#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1phn s LYS 2 N 0.00 4.38 0.16 2.12 2.20 -1.26 -4.86 119.74 122.48 1phn s LYS 2 Ca 0.00 0.97 -0.07 0.00 -0.36 0.00 0.00 55.97 56.51 1phn s LYS 2 Cb 0.00 -3.50 -0.02 0.00 -1.51 0.00 0.00 37.83 32.80 1phn s LYS 2 CO 0.00 -0.11 0.23 0.95 -0.36 0.00 0.00 175.35 176.07 1phn s THR 3 N 1.38 0.07 0.45 3.43 -4.23 -1.26 -3.81 115.64 111.68 1phn s THR 3 Ca 0.39 -1.51 0.13 0.00 -1.18 0.00 0.00 61.69 59.52 1phn s THR 3 Cb -0.18 -1.89 0.30 0.00 1.34 0.00 0.00 72.50 72.08 1phn s THR 3 CO 0.17 -0.33 2.04 -0.65 -0.54 0.00 0.00 174.62 175.30 1phn h PRO 4 N 2.61 0.34 0.01 3.99 0.11 -1.80 -0.12 132.00 137.13 1phn h PRO 4 Ca -0.32 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.72 1phn h PRO 4 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1phn h PRO 4 CO 0.51 0.23 -0.20 0.82 -0.21 0.00 0.00 178.00 179.15 1phn h ILE 5 N 0.35 1.59 0.00 4.15 2.04 -1.95 -2.77 117.51 120.92 1phn h ILE 5 Ca 0.18 -2.00 -0.06 0.00 1.00 0.00 0.00 64.86 63.98 1phn h ILE 5 Cb 0.29 2.89 -0.01 0.00 -0.74 0.00 0.00 36.82 39.24 1phn h ILE 5 CO -0.04 0.54 -0.30 0.71 0.00 0.00 0.00 178.15 179.06 1phn h THR 6 N -0.61 1.19 -0.45 -0.27 1.35 -1.81 -1.94 112.91 110.37 1phn h THR 6 Ca -0.03 -1.02 -0.13 0.00 -0.55 0.00 0.00 66.41 64.68 1phn h THR 6 Cb 0.99 1.55 -0.01 0.00 -1.73 0.00 0.00 68.15 68.95 1phn h THR 6 CO 0.04 0.29 -0.23 -0.33 -0.25 0.00 0.00 175.52 175.04 1phn h GLU 7 N 0.00 0.95 -0.79 4.72 5.08 -1.10 0.28 114.58 123.73 1phn h GLU 7 Ca -0.00 -0.42 0.01 0.00 -1.00 0.00 0.00 59.36 57.95 1phn h GLU 7 Cb 0.53 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 1phn h GLU 7 CO 0.04 1.08 0.52 0.00 -1.00 0.00 0.00 179.01 179.65 1phn h ALA 8 N 0.84 1.00 -0.30 3.43 0.00 -1.11 -0.35 119.26 122.77 1phn h ALA 8 Ca 0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1phn h ALA 8 Cb 0.80 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1phn h ALA 8 CO 0.07 0.41 0.02 0.82 0.00 0.00 0.00 179.25 180.56 1phn h ILE 9 N 1.07 1.25 -0.85 0.00 2.04 -1.15 -2.41 117.51 117.45 1phn h ILE 9 Ca 0.29 -0.89 0.06 0.00 1.00 0.00 0.00 64.86 65.32 1phn h ILE 9 Cb -0.12 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 1phn h ILE 9 CO -0.06 0.29 0.53 0.00 0.00 0.00 0.00 178.15 178.90 1phn h ALA 10 N 0.85 1.16 -0.15 1.87 0.00 -0.56 0.33 119.26 122.77 1phn h ALA 10 Ca 0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1phn h ALA 10 Cb 0.40 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1phn h ALA 10 CO 0.01 0.28 0.08 0.00 0.00 0.00 0.00 179.25 179.63 1phn h ALA 11 N 1.39 0.19 0.19 0.00 0.00 -0.90 0.43 119.26 120.56 1phn h ALA 11 Ca 0.37 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 1phn h ALA 11 Cb 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1phn h ALA 11 CO -0.16 -0.28 -0.09 0.00 0.00 0.00 0.00 179.25 178.71 1phn h ALA 12 N 0.99 -0.26 -0.64 0.00 0.00 -0.91 -2.94 119.26 115.49 1phn h ALA 12 Ca 0.05 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.91 1phn h ALA 12 Cb 0.06 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1phn h ALA 12 CO -0.01 -0.58 0.42 0.22 0.00 0.00 0.00 179.25 179.31 1phn h ASP 13 N -0.40 0.58 0.38 0.00 3.58 -0.90 -1.07 116.42 118.58 1phn h ASP 13 Ca -0.03 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.35 1phn h ASP 13 Cb 0.31 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.23 1phn h ASP 13 CO 0.04 0.38 -0.35 -1.13 -2.88 0.00 0.00 179.24 175.30 1phn h ASN 14 N 0.66 0.00 -0.54 2.28 -1.24 -0.74 -2.29 115.58 113.71 1phn h ASN 14 Ca 0.27 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.28 1phn h ASN 14 Cb 0.23 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.28 1phn h ASN 14 CO -0.08 0.35 0.00 0.00 -1.29 0.00 0.00 177.43 176.41 1phn n GLN 15 N -4.06 2.47 -2.41 6.67 6.02 -0.49 -4.95 117.38 120.62 1phn n GLN 15 Ca -0.02 -2.26 -0.21 0.00 -0.01 0.00 0.00 57.00 54.51 1phn n GLN 15 Cb 0.40 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.14 1phn n GLN 15 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1phn n GLY 16 N 1.51 -0.50 3.46 1.08 0.00 -0.70 -4.99 105.19 105.05 1phn n GLY 16 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 1phn n GLY 16 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1phn s ARG 17 N -5.05 1.66 0.87 1.61 1.70 -0.71 -5.00 118.95 114.02 1phn s ARG 17 Ca 0.00 -1.92 -0.12 0.00 -0.47 0.00 0.00 55.73 53.23 1phn s ARG 17 Cb -0.00 -0.93 0.11 0.00 -0.57 0.00 0.00 34.95 33.56 1phn s ARG 17 CO 0.00 -0.17 1.10 -0.06 -1.08 0.00 0.00 175.30 175.10 1phn s PHE 18 N -3.25 2.54 0.43 5.89 0.40 -1.26 -4.14 117.98 118.59 1phn s PHE 18 Ca 0.36 1.14 -0.25 0.00 -0.60 0.00 0.00 56.93 57.58 1phn s PHE 18 Cb 0.09 -3.18 -0.08 0.00 0.51 0.00 0.00 43.02 40.35 1phn s PHE 18 CO 0.15 -2.18 1.30 -0.51 0.70 0.00 0.00 175.22 174.69 1phn s LEU 19 N -6.03 4.14 0.50 -0.37 1.43 -1.26 -4.89 118.68 112.19 1phn s LEU 19 Ca 0.62 2.65 0.06 0.00 -1.03 0.00 0.00 54.13 56.43 1phn s LEU 19 Cb -0.16 -3.99 0.01 0.00 0.03 0.00 0.00 46.19 42.08 1phn s LEU 19 CO 0.55 -0.97 0.35 -0.94 0.23 0.00 0.00 176.35 175.57 1phn s SER 20 N -0.82 4.65 0.54 2.29 1.04 -1.26 -4.98 113.70 115.15 1phn s SER 20 Ca 0.60 -1.16 0.25 0.00 0.48 0.00 0.00 55.95 56.12 1phn s SER 20 Cb -0.38 0.13 1.52 0.00 0.10 0.00 0.00 66.02 67.39 1phn s SER 20 CO 0.48 -0.94 2.15 -1.13 0.98 0.00 0.00 173.24 174.78 1phn h ASN 21 N 0.92 0.00 -0.58 7.02 -1.24 -1.98 -0.38 115.58 119.34 1phn h ASN 21 Ca -0.39 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.60 1phn h ASN 21 Cb 1.29 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.31 1phn h ASN 21 CO 0.60 0.06 0.25 0.74 -1.29 0.00 0.00 177.43 177.80 1phn h THR 22 N 0.00 1.22 -0.08 -3.57 2.02 -1.99 -0.43 112.91 110.08 1phn h THR 22 Ca -0.00 -0.65 -0.19 0.00 0.77 0.00 0.00 66.41 66.35 1phn h THR 22 Cb 0.15 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1phn h THR 22 CO 0.01 0.25 -0.74 -0.33 0.37 0.00 0.00 175.52 175.09 1phn h GLU 23 N 0.79 0.42 -0.34 6.66 3.07 -1.50 -2.41 114.58 121.26 1phn h GLU 23 Ca 0.20 -0.35 -0.11 0.00 -0.50 0.00 0.00 59.36 58.60 1phn h GLU 23 Cb 0.16 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 1phn h GLU 23 CO -0.02 0.98 -0.24 -0.07 -1.40 0.00 0.00 179.01 178.26 1phn h LEU 24 N 0.29 0.69 -0.87 1.33 3.38 -1.06 -1.91 115.31 117.16 1phn h LEU 24 Ca -0.03 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.59 1phn h LEU 24 Cb 1.31 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1phn h LEU 24 CO 0.13 0.91 -0.23 1.56 0.09 0.00 0.00 178.44 180.90 1phn h GLN 25 N 0.59 0.58 -0.54 1.13 4.20 -1.02 -0.45 115.11 119.60 1phn h GLN 25 Ca 0.08 -0.22 -0.07 0.00 0.06 0.00 0.00 58.65 58.50 1phn h GLN 25 Cb 0.73 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.45 1phn h GLN 25 CO 0.06 0.77 0.05 0.00 -0.67 0.00 0.00 178.83 179.03 1phn h ALA 26 N 1.24 1.06 -0.24 3.87 0.00 -1.06 0.07 119.26 124.20 1phn h ALA 26 Ca 0.08 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 1phn h ALA 26 Cb 0.67 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1phn h ALA 26 CO 0.05 0.60 -0.52 0.28 0.00 0.00 0.00 179.25 179.65 1phn h VAL 27 N 0.84 1.29 -0.97 0.00 2.07 -1.00 -2.57 116.25 115.91 1phn h VAL 27 Ca 0.17 -1.72 0.07 0.00 0.82 0.00 0.00 66.70 66.03 1phn h VAL 27 Cb 0.43 1.77 -0.07 0.00 -1.52 0.00 0.00 31.29 31.90 1phn h VAL 27 CO 0.01 0.55 0.62 -1.13 0.02 0.00 0.00 177.57 177.65 1phn h ASN 28 N 0.52 0.97 -0.94 0.57 -1.24 -0.77 -1.19 115.58 113.50 1phn h ASN 28 Ca 0.00 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.02 1phn h ASN 28 Cb 1.13 -0.19 -0.05 0.00 0.73 0.00 0.00 38.32 39.95 1phn h ASN 28 CO 0.12 0.61 0.57 1.23 -1.29 0.00 0.00 177.43 178.66 1phn h GLY 29 N 1.09 1.36 0.93 1.57 0.00 -0.62 -0.98 103.07 106.43 1phn h GLY 29 Ca 0.43 -0.56 -0.08 0.00 0.00 0.00 0.00 47.33 47.11 1phn h GLY 29 CO -0.17 0.55 -0.10 -0.09 0.00 0.00 0.00 176.54 176.72 1phn h ARG 30 N 1.30 0.66 -0.92 4.80 9.65 -0.97 -2.71 114.38 126.19 1phn h ARG 30 Ca 0.34 -0.27 0.01 0.00 -1.10 0.00 0.00 59.98 58.96 1phn h ARG 30 Cb -0.06 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.44 1phn h ARG 30 CO -0.06 0.85 0.61 1.88 2.80 0.00 0.00 179.97 186.04 1phn h TYR 31 N 0.44 1.15 -0.23 2.20 0.05 -0.66 -1.07 116.97 118.85 1phn h TYR 31 Ca 0.08 0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.79 1phn h TYR 31 Cb 0.61 -0.39 -0.01 0.00 1.01 0.00 0.00 36.73 37.95 1phn h TYR 31 CO 0.05 0.72 -0.29 1.96 -1.05 0.00 0.00 178.16 179.55 1phn h GLN 32 N 1.24 0.45 0.00 4.88 1.08 -1.16 -2.98 115.11 118.62 1phn h GLN 32 Ca 0.34 -0.18 -0.01 0.00 -1.45 0.00 0.00 58.65 57.35 1phn h GLN 32 Cb -0.13 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1phn h GLN 32 CO -0.08 0.70 -0.14 -0.09 -0.95 0.00 0.00 178.83 178.26 1phn h ARG 33 N 0.39 0.00 -0.54 1.46 9.65 -1.11 -3.36 114.38 120.86 1phn h ARG 33 Ca 0.05 0.00 0.13 0.00 -1.10 0.00 0.00 59.98 59.06 1phn h ARG 33 Cb 0.71 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.26 1phn h ARG 33 CO 0.05 0.06 0.38 0.00 2.80 0.00 0.00 179.97 183.26 1phn h ALA 34 N 1.94 2.30 -0.58 2.80 0.00 -1.04 -1.84 119.26 122.84 1phn h ALA 34 Ca -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1phn h ALA 34 Cb 1.05 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1phn h ALA 34 CO 0.01 -0.45 0.37 0.00 0.00 0.00 0.00 179.25 179.18 1phn h ALA 35 N 1.73 0.74 -0.19 0.00 0.00 -1.75 -0.14 119.26 119.66 1phn h ALA 35 Ca 0.26 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.96 1phn h ALA 35 Cb 0.82 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1phn h ALA 35 CO -0.04 0.14 -0.62 0.00 0.00 0.00 0.00 179.25 178.73 1phn h ALA 36 N 1.23 0.56 -0.35 0.00 0.00 -1.63 -2.17 119.26 116.91 1phn h ALA 36 Ca 0.22 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1phn h ALA 36 Cb -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1phn h ALA 36 CO -0.07 0.70 0.13 0.77 0.00 0.00 0.00 179.25 180.78 1phn h SER 37 N 0.48 0.48 0.58 0.00 0.02 -1.15 -2.18 113.55 111.78 1phn h SER 37 Ca -0.01 -0.17 -0.13 0.00 -0.84 0.00 0.00 61.79 60.64 1phn h SER 37 Cb 1.20 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.59 1phn h SER 37 CO 0.12 0.52 -0.62 -0.07 -1.14 0.00 0.00 176.83 175.64 1phn h LEU 38 N 0.41 0.04 -0.35 5.07 3.38 -1.02 -0.41 115.31 122.44 1phn h LEU 38 Ca 0.12 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1phn h LEU 38 Cb 0.20 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1phn h LEU 38 CO -0.01 0.66 0.09 -0.08 0.09 0.00 0.00 178.44 179.18 1phn h GLU 39 N 0.03 0.57 -0.39 1.13 4.81 -1.24 -0.69 114.58 118.80 1phn h GLU 39 Ca -0.01 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.06 1phn h GLU 39 Cb 1.11 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 1phn h GLU 39 CO 0.08 0.61 0.14 0.00 -0.73 0.00 0.00 179.01 179.12 1phn h ALA 40 N 0.93 0.51 -0.85 2.92 0.00 -1.17 -1.69 119.26 119.91 1phn h ALA 40 Ca 0.11 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1phn h ALA 40 Cb 0.30 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1phn h ALA 40 CO 0.00 0.12 0.52 0.00 0.00 0.00 0.00 179.25 179.89 1phn h ALA 41 N 0.99 1.08 -0.22 0.00 0.00 -0.92 -0.61 119.26 119.58 1phn h ALA 41 Ca 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1phn h ALA 41 Cb 0.21 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1phn h ALA 41 CO -0.01 0.53 0.05 -0.09 0.00 0.00 0.00 179.25 179.73 1phn h ARG 42 N 1.16 0.36 -0.05 0.00 2.43 -0.92 -2.07 114.38 115.28 1phn h ARG 42 Ca 0.30 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1phn h ARG 42 Cb -0.06 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1phn h ARG 42 CO -0.06 0.48 0.03 1.03 -1.51 0.00 0.00 179.97 179.94 1phn h SER 43 N 0.17 0.06 -0.96 -3.80 0.87 -1.05 -1.76 113.55 107.09 1phn h SER 43 Ca 0.07 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1phn h SER 43 Cb 0.29 -0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.18 1phn h SER 43 CO 0.00 0.12 0.61 -0.07 -0.53 0.00 0.00 176.83 176.96 1phn h LEU 44 N 0.00 1.13 -0.02 2.23 3.38 -1.11 -2.00 115.31 118.92 1phn h LEU 44 Ca 0.02 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1phn h LEU 44 Cb 0.07 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 1phn h LEU 44 CO -0.00 0.85 0.00 0.74 0.09 0.00 0.00 178.44 180.11 1phn h THR 45 N 1.32 1.24 0.00 0.22 2.02 -1.27 -1.06 112.91 115.38 1phn h THR 45 Ca 0.35 -0.71 -0.03 0.00 0.77 0.00 0.00 66.41 66.78 1phn h THR 45 Cb -0.10 1.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1phn h THR 45 CO -0.07 0.19 -0.15 0.77 0.37 0.00 0.00 175.52 176.63 1phn h SER 46 N -0.25 0.00 -0.63 4.18 4.64 -1.17 -2.10 113.55 118.23 1phn h SER 46 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1phn h SER 46 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1phn h SER 46 CO 0.00 0.15 0.00 0.59 -0.87 0.00 0.00 176.83 176.70 1phn n ASN 47 N -3.80 4.45 0.03 4.97 3.02 -0.76 -4.75 115.26 118.42 1phn n ASN 47 Ca -0.02 -2.36 -0.11 0.00 -0.03 0.00 0.00 54.58 52.06 1phn n ASN 47 Cb 0.25 -0.54 -0.04 0.00 -0.61 0.00 0.00 39.78 38.84 1phn n ASN 47 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1phn h ALA 48 N 3.88 -0.40 -0.84 5.41 0.00 -0.46 -1.78 119.26 125.07 1phn h ALA 48 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1phn h ALA 48 Cb 1.32 0.57 -0.06 0.00 0.00 0.00 0.00 17.79 19.62 1phn h ALA 48 CO 0.17 -0.80 0.53 0.93 0.00 0.00 0.00 179.25 180.08 1phn h GLU 49 N -0.42 0.96 -0.40 0.00 4.39 -1.85 0.63 114.58 117.88 1phn h GLU 49 Ca 0.08 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 1phn h GLU 49 Cb 0.54 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 1phn h GLU 49 CO -0.31 0.64 0.10 -0.09 -1.16 0.00 0.00 179.01 178.19 1phn h ARG 50 N 0.99 0.64 -0.46 2.33 2.43 -1.85 -1.50 114.38 116.97 1phn h ARG 50 Ca 0.35 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 59.25 1phn h ARG 50 Cb 0.10 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1phn h ARG 50 CO -0.15 0.66 -0.21 -0.07 -1.51 0.00 0.00 179.97 178.69 1phn h LEU 51 N 0.51 0.94 -0.09 3.80 3.38 -0.82 -1.75 115.31 121.28 1phn h LEU 51 Ca 0.13 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1phn h LEU 51 Cb 0.30 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1phn h LEU 51 CO 0.00 1.11 -0.00 0.40 0.09 0.00 0.00 178.44 180.04 1phn h ILE 52 N 0.80 1.26 -0.51 1.22 2.04 -0.76 0.11 117.51 121.67 1phn h ILE 52 Ca 0.11 -0.82 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 1phn h ILE 52 Cb 0.77 1.62 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 1phn h ILE 52 CO 0.06 0.23 0.13 0.78 0.00 0.00 0.00 178.15 179.35 1phn h ASN 53 N -0.12 0.77 -0.15 1.72 2.35 -1.31 -0.61 115.58 118.23 1phn h ASN 53 Ca 0.03 -0.23 -0.10 0.00 -0.55 0.00 0.00 56.30 55.45 1phn h ASN 53 Cb 0.36 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1phn h ASN 53 CO 0.01 0.80 -0.22 1.23 -1.65 0.00 0.00 177.43 177.60 1phn h GLY 54 N 0.71 0.64 1.11 2.83 0.00 -1.32 -1.88 103.07 105.17 1phn h GLY 54 Ca 0.16 -0.52 -0.14 0.00 0.00 0.00 0.00 47.33 46.83 1phn h GLY 54 CO 0.00 0.47 -0.27 0.00 0.00 0.00 0.00 176.54 176.74 1phn h ALA 55 N 1.24 0.64 -0.48 3.60 0.00 -0.66 -1.31 119.26 122.29 1phn h ALA 55 Ca 0.08 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1phn h ALA 55 Cb 0.67 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1phn h ALA 55 CO 0.05 0.67 0.15 0.00 0.00 0.00 0.00 179.25 180.11 1phn h ALA 56 N 0.84 0.62 -0.58 0.00 0.00 -0.94 -2.41 119.26 116.79 1phn h ALA 56 Ca 0.09 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1phn h ALA 56 Cb 0.86 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1phn h ALA 56 CO 0.08 0.28 0.22 0.37 0.00 0.00 0.00 179.25 180.19 1phn h GLN 57 N 0.64 0.85 -0.31 0.00 5.75 -1.20 -1.78 115.11 119.05 1phn h GLN 57 Ca 0.15 -0.14 -0.04 0.00 -0.15 0.00 0.00 58.65 58.48 1phn h GLN 57 Cb 0.28 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 1phn h GLN 57 CO -0.00 0.71 0.03 0.00 -2.65 0.00 0.00 178.83 176.91 1phn h ALA 58 N 1.41 1.47 -0.11 3.38 0.00 -0.95 -0.26 119.26 124.19 1phn h ALA 58 Ca 0.20 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1phn h ALA 58 Cb 0.19 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1phn h ALA 58 CO -0.02 0.38 -0.16 0.28 0.00 0.00 0.00 179.25 179.74 1phn h VAL 59 N 0.46 1.37 -0.40 0.00 2.07 -0.86 -1.47 116.25 117.43 1phn h VAL 59 Ca 0.10 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 66.22 1phn h VAL 59 Cb 0.26 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1phn h VAL 59 CO 0.00 0.40 0.13 1.88 0.02 0.00 0.00 177.57 180.00 1phn h TYR 60 N -0.11 0.57 -0.11 1.57 0.05 -1.08 0.20 116.97 118.07 1phn h TYR 60 Ca 0.01 -0.03 -0.23 0.00 0.05 0.00 0.00 58.73 58.53 1phn h TYR 60 Cb 0.71 -0.18 0.01 0.00 1.01 0.00 0.00 36.73 38.29 1phn h TYR 60 CO 0.10 0.47 -0.84 0.77 -1.05 0.00 0.00 178.16 177.61 1phn h SER 61 N 0.57 0.88 -0.17 3.88 0.02 -0.99 -2.97 113.55 114.76 1phn h SER 61 Ca 0.14 -0.61 -0.21 0.00 -0.84 0.00 0.00 61.79 60.26 1phn h SER 61 Cb 0.16 -0.26 0.01 0.00 0.14 0.00 0.00 62.40 62.45 1phn h SER 61 CO -0.01 1.40 -0.72 0.50 -1.14 0.00 0.00 176.83 176.87 1phn h LYS 62 N 0.47 0.81 -2.84 3.45 1.63 -0.82 -3.37 116.57 115.90 1phn h LYS 62 Ca -0.07 -0.62 -0.62 0.00 -0.85 0.00 0.00 60.65 58.49 1phn h LYS 62 Cb 1.47 0.12 -0.42 0.00 -0.60 0.00 0.00 32.23 32.80 1phn h LYS 62 CO 0.17 1.23 -0.55 1.19 -3.45 0.00 0.00 179.45 178.04 1phn n PHE 63 N -3.95 3.41 -0.29 1.91 3.72 0.67 -4.97 117.46 117.96 1phn n PHE 63 Ca -0.07 -4.26 0.13 0.00 -0.05 0.00 0.00 57.45 53.21 1phn n PHE 63 Cb 0.72 -0.63 0.38 0.00 -0.94 0.00 0.00 39.48 39.01 1phn n PHE 63 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1phn h PRO 64 N 5.06 0.65 -0.19 -1.08 0.11 -1.70 -1.76 132.00 133.09 1phn h PRO 64 Ca 0.16 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 66.29 1phn h PRO 64 Cb 0.73 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 1phn h PRO 64 CO 0.76 0.43 0.26 0.10 -0.21 0.00 0.00 178.00 179.34 1phn h TYR 65 N 0.67 0.00 0.00 0.65 -0.00 -1.93 -1.59 116.97 114.77 1phn h TYR 65 Ca 0.49 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 59.21 1phn h TYR 65 Cb 0.84 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.57 1phn h TYR 65 CO -0.00 0.00 -0.03 1.79 -0.00 0.00 0.00 178.16 179.92 1phn h THR 66 N 0.00 0.10 -0.02 -0.90 1.35 -1.66 -1.60 112.91 110.19 1phn h THR 66 Ca 0.09 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 1phn h THR 66 Cb 0.60 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 1phn h THR 66 CO -0.00 0.03 -0.17 -1.54 -0.25 0.00 0.00 175.52 173.59 1phn n SER 67 N -3.17 2.19 -0.07 5.36 3.41 -0.60 -0.58 113.62 120.15 1phn n SER 67 Ca -0.01 -1.59 -0.13 0.00 -0.26 0.00 0.00 58.87 56.88 1phn n SER 67 Cb 0.24 0.21 -0.06 0.00 -0.26 0.00 0.00 64.21 64.34 1phn n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1phn n GLN 68 N 0.54 0.32 -1.98 4.33 6.02 -0.93 -4.27 117.38 121.41 1phn n GLN 68 Ca 0.09 0.11 -0.42 0.00 -0.01 0.00 0.00 57.00 56.77 1phn n GLN 68 Cb 0.42 -1.14 -0.03 0.00 1.02 0.00 0.00 30.24 30.52 1phn n GLN 68 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1phn s MET 69 N -2.27 4.24 0.39 -1.09 -1.94 -0.65 -4.95 119.30 113.04 1phn s MET 69 Ca -0.19 2.31 -0.24 0.00 -1.71 0.00 0.00 55.69 55.85 1phn s MET 69 Cb 0.06 -3.16 -0.09 0.00 2.01 0.00 0.00 34.83 33.66 1phn s MET 69 CO 0.28 -0.55 1.07 -1.25 -0.01 0.00 0.00 175.02 174.57 1phn s PRO 70 N 0.87 4.16 0.00 2.03 0.04 -1.26 -4.52 135.00 136.32 1phn s PRO 70 Ca 0.67 1.59 0.00 0.00 0.04 0.00 0.00 61.00 63.30 1phn s PRO 70 Cb -0.42 -2.60 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1phn s PRO 70 CO 0.33 -0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.62 1phn n GLY 71 N 0.45 4.40 0.27 0.56 0.00 -1.26 -4.94 105.19 104.67 1phn n GLY 71 Ca 0.05 -0.94 0.13 0.00 0.00 0.00 0.00 46.02 45.26 1phn n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1phn h PRO 72 N 0.00 0.00 0.00 1.61 0.13 -1.98 -2.76 132.00 129.01 1phn h PRO 72 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1phn h PRO 72 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1phn h PRO 72 CO 0.00 0.10 0.00 0.00 -0.23 0.00 0.00 178.00 177.87 1phn n GLN 73 N -3.64 0.03 -3.52 0.86 0.00 -1.26 -4.86 117.38 104.98 1phn n GLN 73 Ca -0.02 0.07 -0.19 0.00 0.00 0.00 0.00 57.00 56.86 1phn n GLN 73 Cb 0.22 -1.54 -0.01 0.00 0.00 0.00 0.00 30.24 28.91 1phn n GLN 73 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 1phn s TYR 74 N -3.02 3.02 -0.54 2.61 2.02 -1.04 -4.90 117.35 115.51 1phn s TYR 74 Ca 0.12 -0.26 -0.01 0.00 -0.37 0.00 0.00 57.07 56.55 1phn s TYR 74 Cb 0.17 -1.98 0.41 0.00 -0.40 0.00 0.00 41.96 40.16 1phn s TYR 74 CO 0.50 0.00 1.99 0.00 -1.57 0.00 0.00 175.55 176.47 1phn n ALA 75 N -1.59 5.85 1.25 3.71 0.00 0.25 -4.35 120.51 125.64 1phn n ALA 75 Ca 0.00 -2.86 0.13 0.00 0.00 0.00 0.00 53.44 50.71 1phn n ALA 75 Cb 0.59 -1.61 0.32 0.00 0.00 0.00 0.00 19.45 18.74 1phn n ALA 75 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1phn n SER 76 N -0.60 1.67 -4.51 0.00 3.41 -1.13 -4.37 113.62 108.09 1phn n SER 76 Ca 0.53 -1.38 -0.24 0.00 -0.26 0.00 0.00 58.87 57.52 1phn n SER 76 Cb 0.78 0.12 -0.11 0.00 -0.26 0.00 0.00 64.21 64.74 1phn n SER 76 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1phn s SER 77 N -2.24 3.16 0.17 4.04 1.04 -1.26 -4.92 113.70 113.68 1phn s SER 77 Ca 0.29 -1.30 -0.12 0.00 0.48 0.00 0.00 55.95 55.30 1phn s SER 77 Cb 0.20 -0.25 0.06 0.00 0.10 0.00 0.00 66.02 66.13 1phn s SER 77 CO 0.43 -0.42 1.69 0.00 0.98 0.00 0.00 173.24 175.92 1phn h ALA 78 N 2.04 0.75 -0.50 5.32 0.00 -1.96 -1.40 119.26 123.51 1phn h ALA 78 Ca -0.42 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.24 1phn h ALA 78 Cb 1.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1phn h ALA 78 CO 0.73 0.42 0.09 -0.24 0.00 0.00 0.00 179.25 180.25 1phn h VAL 79 N 0.81 1.22 -0.15 0.00 3.04 -1.96 -1.39 116.25 117.81 1phn h VAL 79 Ca 0.18 -0.83 -0.02 0.00 -1.01 0.00 0.00 66.70 65.03 1phn h VAL 79 Cb 0.29 0.74 -0.01 0.00 -2.01 0.00 0.00 31.29 30.30 1phn h VAL 79 CO -0.00 0.30 0.03 1.23 -1.01 0.00 0.00 177.57 178.12 1phn h GLY 80 N 0.95 0.26 1.26 3.17 0.00 -1.67 -0.97 103.07 106.07 1phn h GLY 80 Ca 0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1phn h GLY 80 CO 0.00 0.16 0.19 0.50 0.00 0.00 0.00 176.54 177.39 1phn h LYS 81 N 0.04 0.93 -0.58 4.80 1.57 -1.11 -1.48 116.57 120.74 1phn h LYS 81 Ca 0.05 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 58.54 1phn h LYS 81 Cb 0.28 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 1phn h LYS 81 CO 0.00 0.80 -0.04 0.00 -0.57 0.00 0.00 179.45 179.64 1phn h ALA 82 N 1.30 0.79 -0.08 3.86 0.00 -1.10 -2.44 119.26 121.60 1phn h ALA 82 Ca 0.20 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1phn h ALA 82 Cb 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1phn h ALA 82 CO -0.01 0.66 -0.53 0.87 0.00 0.00 0.00 179.25 180.23 1phn h LYS 83 N 0.94 0.22 -0.03 0.00 1.57 -0.99 -1.42 116.57 116.87 1phn h LYS 83 Ca 0.16 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1phn h LYS 83 Cb 0.60 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 1phn h LYS 83 CO 0.04 0.70 -0.00 0.00 -0.57 0.00 0.00 179.45 179.62 1phn h ALA 85 N 0.68 1.31 -0.06 0.00 0.00 -1.42 -1.80 119.26 117.96 1phn h ALA 85 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1phn h ALA 85 Cb 0.35 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1phn h ALA 85 CO 0.00 0.51 0.04 -0.09 0.00 0.00 0.00 179.25 179.71 1phn h ARG 86 N 0.79 0.09 -0.32 0.00 2.43 -1.12 -0.92 114.38 115.31 1phn h ARG 86 Ca 0.18 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.38 1phn h ARG 86 Cb 0.20 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 1phn h ARG 86 CO -0.01 0.08 0.11 -0.44 -1.51 0.00 0.00 179.97 178.20 1phn h ASP 87 N 0.07 0.12 -0.87 -3.80 5.19 -0.85 -0.16 116.42 116.10 1phn h ASP 87 Ca 0.02 0.04 0.01 0.00 -0.62 0.00 0.00 57.03 56.48 1phn h ASP 87 Cb 0.01 0.02 -0.04 0.00 0.18 0.00 0.00 39.33 39.50 1phn h ASP 87 CO -0.00 0.10 0.58 0.40 -3.12 0.00 0.00 179.24 177.20 1phn h ILE 88 N 0.25 1.22 -0.53 0.35 2.04 -1.22 -1.77 117.51 117.85 1phn h ILE 88 Ca 0.14 -0.40 -0.07 0.00 1.00 0.00 0.00 64.86 65.53 1phn h ILE 88 Cb 0.12 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.11 1phn h ILE 88 CO -0.15 0.21 0.05 1.23 0.00 0.00 0.00 178.15 179.49 1phn h GLY 89 N 1.18 0.92 1.00 5.37 0.00 -0.28 -1.84 103.07 109.41 1phn h GLY 89 Ca 0.32 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1phn h GLY 89 CO -0.07 0.55 0.35 -0.97 0.00 0.00 0.00 176.54 176.39 1phn h TYR 90 N 0.80 0.75 -0.63 5.60 0.05 -0.22 -0.40 116.97 122.93 1phn h TYR 90 Ca 0.16 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.92 1phn h TYR 90 Cb 0.41 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 37.88 1phn h TYR 90 CO 0.02 0.51 0.30 1.88 -1.05 0.00 0.00 178.16 179.83 1phn h TYR 91 N 0.77 0.90 -0.57 4.88 -1.99 -0.99 -0.86 116.97 119.11 1phn h TYR 91 Ca 0.20 -0.04 -0.07 0.00 2.00 0.00 0.00 58.73 60.82 1phn h TYR 91 Cb -0.02 -0.28 -0.02 0.00 2.00 0.00 0.00 36.73 38.41 1phn h TYR 91 CO -0.02 0.68 0.07 1.25 -0.00 0.00 0.00 178.16 180.14 1phn h LEU 92 N 0.86 0.92 -0.61 3.88 5.85 -1.12 -2.07 115.31 123.01 1phn h LEU 92 Ca 0.22 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 1phn h LEU 92 Cb 0.12 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1phn h LEU 92 CO -0.03 0.96 0.29 -0.09 -0.34 0.00 0.00 178.44 179.23 1phn h ARG 93 N 0.84 0.88 -0.61 1.25 2.43 -0.80 -2.45 114.38 115.92 1phn h ARG 93 Ca 0.17 -0.13 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1phn h ARG 93 Cb 0.44 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 1phn h ARG 93 CO 0.01 0.71 0.27 0.52 -1.51 0.00 0.00 179.97 179.97 1phn h MET 94 N 0.83 0.87 -0.20 0.20 2.86 -0.92 -1.99 114.93 116.59 1phn h MET 94 Ca 0.21 -0.12 0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1phn h MET 94 Cb 0.12 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 1phn h MET 94 CO -0.03 0.69 0.11 0.28 1.06 0.00 0.00 176.91 179.03 1phn h VAL 95 N 0.87 1.02 -0.43 -2.22 2.07 -1.04 -1.45 116.25 115.07 1phn h VAL 95 Ca 0.21 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 1phn h VAL 95 Cb 0.12 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1phn h VAL 95 CO -0.02 0.04 0.17 0.71 0.02 0.00 0.00 177.57 178.49 1phn h THR 96 N 0.24 1.17 -0.52 2.57 1.35 -1.00 -1.84 112.91 114.87 1phn h THR 96 Ca 0.08 -0.52 -0.06 0.00 -0.55 0.00 0.00 66.41 65.35 1phn h THR 96 Cb -0.01 0.66 -0.02 0.00 -1.73 0.00 0.00 68.15 67.05 1phn h THR 96 CO -0.04 0.20 0.08 1.88 -0.25 0.00 0.00 175.52 177.39 1phn h TYR 97 N 0.61 0.93 -0.61 4.73 0.05 -1.08 -1.62 116.97 119.98 1phn h TYR 97 Ca 0.15 -0.13 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 1phn h TYR 97 Cb 0.13 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 37.59 1phn h TYR 97 CO 0.01 0.84 0.31 0.00 -1.05 0.00 0.00 178.16 178.26 1phn h LEU 99 N 0.83 0.89 -0.27 0.00 3.38 -1.09 0.14 115.31 119.19 1phn h LEU 99 Ca 0.21 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1phn h LEU 99 Cb 0.09 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1phn h LEU 99 CO -0.03 0.65 0.11 0.58 0.09 0.00 0.00 178.44 179.84 1phn h VAL 100 N 1.05 1.17 0.00 1.22 2.07 -0.97 -3.16 116.25 117.63 1phn h VAL 100 Ca 0.28 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1phn h VAL 100 Cb -0.12 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1phn h VAL 100 CO -0.06 0.17 -0.50 1.33 0.02 0.00 0.00 177.57 178.53 1phn n VAL 101 N -4.77 0.33 -1.80 2.57 0.24 -0.78 -4.96 118.33 109.16 1phn n VAL 101 Ca -0.03 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1phn n VAL 101 Cb 0.13 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.33 1phn n VAL 101 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1phn n GLY 102 N 1.36 0.38 3.84 7.63 0.00 0.43 -4.39 105.19 114.44 1phn n GLY 102 Ca 0.04 -0.92 -0.06 0.00 0.00 0.00 0.00 46.02 45.08 1phn n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1phn s GLY 103 N -2.99 0.17 0.00 -0.02 0.00 -0.91 -4.57 107.32 99.00 1phn s GLY 103 Ca 0.00 -0.45 0.29 0.00 0.00 0.00 0.00 44.72 44.56 1phn s GLY 103 CO 0.00 0.99 1.86 -1.30 0.00 0.00 0.00 173.10 174.66 1phn n THR 104 N -0.60 0.00 -0.26 0.90 -2.24 -1.26 -4.35 114.28 106.47 1phn n THR 104 Ca -0.05 -0.16 -0.01 0.00 -2.27 0.00 0.00 64.05 61.55 1phn n THR 104 Cb 0.60 0.19 0.05 0.00 -2.10 0.00 0.00 70.33 69.07 1phn n THR 104 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1phn h GLY 105 N 4.91 0.26 1.01 3.38 0.00 -1.95 0.11 103.07 110.78 1phn h GLY 105 Ca 0.00 0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 1phn h GLY 105 CO 0.00 -0.25 0.46 -2.55 0.00 0.00 0.00 176.54 174.19 1phn h PRO 106 N -0.06 1.00 -0.33 4.80 0.11 -1.80 -0.67 132.00 135.05 1phn h PRO 106 Ca 0.32 -0.08 -0.11 0.00 0.11 0.00 0.00 66.00 66.24 1phn h PRO 106 Cb 0.56 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1phn h PRO 106 CO -0.77 0.70 -0.21 1.98 -0.21 0.00 0.00 178.00 179.49 1phn h MET 107 N 1.01 0.73 -0.67 1.05 4.05 -1.35 -0.65 114.93 119.10 1phn h MET 107 Ca 0.27 -0.34 0.02 0.00 -0.28 0.00 0.00 59.70 59.37 1phn h MET 107 Cb -0.05 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.70 1phn h MET 107 CO -0.05 0.95 0.43 -0.44 0.23 0.00 0.00 176.91 178.03 1phn h ASP 108 N 0.50 0.72 0.20 1.39 3.32 -0.51 -0.38 116.42 121.67 1phn h ASP 108 Ca 0.07 -0.01 -0.27 0.00 0.02 0.00 0.00 57.03 56.84 1phn h ASP 108 Cb 0.76 -0.17 0.03 0.00 0.22 0.00 0.00 39.33 40.17 1phn h ASP 108 CO 0.06 0.51 -1.20 -0.33 -1.72 0.00 0.00 179.24 176.56 1phn h GLU 109 N 0.86 0.45 0.00 3.56 5.08 -1.00 -2.07 114.58 121.46 1phn h GLU 109 Ca 0.26 -0.76 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1phn h GLU 109 Cb -0.03 0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1phn h GLU 109 CO -0.09 1.36 -0.96 0.66 -1.00 0.00 0.00 179.01 178.99 1phn n TYR 110 N -3.89 0.65 0.00 4.33 4.01 -0.26 -4.60 117.16 117.39 1phn n TYR 110 Ca -0.15 0.19 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1phn n TYR 110 Cb 0.98 -0.74 0.00 0.00 -0.31 0.00 0.00 39.34 39.28 1phn n TYR 110 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1phn n LEU 111 N -2.34 0.36 -0.07 7.72 0.00 -0.52 -4.90 117.00 117.24 1phn n LEU 111 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 56.01 55.90 1phn n LEU 111 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.92 1phn n LEU 111 CO 0.39 -0.14 0.52 0.40 0.00 0.00 0.00 177.39 178.56 1phn h ILE 112 N 0.00 1.28 -2.61 1.96 2.04 -1.15 -3.31 117.51 115.72 1phn h ILE 112 Ca 0.00 -1.64 -0.55 0.00 1.00 0.00 0.00 64.86 63.67 1phn h ILE 112 Cb 0.47 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 1phn h ILE 112 CO 0.00 0.53 1.10 0.00 0.00 0.00 0.00 178.15 179.78 1phn s ALA 113 N -4.25 3.57 0.00 1.87 0.00 -0.78 -1.52 121.76 120.66 1phn s ALA 113 Ca -0.10 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.75 1phn s ALA 113 Cb 0.11 -3.76 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1phn s ALA 113 CO 0.87 -1.47 0.00 0.41 0.00 0.00 0.00 175.76 175.57 1phn n GLY 114 N 4.20 1.09 0.15 0.00 0.00 -1.26 -4.94 105.19 104.43 1phn n GLY 114 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 1phn n GLY 114 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1phn h LEU 115 N 0.00 -0.30 -0.47 0.99 5.85 -1.36 -1.88 115.31 118.13 1phn h LEU 115 Ca 0.00 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.84 1phn h LEU 115 Cb 0.00 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1phn h LEU 115 CO 0.00 -0.11 0.28 -0.08 -0.34 0.00 0.00 178.44 178.20 1phn h GLU 116 N 0.02 0.55 -0.60 1.25 4.57 -1.92 -1.27 114.58 117.17 1phn h GLU 116 Ca 0.17 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.29 1phn h GLU 116 Cb 0.26 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.70 1phn h GLU 116 CO -0.36 0.37 0.25 1.49 -1.18 0.00 0.00 179.01 179.58 1phn h GLU 117 N 0.57 0.89 -0.27 1.92 4.57 -1.91 -1.82 114.58 118.53 1phn h GLU 117 Ca 0.19 -0.16 -0.03 0.00 -1.18 0.00 0.00 59.36 58.17 1phn h GLU 117 Cb 0.00 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.44 1phn h GLU 117 CO -0.08 0.76 0.04 0.82 -1.18 0.00 0.00 179.01 179.37 1phn h ILE 118 N 0.83 1.23 -0.79 2.32 5.03 -1.12 0.40 117.51 125.42 1phn h ILE 118 Ca 0.20 -0.80 -0.02 0.00 -0.12 0.00 0.00 64.86 64.11 1phn h ILE 118 Cb 0.19 1.24 -0.04 0.00 -3.03 0.00 0.00 36.82 35.18 1phn h ILE 118 CO -0.02 0.26 0.40 0.78 -0.68 0.00 0.00 178.15 178.89 1phn h ASN 119 N 0.26 1.02 -0.20 1.72 2.35 -1.11 -1.26 115.58 118.37 1phn h ASN 119 Ca 0.08 -0.12 -0.12 0.00 -0.55 0.00 0.00 56.30 55.59 1phn h ASN 119 Cb 0.35 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 1phn h ASN 119 CO 0.01 0.85 -0.34 -0.09 -1.65 0.00 0.00 177.43 176.21 1phn h ARG 120 N 1.11 0.58 -0.33 0.81 2.43 -1.25 -0.19 114.38 117.55 1phn h ARG 120 Ca 0.27 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1phn h ARG 120 Cb 0.09 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1phn h ARG 120 CO -0.04 0.97 0.15 1.15 -1.51 0.00 0.00 179.97 180.69 1phn h THR 121 N 0.26 1.16 -0.21 0.20 2.02 -0.66 -3.04 112.91 112.64 1phn h THR 121 Ca 0.01 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1phn h THR 121 Cb 0.93 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1phn h THR 121 CO 0.08 0.17 0.00 0.49 0.37 0.00 0.00 175.52 176.63 1phn n PHE 122 N -4.75 0.27 -3.40 3.16 3.72 -0.50 -4.96 117.46 111.01 1phn n PHE 122 Ca -0.01 -0.14 -0.18 0.00 -0.05 0.00 0.00 57.45 57.07 1phn n PHE 122 Cb 0.11 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.73 1phn n PHE 122 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1phn n ASP 123 N 0.65 -3.22 -4.64 4.37 2.03 -0.69 -4.63 116.55 110.42 1phn n ASP 123 Ca 0.17 -0.56 -0.35 0.00 0.52 0.00 0.00 54.79 54.56 1phn n ASP 123 Cb 0.41 -4.83 -0.10 0.00 -0.72 0.00 0.00 41.12 35.88 1phn n ASP 123 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1phn s LEU 124 N -6.35 3.91 -0.11 -2.67 1.43 -0.17 -4.91 118.68 109.82 1phn s LEU 124 Ca 0.16 0.08 -0.26 0.00 -1.03 0.00 0.00 54.13 53.08 1phn s LEU 124 Cb -0.07 -2.01 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 1phn s LEU 124 CO 0.69 0.13 0.84 -0.55 0.23 0.00 0.00 176.35 177.69 1phn s SER 125 N 0.64 7.06 0.29 2.29 0.15 -1.26 -4.61 113.70 118.25 1phn s SER 125 Ca 0.05 1.29 0.03 0.00 0.70 0.00 0.00 55.95 58.02 1phn s SER 125 Cb -0.13 -2.47 0.63 0.00 -1.71 0.00 0.00 66.02 62.34 1phn s SER 125 CO 0.01 -0.31 1.81 -0.65 1.20 0.00 0.00 173.24 175.31 1phn h PRO 126 N 7.07 0.88 0.00 5.44 0.11 -1.95 -0.98 132.00 142.56 1phn h PRO 126 Ca -0.34 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.71 1phn h PRO 126 Cb 1.16 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1phn h PRO 126 CO 0.80 0.58 -0.00 0.66 -0.21 0.00 0.00 178.00 179.83 1phn h SER 127 N 0.90 0.00 -0.37 -2.05 4.64 -1.92 -1.54 113.55 113.21 1phn h SER 127 Ca 0.53 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.74 1phn h SER 127 Cb 0.66 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 1phn h SER 127 CO -0.31 0.00 -0.22 -0.50 -0.87 0.00 0.00 176.83 174.93 1phn h TRP 128 N 0.00 0.93 -0.06 4.77 6.55 -1.58 -2.50 115.95 124.06 1phn h TRP 128 Ca -0.00 -0.24 -0.17 0.00 0.95 0.00 0.00 58.89 59.43 1phn h TRP 128 Cb 0.13 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 28.21 1phn h TRP 128 CO 0.00 1.00 -0.70 1.88 -1.05 0.00 0.00 178.44 179.57 1phn h TYR 129 N 0.59 0.40 -0.74 0.49 0.05 -1.40 -2.75 116.97 113.61 1phn h TYR 129 Ca 0.08 -0.17 -0.03 0.00 0.05 0.00 0.00 58.73 58.66 1phn h TYR 129 Cb 0.78 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 38.42 1phn h TYR 129 CO 0.06 0.90 0.34 0.28 -1.05 0.00 0.00 178.16 178.69 1phn h VAL 130 N 0.20 1.24 -0.63 -2.88 2.07 -1.28 -0.46 116.25 114.52 1phn h VAL 130 Ca -0.02 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 66.75 1phn h VAL 130 Cb 1.25 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1phn h VAL 130 CO 0.11 0.29 0.18 -0.08 0.02 0.00 0.00 177.57 178.10 1phn h GLU 131 N 1.04 0.99 -0.62 1.57 4.57 -1.40 0.24 114.58 120.97 1phn h GLU 131 Ca 0.25 -0.22 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 1phn h GLU 131 Cb 0.14 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 1phn h GLU 131 CO -0.03 0.88 0.26 0.00 -1.18 0.00 0.00 179.01 178.94 1phn h ALA 132 N 1.07 0.80 -0.56 2.92 0.00 -1.14 -1.56 119.26 120.79 1phn h ALA 132 Ca 0.20 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1phn h ALA 132 Cb 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1phn h ALA 132 CO -0.00 0.41 0.00 -0.07 0.00 0.00 0.00 179.25 179.59 1phn h LEU 133 N 0.86 0.94 -1.29 0.00 3.38 -0.84 -2.41 115.31 115.96 1phn h LEU 133 Ca 0.21 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1phn h LEU 133 Cb 0.19 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1phn h LEU 133 CO -0.02 0.99 0.08 0.78 0.09 0.00 0.00 178.44 180.36 1phn h ASN 134 N 0.89 0.52 -0.22 -0.43 2.35 -0.58 -2.06 115.58 116.05 1phn h ASN 134 Ca 0.16 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1phn h ASN 134 Cb 0.52 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1phn h ASN 134 CO 0.03 0.54 0.04 0.22 -1.65 0.00 0.00 177.43 176.60 1phn h TYR 135 N 0.55 0.38 -0.78 1.19 5.03 -0.94 -2.26 116.97 120.14 1phn h TYR 135 Ca 0.13 -0.05 0.04 0.00 2.58 0.00 0.00 58.73 61.42 1phn h TYR 135 Cb 0.23 -0.11 -0.05 0.00 1.55 0.00 0.00 36.73 38.36 1phn h TYR 135 CO 0.01 0.49 0.49 0.82 -1.32 0.00 0.00 178.16 178.65 1phn h ILE 136 N 0.16 1.10 -0.80 1.81 2.04 -1.09 -1.02 117.51 119.70 1phn h ILE 136 Ca 0.07 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 1phn h ILE 136 Cb 0.31 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.42 1phn h ILE 136 CO 0.00 0.17 0.41 0.50 0.00 0.00 0.00 178.15 179.24 1phn h LYS 137 N 0.95 1.14 0.00 2.37 3.64 -1.29 -1.27 116.57 122.10 1phn h LYS 137 Ca 0.32 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1phn h LYS 137 Cb 0.05 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 1phn h LYS 137 CO -0.13 0.86 0.00 0.00 -2.27 0.00 0.00 179.45 177.92 1phn h ALA 138 N 1.22 1.00 0.00 5.00 0.00 -0.94 -3.36 119.26 122.18 1phn h ALA 138 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1phn h ALA 138 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1phn h ALA 138 CO -0.04 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.30 1phn n ASN 139 N -2.76 1.26 0.18 0.00 3.02 -0.43 -4.72 115.26 111.80 1phn n ASN 139 Ca 0.04 -1.33 0.14 0.00 -0.03 0.00 0.00 54.58 53.39 1phn n ASN 139 Cb 0.43 0.00 0.53 0.00 -0.61 0.00 0.00 39.78 40.13 1phn n ASN 139 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 1phn h HIS 140 N 0.00 0.00 -0.38 3.10 2.07 -1.39 -3.47 115.15 115.08 1phn h HIS 140 Ca 0.00 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.35 1phn h HIS 140 Cb 0.22 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 30.13 1phn h HIS 140 CO 0.00 0.00 -0.15 0.41 -3.07 0.00 0.00 177.93 175.12 1phn n GLY 143 N 0.18 0.92 3.90 6.13 0.00 -1.26 -4.93 105.19 110.13 1phn n GLY 143 Ca 0.02 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1phn n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1phn s LEU 144 N -1.84 3.27 0.24 0.99 1.43 -1.26 -5.09 118.68 116.42 1phn s LEU 144 Ca 0.00 1.03 0.01 0.00 -1.03 0.00 0.00 54.13 54.14 1phn s LEU 144 Cb 0.00 -3.94 -0.04 0.00 0.03 0.00 0.00 46.19 42.23 1phn s LEU 144 CO 0.00 -0.95 0.13 -0.55 0.23 0.00 0.00 176.35 175.21 1phn s SER 145 N -4.23 0.76 0.91 2.29 0.15 -1.26 -4.67 113.70 107.65 1phn s SER 145 Ca 0.53 -1.42 0.00 0.00 0.70 0.00 0.00 55.95 55.76 1phn s SER 145 Cb -0.11 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 1phn s SER 145 CO 0.49 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.73 1phn n GLY 146 N -0.39 1.72 0.27 9.45 0.00 -1.26 -2.22 105.19 112.76 1phn n GLY 146 Ca 0.01 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.67 1phn n GLY 146 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1phn h GLN 147 N 0.00 0.00 -0.28 1.61 1.08 -1.99 -2.14 115.11 113.39 1phn h GLN 147 Ca 0.00 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.04 1phn h GLN 147 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1phn h GLN 147 CO 0.00 0.11 -0.46 0.00 -0.95 0.00 0.00 178.83 177.53 1phn h ALA 148 N 1.89 0.67 -0.43 3.87 0.00 -1.73 -0.65 119.26 122.87 1phn h ALA 148 Ca -0.00 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 1phn h ALA 148 Cb 0.38 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1phn h ALA 148 CO 0.01 0.67 -0.12 0.00 0.00 0.00 0.00 179.25 179.82 1phn h ALA 149 N 0.90 0.98 -0.08 0.00 0.00 -0.93 -1.99 119.26 118.14 1phn h ALA 149 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1phn h ALA 149 Cb 1.02 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1phn h ALA 149 CO 0.10 0.61 0.05 -0.97 0.00 0.00 0.00 179.25 179.04 1phn h ASN 150 N 0.71 0.10 -0.41 0.00 -0.00 -1.13 -0.39 115.58 114.45 1phn h ASN 150 Ca 0.12 -0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.40 1phn h ASN 150 Cb 0.60 -0.02 -0.02 0.00 -0.00 0.00 0.00 38.32 38.88 1phn h ASN 150 CO 0.04 0.08 0.26 -0.33 -0.00 0.00 0.00 177.43 177.48 1phn h GLU 161 N 0.10 0.55 -0.22 6.67 4.39 -0.92 -1.12 114.58 124.03 1phn h GLU 161 Ca 0.03 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1phn h GLU 161 Cb 0.00 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 1phn h GLU 161 CO -0.01 0.39 0.10 0.00 -1.16 0.00 0.00 179.01 178.33 1phn h ALA 162 N 1.13 0.28 -0.16 3.43 0.00 -1.14 -3.03 119.26 119.77 1phn h ALA 162 Ca 0.15 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1phn h ALA 162 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1phn h ALA 162 CO -0.03 -0.14 -0.20 -0.91 0.00 0.00 0.00 179.25 177.97 1phn h ASN 163 N 0.21 0.26 -0.87 0.00 2.35 -0.99 -1.88 115.58 114.65 1phn h ASN 163 Ca 0.07 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.73 1phn h ASN 163 Cb 0.15 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.41 1phn h ASN 163 CO -0.01 0.47 0.43 0.74 -1.65 0.00 0.00 177.43 177.42 1phn h THR 164 N 0.24 1.26 0.04 2.81 2.02 -1.09 0.14 112.91 118.34 1phn h THR 164 Ca 0.04 -0.71 -0.23 0.00 0.77 0.00 0.00 66.41 66.29 1phn h THR 164 Cb 0.50 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 1phn h THR 164 CO 0.03 0.31 -1.03 1.88 0.37 0.00 0.00 175.52 177.09 1phn h TYR 165 N 1.24 0.29 -0.21 3.16 0.05 -1.43 -1.15 116.97 118.91 1phn h TYR 165 Ca 0.30 -0.19 -0.03 0.00 0.05 0.00 0.00 58.73 58.86 1phn h TYR 165 Cb 0.09 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 1phn h TYR 165 CO 0.01 1.08 0.01 0.82 -1.05 0.00 0.00 178.16 179.04 1phn h ILE 166 N 0.07 1.24 -0.26 -2.88 2.04 -1.13 -2.20 117.51 114.40 1phn h ILE 166 Ca -0.07 -0.83 -0.05 0.00 1.00 0.00 0.00 64.86 64.92 1phn h ILE 166 Cb 1.72 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 1phn h ILE 166 CO 0.16 0.26 -0.04 0.44 0.00 0.00 0.00 178.15 178.96 1phn h ASP 167 N 0.14 0.38 -0.84 1.72 3.32 -0.69 -1.02 116.42 119.43 1phn h ASP 167 Ca 0.06 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1phn h ASP 167 Cb 0.37 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.78 1phn h ASP 167 CO 0.01 0.47 0.46 0.22 -1.72 0.00 0.00 179.24 178.68 1phn h TYR 168 N 0.39 1.16 -0.27 4.55 3.20 -0.91 0.06 116.97 125.14 1phn h TYR 168 Ca 0.08 -0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.83 1phn h TYR 168 Cb 0.33 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1phn h TYR 168 CO 0.01 0.80 -0.21 0.00 -1.64 0.00 0.00 178.16 177.12 1phn h ALA 169 N 1.32 0.39 -0.79 1.82 0.00 -0.67 -2.62 119.26 118.72 1phn h ALA 169 Ca 0.30 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.91 1phn h ALA 169 Cb 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1phn h ALA 169 CO -0.05 0.34 0.47 0.82 0.00 0.00 0.00 179.25 180.83 1phn h ILE 170 N 0.35 1.00 -0.21 0.00 2.04 -0.76 -1.61 117.51 118.33 1phn h ILE 170 Ca 0.05 -0.29 -0.06 0.00 1.00 0.00 0.00 64.86 65.55 1phn h ILE 170 Cb 0.76 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1phn h ILE 170 CO 0.06 0.16 -0.16 0.78 0.00 0.00 0.00 178.15 178.98 1phn h ASN 171 N 0.85 0.33 0.79 1.72 2.35 -0.89 -1.37 115.58 119.36 1phn h ASN 171 Ca 0.35 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.99 1phn h ASN 171 Cb 0.20 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 1phn h ASN 171 CO -0.18 0.51 -0.16 0.00 -1.65 0.00 0.00 177.43 175.95 1phn h ALA 172 N 1.52 1.07 -0.02 -0.83 0.00 -0.93 -2.68 119.26 117.39 1phn h ALA 172 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1phn h ALA 172 Cb 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1phn h ALA 172 CO 0.03 0.19 -0.20 1.28 0.00 0.00 0.00 179.25 180.56 1phn n LEU 173 N -3.38 2.03 0.00 0.00 4.77 -0.57 -5.03 117.00 114.83 1phn n LEU 173 Ca -0.00 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 1phn n LEU 173 Cb 0.36 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1phn n LEU 173 CO 0.31 0.36 0.23 -1.20 -1.33 0.00 0.00 177.39 175.76