#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 0.82 -0.49 2.46 2.04 -2.05 -3.00 117.51 117.28 1xx7 h ILE 2 Ca 0.00 -0.99 -0.12 0.00 1.00 0.00 0.00 64.86 64.75 1xx7 h ILE 2 Cb 0.00 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1xx7 h ILE 2 CO 0.00 0.24 -0.18 0.44 0.00 0.00 0.00 178.15 178.65 1xx7 h ASP 3 N 0.00 1.00 -0.52 1.72 3.32 -2.05 0.61 116.42 120.50 1xx7 h ASP 3 Ca -0.00 -0.36 -0.05 0.00 0.02 0.00 0.00 57.03 56.64 1xx7 h ASP 3 Cb 0.58 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1xx7 h ASP 3 CO 0.03 1.15 0.16 -0.07 -1.72 0.00 0.00 179.24 178.79 1xx7 h LEU 4 N 0.86 0.80 -0.26 1.55 3.38 -1.94 0.64 115.31 120.33 1xx7 h LEU 4 Ca 0.12 -0.13 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 1xx7 h LEU 4 Cb 0.75 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1xx7 h LEU 4 CO 0.06 0.77 -0.85 0.40 0.09 0.00 0.00 178.44 178.91 1xx7 h ILE 5 N 0.84 1.38 -0.74 1.22 2.04 -1.39 -0.62 117.51 120.24 1xx7 h ILE 5 Ca 0.19 -2.28 -0.06 0.00 1.00 0.00 0.00 64.86 63.71 1xx7 h ILE 5 Cb 0.27 2.26 -0.03 0.00 -0.74 0.00 0.00 36.82 38.57 1xx7 h ILE 5 CO -0.01 0.69 0.24 -0.07 0.00 0.00 0.00 178.15 179.00 1xx7 h LEU 6 N 0.28 1.06 -0.09 1.44 3.38 -0.76 -1.23 115.31 119.39 1xx7 h LEU 6 Ca -0.06 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1xx7 h LEU 6 Cb 1.46 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1xx7 h LEU 6 CO 0.15 0.97 0.05 0.25 0.09 0.00 0.00 178.44 179.96 1xx7 h LEU 7 N 1.09 0.09 -1.38 1.67 6.46 -0.60 -2.57 115.31 120.07 1xx7 h LEU 7 Ca 0.24 -0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.95 1xx7 h LEU 7 Cb 0.29 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 1xx7 h LEU 7 CO -0.01 0.06 -0.13 0.00 -0.62 0.00 0.00 178.44 177.74 1xx7 h ALA 8 N 1.04 1.49 0.00 1.25 0.00 -0.99 -2.49 119.26 119.57 1xx7 h ALA 8 Ca 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1xx7 h ALA 8 Cb -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1xx7 h ALA 8 CO -0.01 0.36 -0.06 0.78 0.00 0.00 0.00 179.25 180.32 1xx7 h GLY 9 N 0.76 0.00 1.61 0.00 0.00 -0.83 -2.08 103.07 102.52 1xx7 h GLY 9 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.42 1xx7 h GLY 9 CO 0.02 0.00 0.18 0.50 0.00 0.00 0.00 176.54 177.24 1xx7 h LYS 10 N 0.00 0.17 0.00 4.80 1.57 -1.16 -1.54 116.57 120.41 1xx7 h LYS 10 Ca -0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xx7 h LYS 10 Cb 0.13 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1xx7 h LYS 10 CO 0.01 0.12 -0.01 -0.07 -0.57 0.00 0.00 179.45 178.92 1xx7 h LEU 11 N 0.18 0.00 -1.16 2.94 3.38 -1.52 -1.25 115.31 117.88 1xx7 h LEU 11 Ca 0.11 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1xx7 h LEU 11 Cb 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1xx7 h LEU 11 CO -0.02 0.01 -0.18 0.11 0.09 0.00 0.00 178.44 178.46 1xx7 h LYS 12 N 0.00 0.00 0.00 1.13 1.57 -1.43 -0.93 116.57 116.91 1xx7 h LYS 12 Ca -0.00 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 1xx7 h LYS 12 Cb 0.24 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.51 1xx7 h LYS 12 CO 0.00 0.18 -1.94 0.54 -0.57 0.00 0.00 179.45 177.66 1xx7 n ARG 13 N -3.33 1.33 -2.47 3.15 1.74 -0.69 -4.75 116.66 111.64 1xx7 n ARG 13 Ca 0.00 -0.04 -0.43 0.00 -0.77 0.00 0.00 57.85 56.61 1xx7 n ARG 13 Cb 0.41 -1.38 -0.02 0.00 -1.02 0.00 0.00 32.46 30.45 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 -2.53 4.33 0.53 0.55 1.01 -0.56 -4.97 121.20 119.55 1xx7 s ILE 14 Ca -0.07 1.58 -0.13 0.00 0.00 0.00 0.00 60.65 62.03 1xx7 s ILE 14 Cb 0.06 -4.11 -0.06 0.00 0.01 0.00 0.00 42.46 38.36 1xx7 s ILE 14 CO 0.61 -0.24 0.94 -2.16 0.00 0.00 0.00 174.94 174.10 1xx7 s PRO 15 N 3.61 3.76 -0.56 2.79 0.04 -1.26 -1.04 135.00 142.34 1xx7 s PRO 15 Ca 0.53 0.73 -0.28 0.00 0.04 0.00 0.00 61.00 62.02 1xx7 s PRO 15 Cb -0.19 -2.19 0.01 0.00 0.04 0.00 0.00 34.50 32.18 1xx7 s PRO 15 CO 0.15 -0.32 1.45 1.03 0.04 0.00 0.00 177.00 179.35 1xx7 s ARG 16 N -4.46 3.26 0.29 4.56 1.81 0.46 -4.60 118.95 120.27 1xx7 s ARG 16 Ca 0.55 0.48 0.01 0.00 -1.72 0.00 0.00 55.73 55.06 1xx7 s ARG 16 Cb -0.10 -4.14 0.43 0.00 -0.45 0.00 0.00 34.95 30.68 1xx7 s ARG 16 CO 0.40 -1.99 1.78 0.52 -0.68 0.00 0.00 175.30 175.33 1xx7 h MET 17 N 11.34 0.62 -0.65 3.54 2.86 -1.89 -2.94 114.93 127.82 1xx7 h MET 17 Ca -0.27 -0.18 0.13 0.00 -2.06 0.00 0.00 59.70 57.32 1xx7 h MET 17 Cb 1.10 -0.07 -0.09 0.00 0.06 0.00 0.00 31.60 32.60 1xx7 h MET 17 CO 1.18 0.70 0.15 0.78 1.06 0.00 0.00 176.91 180.78 1xx7 h GLY 18 N 0.94 0.85 1.09 8.32 0.00 -1.91 -1.36 103.07 111.01 1xx7 h GLY 18 Ca 0.11 -0.04 -0.12 0.00 0.00 0.00 0.00 47.33 47.28 1xx7 h GLY 18 CO 0.03 -0.13 -0.13 1.49 0.00 0.00 0.00 176.54 177.80 1xx7 h TRP 19 N 0.28 1.14 -0.27 5.60 -0.00 -1.91 -2.53 115.95 118.26 1xx7 h TRP 19 Ca 0.35 -0.25 -0.02 0.00 -0.00 0.00 0.00 58.89 58.97 1xx7 h TRP 19 Cb 0.53 -0.28 -0.01 0.00 -0.00 0.00 0.00 29.16 29.40 1xx7 h TRP 19 CO -0.25 1.07 0.09 1.25 -0.00 0.00 0.00 178.44 180.60 1xx7 h LEU 20 N 0.89 0.38 -0.86 -4.49 6.46 -1.41 -0.99 115.31 115.29 1xx7 h LEU 20 Ca 0.13 -0.19 -0.10 0.00 -0.12 0.00 0.00 57.88 57.60 1xx7 h LEU 20 Cb 0.70 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.52 1xx7 h LEU 20 CO 0.05 0.47 -0.25 0.40 -0.62 0.00 0.00 178.44 178.50 1xx7 h ILE 21 N 0.27 1.27 0.00 4.05 2.04 -1.29 -2.22 117.51 121.63 1xx7 h ILE 21 Ca 0.09 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 64.65 1xx7 h ILE 21 Cb 0.22 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1xx7 h ILE 21 CO -0.00 0.42 0.00 0.11 0.00 0.00 0.00 178.15 178.67 1xx7 h LYS 22 N 0.50 0.00 0.00 2.37 1.79 -0.98 -3.46 116.57 116.78 1xx7 h LYS 22 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1xx7 h LYS 22 Cb 0.69 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1xx7 h LYS 22 CO 0.05 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.83 1xx7 n GLY 23 N -0.51 0.98 3.68 3.86 0.00 -0.81 -4.98 105.19 107.40 1xx7 n GLY 23 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1xx7 n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xx7 s VAL 24 N -2.00 3.10 0.14 1.61 1.01 -0.44 -4.91 120.40 118.91 1xx7 s VAL 24 Ca 0.00 0.41 -0.11 0.00 0.00 0.00 0.00 61.98 62.29 1xx7 s VAL 24 Cb 0.00 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.06 1xx7 s VAL 24 CO 0.00 -0.01 1.47 1.55 0.00 0.00 0.00 175.10 178.10 1xx7 h PRO 25 N 8.96 0.92 -2.40 2.72 0.13 -1.93 -3.36 132.00 137.05 1xx7 h PRO 25 Ca -0.43 -0.50 -0.60 0.00 -0.87 0.00 0.00 66.00 63.60 1xx7 h PRO 25 Cb 1.20 0.02 -0.41 0.00 0.13 0.00 0.00 31.00 31.95 1xx7 h PRO 25 CO 0.94 1.15 -0.70 0.09 -0.23 0.00 0.00 178.00 179.25 1xx7 n ASN 26 N -4.05 2.63 -4.77 1.44 3.02 -1.26 -5.10 115.26 107.18 1xx7 n ASN 26 Ca -0.02 -3.17 -0.36 0.00 -0.03 0.00 0.00 54.58 51.00 1xx7 n ASN 26 Cb 0.56 -0.68 0.01 0.00 -0.61 0.00 0.00 39.78 39.06 1xx7 n ASN 26 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1xx7 s PRO 27 N -1.80 3.26 0.51 3.52 0.04 -1.26 -4.97 135.00 134.31 1xx7 s PRO 27 Ca 0.35 1.70 -0.21 0.00 0.04 0.00 0.00 61.00 62.88 1xx7 s PRO 27 Cb 0.10 -2.02 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 1xx7 s PRO 27 CO -0.08 -0.94 0.95 -0.85 0.04 0.00 0.00 177.00 176.11 1xx7 n GLU 28 N -1.32 1.09 -1.87 4.56 0.28 -1.26 -4.74 120.64 117.38 1xx7 n GLU 28 Ca 0.12 0.40 -0.30 0.00 -0.16 0.00 0.00 57.16 57.23 1xx7 n GLU 28 Cb 0.50 -2.07 0.06 0.00 1.43 0.00 0.00 31.44 31.36 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 -0.99 5.09 0.36 -1.84 1.04 -1.26 -0.40 113.70 115.70 1xx7 s SER 29 Ca 0.69 1.03 0.05 0.00 0.48 0.00 0.00 55.95 58.19 1xx7 s SER 29 Cb -0.48 -1.73 0.68 0.00 0.10 0.00 0.00 66.02 64.59 1xx7 s SER 29 CO 0.53 -1.56 1.95 0.58 0.98 0.00 0.00 173.24 175.72 1xx7 h VAL 30 N -0.81 1.17 -0.46 5.02 2.07 -0.95 -2.05 116.25 120.24 1xx7 h VAL 30 Ca -0.45 -0.53 -0.07 0.00 0.82 0.00 0.00 66.70 66.47 1xx7 h VAL 30 Cb 1.28 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1xx7 h VAL 30 CO 0.64 0.20 0.02 0.00 0.02 0.00 0.00 177.57 178.46 1xx7 h ALA 31 N 1.58 0.61 -0.20 1.67 0.00 -1.44 0.19 119.26 121.68 1xx7 h ALA 31 Ca 0.14 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.84 1xx7 h ALA 31 Cb 0.14 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 1xx7 h ALA 31 CO -0.01 0.38 -0.13 -0.44 0.00 0.00 0.00 179.25 179.05 1xx7 h ASP 32 N 0.64 -0.42 0.26 0.00 3.32 -1.74 0.66 116.42 119.14 1xx7 h ASP 32 Ca 0.13 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 1xx7 h ASP 32 Cb 0.46 0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1xx7 h ASP 32 CO 0.02 -0.17 -0.18 -0.74 -1.72 0.00 0.00 179.24 176.45 1xx7 h HIS 33 N -0.12 -0.48 -0.39 4.55 -0.00 -1.26 -2.91 115.15 114.54 1xx7 h HIS 33 Ca 0.11 -0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.48 1xx7 h HIS 33 Cb 0.30 0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 27.86 1xx7 h HIS 33 CO -0.28 -0.29 0.22 0.77 -0.00 0.00 0.00 177.93 178.36 1xx7 h SER 34 N -0.45 0.46 0.14 3.26 0.02 -0.44 -0.80 113.55 115.75 1xx7 h SER 34 Ca -0.02 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1xx7 h SER 34 Cb 0.38 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 1xx7 h SER 34 CO 0.01 0.36 -0.22 0.22 -1.14 0.00 0.00 176.83 176.06 1xx7 h TYR 35 N 0.53 -0.58 0.00 3.45 3.20 -0.69 -1.20 116.97 121.68 1xx7 h TYR 35 Ca 0.14 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.89 1xx7 h TYR 35 Cb -0.00 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 1xx7 h TYR 35 CO 0.00 -0.32 -0.63 -0.09 -1.64 0.00 0.00 178.16 175.48 1xx7 h ARG 36 N -0.43 0.00 -0.69 1.82 2.43 -1.28 -1.73 114.38 114.49 1xx7 h ARG 36 Ca 0.02 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1xx7 h ARG 36 Cb 0.44 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 1xx7 h ARG 36 CO -0.10 0.63 0.43 0.28 -1.51 0.00 0.00 179.97 179.70 1xx7 h VAL 37 N 0.00 1.08 -0.81 0.20 2.07 -0.98 0.15 116.25 117.96 1xx7 h VAL 37 Ca -0.01 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1xx7 h VAL 37 Cb 1.19 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1xx7 h VAL 37 CO 0.08 0.15 0.35 0.00 0.02 0.00 0.00 177.57 178.18 1xx7 h ALA 38 N 1.30 1.10 -0.29 1.67 0.00 -0.90 0.34 119.26 122.48 1xx7 h ALA 38 Ca 0.28 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1xx7 h ALA 38 Cb 0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1xx7 h ALA 38 CO -0.11 0.66 0.00 0.35 0.00 0.00 0.00 179.25 180.15 1xx7 h PHE 39 N 1.17 0.56 -0.55 0.00 3.57 -0.80 -2.01 116.94 118.88 1xx7 h PHE 39 Ca 0.27 -0.10 -0.10 0.00 3.53 0.00 0.00 57.97 61.58 1xx7 h PHE 39 Cb 0.17 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1xx7 h PHE 39 CO 0.02 0.65 -0.05 0.82 -2.23 0.00 0.00 178.31 177.52 1xx7 h ILE 40 N 0.30 1.27 -0.86 1.41 2.04 -0.59 -2.14 117.51 118.94 1xx7 h ILE 40 Ca 0.08 -1.19 0.06 0.00 1.00 0.00 0.00 64.86 64.81 1xx7 h ILE 40 Cb 0.43 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 37.37 1xx7 h ILE 40 CO 0.01 0.42 0.54 0.74 0.00 0.00 0.00 178.15 179.86 1xx7 h THR 41 N 0.88 1.05 -0.33 -0.27 2.02 -0.20 0.04 112.91 116.10 1xx7 h THR 41 Ca 0.15 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.98 1xx7 h THR 41 Cb 0.60 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 1xx7 h THR 41 CO 0.04 0.18 0.17 0.25 0.37 0.00 0.00 175.52 176.53 1xx7 h LEU 42 N 0.99 0.42 -0.07 2.58 5.85 -1.09 0.78 115.31 124.77 1xx7 h LEU 42 Ca 0.37 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 59.00 1xx7 h LEU 42 Cb 0.15 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1xx7 h LEU 42 CO -0.17 0.41 -0.05 -0.07 -0.34 0.00 0.00 178.44 178.22 1xx7 h LEU 43 N 0.40 -0.16 -0.37 2.25 4.07 -0.99 -1.61 115.31 118.89 1xx7 h LEU 43 Ca 0.11 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 58.09 1xx7 h LEU 43 Cb 0.09 0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.90 1xx7 h LEU 43 CO -0.02 -0.07 0.13 -0.07 -1.08 0.00 0.00 178.44 177.34 1xx7 h LEU 44 N -0.06 0.53 -0.82 1.67 3.38 -0.84 -1.26 115.31 117.91 1xx7 h LEU 44 Ca 0.05 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1xx7 h LEU 44 Cb 0.13 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1xx7 h LEU 44 CO -0.11 0.57 0.54 0.00 0.09 0.00 0.00 178.44 179.53 1xx7 h ALA 45 N 0.98 1.06 -0.15 1.53 0.00 -0.78 -1.39 119.26 120.51 1xx7 h ALA 45 Ca 0.12 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1xx7 h ALA 45 Cb 0.22 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xx7 h ALA 45 CO -0.01 0.40 -0.48 0.93 0.00 0.00 0.00 179.25 180.10 1xx7 h GLU 46 N 1.07 0.39 -0.65 0.00 4.39 -1.17 -1.71 114.58 116.90 1xx7 h GLU 46 Ca 0.32 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.79 1xx7 h GLU 46 Cb -0.06 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 1xx7 h GLU 46 CO -0.09 0.79 0.37 1.49 -1.16 0.00 0.00 179.01 180.41 1xx7 h GLU 47 N 0.31 0.90 -0.23 2.33 4.57 -0.71 -2.04 114.58 119.72 1xx7 h GLU 47 Ca 0.02 -0.10 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 1xx7 h GLU 47 Cb 0.96 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.36 1xx7 h GLU 47 CO 0.08 0.66 0.03 -0.07 -1.18 0.00 0.00 179.01 178.53 1xx7 h LEU 48 N 0.89 0.37 -0.55 1.64 3.38 -0.97 -2.17 115.31 117.90 1xx7 h LEU 48 Ca 0.23 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 57.99 1xx7 h LEU 48 Cb 0.01 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 1xx7 h LEU 48 CO -0.04 0.55 0.24 0.50 0.09 0.00 0.00 178.44 179.78 1xx7 h LYS 49 N 0.17 0.45 -0.25 1.13 3.64 -1.31 -0.64 116.57 119.76 1xx7 h LYS 49 Ca 0.07 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1xx7 h LYS 49 Cb 0.35 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1xx7 h LYS 49 CO 0.01 0.30 -0.05 0.87 -2.27 0.00 0.00 179.45 178.30 1xx7 h LYS 50 N 0.46 0.38 -0.15 1.90 6.56 -1.26 -2.53 116.57 121.92 1xx7 h LYS 50 Ca 0.26 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.77 1xx7 h LYS 50 Cb 0.24 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 31.84 1xx7 h LYS 50 CO -0.22 0.46 0.00 1.63 -2.06 0.00 0.00 179.45 179.25 1xx7 n LYS 51 N -4.29 1.38 -0.48 3.15 5.02 -0.76 -4.90 118.16 117.28 1xx7 n LYS 51 Ca 0.00 -0.59 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 1xx7 n LYS 51 Cb 0.25 -1.16 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 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 0.79 0.76 3.79 0.72 0.00 -0.95 -5.06 105.19 105.24 1xx7 n GLY 52 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.18 4.43 -0.28 1.61 1.01 -0.32 -4.99 120.40 119.68 1xx7 s VAL 53 Ca 0.00 1.58 -0.28 0.00 0.00 0.00 0.00 61.98 63.29 1xx7 s VAL 53 Cb 0.00 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.34 1xx7 s VAL 53 CO 0.00 0.44 0.99 -0.70 0.00 0.00 0.00 175.10 175.83 1xx7 s GLU 54 N -1.36 4.13 -0.08 2.72 2.56 -1.26 -4.10 118.70 121.31 1xx7 s GLU 54 Ca 0.37 1.09 -0.04 0.00 0.00 0.00 0.00 54.97 56.39 1xx7 s GLU 54 Cb -0.21 -3.69 0.04 0.00 2.00 0.00 0.00 34.13 32.27 1xx7 s GLU 54 CO 0.24 -0.72 0.18 -1.50 -0.56 0.00 0.00 175.26 172.90 1xx7 s ILE 55 N 3.29 -0.04 -0.69 -3.70 1.10 -1.26 -5.06 121.20 114.85 1xx7 s ILE 55 Ca 0.42 0.14 -0.21 0.00 -0.51 0.00 0.00 60.65 60.49 1xx7 s ILE 55 Cb -0.14 -0.29 0.09 0.00 0.15 0.00 0.00 42.46 42.28 1xx7 s ILE 55 CO 0.11 0.06 0.92 -0.62 -2.11 0.00 0.00 174.94 173.29 1xx7 s ASP 56 N 1.04 6.25 0.01 4.50 -1.08 -1.26 -4.93 116.67 121.20 1xx7 s ASP 56 Ca -0.08 -1.29 -0.25 0.00 -0.52 0.00 0.00 52.55 50.41 1xx7 s ASP 56 Cb -0.10 -2.38 -0.18 0.00 -1.46 0.00 0.00 42.92 38.80 1xx7 s ASP 56 CO -0.06 -1.29 1.32 0.58 0.52 0.00 0.00 175.17 176.25 1xx7 h VAL 57 N 5.93 1.09 -0.74 1.11 2.07 -1.99 -2.28 116.25 121.43 1xx7 h VAL 57 Ca -0.21 -0.78 0.14 0.00 0.82 0.00 0.00 66.70 66.67 1xx7 h VAL 57 Cb 1.07 1.57 -0.14 0.00 -1.52 0.00 0.00 31.29 32.27 1xx7 h VAL 57 CO 1.15 0.19 -0.23 -0.08 0.02 0.00 0.00 177.57 178.62 1xx7 h GLU 58 N -0.50 -0.03 -0.13 1.57 4.81 -1.99 -1.37 114.58 116.93 1xx7 h GLU 58 Ca -0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1xx7 h GLU 58 Cb 0.41 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1xx7 h GLU 58 CO 0.02 -0.02 0.08 -0.22 -0.73 0.00 0.00 179.01 178.14 1xx7 h LYS 59 N -0.03 0.18 -0.93 1.92 3.64 -1.94 -1.90 116.57 117.52 1xx7 h LYS 59 Ca 0.34 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.77 1xx7 h LYS 59 Cb 0.56 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 1xx7 h LYS 59 CO -0.78 0.18 0.58 0.00 -2.27 0.00 0.00 179.45 177.17 1xx7 h ALA 60 N 0.99 1.29 -0.41 5.00 0.00 -0.99 -1.04 119.26 124.10 1xx7 h ALA 60 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1xx7 h ALA 60 Cb 0.05 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1xx7 h ALA 60 CO -0.01 0.32 0.09 -0.07 0.00 0.00 0.00 179.25 179.59 1xx7 h LEU 61 N 1.04 0.64 -0.57 0.00 3.38 -1.12 -0.15 115.31 118.53 1xx7 h LEU 61 Ca 0.41 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1xx7 h LEU 61 Cb 0.21 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1xx7 h LEU 61 CO -0.19 0.71 0.37 0.11 0.09 0.00 0.00 178.44 179.53 1xx7 h LYS 62 N 0.53 0.76 -0.65 1.13 1.57 -0.97 -1.55 116.57 117.39 1xx7 h LYS 62 Ca 0.13 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1xx7 h LYS 62 Cb 0.33 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1xx7 h LYS 62 CO 0.00 0.52 0.37 0.82 -0.57 0.00 0.00 179.45 180.59 1xx7 h ILE 63 N 0.77 1.20 -0.88 1.86 2.04 -1.07 -2.12 117.51 119.31 1xx7 h ILE 63 Ca 0.21 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1xx7 h ILE 63 Cb -0.07 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.30 1xx7 h ILE 63 CO -0.04 0.21 0.51 0.00 0.00 0.00 0.00 178.15 178.82 1xx7 h ALA 64 N 1.19 1.23 -0.78 1.87 0.00 -0.65 -0.85 119.26 121.27 1xx7 h ALA 64 Ca 0.23 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1xx7 h ALA 64 Cb 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1xx7 h ALA 64 CO -0.04 0.64 0.29 0.82 0.00 0.00 0.00 179.25 180.96 1xx7 h ILE 65 N 1.23 1.26 -0.01 0.00 2.04 -0.97 -3.27 117.51 117.80 1xx7 h ILE 65 Ca 0.31 -0.85 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1xx7 h ILE 65 Cb -0.02 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1xx7 h ILE 65 CO -0.06 0.34 -0.56 2.30 0.00 0.00 0.00 178.15 180.18 1xx7 n ILE 66 N -4.27 0.00 0.22 -0.67 -6.64 -0.82 -4.65 119.36 102.53 1xx7 n ILE 66 Ca 0.07 -0.11 0.07 0.00 -1.77 0.00 0.00 62.75 61.01 1xx7 n ILE 66 Cb 0.20 0.79 0.53 0.00 -1.44 0.00 0.00 39.64 39.72 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 1.06 0.00 -0.23 4.28 2.07 -1.21 -1.78 115.15 119.34 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 0.58 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.56 1xx7 h HIS 67 CO 0.00 0.23 0.00 -0.25 -3.07 0.00 0.00 177.93 174.84 1xx7 n ASP 68 N -3.92 2.93 0.08 3.10 8.00 -1.26 -4.70 116.55 120.78 1xx7 n ASP 68 Ca -0.02 -2.34 0.00 0.00 0.71 0.00 0.00 54.79 53.14 1xx7 n ASP 68 Cb 0.32 -0.28 0.31 0.00 -0.02 0.00 0.00 41.12 41.44 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 1.40 0.32 -2.65 0.64 5.85 -1.60 -0.74 115.31 118.53 1xx7 h LEU 69 Ca 0.00 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1xx7 h LEU 69 Cb 0.88 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.83 1xx7 h LEU 69 CO 0.05 0.53 0.11 1.23 -0.34 0.00 0.00 178.44 180.02 1xx7 h GLY 70 N 0.91 0.00 1.70 3.75 0.00 -1.84 -0.93 103.07 106.66 1xx7 h GLY 70 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1xx7 h GLY 70 CO 0.03 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.75 1xx7 n GLU 71 N -3.12 0.15 0.22 4.80 1.02 -0.28 -1.49 120.64 121.94 1xx7 n GLU 71 Ca -0.02 0.18 0.09 0.00 -0.02 0.00 0.00 57.16 57.38 1xx7 n GLU 71 Cb 0.17 -1.50 0.45 0.00 -0.02 0.00 0.00 31.44 30.54 1xx7 n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xx7 h ALA 72 N 2.65 1.05 0.00 0.62 0.00 -1.32 -0.67 119.26 121.60 1xx7 h ALA 72 Ca 0.00 -0.24 -0.37 0.00 0.00 0.00 0.00 54.91 54.30 1xx7 h ALA 72 Cb 0.17 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 1xx7 h ALA 72 CO 0.00 0.33 -2.31 -0.89 0.00 0.00 0.00 179.25 176.38 1xx7 n ILE 73 N -3.48 1.30 0.07 0.00 5.41 -0.95 -4.69 119.36 117.02 1xx7 n ILE 73 Ca -0.00 -0.41 0.03 0.00 1.00 0.00 0.00 62.75 63.36 1xx7 n ILE 73 Cb 0.43 -1.56 -0.04 0.00 -0.71 0.00 0.00 39.64 37.76 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 -0.43 0.50 -1.25 1.39 1.08 -1.35 -3.51 117.51 113.94 1xx7 h ILE 74 Ca -0.56 -1.87 0.15 0.00 -0.39 0.00 0.00 64.86 62.19 1xx7 h ILE 74 Cb 1.66 2.04 -0.04 0.00 -3.07 0.00 0.00 36.82 37.41 1xx7 h ILE 74 CO -0.22 0.28 -0.22 0.35 -0.69 0.00 0.00 178.15 177.65 1xx7 n THR 75 N -2.94 0.00 -2.84 -0.27 -2.24 -0.26 -4.72 114.28 101.01 1xx7 n THR 75 Ca -0.05 0.02 -0.43 0.00 -2.27 0.00 0.00 64.05 61.32 1xx7 n THR 75 Cb 0.76 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.75 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 -4.23 6.61 0.02 3.42 2.15 -1.26 -4.61 116.67 118.77 1xx7 s ASP 76 Ca 0.00 -1.92 -0.30 0.00 0.43 0.00 0.00 52.55 50.76 1xx7 s ASP 76 Cb 0.00 -2.44 -0.08 0.00 -0.30 0.00 0.00 42.92 40.10 1xx7 s ASP 76 CO 0.00 -1.16 1.77 -0.76 -0.17 0.00 0.00 175.17 174.85 1xx7 s LEU 77 N 3.21 4.38 0.79 -1.34 1.43 -1.26 -4.43 118.68 121.45 1xx7 s LEU 77 Ca 0.36 2.49 -0.12 0.00 -1.03 0.00 0.00 54.13 55.83 1xx7 s LEU 77 Cb -0.04 -3.54 0.07 0.00 0.03 0.00 0.00 46.19 42.71 1xx7 s LEU 77 CO -0.09 -0.96 1.11 -2.16 0.23 0.00 0.00 176.35 174.47 1xx7 s PRO 78 N 3.68 2.14 0.23 1.29 0.04 -1.26 -4.86 135.00 136.27 1xx7 s PRO 78 Ca 0.79 0.50 -0.06 0.00 0.04 0.00 0.00 61.00 62.27 1xx7 s PRO 78 Cb -0.39 -1.94 0.41 0.00 0.04 0.00 0.00 34.50 32.63 1xx7 s PRO 78 CO 0.35 -1.55 1.70 -0.07 0.04 0.00 0.00 177.00 177.47 1xx7 h LEU 79 N -1.03 0.08 -0.86 -3.56 3.38 -1.98 -0.93 115.31 110.40 1xx7 h LEU 79 Ca -0.47 0.13 0.09 0.00 0.09 0.00 0.00 57.88 57.72 1xx7 h LEU 79 Cb 1.28 0.16 -0.07 0.00 0.09 0.00 0.00 40.66 42.11 1xx7 h LEU 79 CO 0.61 0.01 0.51 0.77 0.09 0.00 0.00 178.44 180.43 1xx7 h SER 80 N 0.31 0.74 0.66 -0.43 4.64 -2.02 -0.94 113.55 116.51 1xx7 h SER 80 Ca 0.39 0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.66 1xx7 h SER 80 Cb 0.62 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1xx7 h SER 80 CO -0.45 0.42 -0.43 0.00 -0.87 0.00 0.00 176.83 175.50 1xx7 h ALA 81 N 1.46 1.08 0.00 5.18 0.00 -1.56 -3.14 119.26 122.28 1xx7 h ALA 81 Ca 0.41 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xx7 h ALA 81 Cb 0.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1xx7 h ALA 81 CO -0.24 0.53 0.00 1.04 0.00 0.00 0.00 179.25 180.58 1xx7 n GLN 82 N -3.72 0.24 0.26 0.00 6.02 -0.37 -1.45 117.38 118.37 1xx7 n GLN 82 Ca -0.01 0.31 0.14 0.00 -0.01 0.00 0.00 57.00 57.43 1xx7 n GLN 82 Cb 0.50 -1.85 0.71 0.00 1.02 0.00 0.00 30.24 30.63 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 -1.48 -3.29 116.57 112.50 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 0.59 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1xx7 h LYS 83 CO 0.00 0.11 -1.22 0.66 -1.08 0.00 0.00 179.45 177.92 1xx7 n TYR 84 N -3.44 0.00 -4.39 -1.35 4.01 -0.96 -5.04 117.16 105.99 1xx7 n TYR 84 Ca -0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.54 1xx7 n TYR 84 Cb 0.27 -0.15 -0.15 0.00 -0.31 0.00 0.00 39.34 39.00 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 -3.38 2.04 -0.53 7.72 1.43 -0.53 -5.10 118.68 120.33 1xx7 s LEU 85 Ca -0.02 -0.21 -0.23 0.00 -1.03 0.00 0.00 54.13 52.64 1xx7 s LEU 85 Cb 0.05 -0.50 0.04 0.00 0.03 0.00 0.00 46.19 45.82 1xx7 s LEU 85 CO 0.32 0.10 0.85 0.21 0.23 0.00 0.00 176.35 178.07 1xx7 s ASN 86 N -0.35 6.32 -0.05 2.29 3.84 -1.26 -4.35 114.94 121.38 1xx7 s ASN 86 Ca 0.03 -0.46 -0.19 0.00 0.21 0.00 0.00 52.86 52.44 1xx7 s ASN 86 Cb -0.04 -2.40 -0.14 0.00 -0.55 0.00 0.00 41.25 38.12 1xx7 s ASN 86 CO -0.00 -1.12 0.81 0.50 -2.79 0.00 0.00 177.10 174.50 1xx7 h LYS 87 N 9.21 -0.28 -0.77 0.43 3.64 -1.95 -2.43 116.57 124.41 1xx7 h LYS 87 Ca -0.26 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.11 1xx7 h LYS 87 Cb 1.08 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.93 1xx7 h LYS 87 CO 1.05 0.08 0.37 0.93 -2.27 0.00 0.00 179.45 179.60 1xx7 h GLU 88 N -0.92 1.11 -0.12 1.90 5.08 -1.99 0.42 114.58 120.06 1xx7 h GLU 88 Ca -0.03 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.20 1xx7 h GLU 88 Cb 0.49 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1xx7 h GLU 88 CO 0.05 0.87 -0.09 1.49 -1.00 0.00 0.00 179.01 180.33 1xx7 h GLU 89 N 1.09 -0.10 -0.48 2.33 4.81 -1.99 0.11 114.58 120.34 1xx7 h GLU 89 Ca 0.26 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 1xx7 h GLU 89 Cb 0.13 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 1xx7 h GLU 89 CO -0.03 -0.07 0.27 0.00 -0.73 0.00 0.00 179.01 178.46 1xx7 h ALA 90 N 0.99 0.62 -0.52 2.92 0.00 -1.03 -1.61 119.26 120.64 1xx7 h ALA 90 Ca 0.08 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1xx7 h ALA 90 Cb 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1xx7 h ALA 90 CO -0.18 0.13 0.32 0.93 0.00 0.00 0.00 179.25 180.45 1xx7 h GLU 91 N 0.64 0.63 -0.33 0.00 5.08 -0.70 -1.66 114.58 118.24 1xx7 h GLU 91 Ca 0.17 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1xx7 h GLU 91 Cb 0.03 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1xx7 h GLU 91 CO -0.03 0.42 0.17 0.00 -1.00 0.00 0.00 179.01 178.57 1xx7 h ALA 92 N 1.22 0.43 -0.67 3.43 0.00 -0.58 -0.19 119.26 122.89 1xx7 h ALA 92 Ca 0.20 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1xx7 h ALA 92 Cb -0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 1xx7 h ALA 92 CO -0.08 -0.03 0.41 0.87 0.00 0.00 0.00 179.25 180.42 1xx7 h LYS 93 N 0.41 0.77 -0.06 0.00 1.57 -1.11 -0.37 116.57 117.77 1xx7 h LYS 93 Ca 0.12 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1xx7 h LYS 93 Cb 0.08 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 1xx7 h LYS 93 CO -0.02 0.51 -0.02 0.00 -0.57 0.00 0.00 179.45 179.35 1xx7 h ALA 94 N 1.31 0.09 -0.53 3.86 0.00 -0.96 -2.15 119.26 120.87 1xx7 h ALA 94 Ca 0.28 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 55.08 1xx7 h ALA 94 Cb 0.07 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 1xx7 h ALA 94 CO -0.13 -0.20 0.06 -0.07 0.00 0.00 0.00 179.25 178.91 1xx7 h LEU 95 N -0.22 -0.10 -0.96 0.00 3.38 -0.97 -2.12 115.31 114.31 1xx7 h LEU 95 Ca 0.02 0.11 0.17 0.00 0.09 0.00 0.00 57.88 58.26 1xx7 h LEU 95 Cb 0.41 0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.23 1xx7 h LEU 95 CO 0.01 -0.03 0.57 0.50 0.09 0.00 0.00 178.44 179.58 1xx7 h LYS 96 N 0.18 0.74 0.00 1.13 1.63 -0.88 0.75 116.57 120.12 1xx7 h LYS 96 Ca 0.27 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 1xx7 h LYS 96 Cb 0.40 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 31.86 1xx7 h LYS 96 CO -0.39 0.49 0.00 -0.44 -3.45 0.00 0.00 179.45 175.66 1xx7 h ASP 97 N 0.76 0.00 0.00 4.20 3.32 -0.74 -3.28 116.42 120.69 1xx7 h ASP 97 Ca 0.54 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.55 1xx7 h ASP 97 Cb 0.77 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1xx7 h ASP 97 CO -0.36 0.00 -1.13 1.33 -1.72 0.00 0.00 179.24 177.35 1xx7 n VAL 98 N -3.10 0.13 -3.14 -1.35 0.24 -0.76 -4.87 118.33 105.49 1xx7 n VAL 98 Ca 0.03 -0.07 -0.22 0.00 -2.04 0.00 0.00 64.34 62.04 1xx7 n VAL 98 Cb 0.48 -0.85 -0.04 0.00 -1.47 0.00 0.00 33.84 31.96 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 -2.21 2.06 0.20 1.34 4.77 0.25 -4.95 117.00 118.45 1xx7 n LEU 99 Ca -0.03 -5.20 0.16 0.00 -0.03 0.00 0.00 56.01 50.90 1xx7 n LEU 99 Cb 0.56 0.22 0.80 0.00 -2.33 0.00 0.00 43.42 42.66 1xx7 n LEU 99 CO 0.04 2.26 1.14 1.55 -1.33 0.00 0.00 177.39 181.05 1xx7 h PRO 100 N 3.23 0.00 0.00 3.23 0.13 -1.60 -0.42 132.00 136.57 1xx7 h PRO 100 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1xx7 h PRO 100 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1xx7 h PRO 100 CO 0.62 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.54 1xx7 n GLU 101 N -3.97 0.19 -0.09 0.86 0.00 -1.26 -2.42 120.64 113.95 1xx7 n GLU 101 Ca 0.01 0.48 0.07 0.00 0.00 0.00 0.00 57.16 57.73 1xx7 n GLU 101 Cb 0.30 -1.91 0.12 0.00 0.00 0.00 0.00 31.44 29.94 1xx7 n GLU 101 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1xx7 n TYR 102 N -2.28 0.25 -0.03 -1.84 4.01 -0.17 -4.64 117.16 112.46 1xx7 n TYR 102 Ca 0.01 -0.21 -0.09 0.00 -0.16 0.00 0.00 57.90 57.45 1xx7 n TYR 102 Cb 0.19 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.18 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 2.68 0.40 -0.83 -0.72 2.02 -1.53 0.13 112.91 115.06 1xx7 h THR 103 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1xx7 h THR 103 Cb 0.67 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 1xx7 h THR 103 CO 0.00 0.00 0.51 -0.08 0.37 0.00 0.00 175.52 176.32 1xx7 h GLU 104 N -0.27 1.12 -0.52 6.66 4.22 -1.82 -0.50 114.58 123.47 1xx7 h GLU 104 Ca 0.12 -0.10 -0.05 0.00 0.08 0.00 0.00 59.36 59.42 1xx7 h GLU 104 Cb 0.46 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1xx7 h GLU 104 CO -0.35 0.78 0.15 -0.07 -2.18 0.00 0.00 179.01 177.34 1xx7 h LEU 105 N 1.14 0.77 -1.12 1.64 3.38 -1.76 -2.36 115.31 117.00 1xx7 h LEU 105 Ca 0.30 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1xx7 h LEU 105 Cb -0.06 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 1xx7 h LEU 105 CO -0.06 0.79 0.55 0.15 0.09 0.00 0.00 178.44 179.96 1xx7 h PHE 106 N 0.72 1.09 -0.85 1.13 3.57 -0.43 -2.41 116.94 119.76 1xx7 h PHE 106 Ca 0.17 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 1xx7 h PHE 106 Cb 0.30 -0.37 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 1xx7 h PHE 106 CO 0.02 0.71 0.45 0.93 -2.23 0.00 0.00 178.31 178.19 1xx7 h GLU 107 N 1.17 1.19 -0.87 1.11 4.39 -0.86 0.41 114.58 121.12 1xx7 h GLU 107 Ca 0.31 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.91 1xx7 h GLU 107 Cb -0.10 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 28.27 1xx7 h GLU 107 CO -0.06 0.88 0.57 0.93 -1.16 0.00 0.00 179.01 180.16 1xx7 h GLU 108 N 1.18 1.02 0.39 2.33 5.08 -0.95 0.82 114.58 124.46 1xx7 h GLU 108 Ca 0.30 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1xx7 h GLU 108 Cb 0.05 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1xx7 h GLU 108 CO -0.05 0.68 -0.19 -0.92 -1.00 0.00 0.00 179.01 177.53 1xx7 h TYR 109 N 1.05 -0.48 -0.64 4.33 3.20 -1.02 -2.05 116.97 121.36 1xx7 h TYR 109 Ca 0.35 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.26 1xx7 h TYR 109 Cb 0.07 0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 1xx7 h TYR 109 CO -0.00 -0.30 0.36 1.03 -1.64 0.00 0.00 178.16 177.61 1xx7 h SER 110 N -0.92 0.55 -0.23 -2.11 0.87 -0.01 -2.54 113.55 109.16 1xx7 h SER 110 Ca -0.05 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1xx7 h SER 110 Cb 0.40 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1xx7 h SER 110 CO 0.09 0.37 0.00 0.29 -0.53 0.00 0.00 176.83 177.05 1xx7 n LYS 111 N -4.78 2.25 -3.95 2.24 4.76 0.27 -4.97 118.16 113.98 1xx7 n LYS 111 Ca 0.07 -1.86 -0.27 0.00 -2.87 0.00 0.00 58.31 53.38 1xx7 n LYS 111 Cb 0.14 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 31.85 1xx7 n LYS 111 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xx7 n ALA 112 N 1.12 -1.77 0.59 7.82 0.00 -0.81 -4.87 120.51 122.59 1xx7 n ALA 112 Ca 0.17 -0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.61 1xx7 n ALA 112 Cb 0.53 -2.36 0.42 0.00 0.00 0.00 0.00 19.45 18.04 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 -4.42 0.78 -4.22 0.00 4.77 -0.96 -4.79 117.00 108.17 1xx7 n LEU 113 Ca -0.19 0.59 -0.13 0.00 -0.03 0.00 0.00 56.01 56.26 1xx7 n LEU 113 Cb 0.63 -0.37 -0.10 0.00 -2.33 0.00 0.00 43.42 41.25 1xx7 n LEU 113 CO 0.76 -0.25 -0.30 0.42 -1.33 0.00 0.00 177.39 176.69 1xx7 s THR 114 N -3.14 0.45 0.30 -5.08 -4.23 -1.26 -5.02 115.64 97.67 1xx7 s THR 114 Ca 0.10 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 1xx7 s THR 114 Cb 0.12 -2.19 0.19 0.00 1.34 0.00 0.00 72.50 71.96 1xx7 s THR 114 CO 0.56 -0.38 1.88 0.25 -0.54 0.00 0.00 174.62 176.39 1xx7 h LEU 115 N 2.70 0.75 -0.23 4.79 5.85 -1.94 -1.19 115.31 126.03 1xx7 h LEU 115 Ca -0.36 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.13 1xx7 h LEU 115 Cb 1.21 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 1xx7 h LEU 115 CO 0.61 0.68 -0.36 -0.33 -0.34 0.00 0.00 178.44 178.70 1xx7 h GLU 116 N 0.80 0.65 -0.62 1.25 3.07 -1.95 -1.19 114.58 116.59 1xx7 h GLU 116 Ca 0.19 -0.39 0.10 0.00 -0.50 0.00 0.00 59.36 58.75 1xx7 h GLU 116 Cb 0.18 0.04 -0.07 0.00 -0.84 0.00 0.00 28.75 28.05 1xx7 h GLU 116 CO -0.02 1.01 0.24 0.78 -1.40 0.00 0.00 179.01 179.62 1xx7 h GLY 117 N 0.36 0.88 0.96 -3.84 0.00 -1.71 -2.26 103.07 97.46 1xx7 h GLY 117 Ca 0.02 -0.12 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 1xx7 h GLY 117 CO 0.08 -0.02 0.03 1.46 0.00 0.00 0.00 176.54 178.09 1xx7 h GLN 118 N 0.42 0.73 -0.69 4.80 4.20 -1.11 -2.74 115.11 120.71 1xx7 h GLN 118 Ca 0.32 -0.22 0.06 0.00 0.06 0.00 0.00 58.65 58.87 1xx7 h GLN 118 Cb 0.40 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.05 1xx7 h GLN 118 CO -0.31 0.79 0.39 1.25 -0.67 0.00 0.00 178.83 180.27 1xx7 h LEU 119 N 0.57 0.58 -0.63 1.46 5.85 -1.03 -1.12 115.31 120.99 1xx7 h LEU 119 Ca 0.12 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1xx7 h LEU 119 Cb 0.43 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1xx7 h LEU 119 CO 0.02 0.37 0.31 0.58 -0.34 0.00 0.00 178.44 179.38 1xx7 h VAL 120 N 0.72 1.22 -0.79 1.05 2.07 -1.30 -1.03 116.25 118.18 1xx7 h VAL 120 Ca 0.31 -0.60 0.07 0.00 0.82 0.00 0.00 66.70 67.30 1xx7 h VAL 120 Cb 0.19 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.35 1xx7 h VAL 120 CO -0.18 0.25 0.46 0.50 0.02 0.00 0.00 177.57 178.62 1xx7 h LYS 121 N 0.87 0.80 -0.57 1.57 1.63 -1.15 0.42 116.57 120.13 1xx7 h LYS 121 Ca 0.22 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.94 1xx7 h LYS 121 Cb 0.11 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.54 1xx7 h LYS 121 CO -0.03 0.53 0.25 0.82 -3.45 0.00 0.00 179.45 177.57 1xx7 h ILE 122 N 0.82 1.22 -0.76 2.00 2.04 -0.92 -1.99 117.51 119.91 1xx7 h ILE 122 Ca 0.36 -0.64 -0.06 0.00 1.00 0.00 0.00 64.86 65.53 1xx7 h ILE 122 Cb 0.25 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1xx7 h ILE 122 CO -0.21 0.25 0.26 0.00 0.00 0.00 0.00 178.15 178.46 1xx7 h ALA 123 N 1.09 1.01 -0.28 1.87 0.00 0.20 -1.10 119.26 122.06 1xx7 h ALA 123 Ca 0.19 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1xx7 h ALA 123 Cb 0.16 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1xx7 h ALA 123 CO -0.02 0.67 0.10 0.22 0.00 0.00 0.00 179.25 180.22 1xx7 h ASP 124 N 1.13 0.12 -0.50 0.00 3.58 -0.02 0.13 116.42 120.85 1xx7 h ASP 124 Ca 0.25 0.03 -0.09 0.00 0.42 0.00 0.00 57.03 57.64 1xx7 h ASP 124 Cb 0.28 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.32 1xx7 h ASP 124 CO -0.01 0.10 -0.02 0.11 -2.88 0.00 0.00 179.24 176.54 1xx7 h LYS 125 N 0.23 0.95 -0.60 0.28 1.57 -1.23 -2.71 116.57 115.06 1xx7 h LYS 125 Ca 0.12 -0.29 -0.07 0.00 -1.87 0.00 0.00 60.65 58.54 1xx7 h LYS 125 Cb 0.08 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1xx7 h LYS 125 CO -0.12 0.95 0.08 -0.07 -0.57 0.00 0.00 179.45 179.72 1xx7 h LEU 126 N 0.87 0.96 -0.22 2.94 3.38 -0.84 -1.09 115.31 121.31 1xx7 h LEU 126 Ca 0.16 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 57.90 1xx7 h LEU 126 Cb 0.54 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 1xx7 h LEU 126 CO 0.03 0.99 -0.06 -0.78 0.09 0.00 0.00 178.44 178.71 1xx7 h ASP 127 N 0.90 -0.22 -0.26 -0.43 3.58 -0.90 -1.12 116.42 117.97 1xx7 h ASP 127 Ca 0.18 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.70 1xx7 h ASP 127 Cb 0.44 0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.62 1xx7 h ASP 127 CO 0.01 -0.08 0.17 -0.03 -2.88 0.00 0.00 179.24 176.44 1xx7 h MET 128 N -0.01 0.34 -0.25 0.28 4.05 -1.25 0.00 114.93 118.10 1xx7 h MET 128 Ca 0.11 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.50 1xx7 h MET 128 Cb 0.17 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1xx7 h MET 128 CO -0.23 0.23 0.13 0.82 0.23 0.00 0.00 176.91 178.09 1xx7 h ILE 129 N 0.35 1.13 -0.32 1.77 2.04 -0.97 -0.80 117.51 120.71 1xx7 h ILE 129 Ca 0.10 -0.34 -0.12 0.00 1.00 0.00 0.00 64.86 65.50 1xx7 h ILE 129 Cb -0.04 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1xx7 h ILE 129 CO -0.02 0.12 -0.28 0.40 0.00 0.00 0.00 178.15 178.37 1xx7 h ILE 130 N 0.28 1.28 -0.22 -0.67 2.04 -1.18 -2.52 117.51 116.52 1xx7 h ILE 130 Ca 0.09 -1.38 -0.09 0.00 1.00 0.00 0.00 64.86 64.47 1xx7 h ILE 130 Cb 0.08 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1xx7 h ILE 130 CO -0.01 0.45 -0.26 -0.61 0.00 0.00 0.00 178.15 177.72 1xx7 h GLN 131 N 0.57 0.41 -0.69 2.37 5.75 -0.74 -1.28 115.11 121.51 1xx7 h GLN 131 Ca 0.07 -0.15 -0.02 0.00 -0.15 0.00 0.00 58.65 58.40 1xx7 h GLN 131 Cb 0.77 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.26 1xx7 h GLN 131 CO 0.06 0.65 0.34 0.00 -2.65 0.00 0.00 178.83 177.23 1xx7 h ALA 132 N 1.36 0.88 -0.71 3.38 0.00 -0.88 -0.51 119.26 122.80 1xx7 h ALA 132 Ca 0.05 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xx7 h ALA 132 Cb 0.65 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1xx7 h ALA 132 CO 0.05 0.43 0.43 -0.92 0.00 0.00 0.00 179.25 179.24 1xx7 h TYR 133 N 0.95 0.92 -0.35 0.00 3.20 -1.13 0.14 116.97 120.69 1xx7 h TYR 133 Ca 0.24 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.07 1xx7 h TYR 133 Cb 0.10 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 1xx7 h TYR 133 CO 0.00 0.62 0.08 0.93 -1.64 0.00 0.00 178.16 178.15 1xx7 h GLU 134 N 0.96 0.57 0.00 1.82 5.08 -0.88 -1.93 114.58 120.20 1xx7 h GLU 134 Ca 0.25 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 1xx7 h GLU 134 Cb -0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1xx7 h GLU 134 CO -0.05 0.62 -0.29 1.88 -1.00 0.00 0.00 179.01 180.17 1xx7 h TYR 135 N 0.42 0.00 -0.58 4.33 0.05 -0.82 -2.24 116.97 118.13 1xx7 h TYR 135 Ca 0.11 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.79 1xx7 h TYR 135 Cb 0.31 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.03 1xx7 h TYR 135 CO 0.02 0.29 -0.01 0.93 -1.05 0.00 0.00 178.16 178.34 1xx7 h GLU 136 N 0.00 1.03 -0.52 4.88 5.08 -0.69 -0.66 114.58 123.70 1xx7 h GLU 136 Ca -0.00 -0.34 0.10 0.00 -1.00 0.00 0.00 59.36 58.12 1xx7 h GLU 136 Cb 0.56 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1xx7 h GLU 136 CO 0.04 1.03 0.36 -0.07 -1.00 0.00 0.00 179.01 179.36 1xx7 h LEU 137 N 0.92 0.25 -1.94 1.33 3.38 -0.75 -1.19 115.31 117.32 1xx7 h LEU 137 Ca 0.16 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1xx7 h LEU 137 Cb 0.57 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1xx7 h LEU 137 CO 0.03 0.15 0.00 -1.20 0.09 0.00 0.00 178.44 177.52 1xx7 n SER 138 N -4.46 2.88 0.00 -0.43 7.64 -1.08 -4.95 113.62 113.22 1xx7 n SER 138 Ca 0.08 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 58.05 1xx7 n SER 138 Cb 0.39 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 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 1.38 1.18 3.73 0.23 0.00 -0.45 -5.06 105.19 106.20 1xx7 n GLY 139 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.22 3.51 -0.57 4.61 0.00 -0.31 -4.90 121.76 122.89 1xx7 s ALA 140 Ca 0.00 1.08 0.05 0.00 0.00 0.00 0.00 51.96 53.09 1xx7 s ALA 140 Cb 0.00 -3.48 0.05 0.00 0.00 0.00 0.00 23.12 19.70 1xx7 s ALA 140 CO 0.00 -0.52 0.73 1.63 0.00 0.00 0.00 175.76 177.60 1xx7 n LYS 141 N 2.79 0.22 -1.17 0.00 5.02 -1.26 -4.28 118.16 119.47 1xx7 n LYS 141 Ca 0.06 -0.95 -0.00 0.00 -2.02 0.00 0.00 58.31 55.40 1xx7 n LYS 141 Cb 0.43 -1.10 0.13 0.00 -0.02 0.00 0.00 35.03 34.47 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 0.22 2.18 -0.40 4.39 6.94 -1.26 -4.76 115.26 122.57 1xx7 n ASN 142 Ca 0.03 -3.41 0.05 0.00 -0.02 0.00 0.00 54.58 51.23 1xx7 n ASN 142 Cb 0.16 -0.45 0.12 0.00 -2.36 0.00 0.00 39.78 37.24 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 -0.71 2.70 -0.20 -4.53 4.77 -1.26 -4.78 117.00 112.99 1xx7 n LEU 143 Ca 0.21 -2.29 -0.01 0.00 -0.03 0.00 0.00 56.01 53.89 1xx7 n LEU 143 Cb 0.83 -0.23 0.10 0.00 -2.33 0.00 0.00 43.42 41.79 1xx7 n LEU 143 CO 0.05 0.64 1.00 0.77 -1.33 0.00 0.00 177.39 178.52 1xx7 h SER 144 N 1.08 0.26 -0.19 -1.43 4.64 -1.97 -1.51 113.55 114.42 1xx7 h SER 144 Ca 0.00 0.07 0.06 0.00 -0.47 0.00 0.00 61.79 61.44 1xx7 h SER 144 Cb 0.80 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 1xx7 h SER 144 CO 0.03 0.16 0.36 1.05 -0.87 0.00 0.00 176.83 177.56 1xx7 h GLU 145 N 0.43 0.00 0.00 4.77 9.09 -2.01 -1.08 114.58 125.78 1xx7 h GLU 145 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 1xx7 h GLU 145 Cb 0.33 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.43 1xx7 h GLU 145 CO -0.28 0.00 0.00 1.19 0.05 0.00 0.00 179.01 179.97 1xx7 n PHE 146 N -3.34 0.00 1.35 2.06 3.72 -0.57 -2.67 117.46 118.01 1xx7 n PHE 146 Ca 0.02 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.56 1xx7 n PHE 146 Cb 0.47 -0.47 0.47 0.00 -0.94 0.00 0.00 39.48 39.00 1xx7 n PHE 146 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62 1xx7 n TRP 147 N -1.47 0.00 0.27 1.38 7.02 -0.41 -4.28 117.44 119.95 1xx7 n TRP 147 Ca 0.07 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.68 1xx7 n TRP 147 Cb 0.29 -0.10 0.74 0.00 -2.42 0.00 0.00 31.31 29.82 1xx7 n TRP 147 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1xx7 h ASN 148 N 1.32 0.00 0.18 -0.99 2.35 -1.64 -2.65 115.58 114.15 1xx7 h ASN 148 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1xx7 h ASN 148 Cb 0.47 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.84 1xx7 h ASN 148 CO 0.00 0.11 -0.03 0.00 -1.65 0.00 0.00 177.43 175.85 1xx7 h ALA 149 N 1.89 1.26 -1.94 -0.83 0.00 -1.81 -3.53 119.26 114.30 1xx7 h ALA 149 Ca -0.00 -0.03 -0.57 0.00 0.00 0.00 0.00 54.91 54.31 1xx7 h ALA 149 Cb 0.30 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1xx7 h ALA 149 CO 0.01 0.04 1.17 -1.17 0.00 0.00 0.00 179.25 179.30 1xx7 s LEU 150 N -7.00 3.71 0.00 0.00 2.96 -1.00 -5.07 118.68 112.28 1xx7 s LEU 150 Ca -0.04 1.39 0.00 0.00 -0.22 0.00 0.00 54.13 55.26 1xx7 s LEU 150 Cb 0.13 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.29 1xx7 s LEU 150 CO 0.52 -1.43 0.00 0.00 -1.32 0.00 0.00 176.35 174.11 1xx7 n ILE 158 N 6.86 0.00 0.31 6.68 0.00 -1.26 -5.13 119.36 126.82 1xx7 n ILE 158 Ca 0.20 0.00 0.18 0.00 0.00 0.00 0.00 62.75 63.13 1xx7 n ILE 158 Cb 0.46 0.00 0.92 0.00 0.00 0.00 0.00 39.64 41.02 1xx7 n ILE 158 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1xx7 h SER 159 N 0.00 0.00 0.08 9.51 4.64 -2.03 0.27 113.55 126.02 1xx7 h SER 159 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xx7 h SER 159 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xx7 h SER 159 CO 0.00 0.00 -0.01 0.08 -0.87 0.00 0.00 176.83 176.03 1xx7 h ARG 160 N 0.00 0.00 -0.00 4.77 0.11 -2.08 0.31 114.38 117.49 1xx7 h ARG 160 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1xx7 h ARG 160 Cb 0.50 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.58 1xx7 h ARG 160 CO -0.00 0.01 -0.45 0.66 0.10 0.00 0.00 179.97 180.28 1xx7 n TYR 161 N -3.31 0.00 -1.70 4.08 4.01 0.95 -4.33 117.16 116.86 1xx7 n TYR 161 Ca -0.03 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.63 1xx7 n TYR 161 Cb 0.10 -0.24 0.14 0.00 -0.31 0.00 0.00 39.34 39.03 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 -1.38 3.96 0.07 7.72 4.77 0.11 -4.84 117.00 127.41 1xx7 n LEU 162 Ca 0.07 -4.18 -0.15 0.00 -0.03 0.00 0.00 56.01 51.71 1xx7 n LEU 162 Cb 0.34 -0.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.78 1xx7 n LEU 162 CO 0.33 1.62 -0.18 0.03 -1.33 0.00 0.00 177.39 177.87 1xx7 h ARG 163 N 1.43 0.22 -0.42 3.23 -0.00 -1.66 -2.48 114.38 114.70 1xx7 h ARG 163 Ca 0.20 -0.37 0.09 0.00 -0.50 0.00 0.00 59.98 59.39 1xx7 h ARG 163 Cb 1.31 0.14 -0.08 0.00 0.00 0.00 0.00 29.97 31.33 1xx7 h ARG 163 CO 0.40 1.11 -0.12 0.93 0.00 0.00 0.00 179.97 182.29 1xx7 h GLU 164 N 0.06 -0.03 -0.17 0.04 3.07 -1.90 -1.30 114.58 114.35 1xx7 h GLU 164 Ca -0.18 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.52 1xx7 h GLU 164 Cb 1.97 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.89 1xx7 h GLU 164 CO 0.17 -0.02 -0.54 0.97 -1.40 0.00 0.00 179.01 178.19 1xx7 h ILE 165 N -0.03 1.32 0.00 3.13 2.10 -1.95 -2.02 117.51 120.06 1xx7 h ILE 165 Ca 0.20 -1.78 -0.06 0.00 1.08 0.00 0.00 64.86 64.31 1xx7 h ILE 165 Cb 0.34 1.95 -0.01 0.00 -1.09 0.00 0.00 36.82 38.01 1xx7 h ILE 165 CO -0.45 0.56 -0.27 0.40 -1.08 0.00 0.00 178.15 177.31 1xx7 h ILE 166 N 0.36 1.19 0.05 2.19 2.04 -1.36 -1.75 117.51 120.22 1xx7 h ILE 166 Ca -0.02 -0.92 -0.24 0.00 1.00 0.00 0.00 64.86 64.68 1xx7 h ILE 166 Cb 1.16 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.74 1xx7 h ILE 166 CO 0.12 0.26 -1.05 -0.33 0.00 0.00 0.00 178.15 177.15 1xx7 h GLU 167 N 0.00 0.37 -0.82 2.37 5.08 -1.19 -2.04 114.58 118.35 1xx7 h GLU 167 Ca -0.00 -0.47 0.01 0.00 -1.00 0.00 0.00 59.36 57.90 1xx7 h GLU 167 Cb 0.48 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 1xx7 h GLU 167 CO 0.03 1.15 0.54 0.93 -1.00 0.00 0.00 179.01 180.67 1xx7 h GLU 168 N 0.18 1.09 -0.18 2.33 5.08 -0.91 -0.44 114.58 121.73 1xx7 h GLU 168 Ca -0.10 -0.07 -0.20 0.00 -1.00 0.00 0.00 59.36 57.99 1xx7 h GLU 168 Cb 1.71 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.72 1xx7 h GLU 168 CO 0.18 0.72 -0.67 0.28 -1.00 0.00 0.00 179.01 178.52 1xx7 h VAL 169 N 1.12 1.30 -0.22 3.13 2.07 -1.32 -3.02 116.25 119.31 1xx7 h VAL 169 Ca 0.30 -1.91 -0.00 0.00 0.82 0.00 0.00 66.70 65.91 1xx7 h VAL 169 Cb -0.12 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1xx7 h VAL 169 CO -0.06 0.60 0.14 -0.09 0.02 0.00 0.00 177.57 178.18 1xx7 h ARG 170 N 0.51 0.30 -0.81 1.57 2.43 -1.03 -2.52 114.38 114.83 1xx7 h ARG 170 Ca -0.02 -0.02 0.22 0.00 -0.81 0.00 0.00 59.98 59.34 1xx7 h ARG 170 Cb 1.27 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.72 1xx7 h ARG 170 CO 0.13 0.23 0.57 0.00 -1.51 0.00 0.00 179.97 179.39 1xx7 h ARG 171 N 0.28 0.13 0.00 0.20 -0.00 -1.06 -3.51 114.38 110.41 1xx7 h ARG 171 Ca 0.08 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.55 1xx7 h ARG 171 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 29.95 1xx7 h ARG 171 CO -0.02 0.08 0.00 1.28 0.00 0.00 0.00 179.97 181.32