#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xx7 h ILE 2 N 0.00 1.24 -0.62 2.46 1.08 -2.05 -2.94 117.51 116.68 1xx7 h ILE 2 Ca 0.00 -1.15 -0.00 0.00 -0.39 0.00 0.00 64.86 63.32 1xx7 h ILE 2 Cb 0.00 1.60 -0.03 0.00 -3.07 0.00 0.00 36.82 35.32 1xx7 h ILE 2 CO 0.00 0.33 0.38 0.44 -0.69 0.00 0.00 178.15 178.61 1xx7 h ASP 3 N 0.02 0.74 -0.61 1.72 3.32 -2.05 0.22 116.42 119.79 1xx7 h ASP 3 Ca 0.00 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 56.93 1xx7 h ASP 3 Cb 0.59 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 1xx7 h ASP 3 CO 0.04 0.57 0.12 -0.07 -1.72 0.00 0.00 179.24 178.19 1xx7 h LEU 4 N 0.84 0.97 -0.25 1.55 3.38 -1.96 0.21 115.31 120.05 1xx7 h LEU 4 Ca 0.22 -0.21 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 1xx7 h LEU 4 Cb -0.04 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 1xx7 h LEU 4 CO -0.04 0.95 -0.33 0.40 0.09 0.00 0.00 178.44 179.51 1xx7 h ILE 5 N 0.96 1.31 -0.55 1.22 2.04 -1.26 -0.17 117.51 121.07 1xx7 h ILE 5 Ca 0.20 -1.52 0.04 0.00 1.00 0.00 0.00 64.86 64.58 1xx7 h ILE 5 Cb 0.39 1.70 -0.04 0.00 -0.74 0.00 0.00 36.82 38.12 1xx7 h ILE 5 CO 0.01 0.48 0.29 -0.07 0.00 0.00 0.00 178.15 178.86 1xx7 h LEU 6 N 0.39 0.43 -0.15 1.44 3.38 -0.37 -1.93 115.31 118.50 1xx7 h LEU 6 Ca 0.03 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1xx7 h LEU 6 Cb 0.91 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 1xx7 h LEU 6 CO 0.08 0.29 -0.10 0.25 0.09 0.00 0.00 178.44 179.05 1xx7 h LEU 7 N 0.56 -0.33 -1.80 1.67 5.85 -0.20 -1.69 115.31 119.37 1xx7 h LEU 7 Ca 0.24 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 1xx7 h LEU 7 Cb 0.12 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1xx7 h LEU 7 CO -0.15 -0.14 0.07 0.00 -0.34 0.00 0.00 178.44 177.88 1xx7 h ALA 8 N 1.01 1.85 -0.21 1.25 0.00 -0.95 -2.65 119.26 119.57 1xx7 h ALA 8 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xx7 h ALA 8 Cb 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1xx7 h ALA 8 CO -0.22 0.13 0.14 0.78 0.00 0.00 0.00 179.25 180.08 1xx7 h GLY 9 N 0.27 0.29 1.40 0.00 0.00 -0.48 -1.88 103.07 102.67 1xx7 h GLY 9 Ca 0.05 -0.11 0.06 0.00 0.00 0.00 0.00 47.33 47.34 1xx7 h GLY 9 CO -0.01 0.11 0.24 0.50 0.00 0.00 0.00 176.54 177.38 1xx7 h LYS 10 N 0.28 0.00 0.00 4.80 1.57 -1.30 0.11 116.57 122.03 1xx7 h LYS 10 Ca 0.08 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1xx7 h LYS 10 Cb -0.03 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1xx7 h LYS 10 CO -0.02 0.00 -0.15 -0.07 -0.57 0.00 0.00 179.45 178.64 1xx7 h LEU 11 N 0.00 0.00 -1.16 2.94 3.38 -1.49 -1.13 115.31 117.85 1xx7 h LEU 11 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1xx7 h LEU 11 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1xx7 h LEU 11 CO -0.00 0.15 0.00 0.11 0.09 0.00 0.00 178.44 178.79 1xx7 h LYS 12 N 0.00 0.00 0.00 1.13 1.57 -0.93 -1.40 116.57 116.95 1xx7 h LYS 12 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1xx7 h LYS 12 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1xx7 h LYS 12 CO 0.02 0.00 -1.34 0.54 -0.57 0.00 0.00 179.45 178.10 1xx7 n ARG 13 N -2.74 1.13 -2.55 3.15 1.74 -0.96 -4.79 116.66 111.64 1xx7 n ARG 13 Ca 0.01 -0.04 -0.43 0.00 -0.77 0.00 0.00 57.85 56.62 1xx7 n ARG 13 Cb 0.27 -1.16 -0.02 0.00 -1.02 0.00 0.00 32.46 30.53 1xx7 n ARG 13 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xx7 s ILE 14 N -2.36 4.48 0.40 0.55 1.01 -0.47 -4.97 121.20 119.85 1xx7 s ILE 14 Ca -0.03 1.78 -0.21 0.00 0.00 0.00 0.00 60.65 62.20 1xx7 s ILE 14 Cb 0.03 -4.17 -0.11 0.00 0.01 0.00 0.00 42.46 38.22 1xx7 s ILE 14 CO 0.27 -0.18 0.92 -2.16 0.00 0.00 0.00 174.94 173.78 1xx7 s PRO 15 N 3.38 4.23 -0.58 2.79 0.04 -1.26 -0.44 135.00 143.17 1xx7 s PRO 15 Ca 0.49 1.08 -0.27 0.00 0.04 0.00 0.00 61.00 62.34 1xx7 s PRO 15 Cb -0.18 -2.27 -0.02 0.00 0.04 0.00 0.00 34.50 32.07 1xx7 s PRO 15 CO 0.11 0.02 1.79 1.03 0.04 0.00 0.00 177.00 179.99 1xx7 s ARG 16 N -3.04 2.80 0.27 4.56 1.81 -0.68 -4.49 118.95 120.19 1xx7 s ARG 16 Ca 0.60 0.67 0.08 0.00 -1.72 0.00 0.00 55.73 55.36 1xx7 s ARG 16 Cb -0.10 -4.33 0.38 0.00 -0.45 0.00 0.00 34.95 30.44 1xx7 s ARG 16 CO 0.15 -2.53 1.63 0.52 -0.68 0.00 0.00 175.30 174.39 1xx7 h MET 17 N 14.16 0.12 -0.51 3.54 2.86 -1.90 -3.05 114.93 130.15 1xx7 h MET 17 Ca -0.27 -0.07 0.10 0.00 -2.06 0.00 0.00 59.70 57.39 1xx7 h MET 17 Cb 1.15 0.01 -0.10 0.00 0.06 0.00 0.00 31.60 32.72 1xx7 h MET 17 CO 1.19 0.64 -0.28 0.78 1.06 0.00 0.00 176.91 180.31 1xx7 h GLY 18 N 1.54 -0.01 0.88 8.32 0.00 -1.90 -1.01 103.07 110.89 1xx7 h GLY 18 Ca -0.00 0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.66 1xx7 h GLY 18 CO 0.08 -0.21 0.07 1.49 0.00 0.00 0.00 176.54 177.96 1xx7 h TRP 19 N -0.16 0.42 -0.82 5.60 -0.00 -1.94 -2.48 115.95 116.58 1xx7 h TRP 19 Ca 0.22 -0.05 0.11 0.00 -0.00 0.00 0.00 58.89 59.18 1xx7 h TRP 19 Cb 0.52 -0.12 -0.08 0.00 -0.00 0.00 0.00 29.16 29.48 1xx7 h TRP 19 CO -0.55 0.48 0.44 1.25 -0.00 0.00 0.00 178.44 180.06 1xx7 h LEU 20 N 0.24 0.60 -0.74 -4.49 6.46 -1.45 -0.86 115.31 115.08 1xx7 h LEU 20 Ca 0.08 0.06 -0.13 0.00 -0.12 0.00 0.00 57.88 57.77 1xx7 h LEU 20 Cb 0.26 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.13 1xx7 h LEU 20 CO -0.00 0.31 -0.62 0.40 -0.62 0.00 0.00 178.44 177.91 1xx7 h ILE 21 N 0.71 1.44 0.00 4.05 2.04 -1.01 -2.48 117.51 122.26 1xx7 h ILE 21 Ca 0.41 -2.11 0.00 0.00 1.00 0.00 0.00 64.86 64.16 1xx7 h ILE 21 Cb 0.46 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 1xx7 h ILE 21 CO -0.29 0.61 0.00 0.11 0.00 0.00 0.00 178.15 178.58 1xx7 h LYS 22 N 0.03 0.00 0.00 2.37 1.79 -0.71 -3.47 116.57 116.58 1xx7 h LYS 22 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1xx7 h LYS 22 Cb 1.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.75 1xx7 h LYS 22 CO 0.08 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.86 1xx7 n GLY 23 N 0.23 0.92 3.68 3.86 0.00 -0.88 -4.96 105.19 108.04 1xx7 n GLY 23 Ca 0.02 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.58 1xx7 n GLY 23 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xx7 n VAL 24 N -1.74 0.62 0.06 1.61 0.31 -0.94 -4.92 118.33 113.33 1xx7 n VAL 24 Ca 0.00 -0.11 -0.10 0.00 -0.01 0.00 0.00 64.34 64.12 1xx7 n VAL 24 Cb 0.00 -2.01 0.02 0.00 -0.91 0.00 0.00 33.84 30.95 1xx7 n VAL 24 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1xx7 h PRO 25 N 9.54 0.38 -2.18 5.55 0.13 -1.94 -3.36 132.00 140.12 1xx7 h PRO 25 Ca -0.49 -0.33 -0.59 0.00 -0.87 0.00 0.00 66.00 63.72 1xx7 h PRO 25 Cb 1.26 0.07 -0.41 0.00 0.13 0.00 0.00 31.00 32.05 1xx7 h PRO 25 CO 0.95 0.98 -0.68 0.09 -0.23 0.00 0.00 178.00 179.10 1xx7 n ASN 26 N -3.81 3.11 -4.77 1.44 5.03 -1.26 -5.11 115.26 109.89 1xx7 n ASN 26 Ca -0.04 -3.31 -0.41 0.00 0.87 0.00 0.00 54.58 51.69 1xx7 n ASN 26 Cb 0.73 -0.67 -0.02 0.00 -1.02 0.00 0.00 39.78 38.80 1xx7 n ASN 26 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1xx7 s PRO 27 N -2.22 4.29 0.51 3.52 0.04 -1.26 -4.95 135.00 134.92 1xx7 s PRO 27 Ca 0.39 2.30 -0.19 0.00 0.04 0.00 0.00 61.00 63.54 1xx7 s PRO 27 Cb 0.15 -3.06 -0.12 0.00 0.04 0.00 0.00 34.50 31.50 1xx7 s PRO 27 CO -0.03 -0.30 0.23 -0.85 0.04 0.00 0.00 177.00 176.08 1xx7 n GLU 28 N 1.06 0.26 -2.05 4.56 0.28 -1.26 -4.77 120.64 118.73 1xx7 n GLU 28 Ca 0.02 0.10 -0.29 0.00 -0.16 0.00 0.00 57.16 56.83 1xx7 n GLU 28 Cb 0.41 -1.33 0.04 0.00 1.43 0.00 0.00 31.44 31.99 1xx7 n GLU 28 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1xx7 s SER 29 N -1.06 5.52 0.24 -1.84 1.04 -1.26 -1.68 113.70 114.66 1xx7 s SER 29 Ca 0.62 1.01 -0.07 0.00 0.48 0.00 0.00 55.95 58.00 1xx7 s SER 29 Cb -0.51 -1.88 0.26 0.00 0.10 0.00 0.00 66.02 64.00 1xx7 s SER 29 CO 0.60 -1.24 1.89 0.58 0.98 0.00 0.00 173.24 176.06 1xx7 h VAL 30 N -0.49 1.17 -0.53 5.02 2.07 -0.68 -2.08 116.25 120.72 1xx7 h VAL 30 Ca -0.45 -0.40 0.09 0.00 0.82 0.00 0.00 66.70 66.76 1xx7 h VAL 30 Cb 1.25 -0.09 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 1xx7 h VAL 30 CO 0.63 0.21 0.13 0.00 0.02 0.00 0.00 177.57 178.56 1xx7 h ALA 31 N 1.36 0.62 -0.13 1.67 0.00 -1.52 0.11 119.26 121.37 1xx7 h ALA 31 Ca 0.35 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.40 1xx7 h ALA 31 Cb -0.04 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1xx7 h ALA 31 CO -0.11 -0.29 -0.09 -0.44 0.00 0.00 0.00 179.25 178.32 1xx7 h ASP 32 N 0.27 -0.30 0.19 0.00 3.32 -1.72 0.36 116.42 118.54 1xx7 h ASP 32 Ca 0.27 0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.39 1xx7 h ASP 32 Cb 0.36 0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1xx7 h ASP 32 CO -0.33 -0.13 -0.20 -0.74 -1.72 0.00 0.00 179.24 176.12 1xx7 h HIS 33 N -0.10 -0.53 -0.71 4.55 -0.00 -1.26 -2.70 115.15 114.40 1xx7 h HIS 33 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.45 1xx7 h HIS 33 Cb 0.22 0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.81 1xx7 h HIS 33 CO -0.22 -0.30 0.42 0.77 -0.00 0.00 0.00 177.93 178.60 1xx7 h SER 34 N -0.43 0.85 -0.32 3.26 0.02 -0.34 -1.43 113.55 115.17 1xx7 h SER 34 Ca 0.00 -0.05 0.07 0.00 -0.84 0.00 0.00 61.79 60.97 1xx7 h SER 34 Cb 0.41 -0.22 -0.07 0.00 0.14 0.00 0.00 62.40 62.66 1xx7 h SER 34 CO -0.06 0.67 -0.16 0.22 -1.14 0.00 0.00 176.83 176.35 1xx7 h TYR 35 N 0.98 -0.40 0.00 3.45 3.20 -0.21 -1.29 116.97 122.70 1xx7 h TYR 35 Ca 0.26 0.04 -0.13 0.00 3.14 0.00 0.00 58.73 62.03 1xx7 h TYR 35 Cb -0.02 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1xx7 h TYR 35 CO 0.00 -0.24 -0.63 -0.09 -1.64 0.00 0.00 178.16 175.56 1xx7 h ARG 36 N -0.12 0.00 -0.44 1.82 2.43 -1.04 -1.29 114.38 115.75 1xx7 h ARG 36 Ca 0.16 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1xx7 h ARG 36 Cb 0.37 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1xx7 h ARG 36 CO -0.39 0.63 0.25 0.28 -1.51 0.00 0.00 179.97 179.23 1xx7 h VAL 37 N 0.00 1.15 -0.61 0.20 2.07 -1.14 0.16 116.25 118.08 1xx7 h VAL 37 Ca -0.01 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.18 1xx7 h VAL 37 Cb 1.19 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 1xx7 h VAL 37 CO 0.08 0.16 0.34 0.00 0.02 0.00 0.00 177.57 178.17 1xx7 h ALA 38 N 1.10 0.81 -0.38 1.67 0.00 -0.89 0.78 119.26 122.34 1xx7 h ALA 38 Ca 0.16 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1xx7 h ALA 38 Cb 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xx7 h ALA 38 CO -0.03 0.03 0.05 0.35 0.00 0.00 0.00 179.25 179.66 1xx7 h PHE 39 N 0.65 0.69 -0.47 0.00 3.57 -0.87 -1.85 116.94 118.66 1xx7 h PHE 39 Ca 0.27 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 1xx7 h PHE 39 Cb 0.13 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 1xx7 h PHE 39 CO -0.08 0.69 0.15 0.82 -2.23 0.00 0.00 178.31 177.66 1xx7 h ILE 40 N 0.48 1.22 -0.56 1.41 2.04 -0.54 -2.14 117.51 119.43 1xx7 h ILE 40 Ca 0.12 -0.74 0.09 0.00 1.00 0.00 0.00 64.86 65.32 1xx7 h ILE 40 Cb 0.38 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.21 1xx7 h ILE 40 CO 0.01 0.27 0.18 0.74 0.00 0.00 0.00 178.15 179.35 1xx7 h THR 41 N 0.63 0.76 -0.13 -0.27 2.02 -0.75 -1.00 112.91 114.18 1xx7 h THR 41 Ca 0.15 -0.12 0.02 0.00 0.77 0.00 0.00 66.41 67.24 1xx7 h THR 41 Cb 0.26 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 1xx7 h THR 41 CO -0.01 0.06 -0.02 0.25 0.37 0.00 0.00 175.52 176.18 1xx7 h LEU 42 N 0.35 -0.09 -0.42 2.58 5.85 -1.22 -0.53 115.31 121.82 1xx7 h LEU 42 Ca 0.28 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 59.01 1xx7 h LEU 42 Cb 0.35 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 1xx7 h LEU 42 CO -0.30 -0.03 0.19 0.25 -0.34 0.00 0.00 178.44 178.20 1xx7 h LEU 43 N 0.01 0.57 -0.35 2.25 5.85 -1.00 -2.07 115.31 120.58 1xx7 h LEU 43 Ca 0.06 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.51 1xx7 h LEU 43 Cb 0.08 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1xx7 h LEU 43 CO -0.12 0.56 -0.24 -0.07 -0.34 0.00 0.00 178.44 178.23 1xx7 h LEU 44 N 0.54 0.82 -0.79 2.25 3.38 -1.16 -2.47 115.31 117.88 1xx7 h LEU 44 Ca 0.14 -0.43 0.09 0.00 0.09 0.00 0.00 57.88 57.77 1xx7 h LEU 44 Cb 0.16 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 1xx7 h LEU 44 CO -0.01 1.08 0.44 0.00 0.09 0.00 0.00 178.44 180.03 1xx7 h ALA 45 N 0.77 1.12 0.00 1.53 0.00 -0.99 0.44 119.26 122.13 1xx7 h ALA 45 Ca 0.07 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1xx7 h ALA 45 Cb 0.80 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1xx7 h ALA 45 CO 0.06 0.05 -0.33 0.93 0.00 0.00 0.00 179.25 179.97 1xx7 h GLU 46 N 0.73 0.00 -0.29 0.00 4.39 -1.25 -0.51 114.58 117.65 1xx7 h GLU 46 Ca 0.38 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.91 1xx7 h GLU 46 Cb 0.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1xx7 h GLU 46 CO -0.25 0.33 -0.50 1.49 -1.16 0.00 0.00 179.01 178.91 1xx7 h GLU 47 N 0.00 0.84 -0.25 2.33 4.57 -0.86 -1.89 114.58 119.33 1xx7 h GLU 47 Ca -0.00 -0.53 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 1xx7 h GLU 47 Cb 0.62 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 1xx7 h GLU 47 CO 0.04 1.16 0.17 -0.07 -1.18 0.00 0.00 179.01 179.13 1xx7 h LEU 48 N 0.62 0.29 -0.43 1.64 3.38 -0.44 -2.68 115.31 117.70 1xx7 h LEU 48 Ca 0.02 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1xx7 h LEU 48 Cb 1.11 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.70 1xx7 h LEU 48 CO 0.11 0.22 -0.11 0.50 0.09 0.00 0.00 178.44 179.25 1xx7 h LYS 49 N 0.34 -0.01 -0.89 1.13 3.64 -1.12 -1.07 116.57 118.59 1xx7 h LYS 49 Ca 0.09 0.00 0.22 0.00 -1.27 0.00 0.00 60.65 59.69 1xx7 h LYS 49 Cb -0.03 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.74 1xx7 h LYS 49 CO -0.02 -0.01 0.60 0.87 -2.27 0.00 0.00 179.45 178.63 1xx7 h LYS 50 N -0.01 0.27 -0.01 1.90 6.56 -1.10 0.11 116.57 124.30 1xx7 h LYS 50 Ca 0.21 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 1xx7 h LYS 50 Cb 0.32 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 31.92 1xx7 h LYS 50 CO -0.44 0.18 -0.04 1.63 -2.06 0.00 0.00 179.45 178.72 1xx7 n LYS 51 N -4.45 1.29 -1.65 3.15 5.02 -0.73 -4.95 118.16 115.84 1xx7 n LYS 51 Ca 0.19 -0.58 -0.08 0.00 -2.02 0.00 0.00 58.31 55.82 1xx7 n LYS 51 Cb 0.77 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.28 1xx7 n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xx7 n GLY 52 N 1.16 0.55 3.73 0.72 0.00 0.40 -5.03 105.19 106.72 1xx7 n GLY 52 Ca 0.19 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 45.18 1xx7 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xx7 s VAL 53 N -2.33 4.96 0.18 1.61 1.01 -0.49 -5.00 120.40 120.34 1xx7 s VAL 53 Ca 0.00 1.46 -0.30 0.00 0.00 0.00 0.00 61.98 63.14 1xx7 s VAL 53 Cb 0.00 -4.04 -0.08 0.00 0.00 0.00 0.00 36.38 32.26 1xx7 s VAL 53 CO 0.00 0.30 1.17 -1.83 0.00 0.00 0.00 175.10 174.74 1xx7 s GLU 54 N 0.45 4.52 -0.28 2.72 1.03 -1.26 -4.15 118.70 121.73 1xx7 s GLU 54 Ca 0.37 1.83 -0.17 0.00 0.03 0.00 0.00 54.97 57.02 1xx7 s GLU 54 Cb -0.18 -3.25 0.09 0.00 -0.80 0.00 0.00 34.13 29.98 1xx7 s GLU 54 CO 0.19 -0.04 0.75 -1.50 -1.33 0.00 0.00 175.26 173.33 1xx7 s ILE 55 N -0.12 0.00 -0.71 1.83 2.07 -1.26 -5.02 121.20 117.99 1xx7 s ILE 55 Ca 0.52 0.00 -0.27 0.00 -1.41 0.00 0.00 60.65 59.48 1xx7 s ILE 55 Cb -0.32 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.30 1xx7 s ILE 55 CO 0.36 0.00 1.26 -0.62 -1.91 0.00 0.00 174.94 174.03 1xx7 s ASP 56 N 1.39 6.22 0.09 4.50 -1.08 -1.26 -4.89 116.67 121.64 1xx7 s ASP 56 Ca -0.08 -0.33 -0.20 0.00 -0.52 0.00 0.00 52.55 51.42 1xx7 s ASP 56 Cb -0.05 -2.56 -0.09 0.00 -1.46 0.00 0.00 42.92 38.76 1xx7 s ASP 56 CO -0.16 -1.76 1.58 0.58 0.52 0.00 0.00 175.17 175.92 1xx7 h VAL 57 N 6.06 1.20 -0.67 1.11 2.07 -1.98 -2.27 116.25 121.77 1xx7 h VAL 57 Ca -0.27 -0.65 0.14 0.00 0.82 0.00 0.00 66.70 66.73 1xx7 h VAL 57 Cb 1.05 1.24 -0.10 0.00 -1.52 0.00 0.00 31.29 31.96 1xx7 h VAL 57 CO 1.26 0.21 0.14 -0.08 0.02 0.00 0.00 177.57 179.11 1xx7 h GLU 58 N 0.16 0.24 -0.30 1.57 4.81 -2.00 -1.89 114.58 117.17 1xx7 h GLU 58 Ca 0.07 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1xx7 h GLU 58 Cb 0.26 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1xx7 h GLU 58 CO 0.00 0.16 0.06 -0.22 -0.73 0.00 0.00 179.01 178.28 1xx7 h LYS 59 N 0.25 0.49 -0.99 1.92 3.64 -1.93 -2.23 116.57 117.72 1xx7 h LYS 59 Ca 0.37 -0.13 0.08 0.00 -1.27 0.00 0.00 60.65 59.70 1xx7 h LYS 59 Cb 0.59 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.28 1xx7 h LYS 59 CO -0.47 0.58 0.63 0.00 -2.27 0.00 0.00 179.45 177.92 1xx7 h ALA 60 N 0.89 1.41 -0.25 5.00 0.00 -0.96 -0.96 119.26 124.38 1xx7 h ALA 60 Ca 0.09 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 1xx7 h ALA 60 Cb 0.32 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1xx7 h ALA 60 CO 0.00 0.36 -0.53 -0.07 0.00 0.00 0.00 179.25 179.01 1xx7 h LEU 61 N 1.10 0.81 -0.29 0.00 3.38 -1.27 -0.99 115.31 118.04 1xx7 h LEU 61 Ca 0.45 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1xx7 h LEU 61 Cb 0.27 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1xx7 h LEU 61 CO -0.20 1.18 0.13 0.11 0.09 0.00 0.00 178.44 179.75 1xx7 h LYS 62 N 0.57 0.42 -0.62 1.13 1.57 -1.02 -0.99 116.57 117.62 1xx7 h LYS 62 Ca 0.02 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1xx7 h LYS 62 Cb 1.11 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 1xx7 h LYS 62 CO 0.11 0.42 0.39 0.82 -0.57 0.00 0.00 179.45 180.62 1xx7 h ILE 63 N 0.33 1.17 -0.25 1.86 2.04 -1.11 -2.34 117.51 119.20 1xx7 h ILE 63 Ca 0.10 -0.35 0.01 0.00 1.00 0.00 0.00 64.86 65.62 1xx7 h ILE 63 Cb 0.14 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1xx7 h ILE 63 CO -0.01 0.17 0.15 0.00 0.00 0.00 0.00 178.15 178.46 1xx7 h ALA 64 N 1.21 0.31 -0.95 1.87 0.00 -0.91 0.19 119.26 120.99 1xx7 h ALA 64 Ca 0.22 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.24 1xx7 h ALA 64 Cb -0.06 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.58 1xx7 h ALA 64 CO -0.05 -0.24 0.60 0.82 0.00 0.00 0.00 179.25 180.39 1xx7 h ILE 65 N 0.30 0.93 -0.00 0.00 2.04 -0.93 -3.05 117.51 116.80 1xx7 h ILE 65 Ca 0.10 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1xx7 h ILE 65 Cb -0.01 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.01 1xx7 h ILE 65 CO -0.05 0.17 -0.75 2.30 0.00 0.00 0.00 178.15 179.82 1xx7 n ILE 66 N -4.57 0.00 0.29 -0.67 -6.64 -0.90 -4.55 119.36 102.31 1xx7 n ILE 66 Ca 0.17 -0.12 0.17 0.00 -1.77 0.00 0.00 62.75 61.20 1xx7 n ILE 66 Cb 0.35 1.08 0.84 0.00 -1.44 0.00 0.00 39.64 40.47 1xx7 n ILE 66 CO 0.00 0.00 0.00 1.12 -1.77 0.00 0.00 176.55 175.90 1xx7 h HIS 67 N 0.72 0.00 -0.07 4.28 2.07 -0.51 -1.79 115.15 119.85 1xx7 h HIS 67 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1xx7 h HIS 67 Cb 0.53 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.51 1xx7 h HIS 67 CO 0.00 0.05 0.00 -0.25 -3.07 0.00 0.00 177.93 174.66 1xx7 n ASP 68 N -3.29 2.33 0.05 3.10 8.00 -1.26 -4.75 116.55 120.71 1xx7 n ASP 68 Ca -0.01 -2.27 0.03 0.00 0.71 0.00 0.00 54.79 53.24 1xx7 n ASP 68 Cb 0.22 -0.15 0.40 0.00 -0.02 0.00 0.00 41.12 41.56 1xx7 n ASP 68 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1xx7 h LEU 69 N 0.43 0.39 -1.97 0.64 5.85 -1.57 -1.12 115.31 117.95 1xx7 h LEU 69 Ca 0.00 -0.04 0.15 0.00 0.84 0.00 0.00 57.88 58.83 1xx7 h LEU 69 Cb 0.69 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 1xx7 h LEU 69 CO 0.01 0.39 0.48 1.23 -0.34 0.00 0.00 178.44 180.21 1xx7 h GLY 70 N 0.63 0.00 2.00 3.75 0.00 -1.81 -0.96 103.07 106.68 1xx7 h GLY 70 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1xx7 h GLY 70 CO -0.01 0.00 0.00 0.83 0.00 0.00 0.00 176.54 177.36 1xx7 h GLU 71 N 0.00 0.00 0.00 4.80 5.08 -1.44 -0.66 114.58 122.37 1xx7 h GLU 71 Ca 0.25 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.59 1xx7 h GLU 71 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1xx7 h GLU 71 CO -0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 179.01 177.91 1xx7 h ALA 72 N 2.23 1.27 0.00 3.43 0.00 -1.31 0.28 119.26 125.16 1xx7 h ALA 72 Ca 0.00 -0.09 -0.33 0.00 0.00 0.00 0.00 54.91 54.50 1xx7 h ALA 72 Cb 0.35 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 1xx7 h ALA 72 CO 0.00 0.12 -2.21 -0.89 0.00 0.00 0.00 179.25 176.27 1xx7 n ILE 73 N -3.60 1.21 0.13 0.00 5.41 -0.72 -4.66 119.36 117.14 1xx7 n ILE 73 Ca -0.02 -0.43 0.09 0.00 1.00 0.00 0.00 62.75 63.39 1xx7 n ILE 73 Cb 0.22 -1.35 0.04 0.00 -0.71 0.00 0.00 39.64 37.83 1xx7 n ILE 73 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1xx7 h ILE 74 N -0.16 0.17 -1.74 1.39 1.08 -1.19 -3.51 117.51 113.55 1xx7 h ILE 74 Ca -0.49 -1.28 0.21 0.00 -0.39 0.00 0.00 64.86 62.91 1xx7 h ILE 74 Cb 1.68 1.82 -0.06 0.00 -3.07 0.00 0.00 36.82 37.19 1xx7 h ILE 74 CO -0.13 0.10 -0.34 0.35 -0.69 0.00 0.00 178.15 177.44 1xx7 n THR 75 N -2.89 0.00 -3.05 -0.27 -2.24 0.97 -4.74 114.28 102.06 1xx7 n THR 75 Ca -0.00 0.08 -0.44 0.00 -2.27 0.00 0.00 64.05 61.41 1xx7 n THR 75 Cb 0.61 -0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 68.46 1xx7 n THR 75 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xx7 s ASP 76 N -5.17 6.36 -0.08 3.42 2.15 -1.26 -4.55 116.67 117.54 1xx7 s ASP 76 Ca 0.00 -1.66 -0.30 0.00 0.43 0.00 0.00 52.55 51.02 1xx7 s ASP 76 Cb 0.00 -2.33 -0.03 0.00 -0.30 0.00 0.00 42.92 40.25 1xx7 s ASP 76 CO 0.00 -1.09 1.27 -0.76 -0.17 0.00 0.00 175.17 174.41 1xx7 s LEU 77 N 2.61 4.26 0.96 -1.34 1.43 -1.26 -4.30 118.68 121.04 1xx7 s LEU 77 Ca 0.19 1.84 -0.12 0.00 -1.03 0.00 0.00 54.13 55.01 1xx7 s LEU 77 Cb -0.17 -3.55 0.16 0.00 0.03 0.00 0.00 46.19 42.67 1xx7 s LEU 77 CO 0.01 -0.67 1.10 -2.16 0.23 0.00 0.00 176.35 174.87 1xx7 s PRO 78 N 2.69 0.76 0.21 1.29 0.04 -1.26 -4.83 135.00 133.91 1xx7 s PRO 78 Ca 0.57 0.48 -0.08 0.00 0.04 0.00 0.00 61.00 62.01 1xx7 s PRO 78 Cb -0.25 -1.78 0.29 0.00 0.04 0.00 0.00 34.50 32.80 1xx7 s PRO 78 CO 0.21 -2.50 1.77 -0.07 0.04 0.00 0.00 177.00 176.44 1xx7 h LEU 79 N -1.72 0.36 -0.96 -3.56 3.38 -1.97 -2.01 115.31 108.82 1xx7 h LEU 79 Ca -0.53 0.06 0.17 0.00 0.09 0.00 0.00 57.88 57.68 1xx7 h LEU 79 Cb 1.32 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.98 1xx7 h LEU 79 CO 0.59 0.21 0.56 0.77 0.09 0.00 0.00 178.44 180.65 1xx7 h SER 80 N 0.51 0.72 0.52 -0.43 4.64 -2.03 0.08 113.55 117.58 1xx7 h SER 80 Ca 0.32 0.09 -0.15 0.00 -0.47 0.00 0.00 61.79 61.58 1xx7 h SER 80 Cb 0.35 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 1xx7 h SER 80 CO -0.27 0.28 -0.68 0.00 -0.87 0.00 0.00 176.83 175.29 1xx7 h ALA 81 N 1.61 0.82 0.00 5.18 0.00 -1.74 -3.25 119.26 121.88 1xx7 h ALA 81 Ca 0.53 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1xx7 h ALA 81 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1xx7 h ALA 81 CO -0.37 0.80 0.00 1.04 0.00 0.00 0.00 179.25 180.73 1xx7 n GLN 82 N -3.79 0.07 0.26 0.00 6.02 0.00 -1.42 117.38 118.53 1xx7 n GLN 82 Ca -0.02 0.25 0.14 0.00 -0.01 0.00 0.00 57.00 57.36 1xx7 n GLN 82 Cb 0.66 -1.62 0.67 0.00 1.02 0.00 0.00 30.24 30.98 1xx7 n GLN 82 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1xx7 h LYS 83 N 0.00 0.00 0.00 -1.09 1.79 -1.56 -3.31 116.57 112.40 1xx7 h LYS 83 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1xx7 h LYS 83 Cb 0.35 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.00 1xx7 h LYS 83 CO 0.00 0.11 -0.81 0.66 -1.08 0.00 0.00 179.45 178.33 1xx7 n TYR 84 N -3.34 0.00 -3.96 -1.35 4.01 -0.51 -5.04 117.16 106.97 1xx7 n TYR 84 Ca -0.01 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.60 1xx7 n TYR 84 Cb 0.31 -0.08 -0.14 0.00 -0.31 0.00 0.00 39.34 39.12 1xx7 n TYR 84 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1xx7 s LEU 85 N -2.89 1.89 -0.65 7.72 1.43 -0.73 -5.10 118.68 120.35 1xx7 s LEU 85 Ca -0.00 -0.03 -0.21 0.00 -1.03 0.00 0.00 54.13 52.86 1xx7 s LEU 85 Cb 0.04 -0.10 0.09 0.00 0.03 0.00 0.00 46.19 46.25 1xx7 s LEU 85 CO 0.26 0.00 0.87 0.21 0.23 0.00 0.00 176.35 177.93 1xx7 s ASN 86 N 0.10 6.21 0.01 2.29 3.84 -1.26 -4.32 114.94 121.81 1xx7 s ASN 86 Ca -0.01 -1.25 -0.25 0.00 0.21 0.00 0.00 52.86 51.56 1xx7 s ASN 86 Cb -0.02 -2.37 -0.18 0.00 -0.55 0.00 0.00 41.25 38.13 1xx7 s ASN 86 CO -0.00 -1.28 1.35 0.50 -2.79 0.00 0.00 177.10 174.88 1xx7 h LYS 87 N 9.35 -0.12 -0.46 0.43 3.64 -1.95 -1.98 116.57 125.49 1xx7 h LYS 87 Ca -0.26 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1xx7 h LYS 87 Cb 1.07 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.90 1xx7 h LYS 87 CO 1.14 0.22 0.29 0.93 -2.27 0.00 0.00 179.45 179.76 1xx7 h GLU 88 N -0.47 0.62 -0.27 1.90 5.08 -1.98 0.19 114.58 119.65 1xx7 h GLU 88 Ca -0.01 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1xx7 h GLU 88 Cb 0.39 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1xx7 h GLU 88 CO 0.02 0.45 0.16 1.49 -1.00 0.00 0.00 179.01 180.13 1xx7 h GLU 89 N 0.62 0.32 -0.64 2.33 4.81 -1.99 0.16 114.58 120.19 1xx7 h GLU 89 Ca 0.17 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1xx7 h GLU 89 Cb -0.02 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 1xx7 h GLU 89 CO -0.03 0.21 0.36 0.00 -0.73 0.00 0.00 179.01 178.82 1xx7 h ALA 90 N 1.12 0.83 -0.66 2.92 0.00 -1.20 -2.37 119.26 119.89 1xx7 h ALA 90 Ca 0.11 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1xx7 h ALA 90 Cb -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1xx7 h ALA 90 CO -0.05 0.33 0.12 0.93 0.00 0.00 0.00 179.25 180.58 1xx7 h GLU 91 N 0.88 1.09 -0.52 0.00 5.08 -0.48 -1.85 114.58 118.77 1xx7 h GLU 91 Ca 0.23 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1xx7 h GLU 91 Cb 0.03 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1xx7 h GLU 91 CO -0.04 1.00 0.25 0.00 -1.00 0.00 0.00 179.01 179.22 1xx7 h ALA 92 N 1.05 0.68 -0.13 3.43 0.00 -0.59 -0.15 119.26 123.55 1xx7 h ALA 92 Ca 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1xx7 h ALA 92 Cb 0.43 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1xx7 h ALA 92 CO 0.01 0.24 0.05 0.87 0.00 0.00 0.00 179.25 180.43 1xx7 h LYS 93 N 0.70 0.19 -0.47 0.00 6.56 -1.36 -1.10 116.57 121.10 1xx7 h LYS 93 Ca 0.18 -0.03 0.02 0.00 -1.06 0.00 0.00 60.65 59.76 1xx7 h LYS 93 Cb 0.13 -0.03 -0.03 0.00 -0.57 0.00 0.00 32.23 31.72 1xx7 h LYS 93 CO -0.02 0.29 0.27 0.00 -2.06 0.00 0.00 179.45 177.93 1xx7 h ALA 94 N 0.89 0.59 -0.66 3.86 0.00 -1.18 -1.93 119.26 120.83 1xx7 h ALA 94 Ca 0.04 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1xx7 h ALA 94 Cb 0.17 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1xx7 h ALA 94 CO -0.00 -0.05 0.33 1.25 0.00 0.00 0.00 179.25 180.78 1xx7 h LEU 95 N 0.54 0.86 -0.84 0.00 5.85 -0.97 -2.81 115.31 117.95 1xx7 h LEU 95 Ca 0.19 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.82 1xx7 h LEU 95 Cb 0.03 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 1xx7 h LEU 95 CO -0.09 0.74 0.53 0.50 -0.34 0.00 0.00 178.44 179.78 1xx7 h LYS 96 N 0.92 1.00 0.00 1.25 3.64 -0.64 0.82 116.57 123.55 1xx7 h LYS 96 Ca 0.23 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 1xx7 h LYS 96 Cb 0.10 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1xx7 h LYS 96 CO -0.03 0.66 -0.10 -0.44 -2.27 0.00 0.00 179.45 177.27 1xx7 h ASP 97 N 1.03 0.00 0.00 4.20 3.32 -1.12 -2.83 116.42 121.03 1xx7 h ASP 97 Ca 0.34 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.25 1xx7 h ASP 97 Cb 0.03 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1xx7 h ASP 97 CO -0.12 0.10 -1.53 1.33 -1.72 0.00 0.00 179.24 177.29 1xx7 n VAL 98 N -3.44 0.54 -3.30 -1.35 0.24 -0.71 -4.85 118.33 105.47 1xx7 n VAL 98 Ca -0.01 -0.29 -0.25 0.00 -2.04 0.00 0.00 64.34 61.75 1xx7 n VAL 98 Cb 0.26 -0.81 -0.08 0.00 -1.47 0.00 0.00 33.84 31.73 1xx7 n VAL 98 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1xx7 n LEU 99 N -2.45 0.82 0.26 1.34 4.77 0.28 -4.95 117.00 117.06 1xx7 n LEU 99 Ca -0.14 -4.80 0.10 0.00 -0.03 0.00 0.00 56.01 51.14 1xx7 n LEU 99 Cb 0.73 0.33 0.68 0.00 -2.33 0.00 0.00 43.42 42.83 1xx7 n LEU 99 CO 0.14 2.02 0.99 1.55 -1.33 0.00 0.00 177.39 180.76 1xx7 h PRO 100 N 4.36 0.00 0.00 3.23 0.13 -1.59 -2.05 132.00 136.08 1xx7 h PRO 100 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1xx7 h PRO 100 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1xx7 h PRO 100 CO 0.52 0.10 0.00 1.05 -0.23 0.00 0.00 178.00 179.44 1xx7 h GLU 101 N 0.00 0.00 -0.33 0.86 9.09 -1.91 -3.00 114.58 119.29 1xx7 h GLU 101 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1xx7 h GLU 101 Cb 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 1xx7 h GLU 101 CO 0.01 0.00 0.00 0.66 0.05 0.00 0.00 179.01 179.73 1xx7 n TYR 102 N -2.50 0.43 -0.30 2.06 4.01 -0.77 -4.61 117.16 115.48 1xx7 n TYR 102 Ca 0.00 -0.35 0.05 0.00 -0.16 0.00 0.00 57.90 57.43 1xx7 n TYR 102 Cb 0.17 -0.01 0.19 0.00 -0.31 0.00 0.00 39.34 39.38 1xx7 n TYR 102 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1xx7 h THR 103 N 2.69 0.85 0.08 -0.72 2.02 -1.61 -0.00 112.91 116.23 1xx7 h THR 103 Ca 0.00 -0.26 -0.27 0.00 0.77 0.00 0.00 66.41 66.65 1xx7 h THR 103 Cb 0.74 0.03 0.03 0.00 -1.74 0.00 0.00 68.15 67.21 1xx7 h THR 103 CO 0.00 0.14 -1.09 -0.08 0.37 0.00 0.00 175.52 174.85 1xx7 h GLU 104 N 0.75 0.60 -0.44 6.66 4.81 -1.84 -2.26 114.58 122.87 1xx7 h GLU 104 Ca 0.43 -0.75 0.09 0.00 -0.13 0.00 0.00 59.36 58.99 1xx7 h GLU 104 Cb 0.47 0.24 -0.08 0.00 0.63 0.00 0.00 28.75 30.00 1xx7 h GLU 104 CO -0.28 1.33 -0.07 -0.07 -0.73 0.00 0.00 179.01 179.18 1xx7 h LEU 105 N 0.22 -0.33 -0.95 1.64 3.38 -1.81 0.67 115.31 118.13 1xx7 h LEU 105 Ca -0.16 0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.01 1xx7 h LEU 105 Cb 1.78 0.24 -0.07 0.00 0.09 0.00 0.00 40.66 42.70 1xx7 h LEU 105 CO 0.21 -0.12 0.60 0.15 0.09 0.00 0.00 178.44 179.37 1xx7 h PHE 106 N 0.03 1.11 -0.40 1.13 3.57 -0.98 -2.28 116.94 119.13 1xx7 h PHE 106 Ca 0.21 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.67 1xx7 h PHE 106 Cb 0.32 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1xx7 h PHE 106 CO -0.35 0.55 -0.05 1.49 -2.23 0.00 0.00 178.31 177.72 1xx7 h GLU 107 N 1.07 0.74 -0.85 1.11 4.57 -0.69 0.26 114.58 120.79 1xx7 h GLU 107 Ca 0.42 -0.26 0.14 0.00 -1.18 0.00 0.00 59.36 58.48 1xx7 h GLU 107 Cb 0.22 -0.05 -0.09 0.00 -0.16 0.00 0.00 28.75 28.66 1xx7 h GLU 107 CO -0.19 0.85 0.44 0.93 -1.18 0.00 0.00 179.01 179.86 1xx7 h GLU 108 N 0.56 0.62 0.42 1.92 5.08 -0.51 -1.48 114.58 121.18 1xx7 h GLU 108 Ca 0.11 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1xx7 h GLU 108 Cb 0.55 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1xx7 h GLU 108 CO 0.03 0.41 -0.20 -0.92 -1.00 0.00 0.00 179.01 177.33 1xx7 h TYR 109 N 0.63 -0.52 0.00 4.33 3.20 -0.85 -0.94 116.97 122.82 1xx7 h TYR 109 Ca 0.46 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.22 1xx7 h TYR 109 Cb 0.64 0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.06 1xx7 h TYR 109 CO -0.09 -0.20 -0.46 0.66 -1.64 0.00 0.00 178.16 176.43 1xx7 h SER 110 N -0.98 0.00 -0.36 -2.11 4.64 -0.32 -2.27 113.55 112.15 1xx7 h SER 110 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1xx7 h SER 110 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1xx7 h SER 110 CO 0.09 0.46 0.00 0.29 -0.87 0.00 0.00 176.83 176.80 1xx7 n LYS 111 N -3.83 2.91 -3.90 4.77 5.02 -0.58 -5.00 118.16 117.55 1xx7 n LYS 111 Ca -0.01 -2.24 -0.25 0.00 -2.02 0.00 0.00 58.31 53.79 1xx7 n LYS 111 Cb 0.50 -1.40 -0.01 0.00 -0.02 0.00 0.00 35.03 34.11 1xx7 n LYS 111 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xx7 n ALA 112 N 0.42 -1.94 0.56 7.82 0.00 -0.60 -4.89 120.51 121.89 1xx7 n ALA 112 Ca 0.14 -0.21 0.12 0.00 0.00 0.00 0.00 53.44 53.49 1xx7 n ALA 112 Cb 0.53 -1.84 0.08 0.00 0.00 0.00 0.00 19.45 18.21 1xx7 n ALA 112 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xx7 n LEU 113 N -4.38 0.64 -4.33 0.00 4.77 -0.46 -4.69 117.00 108.54 1xx7 n LEU 113 Ca -0.27 0.07 -0.17 0.00 -0.03 0.00 0.00 56.01 55.61 1xx7 n LEU 113 Cb 0.67 -0.13 -0.10 0.00 -2.33 0.00 0.00 43.42 41.53 1xx7 n LEU 113 CO 0.74 0.01 -0.27 0.42 -1.33 0.00 0.00 177.39 176.95 1xx7 s THR 114 N -3.19 0.73 0.36 -5.08 -4.23 -1.26 -5.03 115.64 97.95 1xx7 s THR 114 Ca 0.05 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.62 1xx7 s THR 114 Cb 0.14 -2.58 0.17 0.00 1.34 0.00 0.00 72.50 71.57 1xx7 s THR 114 CO 0.77 -0.08 1.91 0.17 -0.54 0.00 0.00 174.62 176.85 1xx7 h LEU 115 N 2.38 0.38 -0.22 4.79 -0.00 -1.95 -0.90 115.31 119.78 1xx7 h LEU 115 Ca -0.39 -0.07 -0.09 0.00 -0.00 0.00 0.00 57.88 57.33 1xx7 h LEU 115 Cb 1.24 -0.10 -0.00 0.00 -0.00 0.00 0.00 40.66 41.80 1xx7 h LEU 115 CO 0.63 0.47 -0.23 -0.33 -0.00 0.00 0.00 178.44 178.98 1xx7 h GLU 116 N 0.39 0.55 -0.57 0.17 3.07 -1.95 -0.98 114.58 115.26 1xx7 h GLU 116 Ca 0.09 -0.29 -0.02 0.00 -0.50 0.00 0.00 59.36 58.63 1xx7 h GLU 116 Cb 0.31 0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 1xx7 h GLU 116 CO 0.01 0.88 0.27 0.78 -1.40 0.00 0.00 179.01 179.56 1xx7 h GLY 117 N 0.24 0.89 0.98 -3.84 0.00 -1.70 -2.76 103.07 96.89 1xx7 h GLY 117 Ca 0.03 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 1xx7 h GLY 117 CO 0.06 0.42 0.29 1.46 0.00 0.00 0.00 176.54 178.77 1xx7 h GLN 118 N 0.78 0.74 -0.37 4.80 4.20 -1.12 -1.46 115.11 122.67 1xx7 h GLN 118 Ca 0.20 -0.09 0.05 0.00 0.06 0.00 0.00 58.65 58.87 1xx7 h GLN 118 Cb 0.12 -0.14 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 1xx7 h GLN 118 CO -0.02 0.57 0.09 1.25 -0.67 0.00 0.00 178.83 180.04 1xx7 h LEU 119 N 0.71 0.04 -0.76 1.46 5.85 -1.07 -1.22 115.31 120.30 1xx7 h LEU 119 Ca 0.19 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.87 1xx7 h LEU 119 Cb 0.05 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1xx7 h LEU 119 CO -0.03 0.06 -0.06 0.58 -0.34 0.00 0.00 178.44 178.65 1xx7 h VAL 120 N 0.22 1.26 -0.66 1.05 2.07 -1.34 -0.61 116.25 118.24 1xx7 h VAL 120 Ca 0.18 -1.14 0.04 0.00 0.82 0.00 0.00 66.70 66.59 1xx7 h VAL 120 Cb 0.20 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 1xx7 h VAL 120 CO -0.22 0.40 0.40 0.50 0.02 0.00 0.00 177.57 178.66 1xx7 h LYS 121 N 0.80 0.74 0.26 1.57 3.11 -0.96 0.14 116.57 122.23 1xx7 h LYS 121 Ca 0.14 -0.04 -0.01 0.00 -2.81 0.00 0.00 60.65 57.92 1xx7 h LYS 121 Cb 0.56 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.63 1xx7 h LYS 121 CO 0.03 0.49 -0.13 0.82 -2.81 0.00 0.00 179.45 177.86 1xx7 h ILE 122 N 0.76 0.75 -0.86 2.00 2.04 -1.06 -1.73 117.51 119.41 1xx7 h ILE 122 Ca 0.27 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 66.15 1xx7 h ILE 122 Cb 0.07 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 36.86 1xx7 h ILE 122 CO -0.13 0.01 0.53 0.00 0.00 0.00 0.00 178.15 178.57 1xx7 h ALA 123 N 0.36 1.18 -0.13 1.87 0.00 -0.98 0.65 119.26 122.21 1xx7 h ALA 123 Ca -0.04 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1xx7 h ALA 123 Cb 0.29 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1xx7 h ALA 123 CO 0.06 0.28 -0.03 0.22 0.00 0.00 0.00 179.25 179.78 1xx7 h ASP 124 N 0.98 -0.12 -0.53 0.00 3.58 -0.67 -0.33 116.42 119.33 1xx7 h ASP 124 Ca 0.37 0.04 -0.03 0.00 0.42 0.00 0.00 57.03 57.83 1xx7 h ASP 124 Cb 0.16 0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.27 1xx7 h ASP 124 CO -0.17 -0.04 0.22 0.11 -2.88 0.00 0.00 179.24 176.48 1xx7 h LYS 125 N -0.00 0.78 -0.76 0.28 1.57 -1.12 -2.76 116.57 114.56 1xx7 h LYS 125 Ca 0.06 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 1xx7 h LYS 125 Cb 0.10 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1xx7 h LYS 125 CO -0.13 0.68 0.25 -0.07 -0.57 0.00 0.00 179.45 179.61 1xx7 h LEU 126 N 0.71 1.10 -0.39 2.94 3.38 -0.68 -0.56 115.31 121.81 1xx7 h LEU 126 Ca 0.18 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1xx7 h LEU 126 Cb 0.18 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1xx7 h LEU 126 CO -0.02 1.01 0.20 -0.78 0.09 0.00 0.00 178.44 178.94 1xx7 h ASP 127 N 1.13 0.30 -0.30 -0.43 3.58 -1.03 -0.60 116.42 119.08 1xx7 h ASP 127 Ca 0.25 0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.66 1xx7 h ASP 127 Cb 0.29 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1xx7 h ASP 127 CO -0.01 0.22 -0.05 -0.03 -2.88 0.00 0.00 179.24 176.49 1xx7 h MET 128 N 0.41 0.55 -0.28 0.28 4.05 -1.16 0.12 114.93 118.89 1xx7 h MET 128 Ca 0.16 -0.20 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1xx7 h MET 128 Cb 0.06 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 1xx7 h MET 128 CO -0.11 0.73 0.18 0.82 0.23 0.00 0.00 176.91 178.76 1xx7 h ILE 129 N 0.33 1.09 -0.34 1.77 2.04 -1.05 -0.97 117.51 120.38 1xx7 h ILE 129 Ca 0.08 -0.20 -0.11 0.00 1.00 0.00 0.00 64.86 65.63 1xx7 h ILE 129 Cb 0.51 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1xx7 h ILE 129 CO 0.02 0.09 -0.25 0.40 0.00 0.00 0.00 178.15 178.42 1xx7 h ILE 130 N 0.37 1.27 -0.42 -0.67 2.04 -1.05 -2.32 117.51 116.73 1xx7 h ILE 130 Ca 0.10 -1.34 -0.06 0.00 1.00 0.00 0.00 64.86 64.57 1xx7 h ILE 130 Cb -0.01 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1xx7 h ILE 130 CO -0.02 0.44 0.02 -0.61 0.00 0.00 0.00 178.15 177.98 1xx7 h GLN 131 N 0.59 0.66 -0.57 2.37 5.75 -0.58 -1.43 115.11 121.89 1xx7 h GLN 131 Ca 0.08 -0.15 -0.09 0.00 -0.15 0.00 0.00 58.65 58.34 1xx7 h GLN 131 Cb 0.73 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.17 1xx7 h GLN 131 CO 0.06 0.66 -0.01 0.00 -2.65 0.00 0.00 178.83 176.90 1xx7 h ALA 132 N 1.40 0.78 -0.75 3.38 0.00 -0.86 -0.21 119.26 122.98 1xx7 h ALA 132 Ca 0.13 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1xx7 h ALA 132 Cb 0.37 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1xx7 h ALA 132 CO 0.01 0.61 0.47 -0.92 0.00 0.00 0.00 179.25 179.43 1xx7 h TYR 133 N 0.91 0.89 -0.56 0.00 3.20 -1.14 -0.73 116.97 119.53 1xx7 h TYR 133 Ca 0.16 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.98 1xx7 h TYR 133 Cb 0.56 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 1xx7 h TYR 133 CO 0.04 0.50 0.05 0.93 -1.64 0.00 0.00 178.16 178.04 1xx7 h GLU 134 N 0.92 0.96 -0.06 1.82 5.08 -0.41 -2.36 114.58 120.53 1xx7 h GLU 134 Ca 0.31 -0.28 -0.12 0.00 -1.00 0.00 0.00 59.36 58.26 1xx7 h GLU 134 Cb 0.04 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1xx7 h GLU 134 CO -0.12 0.94 -0.51 1.88 -1.00 0.00 0.00 179.01 180.20 1xx7 h TYR 135 N 0.85 0.18 -0.95 4.33 0.05 -0.92 -2.52 116.97 117.98 1xx7 h TYR 135 Ca 0.16 -0.06 0.01 0.00 0.05 0.00 0.00 58.73 58.90 1xx7 h TYR 135 Cb 0.48 -0.04 -0.05 0.00 1.01 0.00 0.00 36.73 38.14 1xx7 h TYR 135 CO 0.04 0.63 0.63 0.93 -1.05 0.00 0.00 178.16 179.33 1xx7 h GLU 136 N 0.12 1.26 -0.09 4.88 5.08 -0.92 -1.47 114.58 123.44 1xx7 h GLU 136 Ca 0.00 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1xx7 h GLU 136 Cb 0.94 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 1xx7 h GLU 136 CO 0.07 0.83 0.05 -0.07 -1.00 0.00 0.00 179.01 178.89 1xx7 h LEU 137 N 1.29 0.10 -1.61 1.33 3.38 -1.00 -2.32 115.31 116.48 1xx7 h LEU 137 Ca 0.35 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1xx7 h LEU 137 Cb -0.15 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1xx7 h LEU 137 CO -0.07 0.09 0.00 -1.20 0.09 0.00 0.00 178.44 177.34 1xx7 n SER 138 N -4.51 2.45 0.00 -0.43 7.64 -0.99 -4.96 113.62 112.83 1xx7 n SER 138 Ca -0.02 -1.82 0.00 0.00 1.01 0.00 0.00 58.87 58.05 1xx7 n SER 138 Cb 0.09 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 1xx7 n SER 138 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xx7 n GLY 139 N 1.30 1.15 3.72 0.23 0.00 -0.78 -5.07 105.19 105.74 1xx7 n GLY 139 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1xx7 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xx7 s ALA 140 N -0.35 3.55 -1.02 4.61 0.00 -0.62 -4.89 121.76 123.04 1xx7 s ALA 140 Ca 0.00 1.09 0.09 0.00 0.00 0.00 0.00 51.96 53.14 1xx7 s ALA 140 Cb 0.00 -3.51 0.10 0.00 0.00 0.00 0.00 23.12 19.72 1xx7 s ALA 140 CO 0.00 -0.57 0.86 1.63 0.00 0.00 0.00 175.76 177.68 1xx7 n LYS 141 N 3.46 0.75 -1.02 0.00 5.02 -1.26 -4.24 118.16 120.86 1xx7 n LYS 141 Ca 0.09 -1.20 -0.01 0.00 -2.02 0.00 0.00 58.31 55.17 1xx7 n LYS 141 Cb 0.43 -1.18 0.15 0.00 -0.02 0.00 0.00 35.03 34.41 1xx7 n LYS 141 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1xx7 n ASN 142 N 0.45 2.37 -0.66 4.39 6.94 -1.26 -4.74 115.26 122.76 1xx7 n ASN 142 Ca 0.06 -3.71 0.07 0.00 -0.02 0.00 0.00 54.58 50.98 1xx7 n ASN 142 Cb 0.25 -0.47 0.19 0.00 -2.36 0.00 0.00 39.78 37.39 1xx7 n ASN 142 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1xx7 n LEU 143 N -0.91 3.26 -0.10 -4.53 4.77 -1.26 -4.74 117.00 113.49 1xx7 n LEU 143 Ca 0.23 -2.58 -0.02 0.00 -0.03 0.00 0.00 56.01 53.61 1xx7 n LEU 143 Cb 0.78 -0.38 0.22 0.00 -2.33 0.00 0.00 43.42 41.71 1xx7 n LEU 143 CO 0.06 0.68 0.97 0.77 -1.33 0.00 0.00 177.39 178.54 1xx7 h SER 144 N 1.58 0.70 -0.23 -1.43 4.64 -1.97 -1.89 113.55 114.96 1xx7 h SER 144 Ca 0.00 -0.13 0.07 0.00 -0.47 0.00 0.00 61.79 61.26 1xx7 h SER 144 Cb 1.08 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.98 1xx7 h SER 144 CO 0.11 0.71 0.18 1.05 -0.87 0.00 0.00 176.83 178.01 1xx7 h GLU 145 N 0.73 0.00 -6.22 4.77 4.11 -2.00 -3.53 114.58 112.44 1xx7 h GLU 145 Ca 0.16 0.00 -0.56 0.00 0.07 0.00 0.00 59.36 59.03 1xx7 h GLU 145 Cb 0.30 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1xx7 h GLU 145 CO 0.00 0.00 0.75 -0.06 0.07 0.00 0.00 179.01 179.77 1xx7 s PHE 146 N -4.90 3.18 0.13 2.06 0.08 -0.71 -5.17 117.98 112.65 1xx7 s PHE 146 Ca -0.05 1.28 0.00 0.00 0.12 0.00 0.00 56.93 58.28 1xx7 s PHE 146 Cb 0.17 -3.37 0.31 0.00 -0.57 0.00 0.00 43.02 39.56 1xx7 s PHE 146 CO 0.65 -1.06 0.67 -1.91 -0.10 0.00 0.00 175.22 173.46 1xx7 n GLU 157 N 5.75 -0.03 0.00 0.44 0.00 -1.26 -4.56 120.64 120.98 1xx7 n GLU 157 Ca 0.12 0.64 0.14 0.00 0.00 0.00 0.00 57.16 58.06 1xx7 n GLU 157 Cb 0.46 -1.01 0.64 0.00 0.00 0.00 0.00 31.44 31.53 1xx7 n GLU 157 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.13 178.64 1xx7 n ILE 158 N -4.48 0.00 0.28 6.31 3.06 -1.26 -2.91 119.36 120.35 1xx7 n ILE 158 Ca 0.10 -0.00 0.15 0.00 -2.50 0.00 0.00 62.75 60.50 1xx7 n ILE 158 Cb 0.31 -0.48 0.82 0.00 0.54 0.00 0.00 39.64 40.83 1xx7 n ILE 158 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 1xx7 h SER 159 N 0.00 0.00 -0.35 9.51 4.64 -1.97 -1.87 113.55 123.51 1xx7 h SER 159 Ca 0.00 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.42 1xx7 h SER 159 Cb 0.46 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1xx7 h SER 159 CO 0.00 0.07 0.30 0.08 -0.87 0.00 0.00 176.83 176.41 1xx7 h ARG 160 N 0.00 0.00 -0.02 4.77 0.11 -2.00 -1.13 114.38 116.11 1xx7 h ARG 160 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1xx7 h ARG 160 Cb 0.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.34 1xx7 h ARG 160 CO 0.01 0.00 -0.05 0.66 0.10 0.00 0.00 179.97 180.69 1xx7 n TYR 161 N -4.09 0.00 -2.21 4.08 4.01 -0.70 -4.44 117.16 113.81 1xx7 n TYR 161 Ca 0.05 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.80 1xx7 n TYR 161 Cb 0.47 -0.02 0.08 0.00 -0.31 0.00 0.00 39.34 39.57 1xx7 n TYR 161 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1xx7 n LEU 162 N 0.17 2.05 -0.22 7.72 4.77 -0.43 -4.85 117.00 126.21 1xx7 n LEU 162 Ca 0.17 -3.05 -0.05 0.00 -0.03 0.00 0.00 56.01 53.05 1xx7 n LEU 162 Cb 0.38 -0.14 0.11 0.00 -2.33 0.00 0.00 43.42 41.44 1xx7 n LEU 162 CO 0.18 1.04 0.99 0.03 -1.33 0.00 0.00 177.39 178.30 1xx7 h ARG 163 N 1.36 1.04 0.34 3.23 2.47 -1.76 -2.28 114.38 118.78 1xx7 h ARG 163 Ca -0.08 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.42 1xx7 h ARG 163 Cb 1.48 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 29.62 1xx7 h ARG 163 CO 0.15 0.89 -0.38 0.93 0.56 0.00 0.00 179.97 182.12 1xx7 h GLU 164 N 1.00 -0.74 -0.32 0.04 3.07 -1.92 -2.15 114.58 113.57 1xx7 h GLU 164 Ca 0.22 0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 59.01 1xx7 h GLU 164 Cb 0.30 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 1xx7 h GLU 164 CO -0.01 -0.49 -0.28 0.97 -1.40 0.00 0.00 179.01 177.80 1xx7 h ILE 165 N -0.76 1.28 -0.98 3.13 6.09 -1.95 -1.56 117.51 122.76 1xx7 h ILE 165 Ca -0.02 -1.39 0.01 0.00 -1.37 0.00 0.00 64.86 62.09 1xx7 h ILE 165 Cb 0.70 1.34 -0.05 0.00 0.47 0.00 0.00 36.82 39.28 1xx7 h ILE 165 CO -0.09 0.45 0.65 0.40 -3.07 0.00 0.00 178.15 176.49 1xx7 h ILE 166 N 0.56 1.25 0.04 2.19 2.04 -1.36 -2.15 117.51 120.08 1xx7 h ILE 166 Ca 0.07 -0.45 -0.22 0.00 1.00 0.00 0.00 64.86 65.25 1xx7 h ILE 166 Cb 0.77 -0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1xx7 h ILE 166 CO 0.06 0.24 -1.02 -0.33 0.00 0.00 0.00 178.15 177.11 1xx7 h GLU 167 N 1.32 0.17 -0.96 2.37 5.08 -1.14 -2.29 114.58 119.13 1xx7 h GLU 167 Ca 0.36 -0.24 0.13 0.00 -1.00 0.00 0.00 59.36 58.61 1xx7 h GLU 167 Cb -0.15 0.08 -0.09 0.00 0.50 0.00 0.00 28.75 29.09 1xx7 h GLU 167 CO -0.08 1.04 0.58 0.93 -1.00 0.00 0.00 179.01 180.48 1xx7 h GLU 168 N 0.07 0.85 0.05 2.33 5.08 -1.11 -0.92 114.58 120.94 1xx7 h GLU 168 Ca -0.06 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1xx7 h GLU 168 Cb 1.71 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.77 1xx7 h GLU 168 CO 0.15 0.56 -0.03 0.28 -1.00 0.00 0.00 179.01 178.98 1xx7 h VAL 169 N 0.88 1.21 -0.44 3.13 2.07 -1.33 -3.26 116.25 118.51 1xx7 h VAL 169 Ca 0.49 -0.92 0.09 0.00 0.82 0.00 0.00 66.70 67.19 1xx7 h VAL 169 Cb 0.56 1.81 -0.09 0.00 -1.52 0.00 0.00 31.29 32.05 1xx7 h VAL 169 CO -0.29 0.23 -0.18 0.03 0.02 0.00 0.00 177.57 177.37 1xx7 h ARG 170 N -0.48 -0.09 0.00 1.57 -0.00 -1.08 -3.52 114.38 110.78 1xx7 h ARG 170 Ca -0.01 0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1xx7 h ARG 170 Cb 0.43 0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.42 1xx7 h ARG 170 CO 0.01 -0.06 0.00 0.54 0.00 0.00 0.00 179.97 180.46