#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pp7 h LEU 6 N 0.00 0.00 -1.44 0.64 5.85 -2.05 -2.62 115.31 115.69 1pp7 h LEU 6 Ca 0.00 -0.64 -0.02 0.00 0.84 0.00 0.00 57.88 58.07 1pp7 h LEU 6 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1pp7 h LEU 6 CO 0.00 1.31 0.17 -0.08 -0.34 0.00 0.00 178.44 179.50 1pp7 h GLU 7 N -1.00 0.54 -0.63 1.25 4.81 -1.98 0.16 114.58 117.73 1pp7 h GLU 7 Ca -0.23 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 58.90 1pp7 h GLU 7 Cb 1.18 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 1pp7 h GLU 7 CO -0.14 0.44 0.24 0.00 -0.73 0.00 0.00 179.01 178.82 1pp7 h ALA 8 N 1.64 1.24 0.04 2.92 0.00 -1.99 0.18 119.26 123.29 1pp7 h ALA 8 Ca 0.14 -0.17 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 1pp7 h ALA 8 Cb 0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1pp7 h ALA 8 CO -0.02 0.55 -1.01 0.66 0.00 0.00 0.00 179.25 179.44 1pp7 h SER 9 N 0.91 0.26 0.40 0.00 4.64 -0.74 -1.98 113.55 117.04 1pp7 h SER 9 Ca 0.21 -0.24 -0.02 0.00 -0.47 0.00 0.00 61.79 61.27 1pp7 h SER 9 Cb 0.19 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1pp7 h SER 9 CO -0.02 1.11 -0.19 -0.26 -0.87 0.00 0.00 176.83 176.60 1pp7 h PHE 10 N 0.08 -0.49 -0.73 4.77 0.04 -0.36 -2.88 116.94 117.37 1pp7 h PHE 10 Ca -0.06 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.63 1pp7 h PHE 10 Cb 1.69 0.16 -0.03 0.00 2.20 0.00 0.00 35.95 39.97 1pp7 h PHE 10 CO 0.03 -0.31 0.20 1.79 -0.60 0.00 0.00 178.31 179.43 1pp7 h THR 11 N -0.82 1.26 -0.01 -1.55 1.35 -0.79 -1.26 112.91 111.09 1pp7 h THR 11 Ca -0.05 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 1pp7 h THR 11 Cb 0.41 0.48 -0.00 0.00 -1.73 0.00 0.00 68.15 67.31 1pp7 h THR 11 CO 0.09 0.37 0.07 0.77 -0.25 0.00 0.00 175.52 176.57 1pp7 h SER 12 N 1.10 0.00 0.02 5.36 4.64 -1.47 -1.41 113.55 121.80 1pp7 h SER 12 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1pp7 h SER 12 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1pp7 h SER 12 CO -0.00 0.00 -0.89 0.54 -0.87 0.00 0.00 176.83 175.61 1pp7 n ARG 13 N -3.11 0.19 -4.00 4.77 1.74 -0.51 -4.92 116.66 110.81 1pp7 n ARG 13 Ca -0.03 -0.16 -0.29 0.00 -0.77 0.00 0.00 57.85 56.61 1pp7 n ARG 13 Cb 0.14 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.04 1pp7 n ARG 13 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 1pp7 s LEU 14 N -2.92 4.04 0.31 0.55 0.05 -0.53 -5.06 118.68 115.11 1pp7 s LEU 14 Ca 0.10 0.08 -0.27 0.00 0.05 0.00 0.00 54.13 54.08 1pp7 s LEU 14 Cb 0.16 -2.67 -0.14 0.00 -2.05 0.00 0.00 46.19 41.50 1pp7 s LEU 14 CO 0.81 0.14 0.96 -2.65 -0.55 0.00 0.00 176.35 175.06 1pp7 n PRO 15 N 0.14 1.25 -0.28 1.48 -0.02 -1.26 -4.75 135.00 131.55 1pp7 n PRO 15 Ca -0.07 0.44 0.23 0.00 -2.02 0.00 0.00 63.50 62.07 1pp7 n PRO 15 Cb 0.52 -1.81 0.54 0.00 -0.02 0.00 0.00 33.50 32.73 1pp7 n PRO 15 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1pp7 h PRO 16 N 1.81 0.34 -0.25 0.52 0.11 -1.97 -0.65 132.00 131.91 1pp7 h PRO 16 Ca -0.40 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.69 1pp7 h PRO 16 Cb 1.35 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1pp7 h PRO 16 CO 0.59 0.22 0.14 1.49 -0.21 0.00 0.00 178.00 180.23 1pp7 h GLU 17 N 0.35 0.35 -0.40 1.05 4.81 -1.99 -0.83 114.58 117.92 1pp7 h GLU 17 Ca 0.53 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.61 1pp7 h GLU 17 Cb 1.44 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.75 1pp7 h GLU 17 CO -0.21 0.31 -0.20 0.82 -0.73 0.00 0.00 179.01 179.00 1pp7 h ILE 18 N 0.29 1.28 -0.50 2.32 1.08 -1.51 0.57 117.51 121.05 1pp7 h ILE 18 Ca 0.09 -1.34 0.02 0.00 -0.39 0.00 0.00 64.86 63.24 1pp7 h ILE 18 Cb 0.06 1.29 -0.03 0.00 -3.07 0.00 0.00 36.82 35.07 1pp7 h ILE 18 CO -0.01 0.45 0.29 0.58 -0.69 0.00 0.00 178.15 178.77 1pp7 h VAL 19 N 0.65 1.05 -0.38 1.67 2.07 -1.18 -0.06 116.25 120.06 1pp7 h VAL 19 Ca 0.09 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 1pp7 h VAL 19 Cb 0.76 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1pp7 h VAL 19 CO 0.06 0.11 0.04 0.00 0.02 0.00 0.00 177.57 177.80 1pp7 h ALA 20 N 1.22 0.50 0.00 1.67 0.00 -1.03 -1.49 119.26 120.13 1pp7 h ALA 20 Ca 0.20 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1pp7 h ALA 20 Cb 0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1pp7 h ALA 20 CO -0.09 0.23 -0.20 0.00 0.00 0.00 0.00 179.25 179.19 1pp7 h ALA 21 N 0.90 1.36 0.03 0.00 0.00 -0.45 -0.80 119.26 120.30 1pp7 h ALA 21 Ca 0.11 -0.18 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 1pp7 h ALA 21 Cb 0.40 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1pp7 h ALA 21 CO 0.01 0.25 -0.97 -0.07 0.00 0.00 0.00 179.25 178.48 1pp7 h LEU 22 N 0.00 0.32 -0.22 0.00 3.38 -0.81 -3.21 115.31 114.77 1pp7 h LEU 22 Ca -0.00 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.60 1pp7 h LEU 22 Cb 0.45 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1pp7 h LEU 22 CO 0.03 1.11 -0.41 0.50 0.09 0.00 0.00 178.44 179.76 1pp7 h LYS 23 N 0.12 0.00 -6.72 1.13 3.64 -0.55 -3.46 116.57 110.72 1pp7 h LYS 23 Ca -0.06 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.79 1pp7 h LYS 23 Cb 1.63 0.00 0.07 0.00 -0.41 0.00 0.00 32.23 33.51 1pp7 h LYS 23 CO 0.15 0.41 0.90 0.50 -2.27 0.00 0.00 179.45 179.15 1pp7 s ARG 24 N -3.12 4.16 0.52 1.90 3.52 -0.37 -4.94 118.95 120.62 1pp7 s ARG 24 Ca 0.04 2.51 -0.22 0.00 -0.13 0.00 0.00 55.73 57.92 1pp7 s ARG 24 Cb 0.08 -3.07 -0.06 0.00 -1.56 0.00 0.00 34.95 30.33 1pp7 s ARG 24 CO 0.72 -0.63 1.24 1.17 -0.81 0.00 0.00 175.30 176.99 1pp7 n LYS 25 N 3.04 1.57 -2.77 5.12 4.81 -1.26 -4.95 118.16 123.71 1pp7 n LYS 25 Ca 0.11 0.57 -0.43 0.00 -0.87 0.00 0.00 58.31 57.70 1pp7 n LYS 25 Cb 0.37 -2.42 -0.03 0.00 0.02 0.00 0.00 35.03 32.97 1pp7 n LYS 25 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1pp7 s SER 26 N -0.88 6.69 0.00 3.14 0.01 -1.26 -4.83 113.70 116.57 1pp7 s SER 26 Ca 0.69 0.58 0.00 0.00 1.31 0.00 0.00 55.95 58.53 1pp7 s SER 26 Cb -0.45 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.30 1pp7 s SER 26 CO 0.51 -0.91 0.00 -1.54 0.41 0.00 0.00 173.24 171.71 1pp7 n SER 27 N 6.92 0.13 0.11 2.44 3.41 -1.26 -5.01 113.62 120.35 1pp7 n SER 27 Ca 0.08 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.82 1pp7 n SER 27 Cb 0.48 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.74 1pp7 n SER 27 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1pp7 h ARG 28 N 0.00 0.00 -6.34 4.33 -0.00 -1.98 -3.44 114.38 106.95 1pp7 h ARG 28 Ca 0.00 0.00 -0.54 0.00 -0.50 0.00 0.00 59.98 58.94 1pp7 h ARG 28 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 29.97 29.98 1pp7 h ARG 28 CO 0.00 0.00 1.12 0.34 0.00 0.00 0.00 179.97 181.43 1pp7 s ASP 29 N -4.68 6.58 0.59 7.04 3.68 -1.26 -4.86 116.67 123.77 1pp7 s ASP 29 Ca 0.09 2.43 0.33 0.00 2.13 0.00 0.00 52.55 57.53 1pp7 s ASP 29 Cb 0.12 -2.54 1.87 0.00 -1.45 0.00 0.00 42.92 40.92 1pp7 s ASP 29 CO 0.64 -0.96 2.24 -0.65 0.13 0.00 0.00 175.17 176.57 1pp7 h PRO 30 N 9.59 0.00 0.00 4.34 0.11 -1.98 -1.14 132.00 142.92 1pp7 h PRO 30 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1pp7 h PRO 30 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1pp7 h PRO 30 CO 0.94 0.03 0.00 -0.91 -0.21 0.00 0.00 178.00 177.85 1pp7 h ASN 31 N 0.00 0.00 0.62 -2.05 4.21 -1.96 -2.87 115.58 113.52 1pp7 h ASN 31 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1pp7 h ASN 31 Cb 0.09 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.29 1pp7 h ASN 31 CO 0.00 0.00 -0.36 -1.54 -1.29 0.00 0.00 177.43 174.24 1pp7 n SER 32 N -2.55 0.38 -4.84 5.81 3.41 -0.44 -4.50 113.62 110.89 1pp7 n SER 32 Ca 0.05 -0.07 -0.32 0.00 -0.26 0.00 0.00 58.87 58.26 1pp7 n SER 32 Cb 0.45 0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 64.40 1pp7 n SER 32 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1pp7 s ARG 33 N -2.98 4.05 0.24 4.33 0.52 -1.09 -4.15 118.95 119.86 1pp7 s ARG 33 Ca 0.12 0.99 -0.07 0.00 -0.52 0.00 0.00 55.73 56.26 1pp7 s ARG 33 Cb 0.18 -2.17 0.43 0.00 0.52 0.00 0.00 34.95 33.91 1pp7 s ARG 33 CO 0.65 -0.16 1.67 0.35 0.02 0.00 0.00 175.30 177.82 1pp7 h PHE 34 N 1.32 0.13 -0.34 -0.53 3.04 -1.91 -1.32 116.94 117.34 1pp7 h PHE 34 Ca -0.48 0.05 0.06 0.00 3.98 0.00 0.00 57.97 61.58 1pp7 h PHE 34 Cb 1.18 0.05 -0.06 0.00 2.56 0.00 0.00 35.95 39.69 1pp7 h PHE 34 CO 0.63 -0.14 -0.03 -1.35 -2.02 0.00 0.00 178.31 175.40 1pp7 h PRO 35 N 0.19 0.06 0.00 6.41 0.11 -1.94 0.31 132.00 137.14 1pp7 h PRO 35 Ca 0.40 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.44 1pp7 h PRO 35 Cb 0.68 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.77 1pp7 h PRO 35 CO -0.55 0.04 -0.30 0.00 -0.21 0.00 0.00 178.00 176.98 1pp7 h ARG 36 N 0.06 0.00 -0.14 1.05 3.08 -1.69 0.24 114.38 116.98 1pp7 h ARG 36 Ca 0.17 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.15 1pp7 h ARG 36 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 1pp7 h ARG 36 CO -0.30 0.30 -0.19 0.87 -1.07 0.00 0.00 179.97 179.58 1pp7 h LYS 37 N 0.00 0.37 -0.68 0.04 1.57 -0.51 0.20 116.57 117.57 1pp7 h LYS 37 Ca -0.00 -0.22 0.02 0.00 -1.87 0.00 0.00 60.65 58.58 1pp7 h LYS 37 Cb 0.96 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.25 1pp7 h LYS 37 CO 0.04 0.79 0.44 1.25 -0.57 0.00 0.00 179.45 181.40 1pp7 h LEU 38 N -0.02 0.74 -0.39 2.94 6.46 0.06 -1.36 115.31 123.74 1pp7 h LEU 38 Ca 0.02 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.72 1pp7 h LEU 38 Cb 0.75 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.49 1pp7 h LEU 38 CO 0.04 0.53 0.07 -0.74 -0.62 0.00 0.00 178.44 177.73 1pp7 h HIS 39 N 0.88 0.67 -0.07 1.25 2.76 -0.45 -0.06 115.15 120.13 1pp7 h HIS 39 Ca 0.26 -0.09 -0.06 0.00 -2.20 0.00 0.00 60.37 58.28 1pp7 h HIS 39 Cb -0.05 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.71 1pp7 h HIS 39 CO -0.03 0.66 -0.22 0.52 -1.30 0.00 0.00 177.93 177.56 1pp7 h MET 40 N 0.48 0.11 0.05 5.26 2.86 -0.29 0.85 114.93 124.25 1pp7 h MET 40 Ca 0.12 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1pp7 h MET 40 Cb 0.35 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1pp7 h MET 40 CO 0.01 0.33 -0.02 1.25 1.06 0.00 0.00 176.91 179.53 1pp7 h LEU 41 N 0.10 -0.06 -0.16 1.22 6.46 -0.59 -1.01 115.31 121.28 1pp7 h LEU 41 Ca 0.02 -0.38 0.03 0.00 -0.12 0.00 0.00 57.88 57.43 1pp7 h LEU 41 Cb 0.45 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.37 1pp7 h LEU 41 CO 0.03 0.35 -0.05 0.25 -0.62 0.00 0.00 178.44 178.40 1pp7 h LEU 42 N -0.48 -0.18 -0.43 2.25 5.85 -0.89 0.11 115.31 121.54 1pp7 h LEU 42 Ca -0.01 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1pp7 h LEU 42 Cb 0.43 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1pp7 h LEU 42 CO 0.01 -0.07 0.19 0.74 -0.34 0.00 0.00 178.44 178.97 1pp7 h THR 43 N -0.02 0.93 -0.13 1.05 2.02 -0.78 -2.27 112.91 113.70 1pp7 h THR 43 Ca 0.08 -0.13 -0.20 0.00 0.77 0.00 0.00 66.41 66.93 1pp7 h THR 43 Cb 0.14 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1pp7 h THR 43 CO -0.17 0.07 -0.72 0.22 0.37 0.00 0.00 175.52 175.28 1pp7 h TYR 44 N 0.38 0.78 0.00 3.16 5.03 -0.61 -2.80 116.97 122.92 1pp7 h TYR 44 Ca 0.19 -0.34 -0.02 0.00 2.58 0.00 0.00 58.73 61.15 1pp7 h TYR 44 Cb 0.13 -0.12 -0.00 0.00 1.55 0.00 0.00 36.73 38.29 1pp7 h TYR 44 CO -0.12 1.12 -0.07 -0.07 -1.32 0.00 0.00 178.16 177.70 1pp7 h LEU 45 N 0.41 0.00 -2.09 2.82 3.38 -0.51 -1.49 115.31 117.83 1pp7 h LEU 45 Ca -0.03 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.02 1pp7 h LEU 45 Cb 1.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 1pp7 h LEU 45 CO 0.14 0.07 0.33 0.00 0.09 0.00 0.00 178.44 179.07 1pp7 h ALA 46 N 1.93 1.97 -0.01 1.53 0.00 -1.13 0.16 119.26 123.71 1pp7 h ALA 46 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pp7 h ALA 46 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1pp7 h ALA 46 CO 0.01 -0.48 -0.57 -1.13 0.00 0.00 0.00 179.25 177.07 1pp7 n SER 47 N -3.76 1.33 -3.85 0.00 3.41 -0.57 -4.71 113.62 105.48 1pp7 n SER 47 Ca 0.05 -1.17 -0.29 0.00 -0.26 0.00 0.00 58.87 57.20 1pp7 n SER 47 Cb 0.48 0.71 -0.12 0.00 -0.26 0.00 0.00 64.21 65.01 1pp7 n SER 47 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1pp7 s ASN 48 N -2.33 4.33 0.29 4.04 3.84 0.56 -4.96 114.94 120.71 1pp7 s ASN 48 Ca 0.11 -3.50 0.02 0.00 0.21 0.00 0.00 52.86 49.70 1pp7 s ASN 48 Cb 0.14 -1.49 0.59 0.00 -0.55 0.00 0.00 41.25 39.94 1pp7 s ASN 48 CO 0.57 -0.14 1.82 -0.65 -2.79 0.00 0.00 177.10 175.91 1pp7 h PRO 49 N 5.77 0.92 0.34 0.43 0.11 -1.84 0.71 132.00 138.44 1pp7 h PRO 49 Ca 0.09 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.13 1pp7 h PRO 49 Cb 0.81 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.72 1pp7 h PRO 49 CO 0.66 0.61 -0.16 0.37 -0.21 0.00 0.00 178.00 179.27 1pp7 h GLN 50 N 0.95 -0.43 -0.76 1.05 4.15 -1.93 -1.87 115.11 116.27 1pp7 h GLN 50 Ca 0.52 0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.92 1pp7 h GLN 50 Cb 0.58 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.33 1pp7 h GLN 50 CO -0.29 -0.12 0.28 1.25 -1.93 0.00 0.00 178.83 178.02 1pp7 h LEU 51 N -0.80 1.08 -1.63 -2.39 6.46 -1.89 -1.55 115.31 114.59 1pp7 h LEU 51 Ca -0.05 -0.19 0.12 0.00 -0.12 0.00 0.00 57.88 57.65 1pp7 h LEU 51 Cb 0.52 -0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 1pp7 h LEU 51 CO 0.08 0.97 0.44 -0.08 -0.62 0.00 0.00 178.44 179.23 1pp7 h GLU 52 N 1.12 0.38 0.26 1.25 4.81 -0.82 0.11 114.58 121.69 1pp7 h GLU 52 Ca 0.25 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1pp7 h GLU 52 Cb 0.25 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1pp7 h GLU 52 CO -0.02 0.25 -0.13 0.93 -0.73 0.00 0.00 179.01 179.32 1pp7 h GLU 53 N 0.39 -0.34 -0.61 1.92 5.08 -0.44 0.89 114.58 121.48 1pp7 h GLU 53 Ca 0.31 0.02 0.13 0.00 -1.00 0.00 0.00 59.36 58.82 1pp7 h GLU 53 Cb 0.68 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 29.90 1pp7 h GLU 53 CO -0.09 -0.23 -0.09 0.93 -1.00 0.00 0.00 179.01 178.53 1pp7 h GLU 54 N -0.49 0.04 0.10 2.33 4.39 -1.06 -3.01 114.58 116.87 1pp7 h GLU 54 Ca -0.04 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1pp7 h GLU 54 Cb 0.27 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1pp7 h GLU 54 CO 0.06 0.03 -0.05 0.82 -1.16 0.00 0.00 179.01 178.71 1pp7 h ILE 55 N 0.04 0.82 -1.10 3.13 2.04 -0.90 -3.50 117.51 118.05 1pp7 h ILE 55 Ca 0.31 -1.36 0.00 0.00 1.00 0.00 0.00 64.86 64.81 1pp7 h ILE 55 Cb 0.48 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 1pp7 h ILE 55 CO -0.59 0.25 0.00 0.61 0.00 0.00 0.00 178.15 178.42 1pp7 n GLY 56 N 1.11 0.24 3.15 5.37 0.00 0.31 -4.34 105.19 111.03 1pp7 n GLY 56 Ca -0.06 -0.47 0.05 0.00 0.00 0.00 0.00 46.02 45.53 1pp7 n GLY 56 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pp7 s LEU 57 N -0.44 -1.12 -0.01 0.99 2.96 -1.23 -0.57 118.68 119.27 1pp7 s LEU 57 Ca 0.00 0.11 -0.21 0.00 -0.22 0.00 0.00 54.13 53.81 1pp7 s LEU 57 Cb 0.00 1.70 0.04 0.00 0.50 0.00 0.00 46.19 48.43 1pp7 s LEU 57 CO 0.00 -0.20 0.46 -0.94 -1.32 0.00 0.00 176.35 174.35 1pp7 s SER 58 N 2.86 -0.38 0.28 3.68 1.04 -0.78 -4.84 113.70 115.56 1pp7 s SER 58 Ca 0.18 0.28 -0.29 0.00 0.48 0.00 0.00 55.95 56.60 1pp7 s SER 58 Cb -0.06 0.42 -0.10 0.00 0.10 0.00 0.00 66.02 66.38 1pp7 s SER 58 CO -0.24 -0.56 1.13 0.26 0.98 0.00 0.00 173.24 174.81 1pp7 s TRP 59 N -1.55 3.50 -0.36 5.02 0.52 -1.26 -1.40 118.94 123.41 1pp7 s TRP 59 Ca -0.11 1.65 0.14 0.00 0.02 0.00 0.00 56.10 57.80 1pp7 s TRP 59 Cb -0.02 -3.35 -0.19 0.00 -1.15 0.00 0.00 33.47 28.76 1pp7 s TRP 59 CO 0.05 -0.76 0.46 0.44 0.02 0.00 0.00 176.95 177.16 1pp7 n ILE 60 N 1.23 0.00 -3.60 2.03 -5.35 0.13 -4.92 119.36 108.88 1pp7 n ILE 60 Ca -0.01 -0.25 -0.07 0.00 -0.27 0.00 0.00 62.75 62.16 1pp7 n ILE 60 Cb 0.44 0.61 0.01 0.00 -1.74 0.00 0.00 39.64 38.96 1pp7 n ILE 60 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1pp7 n SER 61 N -1.65 -1.32 0.32 7.28 3.41 -1.14 -4.95 113.62 115.57 1pp7 n SER 61 Ca 0.00 -2.07 0.21 0.00 -0.26 0.00 0.00 58.87 56.74 1pp7 n SER 61 Cb 0.29 2.24 1.11 0.00 -0.26 0.00 0.00 64.21 67.59 1pp7 n SER 61 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1pp7 h ASP 62 N 1.27 0.00 0.00 4.04 3.32 -2.00 -3.30 116.42 119.75 1pp7 h ASP 62 Ca -0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1pp7 h ASP 62 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1pp7 h ASP 62 CO 0.26 0.01 0.00 0.35 -1.72 0.00 0.00 179.24 178.14 1pp7 n THR 63 N -3.27 0.11 -4.19 0.35 -2.24 -1.26 -1.81 114.28 101.97 1pp7 n THR 63 Ca -0.03 -0.35 -0.18 0.00 -2.27 0.00 0.00 64.05 61.22 1pp7 n THR 63 Cb 0.10 1.28 -0.12 0.00 -2.10 0.00 0.00 70.33 69.49 1pp7 n THR 63 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1pp7 s GLU 64 N -0.11 0.82 0.11 -0.78 2.02 -1.24 -4.52 118.70 114.99 1pp7 s GLU 64 Ca 0.00 -0.92 0.01 0.00 0.02 0.00 0.00 54.97 54.08 1pp7 s GLU 64 Cb 0.00 -0.81 -0.04 0.00 0.10 0.00 0.00 34.13 33.37 1pp7 s GLU 64 CO 0.00 0.18 -0.02 -0.59 0.02 0.00 0.00 175.26 174.85 1pp7 s PHE 65 N -1.22 0.86 0.18 1.61 -0.71 -0.21 -0.69 117.98 117.80 1pp7 s PHE 65 Ca -0.02 -1.03 0.08 0.00 -1.04 0.00 0.00 56.93 54.92 1pp7 s PHE 65 Cb -0.10 -0.51 -0.04 0.00 -1.21 0.00 0.00 43.02 41.16 1pp7 s PHE 65 CO 0.02 -0.29 -0.16 -1.59 -1.34 0.00 0.00 175.22 171.86 1pp7 s LYS 66 N -3.91 1.29 0.21 1.99 -2.85 -0.49 0.73 119.74 116.70 1pp7 s LYS 66 Ca 0.15 -1.49 -0.21 0.00 -1.00 0.00 0.00 55.97 53.42 1pp7 s LYS 66 Cb 0.07 -1.19 0.04 0.00 -2.06 0.00 0.00 37.83 34.68 1pp7 s LYS 66 CO -0.03 0.22 0.64 0.00 0.10 0.00 0.00 175.35 176.28 1pp7 s MET 67 N -3.21 1.50 -0.45 1.78 0.23 0.35 -1.87 119.30 117.63 1pp7 s MET 67 Ca 0.19 -0.74 -0.07 0.00 -1.03 0.00 0.00 55.69 54.04 1pp7 s MET 67 Cb -0.03 0.59 0.12 0.00 -1.53 0.00 0.00 34.83 33.97 1pp7 s MET 67 CO 0.07 -0.67 0.29 0.15 -2.03 0.00 0.00 175.02 172.83 1pp7 s LYS 68 N -3.84 2.29 0.29 3.16 1.02 0.27 -0.61 119.74 122.31 1pp7 s LYS 68 Ca 0.06 -1.81 0.02 0.00 0.02 0.00 0.00 55.97 54.27 1pp7 s LYS 68 Cb -0.03 -3.79 0.59 0.00 -0.52 0.00 0.00 37.83 34.08 1pp7 s LYS 68 CO -0.03 -1.15 1.83 0.87 -0.92 0.00 0.00 175.35 175.95 1pp7 h LYS 69 N 8.26 0.93 -0.71 1.68 1.57 -1.87 -1.30 116.57 125.14 1pp7 h LYS 69 Ca -0.17 -0.06 0.15 0.00 -1.87 0.00 0.00 60.65 58.70 1pp7 h LYS 69 Cb 1.06 -0.21 -0.10 0.00 0.08 0.00 0.00 32.23 33.06 1pp7 h LYS 69 CO 0.79 0.62 0.16 -0.22 -0.57 0.00 0.00 179.45 180.23 1pp7 h LYS 70 N 0.96 0.26 0.08 3.15 3.64 -1.94 0.29 116.57 123.00 1pp7 h LYS 70 Ca 0.51 -0.02 -0.27 0.00 -1.27 0.00 0.00 60.65 59.60 1pp7 h LYS 70 Cb 0.56 -0.06 0.02 0.00 -0.41 0.00 0.00 32.23 32.33 1pp7 h LYS 70 CO -0.28 0.17 -1.14 -0.91 -2.27 0.00 0.00 179.45 175.02 1pp7 h ASN 71 N 0.27 0.70 -0.48 4.20 4.21 -1.55 -3.08 115.58 119.85 1pp7 h ASN 71 Ca 0.39 -0.63 -0.08 0.00 1.21 0.00 0.00 56.30 57.19 1pp7 h ASN 71 Cb 0.65 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.61 1pp7 h ASN 71 CO -0.49 1.45 -0.00 0.58 -1.29 0.00 0.00 177.43 177.68 1pp7 h VAL 72 N 0.24 1.25 -0.73 2.81 2.07 -0.74 -1.52 116.25 119.65 1pp7 h VAL 72 Ca -0.14 -1.08 -0.06 0.00 0.82 0.00 0.00 66.70 66.25 1pp7 h VAL 72 Cb 1.81 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.39 1pp7 h VAL 72 CO 0.21 0.38 0.24 0.00 0.02 0.00 0.00 177.57 178.42 1pp7 h ALA 73 N 1.15 0.95 0.79 1.67 0.00 -0.50 -2.51 119.26 120.81 1pp7 h ALA 73 Ca 0.16 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1pp7 h ALA 73 Cb 0.50 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.02 1pp7 h ALA 73 CO 0.02 0.62 -0.38 -0.07 0.00 0.00 0.00 179.25 179.45 1pp7 h LEU 74 N 1.07 -0.90 -2.23 0.00 3.38 -1.28 -1.42 115.31 113.93 1pp7 h LEU 74 Ca 0.24 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.26 1pp7 h LEU 74 Cb 0.29 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1pp7 h LEU 74 CO -0.01 -0.63 0.26 -0.37 0.09 0.00 0.00 178.44 177.78 1pp7 h VAL 75 N -1.08 0.12 0.00 1.22 -1.51 -1.34 0.77 116.25 114.44 1pp7 h VAL 75 Ca -0.11 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.36 1pp7 h VAL 75 Cb 0.81 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.73 1pp7 h VAL 75 CO 0.18 0.00 -0.72 0.23 -1.23 0.00 0.00 177.57 176.03 1pp7 n MET 76 N -3.18 0.20 -2.30 5.19 2.81 -0.95 -4.96 117.12 113.93 1pp7 n MET 76 Ca -0.00 0.03 -0.03 0.00 -1.81 0.00 0.00 57.70 55.89 1pp7 n MET 76 Cb 0.34 -1.60 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 1pp7 n MET 76 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1pp7 n GLY 77 N 1.40 0.45 3.05 3.03 0.00 0.26 -4.77 105.19 108.61 1pp7 n GLY 77 Ca 0.03 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 1pp7 n GLY 77 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pp7 s ILE 78 N -2.51 0.52 0.81 -0.61 -4.36 -0.76 -5.05 121.20 109.23 1pp7 s ILE 78 Ca 0.03 -0.96 -0.13 0.00 -0.26 0.00 0.00 60.65 59.33 1pp7 s ILE 78 Cb -0.02 -0.57 0.08 0.00 1.25 0.00 0.00 42.46 43.21 1pp7 s ILE 78 CO 0.04 -0.32 1.21 -0.54 0.24 0.00 0.00 174.94 175.57 1pp7 s LYS 79 N -1.38 1.63 0.21 0.37 -0.14 -1.26 -4.28 119.74 114.88 1pp7 s LYS 79 Ca -0.08 1.76 -0.11 0.00 -1.36 0.00 0.00 55.97 56.18 1pp7 s LYS 79 Cb -0.09 -1.77 0.28 0.00 -1.68 0.00 0.00 37.83 34.56 1pp7 s LYS 79 CO 0.00 -2.22 1.67 1.25 -0.76 0.00 0.00 175.35 175.29 1pp7 h LEU 80 N -0.91 -0.21 -0.86 3.17 6.46 -1.92 -0.99 115.31 120.06 1pp7 h LEU 80 Ca -0.46 0.14 0.07 0.00 -0.12 0.00 0.00 57.88 57.51 1pp7 h LEU 80 Cb 1.30 0.24 -0.06 0.00 -0.73 0.00 0.00 40.66 41.40 1pp7 h LEU 80 CO 0.46 -0.09 0.52 -1.13 -0.62 0.00 0.00 178.44 177.59 1pp7 h ASN 81 N 0.14 0.81 1.00 1.25 -0.73 -2.00 0.10 115.58 116.16 1pp7 h ASN 81 Ca 0.31 0.02 -0.09 0.00 1.87 0.00 0.00 56.30 58.41 1pp7 h ASN 81 Cb 0.49 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 38.92 1pp7 h ASN 81 CO -0.49 0.50 -0.43 0.00 -0.37 0.00 0.00 177.43 176.65 1pp7 h THR 82 N 0.93 0.90 -0.06 -3.57 1.03 -1.56 -0.84 112.91 109.74 1pp7 h THR 82 Ca 0.39 -1.75 0.00 0.00 -0.01 0.00 0.00 66.41 65.03 1pp7 h THR 82 Cb 0.23 2.08 -0.00 0.00 -1.07 0.00 0.00 68.15 69.38 1pp7 h THR 82 CO -0.19 0.42 0.04 0.25 -0.01 0.00 0.00 175.52 176.02 1pp7 h LEU 83 N 0.00 0.07 -0.52 0.00 6.46 -0.11 0.40 115.31 121.61 1pp7 h LEU 83 Ca -0.00 -0.02 0.01 0.00 -0.12 0.00 0.00 57.88 57.74 1pp7 h LEU 83 Cb 1.04 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.93 1pp7 h LEU 83 CO 0.06 0.07 0.34 0.78 -0.62 0.00 0.00 178.44 179.07 1pp7 h ASN 84 N 0.07 0.58 -0.59 1.25 2.35 -0.90 -0.63 115.58 117.71 1pp7 h ASN 84 Ca 0.02 -0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.79 1pp7 h ASN 84 Cb 0.01 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.20 1pp7 h ASN 84 CO -0.00 0.42 0.36 0.58 -1.65 0.00 0.00 177.43 177.13 1pp7 h VAL 85 N 0.69 1.07 -0.74 2.81 2.07 -0.68 -1.06 116.25 120.41 1pp7 h VAL 85 Ca 0.19 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 1pp7 h VAL 85 Cb -0.07 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 29.97 1pp7 h VAL 85 CO -0.05 0.13 0.30 0.78 0.02 0.00 0.00 177.57 178.75 1pp7 h ASN 86 N 0.71 1.02 -0.16 0.57 2.35 -0.30 0.75 115.58 120.52 1pp7 h ASN 86 Ca 0.24 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 1pp7 h ASN 86 Cb 0.02 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.12 1pp7 h ASN 86 CO -0.10 0.92 0.07 -0.07 -1.65 0.00 0.00 177.43 176.60 1pp7 h LEU 87 N 1.07 0.21 0.43 1.61 3.38 -0.77 -0.85 115.31 120.39 1pp7 h LEU 87 Ca 0.25 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1pp7 h LEU 87 Cb 0.21 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1pp7 h LEU 87 CO -0.02 0.29 -0.51 -0.09 0.09 0.00 0.00 178.44 178.20 1pp7 h ARG 88 N 0.12 -0.93 0.00 1.13 9.65 -1.04 -1.12 114.38 122.19 1pp7 h ARG 88 Ca 0.05 0.06 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 1pp7 h ARG 88 Cb 0.14 0.21 0.00 0.00 -1.39 0.00 0.00 29.97 28.93 1pp7 h ARG 88 CO -0.01 -0.62 0.00 -0.44 2.80 0.00 0.00 179.97 181.70 1pp7 h ASP 89 N -0.97 0.00 -0.73 -3.80 3.45 -0.84 -2.72 116.42 110.82 1pp7 h ASP 89 Ca -0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.41 1pp7 h ASP 89 Cb 0.86 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.63 1pp7 h ASP 89 CO -0.11 0.00 0.00 0.18 -1.57 0.00 0.00 179.24 177.74 1pp7 n LEU 90 N -2.95 3.93 -2.32 1.55 4.77 -0.33 -4.97 117.00 116.68 1pp7 n LEU 90 Ca 0.01 -1.96 -0.13 0.00 -0.03 0.00 0.00 56.01 53.89 1pp7 n LEU 90 Cb 0.28 -0.49 0.05 0.00 -2.33 0.00 0.00 43.42 40.93 1pp7 n LEU 90 CO 0.26 0.97 0.13 0.00 -1.33 0.00 0.00 177.39 177.42 1pp7 n ALA 91 N 1.61 -0.82 -2.19 -1.18 0.00 -1.00 -5.02 120.51 111.91 1pp7 n ALA 91 Ca 0.24 0.20 -0.38 0.00 0.00 0.00 0.00 53.44 53.50 1pp7 n ALA 91 Cb 0.62 -3.18 -0.06 0.00 0.00 0.00 0.00 19.45 16.84 1pp7 n ALA 91 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1pp7 s PHE 92 N -3.19 3.81 -0.19 0.00 0.08 -0.46 -4.56 117.98 113.47 1pp7 s PHE 92 Ca 0.29 1.37 -0.01 0.00 0.12 0.00 0.00 56.93 58.70 1pp7 s PHE 92 Cb -0.13 -2.57 0.01 0.00 -0.57 0.00 0.00 43.02 39.75 1pp7 s PHE 92 CO 0.42 0.54 -0.13 -2.00 -0.10 0.00 0.00 175.22 173.96 1pp7 s GLU 93 N -1.24 3.18 0.05 0.44 2.12 0.78 -4.69 118.70 119.34 1pp7 s GLU 93 Ca 0.32 -0.73 -0.30 0.00 0.36 0.00 0.00 54.97 54.61 1pp7 s GLU 93 Cb -0.20 -2.76 -0.05 0.00 0.26 0.00 0.00 34.13 31.38 1pp7 s GLU 93 CO 0.21 -0.17 1.22 -1.14 -0.54 0.00 0.00 175.26 174.84 1pp7 s GLN 94 N 1.29 4.41 0.00 4.30 0.74 -1.26 -2.07 119.66 127.06 1pp7 s GLN 94 Ca 0.04 1.78 0.12 0.00 0.05 0.00 0.00 55.36 57.35 1pp7 s GLN 94 Cb -0.14 -3.38 0.10 0.00 1.10 0.00 0.00 33.01 30.69 1pp7 s GLN 94 CO -0.07 -0.30 0.90 1.28 -0.55 0.00 0.00 175.29 176.54 1pp7 n LEU 95 N 4.16 2.05 -3.63 3.68 4.77 -0.26 -4.99 117.00 122.77 1pp7 n LEU 95 Ca 0.09 -1.02 -0.11 0.00 -0.03 0.00 0.00 56.01 54.94 1pp7 n LEU 95 Cb 0.46 -0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 1pp7 n LEU 95 CO 0.56 0.39 0.46 -1.58 -1.33 0.00 0.00 177.39 175.88 1pp7 s GLN 96 N -1.03 0.75 0.78 3.23 0.74 -1.23 -4.89 119.66 118.01 1pp7 s GLN 96 Ca 0.15 0.98 -0.13 0.00 0.05 0.00 0.00 55.36 56.41 1pp7 s GLN 96 Cb 0.10 0.32 0.07 0.00 1.10 0.00 0.00 33.01 34.60 1pp7 s GLN 96 CO 0.15 -0.10 1.15 -1.58 -0.55 0.00 0.00 175.29 174.36 1pp7 s HIS 97 N 0.67 2.13 0.19 1.67 5.65 -1.26 -3.88 115.29 120.46 1pp7 s HIS 97 Ca -0.02 1.64 -0.32 0.00 0.25 0.00 0.00 55.06 56.61 1pp7 s HIS 97 Cb -0.05 -3.30 -0.11 0.00 -1.18 0.00 0.00 32.58 27.95 1pp7 s HIS 97 CO -0.05 -2.34 1.61 0.34 -0.65 0.00 0.00 174.74 173.65 1pp7 s ASP 98 N -2.58 6.51 -0.22 9.88 -1.08 -1.26 -4.69 116.67 123.23 1pp7 s ASP 98 Ca 0.68 2.72 -0.04 0.00 -0.52 0.00 0.00 52.55 55.39 1pp7 s ASP 98 Cb -0.23 -2.60 0.08 0.00 -1.46 0.00 0.00 42.92 38.71 1pp7 s ASP 98 CO 0.50 -0.87 0.12 -0.54 0.52 0.00 0.00 175.17 174.90 1pp7 s LYS 99 N 0.98 0.12 -1.39 4.34 1.02 -0.66 -4.81 119.74 119.36 1pp7 s LYS 99 Ca 0.71 -0.24 -0.09 0.00 0.02 0.00 0.00 55.97 56.37 1pp7 s LYS 99 Cb -0.46 -1.51 0.03 0.00 -0.52 0.00 0.00 37.83 35.37 1pp7 s LYS 99 CO 0.33 -0.81 1.10 0.41 -0.92 0.00 0.00 175.35 175.45 1pp7 n GLY 100 N 5.27 -0.50 3.13 -3.33 0.00 -1.26 -1.35 105.19 107.15 1pp7 n GLY 100 Ca -0.06 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1pp7 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pp7 n GLY 101 N -1.83 0.65 3.88 -0.02 0.00 -1.26 -5.00 105.19 101.61 1pp7 n GLY 101 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1pp7 n GLY 101 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pp7 s TRP 102 N -2.89 3.60 0.06 1.61 0.52 -0.46 -3.99 118.94 117.38 1pp7 s TRP 102 Ca 0.00 0.52 0.02 0.00 0.02 0.00 0.00 56.10 56.66 1pp7 s TRP 102 Cb 0.00 -1.94 -0.03 0.00 -1.15 0.00 0.00 33.47 30.36 1pp7 s TRP 102 CO 0.00 0.72 -0.08 -0.08 0.02 0.00 0.00 176.95 177.53 1pp7 s THR 103 N -1.09 0.62 0.13 2.01 -1.32 0.22 -1.65 115.64 114.56 1pp7 s THR 103 Ca 0.18 -1.33 0.10 0.00 -1.21 0.00 0.00 61.69 59.43 1pp7 s THR 103 Cb -0.12 -0.93 -0.04 0.00 -1.51 0.00 0.00 72.50 69.90 1pp7 s THR 103 CO 0.07 -0.51 -0.26 -1.10 -2.21 0.00 0.00 174.62 170.62 1pp7 s GLN 104 N -2.20 1.35 0.15 7.08 -0.21 -1.25 -0.49 119.66 124.09 1pp7 s GLN 104 Ca -0.04 -1.32 -0.09 0.00 0.02 0.00 0.00 55.36 53.93 1pp7 s GLN 104 Cb -0.06 -1.79 -0.01 0.00 1.00 0.00 0.00 33.01 32.15 1pp7 s GLN 104 CO -0.01 0.42 0.27 -1.58 -2.12 0.00 0.00 175.29 172.28 1pp7 s TRP 105 N -1.11 0.34 0.15 0.91 0.52 0.22 -1.11 118.94 118.86 1pp7 s TRP 105 Ca 0.13 -0.71 -0.18 0.00 0.02 0.00 0.00 56.10 55.35 1pp7 s TRP 105 Cb -0.10 -0.05 0.04 0.00 -1.15 0.00 0.00 33.47 32.22 1pp7 s TRP 105 CO 0.06 -0.69 0.47 -1.59 0.02 0.00 0.00 176.95 175.22 1pp7 s LYS 106 N -3.95 1.18 -0.28 4.98 -2.85 -0.88 -1.05 119.74 116.90 1pp7 s LYS 106 Ca 0.15 -0.67 -0.20 0.00 -1.00 0.00 0.00 55.97 54.24 1pp7 s LYS 106 Cb 0.03 0.51 0.09 0.00 -2.06 0.00 0.00 37.83 36.40 1pp7 s LYS 106 CO -0.02 -0.49 0.77 0.50 0.10 0.00 0.00 175.35 176.21 1pp7 s ARG 107 N -3.80 0.70 0.22 1.78 3.52 -1.26 -0.16 118.95 119.95 1pp7 s ARG 107 Ca 0.04 1.02 -0.32 0.00 -0.13 0.00 0.00 55.73 56.34 1pp7 s ARG 107 Cb 0.01 0.24 -0.12 0.00 -1.56 0.00 0.00 34.95 33.52 1pp7 s ARG 107 CO -0.11 -0.12 1.71 -1.54 -0.81 0.00 0.00 175.30 174.44 1pp7 s SER 108 N 0.99 6.37 -0.10 -2.12 1.04 -1.26 -1.51 113.70 117.12 1pp7 s SER 108 Ca -0.05 2.89 0.00 0.00 0.48 0.00 0.00 55.95 59.27 1pp7 s SER 108 Cb -0.05 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.47 1pp7 s SER 108 CO -0.10 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.76 1pp7 n GLY 109 N 3.68 0.47 3.12 7.32 0.00 -1.26 -4.67 105.19 113.86 1pp7 n GLY 109 Ca 0.15 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1pp7 n GLY 109 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1pp7 s PHE 110 N -1.90 3.54 0.31 1.61 2.19 -0.57 -1.18 117.98 121.97 1pp7 s PHE 110 Ca 0.00 -2.34 0.03 0.00 0.33 0.00 0.00 56.93 54.95 1pp7 s PHE 110 Cb 0.00 -2.95 -0.02 0.00 -1.31 0.00 0.00 43.02 38.74 1pp7 s PHE 110 CO 0.00 -0.93 0.31 0.95 1.83 0.00 0.00 175.22 177.38 1pp7 s THR 111 N 1.15 0.00 0.28 0.12 -4.23 0.12 -4.56 115.64 108.52 1pp7 s THR 111 Ca 0.06 -1.88 -0.05 0.00 -1.18 0.00 0.00 61.69 58.63 1pp7 s THR 111 Cb -0.22 -2.53 0.40 0.00 1.34 0.00 0.00 72.50 71.50 1pp7 s THR 111 CO -0.04 0.00 1.58 -0.09 -0.54 0.00 0.00 174.62 175.53 1pp7 h ARG 112 N 2.21 0.01 -0.22 3.99 9.65 -1.66 -1.86 114.38 126.51 1pp7 h ARG 112 Ca -0.27 -0.00 -0.17 0.00 -1.10 0.00 0.00 59.98 58.43 1pp7 h ARG 112 Cb 1.24 -0.00 -0.17 0.00 -1.39 0.00 0.00 29.97 29.65 1pp7 h ARG 112 CO 0.39 0.01 -0.66 0.27 2.80 0.00 0.00 179.97 182.79 1pp7 n ASN 113 N -5.53 2.51 -3.64 -3.80 0.23 -1.26 -4.98 115.26 98.79 1pp7 n ASN 113 Ca 0.17 -3.63 -0.14 0.00 -0.53 0.00 0.00 54.58 50.45 1pp7 n ASN 113 Cb 0.56 -0.46 -0.08 0.00 -2.08 0.00 0.00 39.78 37.73 1pp7 n ASN 113 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1pp7 s SER 114 N -3.25 -0.62 -0.25 0.53 1.04 -0.70 -5.11 113.70 105.34 1pp7 s SER 114 Ca 0.41 1.09 -0.03 0.00 0.48 0.00 0.00 55.95 57.90 1pp7 s SER 114 Cb 0.38 1.08 0.08 0.00 0.10 0.00 0.00 66.02 67.67 1pp7 s SER 114 CO -0.05 -0.30 0.08 -0.69 0.98 0.00 0.00 173.24 173.26 1pp7 s VAL 115 N -0.05 0.41 0.70 5.02 1.01 -1.14 0.15 120.40 126.50 1pp7 s VAL 115 Ca -0.03 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1pp7 s VAL 115 Cb -0.04 -1.14 0.11 0.00 0.00 0.00 0.00 36.38 35.31 1pp7 s VAL 115 CO 0.03 -0.48 0.97 -0.36 0.00 0.00 0.00 175.10 175.27 1pp7 s PHE 116 N 1.88 1.80 0.00 5.22 2.99 -0.33 -4.96 117.98 124.59 1pp7 s PHE 116 Ca 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 56.93 56.78 1pp7 s PHE 116 Cb -0.17 -3.00 0.00 0.00 0.00 0.00 0.00 43.02 39.86 1pp7 s PHE 116 CO -0.20 -1.61 0.00 0.39 -0.00 0.00 0.00 175.22 173.80 1pp7 n GLU 117 N -2.80 0.00 0.00 0.44 1.02 -1.26 -4.98 120.64 113.06 1pp7 n GLU 117 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1pp7 n GLU 117 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.02 1pp7 n GLU 117 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06