16 N 0.94 0.30 -0.35 6.66 5.08 -1.37 -1.95 114.58 123.90 2bng h GLU 16 Ca 0.22 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 2bng h GLU 16 Cb 0.23 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2bng h GLU 16 CO -0.01 0.20 0.13 0.00 -1.00 0.00 0.00 179.01 178.32 2bng h ALA 17 N 1.14 0.45 -0.15 3.43 0.00 -0.49 -0.60 119.26 123.04 2bng h ALA 17 Ca 0.11 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2bng h ALA 17 Cb 0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2bng h ALA 17 CO -0.07 0.06 -0.11 0.82 0.00 0.00 0.00 179.25 179.95 2bng h ILE 18 N 0.41 0.67 -0.88 0.00 2.04 -1.36 -2.24 117.51 116.15 2bng h ILE 18 Ca 0.11 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.00 2bng h ILE 18 Cb 0.20 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 2bng h ILE 18 CO -0.01 0.00 0.58 -0.09 0.00 0.00 0.00 178.15 178.63 2bng h ARG 19 N -0.12 1.11 -0.48 2.37 2.43 -1.16 -0.50 114.38 118.04 2bng h ARG 19 Ca 0.10 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 2bng h ARG 19 Cb 0.26 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 2bng h ARG 19 CO -0.23 0.74 0.26 0.00 -1.51 0.00 0.00 179.97 179.23 2bng h ALA 20 N 1.47 0.61 -0.45 2.80 0.00 -0.79 0.57 119.26 123.47 2bng h ALA 20 Ca 0.34 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 2bng h ALA 20 Cb -0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2bng h ALA 20 CO -0.09 0.13 -0.00 0.28 0.00 0.00 0.00 179.25 179.57 2bng h VAL 21 N 0.63 1.26 -0.29 0.00 2.07 -1.08 0.61 116.25 119.45 2bng h VAL 21 Ca 0.17 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 2bng h VAL 21 Cb 0.04 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2bng h VAL 21 CO -0.03 0.36 0.13 -0.33 0.02 0.00 0.00 177.57 177.72 2bng h GLU 22 N 0.65 0.43 -0.75 1.57 5.08 -0.98 -1.39 114.58 119.18 2bng h GLU 22 Ca 0.13 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2bng h GLU 22 Cb 0.50 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 2bng h GLU 22 CO 0.02 0.43 0.47 0.00 -1.00 0.00 0.00 179.01 178.94 2bng h ALA 23 N 0.98 0.99 -0.17 3.43 0.00 -0.72 -1.34 119.26 122.43 2bng h ALA 23 Ca 0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2bng h ALA 23 Cb 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2bng h ALA 23 CO -0.01 0.26 0.07 0.35 0.00 0.00 0.00 179.25 179.91 2bng h PHE 24 N 0.91 0.25 -0.63 0.00 3.57 -0.64 -0.50 116.94 119.91 2bng h PHE 24 Ca 0.31 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.70 2bng h PHE 24 Cb 0.04 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 2bng h PHE 24 CO -0.04 0.31 0.06 -0.07 -2.23 0.00 0.00 178.31 176.34 2bng h LEU 25 N 0.12 1.02 -0.95 0.59 3.38 -1.10 -1.49 115.31 116.88 2bng h LEU 25 Ca 0.06 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 2bng h LEU 25 Cb 0.17 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 2bng h LEU 25 CO -0.00 1.03 0.30 0.78 0.09 0.00 0.00 178.44 180.63 2bng h ASN 26 N 0.98 0.96 -0.93 -0.43 2.35 -1.21 -2.41 115.58 114.89 2bng h ASN 26 Ca 0.19 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2bng h ASN 26 Cb 0.48 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.56 2bng h ASN 26 CO 0.02 0.85 0.55 0.00 -1.65 0.00 0.00 177.43 177.20 2bng h ALA 27 N 1.29 1.18 -0.10 -0.83 0.00 -0.40 0.20 119.26 120.59 2bng h ALA 27 Ca 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2bng h ALA 27 Cb 0.18 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2bng h ALA 27 CO -0.02 0.65 0.06 -0.07 0.00 0.00 0.00 179.25 179.86 2bng h LEU 28 N 1.28 0.13 -0.84 0.00 3.38 -1.10 0.37 115.31 118.53 2bng h LEU 28 Ca 0.33 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 2bng h LEU 28 Cb -0.03 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2bng h LEU 28 CO -0.06 0.18 0.48 -0.61 0.09 0.00 0.00 178.44 178.52 2bng h GLN 29 N 0.07 1.16 -0.00 1.13 4.15 -1.03 -2.84 115.11 117.75 2bng h GLN 29 Ca 0.04 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2bng h GLN 29 Cb 0.08 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.54 2bng h GLN 29 CO -0.01 0.84 -0.13 0.09 -1.93 0.00 0.00 178.83 177.70 2bng n ASN 30 N -4.40 0.49 -2.83 -0.69 3.02 0.65 -4.73 115.26 106.76 2bng n ASN 30 Ca 0.08 -0.54 -0.21 0.00 -0.03 0.00 0.00 54.58 53.89 2bng n ASN 30 Cb 0.08 -0.07 0.04 0.00 -0.61 0.00 0.00 39.78 39.22 2bng n ASN 30 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2bng n GLU 31 N -0.97 -4.85 -3.14 3.52 1.02 -0.11 -4.92 120.64 111.19 2bng n GLU 31 Ca 0.14 0.82 -0.45 0.00 -0.02 0.00 0.00 57.16 57.65 2bng n GLU 31 Cb 0.29 -5.53 -0.00 0.00 -0.02 0.00 0.00 31.44 26.17 2bng n GLU 31 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2bng s ASP 32 N -2.81 7.10 0.44 1.62 2.15 -0.07 -4.86 116.67 120.24 2bng s ASP 32 Ca 0.31 -3.11 0.24 0.00 0.43 0.00 0.00 52.55 50.42 2bng s ASP 32 Cb -0.14 -2.31 0.61 0.00 -0.30 0.00 0.00 42.92 40.79 2bng s ASP 32 CO 0.38 -0.58 1.70 -0.26 -0.17 0.00 0.00 175.17 176.25 2bng h PHE 33 N 7.19 0.00 -0.17 -5.34 0.04 -1.91 -2.01 116.94 114.74 2bng h PHE 33 Ca 0.23 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.83 2bng h PHE 33 Cb 0.90 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 2bng h PHE 33 CO 0.97 0.12 -0.58 -0.44 -0.60 0.00 0.00 178.31 177.77 2bng h ASP 34 N 0.00 0.61 -0.46 2.17 3.45 -1.97 -0.68 116.42 119.53 2bng h ASP 34 Ca -0.00 -0.34 -0.11 0.00 0.43 0.00 0.00 57.03 57.01 2bng h ASP 34 Cb 0.92 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.50 2bng h ASP 34 CO 0.02 1.06 -0.13 0.74 -1.57 0.00 0.00 179.24 179.36 2bng h THR 35 N 0.41 1.27 -0.43 0.35 2.02 -1.85 -1.39 112.91 113.29 2bng h THR 35 Ca 0.00 -1.26 0.04 0.00 0.77 0.00 0.00 66.41 65.96 2bng h THR 35 Cb 1.13 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 68.52 2bng h THR 35 CO 0.11 0.44 0.21 0.58 0.37 0.00 0.00 175.52 177.23 2bng h VAL 36 N 0.84 0.96 -0.46 3.16 2.07 -1.25 -0.34 116.25 121.23 2bng h VAL 36 Ca 0.13 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 67.54 2bng h VAL 36 Cb 0.67 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 2bng h VAL 36 CO 0.05 0.08 0.24 0.44 0.02 0.00 0.00 177.57 178.39 2bng h ASP 37 N 0.42 0.35 0.32 0.57 3.32 -1.02 -2.55 116.42 117.84 2bng h ASP 37 Ca 0.19 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 2bng h ASP 37 Cb 0.10 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2bng h ASP 37 CO -0.13 0.25 -0.34 0.00 -1.72 0.00 0.00 179.24 177.30 2bng h ALA 38 N 1.24 1.42 0.00 3.45 0.00 -1.03 -3.26 119.26 121.08 2bng h ALA 38 Ca 0.20 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2bng h ALA 38 Cb 0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2bng h ALA 38 CO -0.13 0.43 -0.40 0.00 0.00 0.00 0.00 179.25 179.15 2bng h ALA 39 N 1.64 0.79 -3.01 0.00 0.00 -0.65 -3.45 119.26 114.59 2bng h ALA 39 Ca 0.00 -0.37 -0.63 0.00 0.00 0.00 0.00 54.91 53.91 2bng h ALA 39 Cb 0.61 -0.06 -0.16 0.00 0.00 0.00 0.00 17.79 18.17 2bng h ALA 39 CO 0.04 0.50 -0.52 -0.51 0.00 0.00 0.00 179.25 178.76 2bng s LEU 40 N -6.57 4.00 0.59 0.00 1.43 -1.11 -0.28 118.68 116.74 2bng s LEU 40 Ca 0.03 0.03 -0.19 0.00 -1.03 0.00 0.00 54.13 52.97 2bng s LEU 40 Cb 0.08 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 2bng s LEU 40 CO 0.71 0.01 1.23 -0.83 0.23 0.00 0.00 176.35 177.71 2bng s GLY 41 N 1.36 2.78 0.37 -3.19 0.00 0.28 -4.77 107.32 104.14 2bng s GLY 41 Ca 0.07 1.07 0.12 0.00 0.00 0.00 0.00 44.72 45.98 2bng s GLY 41 CO 0.07 1.48 1.83 -0.55 0.00 0.00 0.00 173.10 175.93 2bng h ASP 42 N 0.97 0.58 -0.84 1.64 3.45 -1.95 -1.58 116.42 118.69 2bng h ASP 42 Ca -0.51 0.06 -0.41 0.00 0.43 0.00 0.00 57.03 56.60 2bng h ASP 42 Cb 1.30 -0.05 -0.25 0.00 -0.56 0.00 0.00 39.33 39.78 2bng h ASP 42 CO 0.55 0.23 0.47 0.47 -1.57 0.00 0.00 179.24 179.39 2bng n ASP 43 N -4.61 3.69 -4.55 6.45 10.43 -1.26 -2.21 116.55 124.48 2bng n ASP 43 Ca 0.21 -3.58 -0.52 0.00 2.57 0.00 0.00 54.79 53.47 2bng n ASP 43 Cb 0.63 -0.79 -0.06 0.00 1.84 0.00 0.00 41.12 42.74 2bng n ASP 43 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 2bng n LEU 44 N -0.99 1.06 -4.41 0.64 7.94 -0.63 -4.63 117.00 115.98 2bng n LEU 44 Ca 0.52 1.14 -0.35 0.00 -1.11 0.00 0.00 56.01 56.21 2bng n LEU 44 Cb 1.52 -1.13 -0.13 0.00 0.53 0.00 0.00 43.42 44.21 2bng n LEU 44 CO 0.51 -1.45 -0.36 0.68 -1.11 0.00 0.00 177.39 175.66 2bng s VAL 45 N 0.05 3.69 -0.24 1.96 -7.23 -0.44 0.32 120.40 118.50 2bng s VAL 45 Ca 0.81 -0.41 -0.01 0.00 -1.81 0.00 0.00 61.98 60.56 2bng s VAL 45 Cb -0.98 -2.65 0.03 0.00 0.56 0.00 0.00 36.38 33.33 2bng s VAL 45 CO 0.51 0.45 -0.08 -0.47 -0.31 0.00 0.00 175.10 175.20 2bng s TYR 46 N 0.96 3.07 -0.11 2.82 5.04 0.35 -1.36 117.35 128.11 2bng s TYR 46 Ca 0.00 -1.66 0.03 0.00 -2.44 0.00 0.00 57.07 53.00 2bng s TYR 46 Cb -0.15 -2.03 0.01 0.00 0.35 0.00 0.00 41.96 40.14 2bng s TYR 46 CO 0.01 -0.76 -0.20 -1.21 -1.34 0.00 0.00 175.55 172.05 2bng s GLU 47 N 1.29 2.72 -0.44 4.97 2.02 0.36 -0.84 118.70 128.78 2bng s GLU 47 Ca -0.01 -0.75 -0.19 0.00 0.02 0.00 0.00 54.97 54.05 2bng s GLU 47 Cb -0.17 -2.18 0.03 0.00 0.10 0.00 0.00 34.13 31.91 2bng s GLU 47 CO -0.05 0.03 0.52 -0.80 0.02 0.00 0.00 175.26 174.98 2bng s ASN 48 N 0.71 6.24 0.10 -0.19 0.01 -0.55 -0.26 114.94 120.99 2bng s ASN 48 Ca -0.11 -0.61 -0.31 0.00 -0.71 0.00 0.00 52.86 51.11 2bng s ASN 48 Cb -0.16 -2.26 -0.11 0.00 0.41 0.00 0.00 41.25 39.13 2bng s ASN 48 CO 0.02 -0.68 1.84 0.52 -1.51 0.00 0.00 177.10 177.29 2bng n VAL 49 N 5.58 0.41 -0.36 1.60 0.31 -0.17 -0.51 118.33 125.19 2bng n VAL 49 Ca -0.06 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 2bng n VAL 49 Cb 0.47 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 2bng n VAL 49 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bng n GLY 50 N 4.24 1.27 0.10 2.92 0.00 -1.26 -4.83 105.19 107.64 2bng n GLY 50 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2bng n GLY 50 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2bng n PHE 51 N -2.00 0.00 -3.66 1.61 3.72 0.33 -5.11 117.46 112.34 2bng n PHE 51 Ca 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.26 2bng n PHE 51 Cb 0.00 0.01 -0.08 0.00 -0.94 0.00 0.00 39.48 38.47 2bng n PHE 51 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2bng s SER 52 N -3.70 -0.53 -0.05 4.37 1.04 -0.72 -4.98 113.70 109.11 2bng s SER 52 Ca 0.00 0.88 0.01 0.00 0.48 0.00 0.00 55.95 57.32 2bng s SER 52 Cb 0.00 0.88 0.02 0.00 0.10 0.00 0.00 66.02 67.02 2bng s SER 52 CO 0.00 -0.32 -0.08 -0.60 0.98 0.00 0.00 173.24 173.23 2bng s ARG 53 N -0.26 1.18 -0.00 4.02 3.52 -1.26 -1.48 118.95 124.67 2bng s ARG 53 Ca -0.04 -0.23 0.06 0.00 -0.13 0.00 0.00 55.73 55.39 2bng s ARG 53 Cb -0.03 -1.07 -0.02 0.00 -1.56 0.00 0.00 34.95 32.27 2bng s ARG 53 CO 0.03 -0.04 -0.19 0.42 -0.81 0.00 0.00 175.30 174.71 2bng s ILE 54 N 0.83 1.53 -0.16 4.11 1.01 -0.02 -4.99 121.20 123.52 2bng s ILE 54 Ca -0.12 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.62 2bng s ILE 54 Cb -0.15 -1.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.02 2bng s ILE 54 CO 0.01 0.37 -0.11 -0.13 0.00 0.00 0.00 174.94 175.08 2bng s ARG 55 N -0.62 3.36 0.00 2.79 0.52 -1.26 -0.50 118.95 123.24 2bng s ARG 55 Ca 0.07 -0.68 0.00 0.00 -0.52 0.00 0.00 55.73 54.61 2bng s ARG 55 Cb -0.08 -2.72 0.00 0.00 0.52 0.00 0.00 34.95 32.67 2bng s ARG 55 CO -0.00 0.09 0.00 0.41 0.02 0.00 0.00 175.30 175.81 2bng n GLY 56 N 3.91 2.80 0.29 -3.53 0.00 0.15 -4.80 105.19 104.01 2bng n GLY 56 Ca -0.18 -1.17 -0.04 0.00 0.00 0.00 0.00 46.02 44.63 2bng n GLY 56 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bng h GLY 57 N 0.00 1.06 1.16 -0.02 0.00 -1.11 -2.02 103.07 102.14 2bng h GLY 57 Ca 0.00 -0.39 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 2bng h GLY 57 CO 0.00 0.38 -0.08 3.21 0.00 0.00 0.00 176.54 180.04 2bng h ARG 58 N 1.01 0.99 -0.53 4.80 3.08 -1.82 0.23 114.38 122.14 2bng h ARG 58 Ca 0.28 -0.34 -0.12 0.00 0.07 0.00 0.00 59.98 59.87 2bng h ARG 58 Cb -0.10 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 2bng h ARG 58 CO -0.07 1.02 -0.13 -0.09 -1.07 0.00 0.00 179.97 179.64 2bng h ARG 59 N 0.89 1.01 -0.32 0.04 2.43 -1.85 -1.99 114.38 114.59 2bng h ARG 59 Ca 0.14 -0.39 -0.08 0.00 -0.81 0.00 0.00 59.98 58.85 2bng h ARG 59 Cb 0.63 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 2bng h ARG 59 CO 0.04 1.07 -0.11 1.15 -1.51 0.00 0.00 179.97 180.62 2bng h THR 60 N 0.88 1.28 -0.57 0.20 2.02 -1.24 -2.14 112.91 113.35 2bng h THR 60 Ca 0.13 -1.18 0.04 0.00 0.77 0.00 0.00 66.41 66.18 2bng h THR 60 Cb 0.70 1.39 -0.04 0.00 -1.74 0.00 0.00 68.15 68.46 2bng h THR 60 CO 0.05 0.38 0.32 0.00 0.37 0.00 0.00 175.52 176.64 2bng h ALA 61 N 0.78 0.74 0.00 6.16 0.00 -0.52 -0.99 119.26 125.44 2bng h ALA 61 Ca 0.08 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2bng h ALA 61 Cb 0.61 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2bng h ALA 61 CO 0.04 0.01 -0.74 1.79 0.00 0.00 0.00 179.25 180.34 2bng h THR 62 N 0.62 1.34 -0.15 0.00 1.35 -1.38 -0.82 112.91 113.87 2bng h THR 62 Ca 0.25 -2.74 0.02 0.00 -0.55 0.00 0.00 66.41 63.39 2bng h THR 62 Cb 0.10 2.56 -0.02 0.00 -1.73 0.00 0.00 68.15 69.06 2bng h THR 62 CO -0.14 0.73 0.01 0.25 -0.25 0.00 0.00 175.52 176.12 2bng h LEU 63 N 0.00 -0.04 -0.38 3.87 5.85 -1.08 -0.32 115.31 123.21 2bng h LEU 63 Ca -0.01 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2bng h LEU 63 Cb 1.50 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.57 2bng h LEU 63 CO 0.10 0.00 0.10 -0.07 -0.34 0.00 0.00 178.44 178.22 2bng h LEU 64 N 0.06 0.57 -1.03 2.25 3.38 -1.12 -2.61 115.31 116.81 2bng h LEU 64 Ca 0.07 -0.23 0.11 0.00 0.09 0.00 0.00 57.88 57.92 2bng h LEU 64 Cb 0.08 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.60 2bng h LEU 64 CO -0.11 0.65 0.63 -0.09 0.09 0.00 0.00 178.44 179.61 2bng h ARG 65 N 0.47 0.98 -2.57 1.13 2.43 -1.02 -3.30 114.38 112.50 2bng h ARG 65 Ca 0.12 -0.06 -0.33 0.00 -0.81 0.00 0.00 59.98 58.90 2bng h ARG 65 Cb 0.30 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 2bng h ARG 65 CO 0.00 0.65 1.28 0.54 -1.51 0.00 0.00 179.97 180.92 2bng n ARG 66 N -4.59 2.30 -1.34 0.20 1.74 -0.14 -4.94 116.66 109.89 2bng n ARG 66 Ca 0.18 -1.30 0.00 0.00 -0.77 0.00 0.00 57.85 55.96 2bng n ARG 66 Cb 0.33 -2.24 0.00 0.00 -1.02 0.00 0.00 32.46 29.54 2bng n ARG 66 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2bng n GLN 68 N 3.08 -3.68 -0.46 5.56 0.00 -1.25 -4.88 117.38 115.76 2bng n GLN 68 Ca 0.49 2.67 0.00 0.00 -0.00 0.00 0.00 57.00 60.16 2bng n GLN 68 Cb 0.54 -2.91 0.00 0.00 0.00 0.00 0.00 30.24 27.87 2bng n GLN 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2bng n GLY 69 N 0.35 1.73 0.37 1.69 0.00 -1.26 -4.80 105.19 103.27 2bng n GLY 69 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2bng n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bng n ARG 70 N -2.00 0.10 -3.87 1.61 1.74 -1.26 -4.99 116.66 107.99 2bng n ARG 70 Ca 0.00 0.03 -0.21 0.00 -0.77 0.00 0.00 57.85 56.90 2bng n ARG 70 Cb 0.00 -0.91 -0.17 0.00 -1.02 0.00 0.00 32.46 30.36 2bng n ARG 70 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2bng s VAL 71 N -2.08 0.33 0.34 1.55 0.11 -1.26 -4.48 120.40 114.92 2bng s VAL 71 Ca -0.06 0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 59.04 2bng s VAL 71 Cb 0.02 -0.46 -0.05 0.00 -1.53 0.00 0.00 36.38 34.36 2bng s VAL 71 CO 0.09 0.23 0.61 -0.83 -3.33 0.00 0.00 175.10 171.86 2bng s GLY 72 N 1.59 1.69 0.00 6.54 0.00 0.30 -4.55 107.32 112.90 2bng s GLY 72 Ca -0.01 -0.60 0.08 0.00 0.00 0.00 0.00 44.72 44.19 2bng s GLY 72 CO -0.03 -0.48 -0.24 -1.36 0.00 0.00 0.00 173.10 170.98 2bng s PHE 73 N -2.26 2.17 0.06 1.90 0.08 -1.26 -1.46 117.98 117.21 2bng s PHE 73 Ca 0.44 -0.41 0.09 0.00 0.12 0.00 0.00 56.93 57.17 2bng s PHE 73 Cb -0.10 -1.37 -0.03 0.00 -0.57 0.00 0.00 43.02 40.95 2bng s PHE 73 CO 0.34 0.01 -0.25 -1.21 -0.10 0.00 0.00 175.22 174.01 2bng s GLU 74 N -0.77 1.61 -0.03 0.44 2.02 -0.45 -4.37 118.70 117.15 2bng s GLU 74 Ca 0.10 -1.10 -0.01 0.00 0.02 0.00 0.00 54.97 53.98 2bng s GLU 74 Cb -0.09 -1.82 0.03 0.00 0.10 0.00 0.00 34.13 32.35 2bng s GLU 74 CO -0.00 0.46 0.03 0.08 0.02 0.00 0.00 175.26 175.86 2bng s VAL 75 N -0.85 -0.03 -0.17 2.63 1.01 -1.26 -1.40 120.40 120.32 2bng s VAL 75 Ca 0.11 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.36 2bng s VAL 75 Cb -0.10 -0.14 0.03 0.00 0.00 0.00 0.00 36.38 36.17 2bng s VAL 75 CO 0.03 0.13 -0.12 -0.75 0.00 0.00 0.00 175.10 174.39 2bng s LYS 76 N 1.45 2.14 -0.29 2.72 2.47 -0.03 -5.00 119.74 123.21 2bng s LYS 76 Ca -0.04 -0.68 -0.17 0.00 -1.56 0.00 0.00 55.97 53.51 2bng s LYS 76 Cb -0.13 -2.23 -0.02 0.00 -1.46 0.00 0.00 37.83 33.98 2bng s LYS 76 CO -0.03 -0.33 0.49 0.42 0.16 0.00 0.00 175.35 176.06 2bng s ILE 77 N 1.45 5.07 -0.05 5.43 1.01 -1.26 -0.80 121.20 132.05 2bng s ILE 77 Ca 0.02 0.69 -0.12 0.00 0.00 0.00 0.00 60.65 61.24 2bng s ILE 77 Cb -0.14 -3.84 -0.30 0.00 0.01 0.00 0.00 42.46 38.18 2bng s ILE 77 CO -0.09 0.02 0.66 0.45 0.00 0.00 0.00 174.94 175.97 2bng h HIS 78 N 8.16 0.70 -3.18 3.97 3.86 -0.70 -3.48 115.15 124.47 2bng h HIS 78 Ca -0.29 -0.51 -0.14 0.00 -1.16 0.00 0.00 60.37 58.27 2bng h HIS 78 Cb 1.14 -0.03 -0.22 0.00 1.06 0.00 0.00 27.41 29.36 2bng h HIS 78 CO 0.75 1.67 -0.38 1.03 0.86 0.00 0.00 177.93 181.86 2bng s ARG 79 N -2.57 0.48 -0.16 2.45 0.52 -1.12 -5.00 118.95 113.55 2bng s ARG 79 Ca -0.16 -0.03 -0.13 0.00 -0.52 0.00 0.00 55.73 54.89 2bng s ARG 79 Cb 0.05 0.21 0.04 0.00 0.52 0.00 0.00 34.95 35.78 2bng s ARG 79 CO 0.85 -0.11 0.41 -1.50 0.02 0.00 0.00 175.30 174.96 2bng s ILE 80 N -0.77 -0.01 0.22 1.52 2.07 -1.26 -0.35 121.20 122.62 2bng s ILE 80 Ca -0.09 0.02 -0.19 0.00 -1.41 0.00 0.00 60.65 58.98 2bng s ILE 80 Cb -0.05 -0.58 0.03 0.00 0.13 0.00 0.00 42.46 42.00 2bng s ILE 80 CO 0.02 0.01 0.59 -0.83 -1.91 0.00 0.00 174.94 172.82 2bng s GLY 81 N 0.46 -0.15 0.13 1.50 0.00 -0.70 -4.99 107.32 103.57 2bng s GLY 81 Ca -0.02 -0.16 0.07 0.00 0.00 0.00 0.00 44.72 44.61 2bng s GLY 81 CO -0.02 -0.16 -0.17 0.00 0.00 0.00 0.00 173.10 172.75 2bng s ALA 82 N -3.87 1.72 -0.39 3.20 0.00 -1.26 -0.53 121.76 120.63 2bng s ALA 82 Ca 0.09 -1.32 0.01 0.00 0.00 0.00 0.00 51.96 50.74 2bng s ALA 82 Cb -0.03 -0.16 0.14 0.00 0.00 0.00 0.00 23.12 23.08 2bng s ALA 82 CO -0.01 0.22 0.24 0.34 0.00 0.00 0.00 175.76 176.55 2bng s ASP 83 N -2.31 3.06 1.96 0.00 2.15 0.21 -4.98 116.67 116.76 2bng s ASP 83 Ca 0.10 -2.45 0.00 0.00 0.43 0.00 0.00 52.55 50.62 2bng s ASP 83 Cb -0.07 -0.63 0.00 0.00 -0.30 0.00 0.00 42.92 41.92 2bng s ASP 83 CO 0.04 -0.28 0.00 0.61 -0.17 0.00 0.00 175.17 175.38 2bng n GLY 84 N 3.72 4.27 0.14 2.66 0.00 -1.26 -1.05 105.19 113.67 2bng n GLY 84 Ca 0.13 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.39 2bng n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bng h ALA 85 N -0.96 1.00 -2.65 4.61 0.00 -1.92 -3.41 119.26 115.92 2bng h ALA 85 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 2bng h ALA 85 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2bng h ALA 85 CO 0.00 0.00 0.33 0.00 0.00 0.00 0.00 179.25 179.58 2bng s ALA 86 N -3.13 3.31 -0.06 0.00 0.00 -0.21 -1.85 121.76 119.81 2bng s ALA 86 Ca 0.10 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.65 2bng s ALA 86 Cb 0.10 -3.18 0.01 0.00 0.00 0.00 0.00 23.12 20.05 2bng s ALA 86 CO 0.62 0.21 -0.15 0.08 0.00 0.00 0.00 175.76 176.52 2bng s VAL 87 N -1.32 1.29 0.10 0.00 1.01 -0.05 0.63 120.40 122.07 2bng s VAL 87 Ca 0.43 -0.60 0.08 0.00 0.00 0.00 0.00 61.98 61.89 2bng s VAL 87 Cb -0.23 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2bng s VAL 87 CO 0.29 0.38 -0.17 -0.76 0.00 0.00 0.00 175.10 174.84 2bng s LEU 88 N 0.36 2.74 -0.08 3.92 1.02 0.31 -0.24 118.68 126.71 2bng s LEU 88 Ca -0.10 -0.51 -0.04 0.00 0.02 0.00 0.00 54.13 53.50 2bng s LEU 88 Cb -0.14 -1.58 0.04 0.00 0.02 0.00 0.00 46.19 44.53 2bng s LEU 88 CO 0.03 0.19 0.19 0.28 0.02 0.00 0.00 176.35 177.06 2bng s THR 89 N -1.12 -0.06 -0.26 5.49 -1.32 -0.16 -1.71 115.64 116.50 2bng s THR 89 Ca 0.18 0.17 -0.04 0.00 -1.21 0.00 0.00 61.69 60.79 2bng s THR 89 Cb -0.11 -0.30 0.01 0.00 -1.51 0.00 0.00 72.50 70.59 2bng s THR 89 CO 0.10 0.07 -0.01 -0.70 -2.21 0.00 0.00 174.62 171.87 2bng s GLU 90 N 1.26 3.05 0.19 7.08 2.12 0.52 -2.06 118.70 130.86 2bng s GLU 90 Ca -0.09 -0.86 0.02 0.00 0.36 0.00 0.00 54.97 54.41 2bng s GLU 90 Cb -0.11 -3.13 -0.05 0.00 0.26 0.00 0.00 34.13 31.10 2bng s GLU 90 CO -0.07 -0.37 0.01 1.03 -0.54 0.00 0.00 175.26 175.31 2bng s ARG 91 N 1.42 1.16 -0.15 4.30 0.52 0.56 0.10 118.95 126.86 2bng s ARG 91 Ca 0.02 -1.57 -0.00 0.00 -0.52 0.00 0.00 55.73 53.66 2bng s ARG 91 Cb -0.16 -0.31 -0.01 0.00 0.52 0.00 0.00 34.95 34.99 2bng s ARG 91 CO -0.02 -0.13 -0.13 0.99 0.02 0.00 0.00 175.30 176.03 2bng s THR 92 N -3.63 2.88 0.28 0.02 2.01 0.02 -1.59 115.64 115.63 2bng s THR 92 Ca 0.25 -0.70 0.09 0.00 0.31 0.00 0.00 61.69 61.64 2bng s THR 92 Cb 0.06 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.31 2bng s THR 92 CO 0.05 0.51 0.08 -1.81 -0.69 0.00 0.00 174.62 172.76 2bng s ASP 93 N 0.71 4.78 -0.03 3.53 -0.00 -0.16 -0.85 116.67 124.65 2bng s ASP 93 Ca -0.06 -0.60 -0.01 0.00 -0.00 0.00 0.00 52.55 51.87 2bng s ASP 93 Cb -0.15 -0.92 0.02 0.00 -0.00 0.00 0.00 42.92 41.87 2bng s ASP 93 CO 0.02 -0.09 0.06 0.00 -0.00 0.00 0.00 175.17 175.15 2bng s ALA 94 N -2.32 -0.08 -0.15 5.23 0.00 -0.49 -1.78 121.76 122.17 2bng s ALA 94 Ca 0.34 0.28 -0.06 0.00 0.00 0.00 0.00 51.96 52.52 2bng s ALA 94 Cb -0.06 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 2bng s ALA 94 CO 0.22 -0.07 0.05 -0.51 0.00 0.00 0.00 175.76 175.45 2bng s LEU 95 N 0.55 3.81 -0.15 0.00 1.43 -0.06 -1.35 118.68 122.92 2bng s LEU 95 Ca -0.04 0.14 0.02 0.00 -1.03 0.00 0.00 54.13 53.21 2bng s LEU 95 Cb -0.06 -1.94 0.02 0.00 0.03 0.00 0.00 46.19 44.24 2bng s LEU 95 CO -0.02 0.25 -0.19 -0.63 0.23 0.00 0.00 176.35 175.99 2bng s ILE 96 N -0.12 1.92 -0.29 -0.59 -1.09 -0.54 -0.80 121.20 119.70 2bng s ILE 96 Ca 0.07 -0.88 0.01 0.00 -2.23 0.00 0.00 60.65 57.62 2bng s ILE 96 Cb -0.12 -1.73 0.09 0.00 -1.58 0.00 0.00 42.46 39.12 2bng s ILE 96 CO 0.01 0.52 0.05 -0.63 -1.23 0.00 0.00 174.94 173.66 2bng s ILE 97 N 1.09 1.36 0.00 2.92 1.01 -0.25 -0.54 121.20 126.80 2bng s ILE 97 Ca -0.01 -1.54 0.00 0.00 0.00 0.00 0.00 60.65 59.09 2bng s ILE 97 Cb -0.14 -1.92 0.00 0.00 0.01 0.00 0.00 42.46 40.41 2bng s ILE 97 CO -0.07 -0.49 0.00 0.61 0.00 0.00 0.00 174.94 174.99 2bng n GLY 98 N 4.67 3.38 0.13 6.18 0.00 -1.26 -1.50 105.19 116.78 2bng n GLY 98 Ca -0.03 0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.30 2bng n GLY 98 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2bng n PRO 99 N 14.00 0.56 -2.84 1.61 -0.04 -1.26 -4.79 135.00 142.24 2bng n PRO 99 Ca 0.00 -0.27 -0.42 0.00 -0.04 0.00 0.00 63.50 62.77 2bng n PRO 99 Cb 0.00 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 31.93 2bng n PRO 99 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2bng s LEU 100 N -2.63 4.13 -0.15 1.53 2.96 -0.56 -4.78 118.68 119.17 2bng s LEU 100 Ca 0.23 1.17 0.02 0.00 -0.22 0.00 0.00 54.13 55.33 2bng s LEU 100 Cb 0.19 -3.29 0.01 0.00 0.50 0.00 0.00 46.19 43.61 2bng s LEU 100 CO 0.54 -0.50 -0.21 -0.60 -1.32 0.00 0.00 176.35 174.26 2bng s ARG 101 N 2.62 2.98 -0.23 1.98 3.52 -1.26 -1.09 118.95 127.47 2bng s ARG 101 Ca 0.38 -0.84 0.00 0.00 -0.13 0.00 0.00 55.73 55.15 2bng s ARG 101 Cb -0.16 -2.46 0.03 0.00 -1.56 0.00 0.00 34.95 30.80 2bng s ARG 101 CO 0.09 -0.08 -0.12 0.08 -0.81 0.00 0.00 175.30 174.46 2bng s VAL 102 N 0.99 2.42 -0.04 7.11 1.01 0.02 -3.98 120.40 127.94 2bng s VAL 102 Ca -0.03 -1.17 0.06 0.00 0.00 0.00 0.00 61.98 60.84 2bng s VAL 102 Cb -0.15 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 2bng s VAL 102 CO -0.06 0.24 -0.21 -1.58 0.00 0.00 0.00 175.10 173.49 2bng s GLN 103 N 1.25 2.33 0.10 2.72 0.74 -1.26 -0.88 119.66 124.66 2bng s GLN 103 Ca -0.01 -0.83 -0.25 0.00 0.05 0.00 0.00 55.36 54.32 2bng s GLN 103 Cb -0.16 -2.20 0.07 0.00 1.10 0.00 0.00 33.01 31.82 2bng s GLN 103 CO -0.07 0.57 0.62 -0.59 -0.55 0.00 0.00 175.29 175.27 2bng s PHE 104 N -0.61 -0.57 0.41 1.67 -0.12 -0.73 -4.30 117.98 113.73 2bng s PHE 104 Ca 0.09 0.56 -0.22 0.00 -0.05 0.00 0.00 56.93 57.32 2bng s PHE 104 Cb -0.11 0.52 -0.10 0.00 -0.63 0.00 0.00 43.02 42.70 2bng s PHE 104 CO 0.00 -0.78 0.97 1.67 -0.05 0.00 0.00 175.22 177.03 2bng s TRP 105 N -3.00 3.34 -0.01 3.49 1.48 -1.26 -0.99 118.94 122.00 2bng s TRP 105 Ca -0.03 1.64 0.01 0.00 -1.06 0.00 0.00 56.10 56.66 2bng s TRP 105 Cb -0.01 -2.91 0.01 0.00 -1.16 0.00 0.00 33.47 29.40 2bng s TRP 105 CO -0.06 -0.18 -0.02 0.08 -4.06 0.00 0.00 176.95 172.71 2bng s VAL 106 N -2.01 0.21 -0.23 -0.66 1.01 -0.62 -4.60 120.40 113.49 2bng s VAL 106 Ca 0.60 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 62.46 2bng s VAL 106 Cb -0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 2bng s VAL 106 CO 0.17 0.08 0.04 0.00 0.00 0.00 0.00 175.10 175.39 2bng s GLY 108 N 1.47 1.60 -0.08 0.00 0.00 -0.87 -0.01 107.32 109.43 2bng s GLY 108 Ca 0.05 -0.93 0.04 0.00 0.00 0.00 0.00 44.72 43.88 2bng s GLY 108 CO 0.02 -0.66 -0.19 -1.34 0.00 0.00 0.00 173.10 170.93 2bng s VAL 109 N -0.64 2.56 0.19 1.40 -7.23 0.16 -0.99 120.40 115.84 2bng s VAL 109 Ca 0.10 -0.87 0.09 0.00 -1.81 0.00 0.00 61.98 59.48 2bng s VAL 109 Cb -0.11 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.79 2bng s VAL 109 CO 0.01 0.56 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.82 2bng s PHE 110 N -0.10 1.89 -0.07 2.82 0.40 0.67 -0.87 117.98 122.72 2bng s PHE 110 Ca -0.04 -0.47 0.04 0.00 -0.60 0.00 0.00 56.93 55.86 2bng s PHE 110 Cb -0.14 -0.91 0.00 0.00 0.51 0.00 0.00 43.02 42.48 2bng s PHE 110 CO 0.04 0.40 -0.18 -1.21 0.70 0.00 0.00 175.22 174.96 2bng s GLU 111 N -3.07 2.21 -0.06 0.44 2.02 -0.73 -0.87 118.70 118.63 2bng s GLU 111 Ca 0.19 -0.66 0.05 0.00 0.02 0.00 0.00 54.97 54.57 2bng s GLU 111 Cb -0.05 -1.79 -0.01 0.00 0.10 0.00 0.00 34.13 32.39 2bng s GLU 111 CO 0.08 0.17 -0.21 0.54 0.02 0.00 0.00 175.26 175.86 2bng s VAL 112 N 0.30 1.79 -0.22 2.63 0.11 -0.77 -0.36 120.40 123.88 2bng s VAL 112 Ca -0.12 -0.91 -0.01 0.00 -2.93 0.00 0.00 61.98 58.02 2bng s VAL 112 Cb -0.15 -1.53 0.06 0.00 -1.53 0.00 0.00 36.38 33.23 2bng s VAL 112 CO 0.05 0.50 -0.02 -0.62 -3.33 0.00 0.00 175.10 171.68 2bng s ASP 113 N 0.03 3.45 -0.77 3.54 2.15 0.85 -4.77 116.67 121.16 2bng s ASP 113 Ca -0.07 -1.02 -0.02 0.00 0.43 0.00 0.00 52.55 51.87 2bng s ASP 113 Cb -0.14 -0.95 0.00 0.00 -0.30 0.00 0.00 42.92 41.54 2bng s ASP 113 CO 0.04 -0.26 0.65 -0.67 -0.17 0.00 0.00 175.17 174.76 2bng n ASP 114 N 4.82 -2.97 0.00 -0.34 -0.08 -1.26 -1.55 116.55 115.17 2bng n ASP 114 Ca -0.11 -0.36 0.00 0.00 -1.51 0.00 0.00 54.79 52.81 2bng n ASP 114 Cb 0.45 -3.30 0.00 0.00 2.34 0.00 0.00 41.12 40.61 2bng n ASP 114 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2bng n GLY 115 N -1.20 1.26 3.67 0.27 0.00 -1.26 -4.98 105.19 102.95 2bng n GLY 115 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 2bng n GLY 115 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bng s ARG 116 N -0.15 2.92 -0.25 1.61 0.52 -0.60 -4.85 118.95 118.15 2bng s ARG 116 Ca 0.00 -0.46 -0.27 0.00 -0.52 0.00 0.00 55.73 54.48 2bng s ARG 116 Cb 0.00 -2.75 0.00 0.00 0.52 0.00 0.00 34.95 32.72 2bng s ARG 116 CO 0.00 0.68 0.93 0.42 0.02 0.00 0.00 175.30 177.36 2bng s ILE 117 N -0.92 4.73 -0.07 1.52 1.01 0.61 -0.10 121.20 127.98 2bng s ILE 117 Ca 0.14 1.72 0.17 0.00 0.00 0.00 0.00 60.65 62.68 2bng s ILE 117 Cb -0.11 -4.23 -0.25 0.00 0.01 0.00 0.00 42.46 37.87 2bng s ILE 117 CO 0.04 -0.18 0.28 0.35 0.00 0.00 0.00 174.94 175.43 2bng n THR 118 N 5.39 0.37 -4.45 2.92 -2.24 0.51 -0.56 114.28 116.22 2bng n THR 118 Ca 0.09 -0.50 -0.22 0.00 -2.27 0.00 0.00 64.05 61.14 2bng n THR 118 Cb 0.47 -0.12 -0.16 0.00 -2.10 0.00 0.00 70.33 68.42 2bng n THR 118 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2bng s LEU 119 N -4.56 1.72 -0.20 3.22 2.96 -1.12 -1.33 118.68 119.37 2bng s LEU 119 Ca -0.07 -0.22 -0.04 0.00 -0.22 0.00 0.00 54.13 53.58 2bng s LEU 119 Cb 0.09 -0.64 0.07 0.00 0.50 0.00 0.00 46.19 46.21 2bng s LEU 119 CO 0.72 0.06 0.08 0.86 -1.32 0.00 0.00 176.35 176.75 2bng s TRP 120 N 0.34 0.52 -0.26 5.38 -0.00 -0.46 -1.78 118.94 122.68 2bng s TRP 120 Ca -0.06 -0.62 0.01 0.00 -0.00 0.00 0.00 56.10 55.43 2bng s TRP 120 Cb -0.11 -0.87 0.07 0.00 -0.00 0.00 0.00 33.47 32.57 2bng s TRP 120 CO 0.01 -0.60 -0.02 0.50 -0.00 0.00 0.00 176.95 176.84 2bng s ARG 121 N 2.03 1.47 -0.17 5.86 3.52 -0.05 -0.49 118.95 131.12 2bng s ARG 121 Ca 0.03 -1.14 -0.08 0.00 -0.13 0.00 0.00 55.73 54.41 2bng s ARG 121 Cb -0.16 -2.60 -0.04 0.00 -1.56 0.00 0.00 34.95 30.58 2bng s ARG 121 CO -0.14 -0.71 0.08 -0.51 -0.81 0.00 0.00 175.30 173.22 2bng s ASP 122 N 1.35 5.82 -0.09 -2.12 1.01 0.64 -0.67 116.67 122.60 2bng s ASP 122 Ca -0.01 0.16 -0.01 0.00 0.71 0.00 0.00 52.55 53.40 2bng s ASP 122 Cb -0.19 -1.97 -0.03 0.00 1.01 0.00 0.00 42.92 41.74 2bng s ASP 122 CO -0.09 0.21 -0.03 -0.31 0.21 0.00 0.00 175.17 175.16 2bng s TYR 123 N 0.13 3.05 0.31 4.23 1.51 0.99 -1.00 117.35 126.57 2bng s TYR 123 Ca 0.06 0.03 -0.16 0.00 -1.01 0.00 0.00 57.07 55.98 2bng s TYR 123 Cb -0.12 -1.80 0.02 0.00 -0.11 0.00 0.00 41.96 39.96 2bng s TYR 123 CO 0.00 0.31 0.67 -0.59 -1.11 0.00 0.00 175.55 174.83 2bng s PHE 124 N -0.58 0.12 -0.11 2.71 -0.71 -1.26 -1.54 117.98 116.60 2bng s PHE 124 Ca 0.09 -0.61 0.01 0.00 -1.04 0.00 0.00 56.93 55.39 2bng s PHE 124 Cb -0.12 0.58 -0.01 0.00 -1.21 0.00 0.00 43.02 42.26 2bng s PHE 124 CO 0.02 -1.29 -0.17 0.34 -1.34 0.00 0.00 175.22 172.79 2bng s ASP 125 N -3.01 3.73 0.37 1.98 2.15 -1.26 -5.01 116.67 115.61 2bng s ASP 125 Ca 0.16 -0.39 0.08 0.00 0.43 0.00 0.00 52.55 52.84 2bng s ASP 125 Cb -0.04 -1.48 0.73 0.00 -0.30 0.00 0.00 42.92 41.83 2bng s ASP 125 CO 0.10 0.18 1.89 -0.37 -0.17 0.00 0.00 175.17 176.80 2bng h VAL 126 N 5.41 1.19 0.16 1.11 -1.51 -2.00 -2.96 116.25 117.64 2bng h VAL 126 Ca -0.25 -0.83 -0.01 0.00 -1.23 0.00 0.00 66.70 64.38 2bng h VAL 126 Cb 1.22 1.20 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 2bng h VAL 126 CO 0.53 0.26 -0.08 0.22 -1.23 0.00 0.00 177.57 177.27 2bng h TYR 127 N 0.27 -0.20 0.00 5.19 3.20 -2.05 0.27 116.97 123.66 2bng h TYR 127 Ca 0.05 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2bng h TYR 127 Cb 0.40 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.73 2bng h TYR 127 CO 0.01 0.01 0.00 -3.47 -1.64 0.00 0.00 178.16 173.07 2bng n ASP 128 N -5.11 0.00 0.00 -2.11 2.03 -1.12 -0.62 116.55 109.62 2bng n ASP 128 Ca -0.09 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.22 2bng n ASP 128 Cb 0.17 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.57 2bng n ASP 128 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2bng n PHE 130 N 0.59 0.00 -0.17 -0.67 7.35 0.96 -1.09 117.46 124.42 2bng n PHE 130 Ca 0.00 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.68 2bng n PHE 130 Cb 0.00 0.00 0.21 0.00 0.35 0.00 0.00 39.48 40.04 2bng n PHE 130 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 2bng h LYS 131 N 0.00 0.90 -0.42 -4.13 1.57 -1.11 -1.18 116.57 112.20 2bng h LYS 131 Ca 0.00 -0.12 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 2bng h LYS 131 Cb 0.00 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2bng h LYS 131 CO 0.00 0.71 -0.08 0.78 -0.57 0.00 0.00 179.45 180.28 2bng h GLY 132 N 0.99 0.79 0.98 3.86 0.00 -1.30 -2.11 103.07 106.29 2bng h GLY 132 Ca 0.22 -0.57 -0.09 0.00 0.00 0.00 0.00 47.33 46.89 2bng h GLY 132 CO -0.03 0.53 -0.10 -2.00 0.00 0.00 0.00 176.54 174.94 2bng h LEU 133 N 0.67 0.77 -0.68 3.11 5.85 -1.70 -0.83 115.31 122.50 2bng h LEU 133 Ca 0.12 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 2bng h LEU 133 Cb 0.54 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2bng h LEU 133 CO 0.03 0.96 0.18 -0.07 -0.34 0.00 0.00 178.44 179.20 2bng h LEU 134 N 0.57 1.01 -0.67 2.25 3.38 -1.14 0.14 115.31 120.85 2bng h LEU 134 Ca 0.10 -0.22 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 2bng h LEU 134 Cb 0.63 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2bng h LEU 134 CO 0.04 0.97 -0.28 -0.09 0.09 0.00 0.00 178.44 179.18 2bng h ARG 135 N 1.00 0.74 0.00 1.13 2.43 -1.35 0.04 114.38 118.37 2bng h ARG 135 Ca 0.21 -0.32 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2bng h ARG 135 Cb 0.34 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2bng h ARG 135 CO -0.00 0.93 -0.00 0.78 -1.51 0.00 0.00 179.97 180.17 2bng h GLY 136 N 0.97 -0.00 0.99 2.80 0.00 -0.72 -0.51 103.07 106.60 2bng h GLY 136 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 2bng h GLY 136 CO 0.07 -0.00 0.34 1.41 0.00 0.00 0.00 176.54 178.35 2bng h LEU 137 N -0.04 0.70 -0.75 3.11 3.38 -0.64 -2.07 115.31 119.01 2bng h LEU 137 Ca -0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2bng h LEU 137 Cb 0.04 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 2bng h LEU 137 CO 0.00 0.57 0.43 0.58 0.09 0.00 0.00 178.44 180.11 2bng h VAL 138 N 0.78 1.22 0.00 1.22 2.07 -0.90 -2.79 116.25 117.84 2bng h VAL 138 Ca 0.21 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 2bng h VAL 138 Cb 0.01 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 29.98 2bng h VAL 138 CO -0.04 0.24 -0.13 0.00 0.02 0.00 0.00 177.57 177.67 2bng h ALA 139 N 1.22 1.11 -0.06 1.67 0.00 -0.66 0.35 119.26 122.89 2bng h ALA 139 Ca 0.26 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.08 2bng h ALA 139 Cb 0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2bng h ALA 139 CO -0.05 0.16 0.15 -0.07 0.00 0.00 0.00 179.25 179.44 2bng h LEU 140 N 0.00 0.00 0.00 0.00 4.07 -1.09 -2.47 115.31 115.81 2bng h LEU 140 Ca -0.00 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.89 2bng h LEU 140 Cb 0.49 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 2bng h LEU 140 CO 0.02 0.00 -1.26 0.52 -1.08 0.00 0.00 178.44 176.64 2bng n VAL 141 N -3.33 0.26 -3.90 1.22 0.31 -0.57 -4.80 118.33 107.52 2bng n VAL 141 Ca -0.01 -0.12 -0.30 0.00 -0.01 0.00 0.00 64.34 63.90 2bng n VAL 141 Cb 0.23 -0.75 -0.13 0.00 -0.91 0.00 0.00 33.84 32.29 2bng n VAL 141 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2bng s VAL 142 N -2.09 2.87 -1.28 2.52 1.01 0.01 -4.96 120.40 118.48 2bng s VAL 142 Ca -0.05 -3.65 0.00 0.00 0.00 0.00 0.00 61.98 58.28 2bng s VAL 142 Cb 0.01 -2.93 0.00 0.00 0.00 0.00 0.00 36.38 33.47 2bng s VAL 142 CO 0.12 -0.89 0.64 -2.65 0.00 0.00 0.00 175.10 172.32 2bng n PRO 143 N 2.71 0.00 0.00 2.72 -0.02 -0.94 -0.73 135.00 138.74 2bng n PRO 143 Ca 0.11 0.19 0.14 0.00 -2.02 0.00 0.00 63.50 61.92 2bng n PRO 143 Cb 0.34 -1.54 0.55 0.00 -0.02 0.00 0.00 33.50 32.83 2bng n PRO 143 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2bng n SER 144 N -1.14 0.61 -0.99 2.55 2.88 -1.26 -3.87 113.62 112.40 2bng n SER 144 Ca 0.00 -0.65 0.08 0.00 -1.33 0.00 0.00 58.87 56.96 2bng n SER 144 Cb 0.04 -0.02 0.24 0.00 -0.75 0.00 0.00 64.21 63.72 2bng n SER 144 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2bng n LEU 145 N -0.87 3.72 -4.73 2.46 4.77 0.09 -4.99 117.00 117.44 2bng n LEU 145 Ca 0.14 -2.39 -0.41 0.00 -0.03 0.00 0.00 56.01 53.31 2bng n LEU 145 Cb 0.30 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 2bng n LEU 145 CO 0.24 0.75 0.93 -0.75 -1.33 0.00 0.00 177.39 177.23 2bng s LYS 146 N -1.71 4.44 0.65 3.23 2.20 -1.25 -4.76 119.74 122.53 2bng s LYS 146 Ca 0.37 1.93 -0.18 0.00 -0.36 0.00 0.00 55.97 57.73 2bng s LYS 146 Cb 0.24 -3.25 -0.01 0.00 -1.51 0.00 0.00 37.83 33.31 2bng s LYS 146 CO 0.17 -0.20 1.27 0.00 -0.36 0.00 0.00 175.35 176.23 2bng s ALA 147 N 0.30 2.38 0.07 3.13 0.00 -1.26 -5.06 121.76 121.31 2bng s ALA 147 Ca 0.56 1.14 0.01 0.00 0.00 0.00 0.00 51.96 53.67 2bng s ALA 147 Cb -0.34 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 2bng s ALA 147 CO 0.35 -1.55 -0.06 0.95 0.00 0.00 0.00 175.76 175.45 2bng s THR 148 N -1.50 0.54 -2.72 0.00 -4.23 -1.26 -5.08 115.64 101.39 2bng s THR 148 Ca 0.81 -1.53 0.22 0.00 -1.18 0.00 0.00 61.69 60.01 2bng s THR 148 Cb -0.35 -1.16 0.17 0.00 1.34 0.00 0.00 72.50 72.50 2bng s THR 148 CO 0.39 -0.68 1.19 0.18 -0.54 0.00 0.00 174.62 175.16