#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rw5 n PRO 2 N 0.00 1.45 -0.28 1.96 -0.02 -1.26 -4.87 135.00 131.98 1rw5 n PRO 2 Ca 0.00 0.52 0.05 0.00 -2.02 0.00 0.00 63.50 62.05 1rw5 n PRO 2 Cb 0.00 -2.18 0.27 0.00 -0.02 0.00 0.00 33.50 31.57 1rw5 n PRO 2 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1rw5 h ILE 3 N 1.52 1.04 -4.23 4.25 2.04 -2.07 -3.42 117.51 116.64 1rw5 h ILE 3 Ca -0.46 -0.33 -0.51 0.00 1.00 0.00 0.00 64.86 64.55 1rw5 h ILE 3 Cb 1.33 -0.01 0.12 0.00 -0.74 0.00 0.00 36.82 37.52 1rw5 h ILE 3 CO 0.57 0.18 0.35 0.00 0.00 0.00 0.00 178.15 179.25 1rw5 n PRO 5 N -2.86 1.30 -1.65 0.00 -0.02 -1.26 -4.81 135.00 125.69 1rw5 n PRO 5 Ca 0.10 0.47 -0.43 0.00 -2.02 0.00 0.00 63.50 61.62 1rw5 n PRO 5 Cb 0.52 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 1rw5 n PRO 5 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1rw5 s GLY 6 N -0.79 0.66 -0.34 -1.23 0.00 -1.26 -1.90 107.32 102.46 1rw5 s GLY 6 Ca 0.64 0.81 -0.02 0.00 0.00 0.00 0.00 44.72 46.16 1rw5 s GLY 6 CO 0.56 3.72 0.29 0.61 0.00 0.00 0.00 173.10 178.28 1rw5 n GLY 7 N 5.56 0.46 3.61 0.20 0.00 -1.26 -4.97 105.19 108.80 1rw5 n GLY 7 Ca 0.28 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 1rw5 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rw5 s ALA 8 N -3.09 3.17 0.45 4.61 0.00 -0.80 -4.86 121.76 121.25 1rw5 s ALA 8 Ca 0.10 -0.32 0.11 0.00 0.00 0.00 0.00 51.96 51.86 1rw5 s ALA 8 Cb -0.05 -3.88 1.01 0.00 0.00 0.00 0.00 23.12 20.20 1rw5 s ALA 8 CO 0.19 -2.19 2.06 0.00 0.00 0.00 0.00 175.76 175.82 1rw5 h ALA 9 N 9.52 1.78 -2.25 0.00 0.00 -1.93 -3.03 119.26 123.35 1rw5 h ALA 9 Ca -0.24 -0.06 -0.59 0.00 0.00 0.00 0.00 54.91 54.02 1rw5 h ALA 9 Cb 1.07 -0.08 -0.42 0.00 0.00 0.00 0.00 17.79 18.37 1rw5 h ALA 9 CO 1.10 0.18 -0.65 2.89 0.00 0.00 0.00 179.25 182.77 1rw5 n ARG 10 N -4.45 2.92 -0.37 0.00 1.85 -1.26 -4.88 116.66 110.47 1rw5 n ARG 10 Ca -0.00 -4.73 0.01 0.00 -1.00 0.00 0.00 57.85 52.12 1rw5 n ARG 10 Cb 0.12 -2.21 0.15 0.00 -1.05 0.00 0.00 32.46 29.47 1rw5 n ARG 10 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1rw5 s GLN 12 N -6.07 1.20 0.17 0.00 -0.21 -1.26 -5.00 119.66 108.49 1rw5 s GLN 12 Ca -0.13 -1.47 0.07 0.00 0.02 0.00 0.00 55.36 53.85 1rw5 s GLN 12 Cb 0.19 -0.98 -0.04 0.00 1.00 0.00 0.00 33.01 33.18 1rw5 s GLN 12 CO 0.82 0.16 -0.14 0.14 -2.12 0.00 0.00 175.29 174.15 1rw5 s VAL 13 N -2.82 1.59 0.19 1.09 -7.23 -1.26 -5.11 120.40 106.85 1rw5 s VAL 13 Ca 0.18 -2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 58.01 1rw5 s VAL 13 Cb -0.01 -1.88 -0.08 0.00 0.56 0.00 0.00 36.38 34.97 1rw5 s VAL 13 CO 0.05 -0.53 1.29 -0.89 -0.31 0.00 0.00 175.10 174.71 1rw5 s THR 14 N -2.69 3.29 0.23 5.32 2.01 -1.26 -4.90 115.64 117.64 1rw5 s THR 14 Ca 0.18 1.06 -0.07 0.00 0.31 0.00 0.00 61.69 63.16 1rw5 s THR 14 Cb -0.02 -3.67 0.21 0.00 0.01 0.00 0.00 72.50 69.03 1rw5 s THR 14 CO 0.05 0.15 1.89 -0.07 -0.69 0.00 0.00 174.62 175.96 1rw5 h LEU 15 N 5.46 0.97 -0.50 4.42 3.38 -1.99 -2.36 115.31 124.68 1rw5 h LEU 15 Ca -0.44 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 1rw5 h LEU 15 Cb 1.21 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1rw5 h LEU 15 CO 0.77 0.68 0.19 -0.09 0.09 0.00 0.00 178.44 180.08 1rw5 h ARG 16 N 1.13 0.76 0.73 1.13 2.43 -1.92 -0.86 114.38 117.78 1rw5 h ARG 16 Ca 0.34 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1rw5 h ARG 16 Cb -0.05 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1rw5 h ARG 16 CO -0.10 0.69 -0.35 -0.44 -1.51 0.00 0.00 179.97 178.26 1rw5 h ASP 17 N 0.68 -0.83 -0.53 -3.80 3.32 -1.82 0.84 116.42 114.27 1rw5 h ASP 17 Ca 0.17 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1rw5 h ASP 17 Cb 0.22 0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 1rw5 h ASP 17 CO -0.01 -0.54 0.32 -0.07 -1.72 0.00 0.00 179.24 177.21 1rw5 h LEU 18 N -1.07 0.65 -0.22 1.55 -0.00 -1.50 -1.18 115.31 113.54 1rw5 h LEU 18 Ca -0.10 -0.07 -0.02 0.00 -0.00 0.00 0.00 57.88 57.69 1rw5 h LEU 18 Cb 0.77 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 41.26 1rw5 h LEU 18 CO 0.16 0.52 0.04 0.15 -0.00 0.00 0.00 178.44 179.32 1rw5 h PHE 19 N 0.72 0.39 -0.83 1.13 3.57 -1.09 -0.37 116.94 120.45 1rw5 h PHE 19 Ca 0.19 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.69 1rw5 h PHE 19 Cb 0.00 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.58 1rw5 h PHE 19 CO -0.02 0.49 0.54 0.22 -2.23 0.00 0.00 178.31 177.31 1rw5 h ASP 20 N 0.18 0.85 -0.19 0.41 3.58 0.97 0.22 116.42 122.42 1rw5 h ASP 20 Ca 0.07 -0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.42 1rw5 h ASP 20 Cb 0.30 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.16 1rw5 h ASP 20 CO 0.00 0.57 -0.27 0.03 -2.88 0.00 0.00 179.24 176.69 1rw5 h ARG 21 N 0.98 0.53 -0.39 0.28 3.08 -0.95 -2.45 114.38 115.45 1rw5 h ARG 21 Ca 0.34 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 1rw5 h ARG 21 Cb 0.12 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1rw5 h ARG 21 CO -0.11 0.90 0.02 0.00 -1.07 0.00 0.00 179.97 179.71 1rw5 h ALA 22 N 0.62 1.30 -0.39 0.04 0.00 -0.33 0.28 119.26 120.78 1rw5 h ALA 22 Ca 0.02 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 1rw5 h ALA 22 Cb 0.84 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1rw5 h ALA 22 CO 0.06 0.48 -0.20 0.28 0.00 0.00 0.00 179.25 179.87 1rw5 h VAL 23 N 0.59 1.27 0.07 0.00 2.07 -0.52 -2.28 116.25 117.44 1rw5 h VAL 23 Ca 0.12 -1.29 -0.26 0.00 0.82 0.00 0.00 66.70 66.09 1rw5 h VAL 23 Cb 0.35 1.19 0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1rw5 h VAL 23 CO 0.01 0.43 -1.11 0.58 0.02 0.00 0.00 177.57 177.50 1rw5 h VAL 24 N 0.66 1.39 -0.40 2.57 2.07 -0.93 -3.23 116.25 118.38 1rw5 h VAL 24 Ca 0.10 -2.62 -0.00 0.00 0.82 0.00 0.00 66.70 64.99 1rw5 h VAL 24 Cb 0.70 2.64 -0.02 0.00 -1.52 0.00 0.00 31.29 33.09 1rw5 h VAL 24 CO 0.05 0.78 0.24 0.25 0.02 0.00 0.00 177.57 178.91 1rw5 h LEU 25 N 0.20 0.47 -1.54 2.57 5.85 -0.27 -1.66 115.31 120.92 1rw5 h LEU 25 Ca -0.13 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1rw5 h LEU 25 Cb 1.78 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.68 1rw5 h LEU 25 CO 0.20 0.37 0.02 0.77 -0.34 0.00 0.00 178.44 179.46 1rw5 h SER 26 N 0.55 0.29 0.46 1.25 4.64 -1.43 -1.72 113.55 117.58 1rw5 h SER 26 Ca 0.14 -0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.30 1rw5 h SER 26 Cb -0.02 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 1rw5 h SER 26 CO -0.03 0.32 -0.58 0.45 -0.87 0.00 0.00 176.83 176.12 1rw5 h HIS 27 N 0.31 0.16 -0.28 4.77 3.86 -1.41 -2.97 115.15 119.59 1rw5 h HIS 27 Ca 0.07 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1rw5 h HIS 27 Cb 0.17 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 1rw5 h HIS 27 CO 0.00 0.68 0.09 -0.92 0.86 0.00 0.00 177.93 178.64 1rw5 h TYR 28 N 0.09 0.44 -0.40 2.45 3.20 -1.22 -2.25 116.97 119.28 1rw5 h TYR 28 Ca -0.00 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.84 1rw5 h TYR 28 Cb 1.05 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.18 1rw5 h TYR 28 CO 0.01 0.47 0.27 0.82 -1.64 0.00 0.00 178.16 178.08 1rw5 h ILE 29 N 0.29 1.07 -0.39 1.81 2.04 -1.45 -1.10 117.51 119.77 1rw5 h ILE 29 Ca 0.09 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.81 1rw5 h ILE 29 Cb 0.23 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1rw5 h ILE 29 CO -0.00 0.09 0.21 -0.74 0.00 0.00 0.00 178.15 177.71 1rw5 h HIS 30 N 0.49 0.39 -0.62 1.37 2.76 -1.25 0.21 115.15 118.50 1rw5 h HIS 30 Ca 0.16 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.29 1rw5 h HIS 30 Cb 0.03 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 28.84 1rw5 h HIS 30 CO -0.00 0.22 0.18 -0.91 -1.30 0.00 0.00 177.93 176.11 1rw5 h ASN 31 N 0.43 0.91 0.33 3.26 2.35 -1.00 0.81 115.58 122.67 1rw5 h ASN 31 Ca 0.16 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 1rw5 h ASN 31 Cb 0.04 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.18 1rw5 h ASN 31 CO -0.10 0.89 -0.16 -0.07 -1.65 0.00 0.00 177.43 176.34 1rw5 h LEU 32 N 0.89 -0.38 -0.72 1.61 3.38 -0.44 0.22 115.31 119.88 1rw5 h LEU 32 Ca 0.20 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.02 1rw5 h LEU 32 Cb 0.31 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1rw5 h LEU 32 CO -0.00 -0.23 -0.32 0.77 0.09 0.00 0.00 178.44 178.75 1rw5 h SER 33 N -0.50 0.65 0.63 -0.43 4.64 -0.51 -0.06 113.55 117.96 1rw5 h SER 33 Ca -0.05 -0.26 -0.03 0.00 -0.47 0.00 0.00 61.79 60.98 1rw5 h SER 33 Cb 0.38 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1rw5 h SER 33 CO 0.08 0.93 -0.30 -1.28 -0.87 0.00 0.00 176.83 175.38 1rw5 h SER 34 N 0.54 -0.72 -0.37 4.97 0.87 0.88 -1.81 113.55 117.91 1rw5 h SER 34 Ca 0.06 0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.52 1rw5 h SER 34 Cb 0.81 0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.95 1rw5 h SER 34 CO 0.07 -0.39 -0.27 -0.33 -0.53 0.00 0.00 176.83 175.38 1rw5 h GLU 35 N -1.11 0.84 -0.43 2.24 4.39 -0.63 -1.11 114.58 118.77 1rw5 h GLU 35 Ca -0.09 -0.41 0.01 0.00 0.34 0.00 0.00 59.36 59.22 1rw5 h GLU 35 Cb 0.65 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.27 1rw5 h GLU 35 CO 0.14 1.05 0.27 1.98 -1.16 0.00 0.00 179.01 181.28 1rw5 h MET 36 N 0.64 0.52 -0.34 2.33 4.05 -1.10 0.17 114.93 121.20 1rw5 h MET 36 Ca 0.07 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.40 1rw5 h MET 36 Cb 0.85 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 1rw5 h MET 36 CO 0.07 0.35 -0.03 0.35 0.23 0.00 0.00 176.91 177.88 1rw5 h PHE 37 N 0.54 0.68 -0.77 1.39 3.57 -1.28 -2.17 116.94 118.90 1rw5 h PHE 37 Ca 0.17 -0.13 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1rw5 h PHE 37 Cb -0.02 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.51 1rw5 h PHE 37 CO -0.06 0.75 0.43 0.77 -2.23 0.00 0.00 178.31 177.97 1rw5 h SER 38 N 0.42 0.95 -0.61 0.41 0.02 -0.77 0.88 113.55 114.84 1rw5 h SER 38 Ca 0.09 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 1rw5 h SER 38 Cb 0.49 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 1rw5 h SER 38 CO 0.02 0.76 0.15 -0.33 -1.14 0.00 0.00 176.83 176.29 1rw5 h GLU 39 N 1.07 1.01 0.10 3.45 5.08 -0.48 -0.00 114.58 124.80 1rw5 h GLU 39 Ca 0.27 -0.23 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1rw5 h GLU 39 Cb 0.01 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1rw5 h GLU 39 CO -0.05 0.90 -0.05 0.35 -1.00 0.00 0.00 179.01 179.17 1rw5 h PHE 40 N 0.96 -0.12 -0.93 4.33 3.57 -0.64 -2.67 116.94 121.44 1rw5 h PHE 40 Ca 0.20 -0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.88 1rw5 h PHE 40 Cb 0.35 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.05 1rw5 h PHE 40 CO 0.02 0.40 0.60 0.22 -2.23 0.00 0.00 178.31 177.32 1rw5 h ASP 41 N -0.84 0.62 0.06 0.41 1.82 0.84 -0.40 116.42 118.92 1rw5 h ASP 41 Ca -0.01 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.68 1rw5 h ASP 41 Cb 0.58 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.53 1rw5 h ASP 41 CO 0.02 0.27 -0.08 0.29 -1.61 0.00 0.00 179.24 178.12 1rw5 n LYS 42 N -4.60 1.46 -0.03 0.28 4.76 -0.02 -1.06 118.16 118.94 1rw5 n LYS 42 Ca 0.20 -0.89 -0.03 0.00 -2.87 0.00 0.00 58.31 54.72 1rw5 n LYS 42 Cb 0.57 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 32.27 1rw5 n LYS 42 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1rw5 n ARG 43 N 0.00 0.20 -0.03 1.97 1.74 -0.18 -4.15 116.66 116.22 1rw5 n ARG 43 Ca 0.17 0.16 -0.09 0.00 -0.77 0.00 0.00 57.85 57.31 1rw5 n ARG 43 Cb 0.37 -0.93 -0.14 0.00 -1.02 0.00 0.00 32.46 30.74 1rw5 n ARG 43 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1rw5 n TYR 44 N -3.23 0.95 -1.25 -1.55 4.01 -1.12 -4.15 117.16 110.82 1rw5 n TYR 44 Ca -0.05 0.33 -0.05 0.00 -0.16 0.00 0.00 57.90 57.97 1rw5 n TYR 44 Cb 0.17 -1.17 0.23 0.00 -0.31 0.00 0.00 39.34 38.26 1rw5 n TYR 44 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1rw5 n THR 45 N -3.05 2.69 -0.32 -0.72 -2.24 -1.20 -4.70 114.28 104.74 1rw5 n THR 45 Ca -0.19 -2.23 0.11 0.00 -2.27 0.00 0.00 64.05 59.47 1rw5 n THR 45 Cb 1.06 -0.34 0.28 0.00 -2.10 0.00 0.00 70.33 69.23 1rw5 n THR 45 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1rw5 h HIS 46 N 1.46 0.86 -0.23 4.78 6.17 -1.25 -3.39 115.15 123.55 1rw5 h HIS 46 Ca 0.26 0.04 -0.08 0.00 0.71 0.00 0.00 60.37 61.29 1rw5 h HIS 46 Cb 1.96 -0.24 -0.14 0.00 2.52 0.00 0.00 27.41 31.51 1rw5 h HIS 46 CO 1.07 0.15 -0.22 0.41 0.71 0.00 0.00 177.93 180.05 1rw5 n GLY 47 N -1.33 -1.23 0.10 5.26 0.00 -1.26 -4.92 105.19 101.80 1rw5 n GLY 47 Ca 0.20 0.86 0.10 0.00 0.00 0.00 0.00 46.02 47.19 1rw5 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rw5 n ARG 48 N 2.13 0.24 -2.23 1.61 1.74 -1.26 -4.98 116.66 113.91 1rw5 n ARG 48 Ca 0.09 -0.20 -0.02 0.00 -0.77 0.00 0.00 57.85 56.95 1rw5 n ARG 48 Cb 0.65 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.60 1rw5 n ARG 48 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rw5 n GLY 49 N 1.48 0.48 0.82 -0.13 0.00 -1.26 -4.92 105.19 101.65 1rw5 n GLY 49 Ca 0.05 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.32 1rw5 n GLY 49 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1rw5 n PHE 50 N -3.56 0.00 -4.20 1.61 -1.74 -1.26 -5.08 117.46 103.23 1rw5 n PHE 50 Ca -0.01 -0.23 -0.30 0.00 -0.56 0.00 0.00 57.45 56.35 1rw5 n PHE 50 Cb 0.51 0.19 -0.17 0.00 1.52 0.00 0.00 39.48 41.54 1rw5 n PHE 50 CO 0.00 0.00 0.00 0.42 -0.56 0.00 0.00 176.76 176.62 1rw5 s ILE 51 N 0.00 1.59 0.10 1.97 1.01 -1.26 -5.05 121.20 119.57 1rw5 s ILE 51 Ca 0.06 -0.66 0.07 0.00 0.00 0.00 0.00 60.65 60.12 1rw5 s ILE 51 Cb 0.07 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 1rw5 s ILE 51 CO -0.03 0.46 -0.18 0.42 0.00 0.00 0.00 174.94 175.61 1rw5 s THR 52 N 1.28 1.51 0.32 2.92 -4.23 -1.26 -5.03 115.64 111.15 1rw5 s THR 52 Ca 0.01 -1.54 0.03 0.00 -1.18 0.00 0.00 61.69 59.01 1rw5 s THR 52 Cb -0.14 -1.45 0.15 0.00 1.34 0.00 0.00 72.50 72.41 1rw5 s THR 52 CO -0.07 -0.18 1.86 0.11 -0.54 0.00 0.00 174.62 175.79 1rw5 h LYS 53 N 3.97 0.59 -5.89 3.99 1.57 -2.01 -3.37 116.57 115.42 1rw5 h LYS 53 Ca -0.43 -0.13 -0.59 0.00 -1.87 0.00 0.00 60.65 57.63 1rw5 h LYS 53 Cb 1.19 -0.08 -0.11 0.00 0.08 0.00 0.00 32.23 33.30 1rw5 h LYS 53 CO 0.42 0.60 0.77 0.00 -0.57 0.00 0.00 179.45 180.68 1rw5 s ALA 54 N -4.99 2.96 0.09 3.86 0.00 -1.26 -4.99 121.76 117.43 1rw5 s ALA 54 Ca -0.08 -1.57 0.06 0.00 0.00 0.00 0.00 51.96 50.37 1rw5 s ALA 54 Cb 0.15 -4.02 -0.03 0.00 0.00 0.00 0.00 23.12 19.22 1rw5 s ALA 54 CO 0.77 -2.96 -0.15 0.42 0.00 0.00 0.00 175.76 173.84 1rw5 s ILE 55 N 4.78 1.26 -1.13 0.00 1.09 -1.26 -5.04 121.20 120.90 1rw5 s ILE 55 Ca 0.29 -1.42 -0.22 0.00 -1.10 0.00 0.00 60.65 58.19 1rw5 s ILE 55 Cb -0.13 -1.24 -0.08 0.00 -1.06 0.00 0.00 42.46 39.95 1rw5 s ILE 55 CO 0.13 -0.23 1.91 0.59 -0.10 0.00 0.00 174.94 177.25 1rw5 n ASN 56 N 1.11 3.22 0.00 3.58 3.02 -1.26 -4.78 115.26 120.15 1rw5 n ASN 56 Ca -0.20 -2.73 0.00 0.00 -0.03 0.00 0.00 54.58 51.63 1rw5 n ASN 56 Cb 0.55 -1.63 0.00 0.00 -0.61 0.00 0.00 39.78 38.09 1rw5 n ASN 56 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1rw5 n SER 57 N 12.29 0.00 -2.71 6.41 2.88 -1.26 -5.00 113.62 126.22 1rw5 n SER 57 Ca 0.46 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.94 1rw5 n SER 57 Cb 0.45 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.92 1rw5 n SER 57 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rw5 h HIS 59 N 1.89 0.00 0.00 0.00 2.07 -1.96 -3.13 115.15 114.02 1rw5 h HIS 59 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1rw5 h HIS 59 Cb 0.84 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.82 1rw5 h HIS 59 CO 0.08 0.32 0.00 1.79 -3.07 0.00 0.00 177.93 177.06 1rw5 h THR 60 N 0.00 0.00 -0.24 6.12 1.35 -1.98 -2.43 112.91 115.74 1rw5 h THR 60 Ca -0.00 -0.23 0.07 0.00 -0.55 0.00 0.00 66.41 65.70 1rw5 h THR 60 Cb 1.08 1.04 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 1rw5 h THR 60 CO 0.04 0.00 0.18 0.28 -0.25 0.00 0.00 175.52 175.77 1rw5 h SER 61 N 0.00 0.00 -0.58 5.36 0.02 -1.90 -1.11 113.55 115.33 1rw5 h SER 61 Ca 0.00 0.00 0.14 0.00 -0.84 0.00 0.00 61.79 61.09 1rw5 h SER 61 Cb 0.27 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 1rw5 h SER 61 CO 0.00 0.00 0.40 -1.28 -1.14 0.00 0.00 176.83 174.81 1rw5 h SER 62 N 0.00 0.16 -4.04 3.07 0.87 -1.68 -3.42 113.55 108.51 1rw5 h SER 62 Ca 0.11 0.01 -0.52 0.00 -1.23 0.00 0.00 61.79 60.16 1rw5 h SER 62 Cb 0.47 -0.03 0.09 0.00 -0.44 0.00 0.00 62.40 62.50 1rw5 h SER 62 CO -0.00 0.09 0.51 -0.76 -0.53 0.00 0.00 176.83 176.13 1rw5 s LEU 63 N -9.01 3.88 -1.00 2.23 2.01 -0.42 -4.83 118.68 111.52 1rw5 s LEU 63 Ca -0.06 2.41 -0.12 0.00 0.01 0.00 0.00 54.13 56.37 1rw5 s LEU 63 Cb 0.20 -4.36 -0.08 0.00 0.01 0.00 0.00 46.19 41.96 1rw5 s LEU 63 CO 0.74 -1.23 2.15 0.00 1.01 0.00 0.00 176.35 179.02 1rw5 n ALA 64 N -0.92 4.65 -1.97 4.21 0.00 -1.26 -4.90 120.51 120.31 1rw5 n ALA 64 Ca 0.10 -2.80 -0.30 0.00 0.00 0.00 0.00 53.44 50.44 1rw5 n ALA 64 Cb 0.48 -3.31 0.01 0.00 0.00 0.00 0.00 19.45 16.63 1rw5 n ALA 64 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1rw5 s THR 65 N 3.78 4.67 0.04 0.00 -4.23 -1.26 -4.96 115.64 113.67 1rw5 s THR 65 Ca 0.49 0.67 -0.34 0.00 -1.18 0.00 0.00 61.69 61.34 1rw5 s THR 65 Cb 0.13 -3.84 -0.13 0.00 1.34 0.00 0.00 72.50 70.00 1rw5 s THR 65 CO 0.01 -1.03 1.72 -0.81 -0.54 0.00 0.00 174.62 173.96 1rw5 n PRO 66 N -2.64 2.12 -0.14 3.99 -0.04 -1.26 -4.86 135.00 132.16 1rw5 n PRO 66 Ca 0.05 0.77 0.00 0.00 -0.04 0.00 0.00 63.50 64.28 1rw5 n PRO 66 Cb 0.55 -2.57 0.26 0.00 -0.04 0.00 0.00 33.50 31.70 1rw5 n PRO 66 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1rw5 h GLU 67 N 7.45 0.84 -3.31 0.54 4.57 -1.93 -3.46 114.58 119.28 1rw5 h GLU 67 Ca -0.47 -0.09 -0.06 0.00 -1.18 0.00 0.00 59.36 57.56 1rw5 h GLU 67 Cb 1.27 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.65 1rw5 h GLU 67 CO 0.91 0.63 0.12 0.16 -1.18 0.00 0.00 179.01 179.65 1rw5 s ASP 68 N -6.50 0.14 0.33 1.04 1.47 -1.26 -5.01 116.67 106.88 1rw5 s ASP 68 Ca -0.10 -1.10 0.01 0.00 1.18 0.00 0.00 52.55 52.54 1rw5 s ASP 68 Cb 0.17 0.76 0.57 0.00 -0.34 0.00 0.00 42.92 44.08 1rw5 s ASP 68 CO 0.78 -1.49 1.98 0.11 0.68 0.00 0.00 175.17 177.23 1rw5 h LYS 69 N 2.05 0.93 -0.48 2.11 1.57 -2.00 -1.35 116.57 119.40 1rw5 h LYS 69 Ca -0.28 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.40 1rw5 h LYS 69 Cb 1.25 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 1rw5 h LYS 69 CO 0.37 0.62 0.15 0.93 -0.57 0.00 0.00 179.45 180.94 1rw5 h GLU 70 N 0.96 0.75 -0.32 3.15 4.39 -1.99 -2.47 114.58 119.05 1rw5 h GLU 70 Ca 0.28 -0.16 -0.09 0.00 0.34 0.00 0.00 59.36 59.73 1rw5 h GLU 70 Cb -0.05 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.48 1rw5 h GLU 70 CO -0.07 0.71 -0.18 0.37 -1.16 0.00 0.00 179.01 178.68 1rw5 h GLN 71 N 0.65 0.58 -0.76 2.33 4.15 -1.81 -2.46 115.11 117.78 1rw5 h GLN 71 Ca 0.16 -0.20 0.05 0.00 0.77 0.00 0.00 58.65 59.43 1rw5 h GLN 71 Cb 0.27 -0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.86 1rw5 h GLN 71 CO -0.00 0.73 0.46 0.00 -1.93 0.00 0.00 178.83 178.09 1rw5 h ALA 72 N 1.28 1.03 -0.90 3.38 0.00 -0.86 0.25 119.26 123.45 1rw5 h ALA 72 Ca 0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1rw5 h ALA 72 Cb 0.61 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1rw5 h ALA 72 CO 0.04 0.20 0.52 0.37 0.00 0.00 0.00 179.25 180.38 1rw5 h GLN 73 N 0.87 1.23 -0.26 0.00 4.15 -1.02 -0.19 115.11 119.89 1rw5 h GLN 73 Ca 0.33 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.59 1rw5 h GLN 73 Cb 0.13 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 1rw5 h GLN 73 CO -0.16 0.88 0.02 1.96 -1.93 0.00 0.00 178.83 179.60 1rw5 h GLN 74 N 1.25 0.39 0.00 1.69 4.20 -0.37 -3.30 115.11 118.97 1rw5 h GLN 74 Ca 0.32 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1rw5 h GLN 74 Cb -0.01 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.70 1rw5 h GLN 74 CO -0.06 0.41 0.00 -1.33 -0.67 0.00 0.00 178.83 177.18 1rw5 n MET 75 N -4.34 0.00 -3.80 1.46 2.81 0.61 -4.88 117.12 108.98 1rw5 n MET 75 Ca 0.01 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.63 1rw5 n MET 75 Cb 0.20 -0.79 0.04 0.00 -0.71 0.00 0.00 33.22 31.96 1rw5 n MET 75 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1rw5 n ASN 76 N -0.43 -3.76 -3.98 7.83 2.85 -0.99 -4.97 115.26 111.82 1rw5 n ASN 76 Ca 0.00 -0.76 -0.19 0.00 -0.11 0.00 0.00 54.58 53.51 1rw5 n ASN 76 Cb 0.00 -4.10 -0.09 0.00 1.24 0.00 0.00 39.78 36.83 1rw5 n ASN 76 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1rw5 s GLN 77 N -6.35 1.64 0.66 1.20 -0.21 -1.26 -5.01 119.66 110.33 1rw5 s GLN 77 Ca 0.43 -1.94 0.37 0.00 0.02 0.00 0.00 55.36 54.23 1rw5 s GLN 77 Cb -0.21 -0.14 2.00 0.00 1.00 0.00 0.00 33.01 35.66 1rw5 s GLN 77 CO 0.81 -0.46 2.14 0.87 -2.12 0.00 0.00 175.29 176.54 1rw5 h LYS 78 N 2.17 0.00 -0.98 2.91 1.57 -1.97 -2.37 116.57 117.89 1rw5 h LYS 78 Ca -0.33 0.00 0.18 0.00 -1.87 0.00 0.00 60.65 58.63 1rw5 h LYS 78 Cb 1.25 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.47 1rw5 h LYS 78 CO 0.52 0.00 0.61 -0.44 -0.57 0.00 0.00 179.45 179.57 1rw5 h ASP 79 N 0.00 0.72 0.21 0.86 3.32 -1.97 -0.66 116.42 118.90 1rw5 h ASP 79 Ca 0.01 0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.14 1rw5 h ASP 79 Cb 0.35 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1rw5 h ASP 79 CO -0.00 0.28 -0.28 -0.26 -1.72 0.00 0.00 179.24 177.26 1rw5 h PHE 80 N 0.71 -0.74 -0.74 4.55 -1.00 -1.84 0.75 116.94 118.62 1rw5 h PHE 80 Ca 0.54 0.01 0.05 0.00 2.81 0.00 0.00 57.97 61.38 1rw5 h PHE 80 Cb 0.91 0.30 -0.05 0.00 3.61 0.00 0.00 35.95 40.72 1rw5 h PHE 80 CO -0.00 -0.39 0.45 -0.07 -1.61 0.00 0.00 178.31 176.68 1rw5 h LEU 81 N -0.55 0.71 -1.04 1.54 4.07 -1.41 -1.40 115.31 117.24 1rw5 h LEU 81 Ca 0.01 0.01 -0.10 0.00 0.08 0.00 0.00 57.88 57.88 1rw5 h LEU 81 Cb 0.53 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.12 1rw5 h LEU 81 CO -0.10 0.47 -0.37 0.77 -1.08 0.00 0.00 178.44 178.12 1rw5 h SER 82 N 0.84 0.21 -0.47 -0.43 4.64 -0.49 -3.00 113.55 114.85 1rw5 h SER 82 Ca 0.32 -0.08 -0.10 0.00 -0.47 0.00 0.00 61.79 61.45 1rw5 h SER 82 Cb 0.12 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 1rw5 h SER 82 CO -0.15 0.57 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.22 1rw5 h LEU 83 N 0.17 0.93 -0.11 5.97 3.38 0.16 -2.88 115.31 122.94 1rw5 h LEU 83 Ca 0.02 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.72 1rw5 h LEU 83 Cb 0.75 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1rw5 h LEU 83 CO 0.06 1.04 -0.05 0.40 0.09 0.00 0.00 178.44 179.98 1rw5 h ILE 84 N 0.85 0.83 -0.54 1.22 2.04 -1.27 -1.47 117.51 119.16 1rw5 h ILE 84 Ca 0.14 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.98 1rw5 h ILE 84 Cb 0.63 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1rw5 h ILE 84 CO 0.04 0.00 0.24 -0.37 0.00 0.00 0.00 178.15 178.06 1rw5 h VAL 85 N -0.04 1.19 -0.49 1.67 -1.51 -1.59 -1.23 116.25 114.24 1rw5 h VAL 85 Ca 0.06 -0.55 -0.03 0.00 -1.23 0.00 0.00 66.70 64.95 1rw5 h VAL 85 Cb 0.13 0.51 -0.02 0.00 -2.13 0.00 0.00 31.29 29.78 1rw5 h VAL 85 CO -0.13 0.22 0.19 0.28 -1.23 0.00 0.00 177.57 176.90 1rw5 h SER 86 N 0.77 0.69 0.41 4.19 0.02 -1.18 -0.82 113.55 117.62 1rw5 h SER 86 Ca 0.19 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1rw5 h SER 86 Cb 0.11 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1rw5 h SER 86 CO -0.02 0.68 -0.20 0.40 -1.14 0.00 0.00 176.83 176.55 1rw5 h ILE 87 N 0.66 0.00 -0.57 3.27 2.04 -0.79 -2.08 117.51 120.04 1rw5 h ILE 87 Ca 0.16 -0.50 0.04 0.00 1.00 0.00 0.00 64.86 65.57 1rw5 h ILE 87 Cb 0.21 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.25 1rw5 h ILE 87 CO -0.01 0.00 0.32 -0.07 0.00 0.00 0.00 178.15 178.39 1rw5 h LEU 88 N -1.05 0.49 -0.57 1.44 3.38 -1.32 -1.70 115.31 115.98 1rw5 h LEU 88 Ca -0.06 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1rw5 h LEU 88 Cb 0.43 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1rw5 h LEU 88 CO 0.09 0.33 -0.07 -0.09 0.09 0.00 0.00 178.44 178.80 1rw5 h ARG 89 N 0.62 1.06 0.00 1.13 2.43 -1.27 -2.66 114.38 115.69 1rw5 h ARG 89 Ca 0.24 -0.37 -0.03 0.00 -0.81 0.00 0.00 59.98 59.01 1rw5 h ARG 89 Cb 0.10 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1rw5 h ARG 89 CO -0.14 1.07 -0.15 0.66 -1.51 0.00 0.00 179.97 179.90 1rw5 h SER 90 N 0.95 0.00 0.62 -3.80 4.64 -0.98 -2.41 113.55 112.57 1rw5 h SER 90 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1rw5 h SER 90 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1rw5 h SER 90 CO 0.04 0.15 -0.35 0.79 -0.87 0.00 0.00 176.83 176.60 1rw5 n TRP 91 N -3.57 0.00 -0.22 4.77 7.02 -0.67 -3.98 117.44 120.79 1rw5 n TRP 91 Ca -0.01 0.00 -0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1rw5 n TRP 91 Cb 0.29 -0.31 0.22 0.00 -2.42 0.00 0.00 31.31 29.09 1rw5 n TRP 91 CO 0.00 0.00 0.00 -0.97 -2.02 0.00 0.00 177.69 174.70 1rw5 h ASN 92 N 0.05 0.89 0.40 -0.99 -1.24 -1.22 -2.81 115.58 110.66 1rw5 h ASN 92 Ca 0.00 -0.05 -0.02 0.00 0.71 0.00 0.00 56.30 56.94 1rw5 h ASN 92 Cb 0.50 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.33 1rw5 h ASN 92 CO 0.00 0.68 -0.19 -0.08 -1.29 0.00 0.00 177.43 176.55 1rw5 h GLU 93 N 1.03 -0.52 -1.09 6.67 4.57 -1.75 -3.09 114.58 120.39 1rw5 h GLU 93 Ca 0.27 0.04 0.31 0.00 -1.18 0.00 0.00 59.36 58.79 1rw5 h GLU 93 Cb -0.05 0.12 -0.12 0.00 -0.16 0.00 0.00 28.75 28.54 1rw5 h GLU 93 CO -0.05 -0.26 0.68 -1.35 -1.18 0.00 0.00 179.01 176.84 1rw5 h PRO 94 N -1.07 0.33 -0.29 0.92 0.11 -1.75 0.51 132.00 130.76 1rw5 h PRO 94 Ca -0.06 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.93 1rw5 h PRO 94 Cb 0.50 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 1rw5 h PRO 94 CO 0.09 0.22 -0.27 -0.07 -0.21 0.00 0.00 178.00 177.76 1rw5 h LEU 95 N 0.34 0.59 -0.11 2.35 3.38 -1.54 -2.65 115.31 117.67 1rw5 h LEU 95 Ca 0.68 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 58.44 1rw5 h LEU 95 Cb 1.72 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 1rw5 h LEU 95 CO -0.41 0.84 0.02 0.22 0.09 0.00 0.00 178.44 179.21 1rw5 h TYR 96 N 0.50 0.04 -0.40 1.13 5.03 0.10 -1.60 116.97 121.77 1rw5 h TYR 96 Ca 0.07 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.38 1rw5 h TYR 96 Cb 0.73 -0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.99 1rw5 h TYR 96 CO 0.03 0.02 0.24 0.45 -1.32 0.00 0.00 178.16 177.58 1rw5 h HIS 97 N 0.07 0.53 -0.69 -3.82 3.86 -1.39 -1.19 115.15 112.52 1rw5 h HIS 97 Ca 0.05 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.34 1rw5 h HIS 97 Cb 0.04 -0.17 -0.07 0.00 1.06 0.00 0.00 27.41 28.26 1rw5 h HIS 97 CO -0.11 0.38 0.34 -0.07 0.86 0.00 0.00 177.93 179.33 1rw5 h LEU 98 N 0.53 0.45 -0.63 2.43 3.38 -1.15 0.12 115.31 120.44 1rw5 h LEU 98 Ca 0.14 0.06 -0.08 0.00 0.09 0.00 0.00 57.88 58.10 1rw5 h LEU 98 Cb 0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1rw5 h LEU 98 CO -0.03 0.26 0.10 0.58 0.09 0.00 0.00 178.44 179.44 1rw5 h VAL 99 N 0.59 1.26 0.21 1.22 2.07 -0.83 0.30 116.25 121.07 1rw5 h VAL 99 Ca 0.34 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1rw5 h VAL 99 Cb 0.35 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1rw5 h VAL 99 CO -0.26 0.38 -0.10 0.71 0.02 0.00 0.00 177.57 178.31 1rw5 h THR 100 N 0.96 0.87 -0.46 2.57 1.35 0.01 0.14 112.91 118.34 1rw5 h THR 100 Ca 0.19 -0.59 -0.14 0.00 -0.55 0.00 0.00 66.41 65.32 1rw5 h THR 100 Cb 0.44 1.21 -0.01 0.00 -1.73 0.00 0.00 68.15 68.06 1rw5 h THR 100 CO 0.01 0.13 -0.25 -0.33 -0.25 0.00 0.00 175.52 174.83 1rw5 h GLU 101 N -0.59 0.99 -0.39 4.72 4.39 -0.80 -2.95 114.58 119.95 1rw5 h GLU 101 Ca -0.03 -0.44 -0.09 0.00 0.34 0.00 0.00 59.36 59.14 1rw5 h GLU 101 Cb 0.43 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1rw5 h GLU 101 CO 0.05 1.12 -0.11 0.28 -1.16 0.00 0.00 179.01 179.18 1rw5 h VAL 102 N 0.84 1.28 -0.95 3.13 2.07 -0.41 -2.54 116.25 119.67 1rw5 h VAL 102 Ca 0.10 -1.20 0.13 0.00 0.82 0.00 0.00 66.70 66.55 1rw5 h VAL 102 Cb 0.83 1.25 -0.08 0.00 -1.52 0.00 0.00 31.29 31.78 1rw5 h VAL 102 CO 0.07 0.40 0.60 -0.09 0.02 0.00 0.00 177.57 178.58 1rw5 h ARG 103 N 0.56 0.84 -0.26 1.57 2.43 -0.66 0.13 114.38 118.99 1rw5 h ARG 103 Ca 0.10 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1rw5 h ARG 103 Cb 0.63 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1rw5 h ARG 103 CO 0.04 0.55 0.00 0.41 -1.51 0.00 0.00 179.97 179.46 1rw5 n GLY 104 N -1.39 0.43 3.57 2.80 0.00 -1.09 -4.77 105.19 104.75 1rw5 n GLY 104 Ca 0.18 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 1rw5 n GLY 104 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1rw5 s MET 105 N -1.66 3.64 0.22 1.61 -2.45 0.45 -4.91 119.30 116.20 1rw5 s MET 105 Ca 0.28 0.20 -0.08 0.00 -1.25 0.00 0.00 55.69 54.83 1rw5 s MET 105 Cb 0.15 -3.86 0.19 0.00 1.25 0.00 0.00 34.83 32.56 1rw5 s MET 105 CO 0.21 -0.97 1.85 1.96 1.05 0.00 0.00 175.02 179.12 1rw5 h GLN 106 N 8.68 1.16 -0.10 4.11 4.20 -1.87 0.40 115.11 131.69 1rw5 h GLN 106 Ca -0.25 -0.12 -0.08 0.00 0.06 0.00 0.00 58.65 58.26 1rw5 h GLN 106 Cb 1.09 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 1rw5 h GLN 106 CO 0.94 0.84 -0.32 0.93 -0.67 0.00 0.00 178.83 180.55 1rw5 h GLU 107 N 1.17 0.19 -2.35 1.46 5.08 -1.95 -3.33 114.58 114.85 1rw5 h GLU 107 Ca 0.30 -0.07 -0.59 0.00 -1.00 0.00 0.00 59.36 58.00 1rw5 h GLU 107 Cb -0.00 -0.01 -0.40 0.00 0.50 0.00 0.00 28.75 28.83 1rw5 h GLU 107 CO -0.05 0.50 -0.85 0.00 -1.00 0.00 0.00 179.01 177.61 1rw5 n ALA 108 N -2.48 3.13 -0.58 3.43 0.00 -0.57 -4.96 120.51 118.48 1rw5 n ALA 108 Ca -0.01 -3.87 0.00 0.00 0.00 0.00 0.00 53.44 49.55 1rw5 n ALA 108 Cb 0.40 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1rw5 n ALA 108 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1rw5 n PRO 109 N 1.75 0.00 -0.36 0.00 -0.04 0.03 -4.15 135.00 132.23 1rw5 n PRO 109 Ca 0.25 0.11 0.12 0.00 -0.04 0.00 0.00 63.50 63.94 1rw5 n PRO 109 Cb 0.45 -0.47 0.32 0.00 -0.04 0.00 0.00 33.50 33.76 1rw5 n PRO 109 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1rw5 n GLU 110 N -1.52 2.71 0.00 0.54 -0.58 -1.26 -3.85 120.64 116.68 1rw5 n GLU 110 Ca 0.00 -2.65 0.00 0.00 -0.42 0.00 0.00 57.16 54.09 1rw5 n GLU 110 Cb 0.00 -1.57 0.00 0.00 -0.57 0.00 0.00 31.44 29.30 1rw5 n GLU 110 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1rw5 n ALA 111 N 1.67 0.00 0.15 0.62 0.00 -1.26 -3.98 120.51 117.70 1rw5 n ALA 111 Ca 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1rw5 n ALA 111 Cb 0.63 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.27 1rw5 n ALA 111 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1rw5 h ILE 112 N 0.00 1.33 -0.43 0.00 2.04 -1.83 -3.08 117.51 115.54 1rw5 h ILE 112 Ca 0.00 -2.02 -0.03 0.00 1.00 0.00 0.00 64.86 63.81 1rw5 h ILE 112 Cb 0.00 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 1rw5 h ILE 112 CO 0.00 0.56 0.14 0.25 0.00 0.00 0.00 178.15 179.10 1rw5 h LEU 113 N 0.00 0.56 -0.52 1.44 5.85 -1.80 -2.04 115.31 118.80 1rw5 h LEU 113 Ca -0.01 -0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.73 1rw5 h LEU 113 Cb 1.07 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.89 1rw5 h LEU 113 CO 0.07 0.53 0.13 0.28 -0.34 0.00 0.00 178.44 179.12 1rw5 h SER 114 N 0.61 0.07 0.77 1.25 0.02 -1.66 0.60 113.55 115.20 1rw5 h SER 114 Ca 0.15 0.08 -0.21 0.00 -0.84 0.00 0.00 61.79 60.97 1rw5 h SER 114 Cb 0.17 0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1rw5 h SER 114 CO -0.01 0.06 -0.98 0.11 -1.14 0.00 0.00 176.83 174.87 1rw5 h LYS 115 N 0.28 0.11 -0.49 3.45 1.57 -1.67 -3.13 116.57 116.70 1rw5 h LYS 115 Ca 0.26 -0.16 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 1rw5 h LYS 115 Cb 0.33 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1rw5 h LYS 115 CO -0.31 1.00 -0.07 0.00 -0.57 0.00 0.00 179.45 179.50 1rw5 h ALA 116 N 0.94 0.96 -0.19 3.86 0.00 -0.60 0.34 119.26 124.57 1rw5 h ALA 116 Ca -0.04 -0.31 -0.21 0.00 0.00 0.00 0.00 54.91 54.34 1rw5 h ALA 116 Cb 1.68 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 19.28 1rw5 h ALA 116 CO 0.14 0.62 -0.71 -0.24 0.00 0.00 0.00 179.25 179.06 1rw5 h VAL 117 N 0.79 1.28 0.00 0.00 3.04 -0.98 -3.17 116.25 117.22 1rw5 h VAL 117 Ca 0.14 -1.91 -0.19 0.00 -1.01 0.00 0.00 66.70 63.73 1rw5 h VAL 117 Cb 0.57 1.88 -0.02 0.00 -2.01 0.00 0.00 31.29 31.70 1rw5 h VAL 117 CO 0.03 0.61 -0.90 1.05 -1.01 0.00 0.00 177.57 177.35 1rw5 h GLU 118 N 0.57 0.02 -0.44 4.17 4.11 -1.47 -3.18 114.58 118.37 1rw5 h GLU 118 Ca -0.03 -0.03 -0.06 0.00 0.07 0.00 0.00 59.36 59.31 1rw5 h GLU 118 Cb 1.33 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.57 1rw5 h GLU 118 CO 0.15 0.91 0.01 0.97 0.07 0.00 0.00 179.01 181.11 1rw5 h ILE 119 N 0.01 1.23 -0.10 -1.06 2.10 -0.35 -0.41 117.51 118.93 1rw5 h ILE 119 Ca -0.01 -0.93 -0.11 0.00 1.08 0.00 0.00 64.86 64.88 1rw5 h ILE 119 Cb 1.59 0.89 -0.01 0.00 -1.09 0.00 0.00 36.82 38.20 1rw5 h ILE 119 CO 0.12 0.33 -0.45 -0.08 -1.08 0.00 0.00 178.15 176.99 1rw5 h GLU 120 N 0.67 0.23 -0.06 2.19 4.81 -1.58 -2.21 114.58 118.63 1rw5 h GLU 120 Ca 0.13 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.16 1rw5 h GLU 120 Cb 0.41 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1rw5 h GLU 120 CO 0.02 0.64 -0.32 0.93 -0.73 0.00 0.00 179.01 179.54 1rw5 h GLU 121 N 0.19 0.32 -0.25 1.92 4.39 -1.35 -3.07 114.58 116.71 1rw5 h GLU 121 Ca 0.01 -0.27 -0.05 0.00 0.34 0.00 0.00 59.36 59.40 1rw5 h GLU 121 Cb 0.87 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 1rw5 h GLU 121 CO 0.07 0.92 -0.07 1.96 -1.16 0.00 0.00 179.01 180.73 1rw5 h GLN 122 N -0.20 0.39 -0.58 2.33 1.08 -1.08 -1.96 115.11 115.09 1rw5 h GLN 122 Ca -0.02 -0.09 -0.06 0.00 -1.45 0.00 0.00 58.65 57.02 1rw5 h GLN 122 Cb 0.99 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.34 1rw5 h GLN 122 CO 0.07 0.48 0.10 1.79 -0.95 0.00 0.00 178.83 180.32 1rw5 h THR 123 N 0.38 1.24 -0.03 -0.54 1.35 -1.41 -0.07 112.91 113.83 1rw5 h THR 123 Ca 0.08 -0.93 -0.23 0.00 -0.55 0.00 0.00 66.41 64.78 1rw5 h THR 123 Cb 0.36 0.69 0.01 0.00 -1.73 0.00 0.00 68.15 67.48 1rw5 h THR 123 CO 0.02 0.34 -0.90 0.11 -0.25 0.00 0.00 175.52 174.84 1rw5 h LYS 124 N 0.88 0.51 -0.26 4.72 1.57 -1.37 -0.56 116.57 122.05 1rw5 h LYS 124 Ca 0.18 -0.50 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 1rw5 h LYS 124 Cb 0.37 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1rw5 h LYS 124 CO 0.01 1.14 0.14 0.00 -0.57 0.00 0.00 179.45 180.16 1rw5 h ARG 125 N 0.30 0.37 -0.69 3.15 3.08 -1.08 0.28 114.38 119.80 1rw5 h ARG 125 Ca -0.08 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.92 1rw5 h ARG 125 Cb 1.53 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.48 1rw5 h ARG 125 CO 0.16 0.35 0.41 1.25 -1.07 0.00 0.00 179.97 181.08 1rw5 h LEU 126 N 0.30 0.83 -0.28 3.04 6.46 -0.98 0.15 115.31 124.83 1rw5 h LEU 126 Ca 0.09 -0.06 0.03 0.00 -0.12 0.00 0.00 57.88 57.82 1rw5 h LEU 126 Cb 0.09 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 39.78 1rw5 h LEU 126 CO -0.01 0.65 0.07 0.25 -0.62 0.00 0.00 178.44 178.78 1rw5 h LEU 127 N 0.94 0.05 -0.48 2.25 5.85 -0.22 0.70 115.31 124.40 1rw5 h LEU 127 Ca 0.25 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.90 1rw5 h LEU 127 Cb -0.03 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1rw5 h LEU 127 CO -0.05 0.06 -0.11 -0.08 -0.34 0.00 0.00 178.44 177.93 1rw5 h GLU 128 N 0.18 0.92 -0.55 1.25 4.81 0.04 0.23 114.58 121.46 1rw5 h GLU 128 Ca 0.12 -0.35 -0.02 0.00 -0.13 0.00 0.00 59.36 58.99 1rw5 h GLU 128 Cb 0.11 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1rw5 h GLU 128 CO -0.15 1.01 0.28 0.78 -0.73 0.00 0.00 179.01 180.19 1rw5 h GLY 129 N 0.77 0.84 1.60 1.92 0.00 -0.12 -2.62 103.07 105.45 1rw5 h GLY 129 Ca 0.12 -0.41 -0.15 0.00 0.00 0.00 0.00 47.33 46.89 1rw5 h GLY 129 CO 0.05 0.39 -0.57 1.98 0.00 0.00 0.00 176.54 178.39 1rw5 h MET 130 N 0.74 0.42 0.00 4.80 1.85 0.61 -3.05 114.93 120.30 1rw5 h MET 130 Ca 0.19 -0.27 -0.01 0.00 -0.61 0.00 0.00 59.70 59.01 1rw5 h MET 130 Cb 0.09 0.03 -0.00 0.00 0.43 0.00 0.00 31.60 32.16 1rw5 h MET 130 CO -0.03 0.87 -0.03 0.93 -0.40 0.00 0.00 176.91 178.25 1rw5 h GLU 131 N 0.32 0.00 0.00 0.39 5.08 -0.17 -0.76 114.58 119.44 1rw5 h GLU 131 Ca 0.00 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.18 1rw5 h GLU 131 Cb 1.09 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 1rw5 h GLU 131 CO 0.10 0.03 -0.89 1.37 -1.00 0.00 0.00 179.01 178.62 1rw5 h LEU 132 N 0.00 0.00 0.14 1.33 8.10 -1.39 -2.06 115.31 121.43 1rw5 h LEU 132 Ca -0.00 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.98 1rw5 h LEU 132 Cb 0.06 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.28 1rw5 h LEU 132 CO 0.00 0.89 -0.07 0.40 -4.11 0.00 0.00 178.44 175.55 1rw5 h ILE 133 N 0.00 0.96 -0.63 0.15 2.04 -1.15 0.25 117.51 119.12 1rw5 h ILE 133 Ca -0.01 -0.42 -0.07 0.00 1.00 0.00 0.00 64.86 65.36 1rw5 h ILE 133 Cb 1.65 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 38.92 1rw5 h ILE 133 CO 0.12 0.10 0.12 1.62 0.00 0.00 0.00 178.15 180.10 1rw5 h VAL 134 N -0.39 1.26 0.00 1.67 3.04 -1.52 0.90 116.25 121.21 1rw5 h VAL 134 Ca -0.02 -0.99 -0.03 0.00 -1.01 0.00 0.00 66.70 64.65 1rw5 h VAL 134 Cb 0.31 0.68 -0.00 0.00 -2.01 0.00 0.00 31.29 30.27 1rw5 h VAL 134 CO 0.03 0.37 -0.15 0.28 -1.01 0.00 0.00 177.57 177.09 1rw5 h SER 135 N 0.95 0.00 0.00 3.17 0.02 -1.19 0.25 113.55 116.75 1rw5 h SER 135 Ca 0.19 0.00 -0.44 0.00 -0.84 0.00 0.00 61.79 60.70 1rw5 h SER 135 Cb 0.41 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.88 1rw5 h SER 135 CO 0.01 0.15 -2.51 0.00 -1.14 0.00 0.00 176.83 173.34 1rw5 n GLN 136 N -3.52 0.61 0.18 3.45 6.02 0.87 -3.72 117.38 121.26 1rw5 n GLN 136 Ca -0.01 0.23 0.02 0.00 -0.01 0.00 0.00 57.00 57.23 1rw5 n GLN 136 Cb 0.30 -1.51 0.33 0.00 1.02 0.00 0.00 30.24 30.38 1rw5 n GLN 136 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 1rw5 h VAL 137 N -0.69 1.25 -2.25 5.09 3.04 0.77 -3.38 116.25 120.08 1rw5 h VAL 137 Ca -0.66 -1.44 -0.46 0.00 -1.01 0.00 0.00 66.70 63.13 1rw5 h VAL 137 Cb 1.70 1.79 -0.35 0.00 -2.01 0.00 0.00 31.29 32.42 1rw5 h VAL 137 CO -0.32 0.41 -0.76 -1.00 -1.01 0.00 0.00 177.57 174.89 1rw5 s HIS 138 N -4.03 0.14 0.56 3.17 3.76 0.88 -4.99 115.29 114.78 1rw5 s HIS 138 Ca -0.02 -1.13 0.32 0.00 -0.15 0.00 0.00 55.06 54.08 1rw5 s HIS 138 Cb 0.14 -0.64 1.47 0.00 1.11 0.00 0.00 32.58 34.66 1rw5 s HIS 138 CO 0.72 -0.90 1.82 -1.00 -0.85 0.00 0.00 174.74 174.53 1rw5 h PRO 139 N 7.15 0.00 -6.24 8.40 0.13 -1.66 -3.37 132.00 136.40 1rw5 h PRO 139 Ca 0.04 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.48 1rw5 h PRO 139 Cb 1.02 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.84 1rw5 h PRO 139 CO 0.24 0.00 -0.88 -2.00 -0.23 0.00 0.00 178.00 175.13 1rw5 s GLU 140 N -4.83 2.26 -0.07 0.86 2.12 -1.26 -4.93 118.70 112.84 1rw5 s GLU 140 Ca -0.05 -0.89 0.00 0.00 0.36 0.00 0.00 54.97 54.40 1rw5 s GLU 140 Cb 0.20 -2.04 -0.03 0.00 0.26 0.00 0.00 34.13 32.52 1rw5 s GLU 140 CO 0.70 0.46 -0.06 0.99 -0.54 0.00 0.00 175.26 176.81 1rw5 s THR 141 N -0.37 3.78 0.26 -1.70 2.01 -1.26 -5.00 115.64 113.36 1rw5 s THR 141 Ca 0.03 -0.45 -0.05 0.00 0.31 0.00 0.00 61.69 61.54 1rw5 s THR 141 Cb -0.12 -2.55 0.26 0.00 0.01 0.00 0.00 72.50 70.11 1rw5 s THR 141 CO 0.01 0.60 1.92 0.50 -0.69 0.00 0.00 174.62 176.96 1rw5 h LYS 142 N 5.25 1.26 -6.47 4.92 3.64 -1.97 -3.41 116.57 119.78 1rw5 h LYS 142 Ca -0.49 -0.08 -0.68 0.00 -1.27 0.00 0.00 60.65 58.13 1rw5 h LYS 142 Cb 1.18 -0.28 -0.21 0.00 -0.41 0.00 0.00 32.23 32.50 1rw5 h LYS 142 CO 0.53 0.83 -0.78 -2.00 -2.27 0.00 0.00 179.45 175.76 1rw5 s GLU 143 N -6.08 2.26 0.96 1.90 2.12 -1.26 -5.10 118.70 113.49 1rw5 s GLU 143 Ca -0.13 -0.87 -0.13 0.00 0.36 0.00 0.00 54.97 54.20 1rw5 s GLU 143 Cb 0.19 -2.29 0.17 0.00 0.26 0.00 0.00 34.13 32.46 1rw5 s GLU 143 CO 0.82 0.57 1.14 -0.80 -0.54 0.00 0.00 175.26 176.45 1rw5 s ASN 144 N -1.29 3.07 -0.99 -1.70 0.01 -1.26 -4.84 114.94 107.94 1rw5 s ASN 144 Ca 0.15 0.90 -0.23 0.00 -0.71 0.00 0.00 52.86 52.97 1rw5 s ASN 144 Cb -0.11 -1.42 -0.13 0.00 0.41 0.00 0.00 41.25 40.00 1rw5 s ASN 144 CO 0.05 -2.82 1.92 -1.84 -1.51 0.00 0.00 177.10 172.90 1rw5 n GLU 145 N -3.93 1.45 -4.48 -0.60 0.28 -1.26 -4.89 120.64 107.21 1rw5 n GLU 145 Ca 0.08 -2.16 -0.33 0.00 -0.16 0.00 0.00 57.16 54.58 1rw5 n GLU 145 Cb 0.59 -3.40 -0.10 0.00 1.43 0.00 0.00 31.44 29.96 1rw5 n GLU 145 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1rw5 s ILE 146 N 8.95 3.78 0.17 3.84 1.01 -1.26 -5.01 121.20 132.68 1rw5 s ILE 146 Ca 0.65 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 60.68 1rw5 s ILE 146 Cb 0.05 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 1rw5 s ILE 146 CO 0.14 0.47 0.06 -0.72 0.00 0.00 0.00 174.94 174.89 1rw5 s TYR 147 N -0.94 1.09 0.78 3.97 -0.85 -1.26 -4.47 117.35 115.67 1rw5 s TYR 147 Ca 0.16 -1.19 -0.14 0.00 -0.52 0.00 0.00 57.07 55.37 1rw5 s TYR 147 Cb -0.11 -0.60 0.07 0.00 0.38 0.00 0.00 41.96 41.69 1rw5 s TYR 147 CO 0.06 -0.43 1.21 -2.14 -1.52 0.00 0.00 175.55 172.72 1rw5 s PRO 148 N -4.03 1.78 -0.13 -3.49 0.02 -1.26 -4.99 135.00 122.89 1rw5 s PRO 148 Ca 0.28 1.77 -0.14 0.00 0.02 0.00 0.00 61.00 62.93 1rw5 s PRO 148 Cb 0.07 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.75 1rw5 s PRO 148 CO 0.06 -2.11 0.32 0.14 -0.33 0.00 0.00 177.00 175.07 1rw5 s VAL 149 N -2.08 5.27 -0.46 3.83 -7.23 -1.26 -4.95 120.40 113.52 1rw5 s VAL 149 Ca 0.74 0.61 -0.25 0.00 -1.81 0.00 0.00 61.98 61.27 1rw5 s VAL 149 Cb -0.29 -3.65 -0.13 0.00 0.56 0.00 0.00 36.38 32.87 1rw5 s VAL 149 CO 0.49 0.42 1.54 1.87 -0.31 0.00 0.00 175.10 179.11 1rw5 n TRP 150 N 3.26 0.59 -4.14 2.82 -0.00 -1.26 -4.92 117.44 113.78 1rw5 n TRP 150 Ca -0.12 0.39 -0.14 0.00 -0.00 0.00 0.00 57.50 57.63 1rw5 n TRP 150 Cb 0.52 -1.51 -0.11 0.00 -0.00 0.00 0.00 31.31 30.21 1rw5 n TRP 150 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 1rw5 s SER 151 N 4.70 1.31 0.00 5.87 0.01 -1.26 -5.10 113.70 119.24 1rw5 s SER 151 Ca 0.82 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 57.36 1rw5 s SER 151 Cb -0.91 0.01 0.00 0.00 0.21 0.00 0.00 66.02 65.33 1rw5 s SER 151 CO 0.38 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.41 1rw5 n GLY 152 N 0.88 -0.02 3.51 3.44 0.00 -1.26 -4.89 105.19 106.86 1rw5 n GLY 152 Ca -0.18 -1.91 -0.23 0.00 0.00 0.00 0.00 46.02 43.69 1rw5 n GLY 152 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rw5 n LEU 153 N -0.43 -4.00 -4.69 0.99 4.32 -1.26 -4.84 117.00 107.08 1rw5 n LEU 153 Ca 0.00 -0.86 -0.44 0.00 -0.02 0.00 0.00 56.01 54.69 1rw5 n LEU 153 Cb 0.00 -2.78 -0.04 0.00 -1.62 0.00 0.00 43.42 38.99 1rw5 n LEU 153 CO 0.00 0.32 1.34 -0.81 -1.22 0.00 0.00 177.39 177.02 1rw5 n PRO 154 N -3.83 2.50 -2.88 3.23 -0.04 -1.26 -3.89 135.00 128.83 1rw5 n PRO 154 Ca -0.12 0.90 -0.00 0.00 -0.04 0.00 0.00 63.50 64.24 1rw5 n PRO 154 Cb 0.62 -2.73 -0.00 0.00 -0.04 0.00 0.00 33.50 31.34 1rw5 n PRO 154 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1rw5 n SER 155 N 4.40 -7.10 0.29 3.54 7.64 -1.26 -4.57 113.62 116.55 1rw5 n SER 155 Ca 0.17 1.09 0.18 0.00 1.01 0.00 0.00 58.87 61.33 1rw5 n SER 155 Cb 0.33 -4.00 0.96 0.00 -1.01 0.00 0.00 64.21 60.48 1rw5 n SER 155 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1rw5 h LEU 156 N 3.37 0.00 -1.66 -3.43 7.12 -1.96 0.41 115.31 119.15 1rw5 h LEU 156 Ca -0.03 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.98 1rw5 h LEU 156 Cb 0.40 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.53 1rw5 h LEU 156 CO 0.06 0.00 0.00 0.00 -0.13 0.00 0.00 178.44 178.37 1rw5 n GLN 157 N -3.28 2.18 -1.53 1.25 6.02 -1.26 -4.88 117.38 115.88 1rw5 n GLN 157 Ca -0.01 -1.06 -0.33 0.00 -0.01 0.00 0.00 57.00 55.58 1rw5 n GLN 157 Cb 0.26 -1.63 -0.08 0.00 1.02 0.00 0.00 30.24 29.80 1rw5 n GLN 157 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1rw5 n MET 158 N 0.23 0.61 0.25 -1.09 2.81 0.13 -4.74 117.12 115.33 1rw5 n MET 158 Ca 0.09 -0.12 0.15 0.00 -1.81 0.00 0.00 57.70 56.02 1rw5 n MET 158 Cb 0.49 -2.77 0.52 0.00 -0.71 0.00 0.00 33.22 30.76 1rw5 n MET 158 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1rw5 h ALA 159 N 16.04 1.00 -2.37 3.04 0.00 -1.90 -3.41 119.26 131.66 1rw5 h ALA 159 Ca -0.14 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.20 1rw5 h ALA 159 Cb 1.24 0.00 0.07 0.00 0.00 0.00 0.00 17.79 19.10 1rw5 h ALA 159 CO 1.24 0.00 0.77 -0.25 0.00 0.00 0.00 179.25 181.01 1rw5 n ASP 160 N -3.03 3.14 -0.03 0.00 8.00 -1.26 -4.89 116.55 118.49 1rw5 n ASP 160 Ca 0.02 1.11 -0.13 0.00 0.71 0.00 0.00 54.79 56.49 1rw5 n ASP 160 Cb 0.37 -1.46 -0.09 0.00 -0.02 0.00 0.00 41.12 39.92 1rw5 n ASP 160 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1rw5 h GLU 161 N 5.37 0.11 -0.33 -1.24 5.08 -1.99 -1.35 114.58 120.23 1rw5 h GLU 161 Ca -0.45 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 57.79 1rw5 h GLU 161 Cb 1.25 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1rw5 h GLU 161 CO 0.85 0.54 -0.03 0.93 -1.00 0.00 0.00 179.01 180.30 1rw5 h GLU 162 N -0.31 0.60 -0.55 2.33 5.08 -1.98 -2.91 114.58 116.85 1rw5 h GLU 162 Ca 0.01 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 1rw5 h GLU 162 Cb 0.51 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1rw5 h GLU 162 CO 0.01 0.75 -0.07 0.77 -1.00 0.00 0.00 179.01 179.47 1rw5 h SER 163 N 0.40 1.00 -1.00 1.42 0.02 -1.95 -3.04 113.55 110.40 1rw5 h SER 163 Ca 0.09 -0.33 0.03 0.00 -0.84 0.00 0.00 61.79 60.74 1rw5 h SER 163 Cb 0.49 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.71 1rw5 h SER 163 CO 0.02 1.10 0.65 -0.09 -1.14 0.00 0.00 176.83 177.38 1rw5 h ARG 164 N 0.88 1.24 -0.96 3.45 9.65 -1.19 -1.43 114.38 126.02 1rw5 h ARG 164 Ca 0.15 -0.07 0.06 0.00 -1.10 0.00 0.00 59.98 59.02 1rw5 h ARG 164 Cb 0.63 -0.28 -0.07 0.00 -1.39 0.00 0.00 29.97 28.86 1rw5 h ARG 164 CO 0.04 0.82 0.61 -0.07 2.80 0.00 0.00 179.97 184.17 1rw5 h LEU 165 N 1.28 0.98 -1.22 3.80 3.38 -1.39 0.34 115.31 122.48 1rw5 h LEU 165 Ca 0.39 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.43 1rw5 h LEU 165 Cb -0.02 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 1rw5 h LEU 165 CO -0.12 0.62 0.55 -1.28 0.09 0.00 0.00 178.44 178.30 1rw5 h SER 166 N 1.11 0.85 -0.85 -0.43 0.87 -1.27 0.84 113.55 114.67 1rw5 h SER 166 Ca 0.42 -0.00 0.15 0.00 -1.23 0.00 0.00 61.79 61.12 1rw5 h SER 166 Cb 0.17 -0.19 -0.09 0.00 -0.44 0.00 0.00 62.40 61.85 1rw5 h SER 166 CO -0.17 0.56 0.44 0.00 -0.53 0.00 0.00 176.83 177.13 1rw5 h ALA 167 N 1.53 1.28 0.00 6.23 0.00 0.08 -2.09 119.26 126.29 1rw5 h ALA 167 Ca 0.35 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.27 1rw5 h ALA 167 Cb 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1rw5 h ALA 167 CO -0.12 -0.09 -1.96 0.66 0.00 0.00 0.00 179.25 177.75 1rw5 n TYR 168 N -4.87 0.00 -0.24 0.00 4.01 -0.61 -3.48 117.16 111.97 1rw5 n TYR 168 Ca 0.17 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.85 1rw5 n TYR 168 Cb 0.43 -0.54 0.05 0.00 -0.31 0.00 0.00 39.34 38.97 1rw5 n TYR 168 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 1rw5 h TYR 169 N 0.00 0.91 -0.19 -0.72 3.20 0.90 0.88 116.97 121.94 1rw5 h TYR 169 Ca -0.11 -0.01 -0.21 0.00 3.14 0.00 0.00 58.73 61.55 1rw5 h TYR 169 Cb 1.15 -0.30 0.01 0.00 1.54 0.00 0.00 36.73 39.13 1rw5 h TYR 169 CO 0.00 0.62 -0.70 -0.91 -1.64 0.00 0.00 178.16 175.53 1rw5 h ASN 170 N 0.93 0.92 0.39 -2.11 2.35 -1.57 -1.78 115.58 114.70 1rw5 h ASN 170 Ca 0.24 -0.56 -0.02 0.00 -0.55 0.00 0.00 56.30 55.41 1rw5 h ASN 170 Cb -0.01 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.10 1rw5 h ASN 170 CO -0.04 1.36 -0.19 0.25 -1.65 0.00 0.00 177.43 177.16 1rw5 h LEU 171 N 0.56 -0.44 -1.10 1.61 5.85 -1.47 -1.73 115.31 118.60 1rw5 h LEU 171 Ca -0.03 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1rw5 h LEU 171 Cb 1.32 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.40 1rw5 h LEU 171 CO 0.15 -0.01 0.61 -0.07 -0.34 0.00 0.00 178.44 178.77 1rw5 h LEU 172 N -1.12 0.99 0.10 2.25 3.38 0.63 0.33 115.31 121.87 1rw5 h LEU 172 Ca -0.05 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1rw5 h LEU 172 Cb 0.40 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1rw5 h LEU 172 CO 0.09 0.67 -0.05 -0.74 0.09 0.00 0.00 178.44 178.50 1rw5 h HIS 173 N 1.14 -0.13 -0.33 1.13 2.76 -1.40 -1.95 115.15 116.38 1rw5 h HIS 173 Ca 0.38 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.52 1rw5 h HIS 173 Cb 0.05 0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.04 1rw5 h HIS 173 CO -0.00 0.18 0.11 0.00 -1.30 0.00 0.00 177.93 176.92 1rw5 h LEU 175 N 0.47 0.64 -1.78 0.00 6.46 -0.02 0.30 115.31 121.37 1rw5 h LEU 175 Ca 0.11 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.88 1rw5 h LEU 175 Cb 0.13 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 39.94 1rw5 h LEU 175 CO -0.01 0.43 -0.06 -0.09 -0.62 0.00 0.00 178.44 178.08 1rw5 h ARG 176 N 0.77 0.00 0.01 1.25 2.43 -0.46 -2.03 114.38 116.35 1rw5 h ARG 176 Ca 0.30 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 59.19 1rw5 h ARG 176 Cb 0.12 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 1rw5 h ARG 176 CO -0.15 0.06 -1.49 0.54 -1.51 0.00 0.00 179.97 177.42 1rw5 n ARG 177 N -3.26 0.58 -0.14 0.20 1.74 0.06 -3.79 116.66 112.05 1rw5 n ARG 177 Ca -0.01 0.52 -0.05 0.00 -0.77 0.00 0.00 57.85 57.54 1rw5 n ARG 177 Cb 0.27 -1.71 0.14 0.00 -1.02 0.00 0.00 32.46 30.14 1rw5 n ARG 177 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1rw5 h ASP 178 N -0.94 0.83 -0.15 0.55 3.32 -0.56 -1.73 116.42 117.75 1rw5 h ASP 178 Ca -0.41 -0.19 -0.04 0.00 0.02 0.00 0.00 57.03 56.42 1rw5 h ASP 178 Cb 1.39 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 1rw5 h ASP 178 CO -0.23 0.86 -0.02 0.77 -1.72 0.00 0.00 179.24 178.90 1rw5 h SER 179 N 0.82 0.37 -0.30 6.45 4.64 -1.56 -0.98 113.55 122.99 1rw5 h SER 179 Ca 0.17 -0.06 -0.13 0.00 -0.47 0.00 0.00 61.79 61.29 1rw5 h SER 179 Cb 0.41 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1rw5 h SER 179 CO 0.01 0.45 -0.34 -0.74 -0.87 0.00 0.00 176.83 175.35 1rw5 h HIS 180 N 0.39 0.92 -0.31 4.77 -0.00 -1.51 -1.27 115.15 118.14 1rw5 h HIS 180 Ca 0.09 -0.29 0.03 0.00 -0.00 0.00 0.00 60.37 60.20 1rw5 h HIS 180 Cb 0.29 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 27.48 1rw5 h HIS 180 CO 0.01 1.06 0.14 0.87 -0.00 0.00 0.00 177.93 180.01 1rw5 h LYS 181 N 0.52 0.29 -0.69 5.26 1.57 -0.54 0.87 116.57 123.84 1rw5 h LYS 181 Ca 0.04 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1rw5 h LYS 181 Cb 0.92 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.12 1rw5 h LYS 181 CO 0.08 0.19 0.44 0.82 -0.57 0.00 0.00 179.45 180.42 1rw5 h ILE 182 N 0.30 1.12 -0.57 1.86 2.04 -1.11 -1.39 117.51 119.77 1rw5 h ILE 182 Ca 0.13 -0.30 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 1rw5 h ILE 182 Cb 0.06 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 1rw5 h ILE 182 CO -0.11 0.16 0.03 -0.78 0.00 0.00 0.00 178.15 177.46 1rw5 h ASP 183 N 0.88 0.93 -0.55 1.72 1.82 -0.10 -2.99 116.42 118.13 1rw5 h ASP 183 Ca 0.27 -0.23 0.02 0.00 -0.39 0.00 0.00 57.03 56.69 1rw5 h ASP 183 Cb -0.03 -0.25 -0.03 0.00 0.68 0.00 0.00 39.33 39.70 1rw5 h ASP 183 CO -0.09 0.97 0.34 -1.13 -1.61 0.00 0.00 179.24 177.72 1rw5 h ASN 184 N 0.89 0.57 -0.76 2.28 -0.73 0.18 -2.53 115.58 115.48 1rw5 h ASN 184 Ca 0.17 -0.00 -0.03 0.00 1.87 0.00 0.00 56.30 58.31 1rw5 h ASN 184 Cb 0.48 -0.13 -0.04 0.00 0.27 0.00 0.00 38.32 38.90 1rw5 h ASN 184 CO 0.02 0.41 0.36 1.88 -0.37 0.00 0.00 177.43 179.73 1rw5 h TYR 185 N 0.69 1.11 -0.82 0.67 0.05 -1.24 -2.38 116.97 115.05 1rw5 h TYR 185 Ca 0.21 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.91 1rw5 h TYR 185 Cb -0.02 -0.34 -0.04 0.00 1.01 0.00 0.00 36.73 37.34 1rw5 h TYR 185 CO -0.05 0.81 0.41 -0.07 -1.05 0.00 0.00 178.16 178.20 1rw5 h LEU 186 N 1.10 1.07 -0.61 3.88 -0.00 -1.37 0.28 115.31 119.66 1rw5 h LEU 186 Ca 0.27 -0.13 0.00 0.00 -0.00 0.00 0.00 57.88 58.02 1rw5 h LEU 186 Cb 0.12 -0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 40.48 1rw5 h LEU 186 CO -0.03 0.90 0.38 0.11 -0.00 0.00 0.00 178.44 179.80 1rw5 h LYS 187 N 1.17 0.82 -0.22 1.13 1.57 -1.08 -0.50 116.57 119.46 1rw5 h LYS 187 Ca 0.28 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.92 1rw5 h LYS 187 Cb 0.10 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 1rw5 h LYS 187 CO -0.04 0.57 -0.17 -0.07 -0.57 0.00 0.00 179.45 179.17 1rw5 h LEU 188 N 0.83 0.53 -1.61 2.94 3.38 -1.04 -2.99 115.31 117.35 1rw5 h LEU 188 Ca 0.22 -0.46 0.09 0.00 0.09 0.00 0.00 57.88 57.83 1rw5 h LEU 188 Cb -0.05 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 1rw5 h LEU 188 CO -0.04 0.87 0.41 0.25 0.09 0.00 0.00 178.44 180.02 1rw5 h LEU 189 N 0.19 0.40 -0.50 1.67 5.85 -0.09 -1.87 115.31 120.96 1rw5 h LEU 189 Ca 0.04 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.83 1rw5 h LEU 189 Cb 0.71 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.61 1rw5 h LEU 189 CO 0.05 0.24 0.19 0.50 -0.34 0.00 0.00 178.44 179.08 1rw5 h LYS 190 N 0.45 0.37 -0.14 1.25 3.64 -0.94 0.92 116.57 122.12 1rw5 h LYS 190 Ca 0.28 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.68 1rw5 h LYS 190 Cb 0.51 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1rw5 h LYS 190 CO -0.08 0.25 0.11 0.00 -2.27 0.00 0.00 179.45 177.45 1rw5 n ARG 192 N -4.40 1.10 0.07 0.00 1.74 -0.49 -2.53 116.66 112.14 1rw5 n ARG 192 Ca 0.00 -0.07 -0.09 0.00 -0.77 0.00 0.00 57.85 56.93 1rw5 n ARG 192 Cb 0.23 -1.39 0.03 0.00 -1.02 0.00 0.00 32.46 30.32 1rw5 n ARG 192 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1rw5 h ILE 193 N 0.00 1.41 0.00 0.55 2.10 0.96 -3.35 117.51 119.18 1rw5 h ILE 193 Ca -0.23 -2.26 0.00 0.00 1.08 0.00 0.00 64.86 63.45 1rw5 h ILE 193 Cb 1.42 2.21 0.00 0.00 -1.09 0.00 0.00 36.82 39.36 1rw5 h ILE 193 CO 0.01 0.67 0.00 -0.38 -1.08 0.00 0.00 178.15 177.37 1rw5 n ILE 194 N -3.79 0.00 -2.72 2.19 5.41 -0.87 -4.96 119.36 114.62 1rw5 n ILE 194 Ca -0.04 -0.46 -0.12 0.00 1.00 0.00 0.00 62.75 63.13 1rw5 n ILE 194 Cb 0.73 1.04 0.02 0.00 -0.71 0.00 0.00 39.64 40.72 1rw5 n ILE 194 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 1rw5 n HIS 195 N -0.51 -1.10 -3.92 1.39 -0.00 -1.05 -5.01 115.22 105.03 1rw5 n HIS 195 Ca 0.00 0.31 -0.35 0.00 0.46 0.00 0.00 57.72 58.14 1rw5 n HIS 195 Cb 0.01 -2.87 -0.13 0.00 -0.12 0.00 0.00 29.99 26.88 1rw5 n HIS 195 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1rw5 s ASN 196 N -2.90 4.87 -0.19 0.26 2.47 -1.22 -5.00 114.94 113.23 1rw5 s ASN 196 Ca 0.18 -0.23 -0.29 0.00 0.42 0.00 0.00 52.86 52.94 1rw5 s ASN 196 Cb -0.08 -1.85 -0.04 0.00 -1.45 0.00 0.00 41.25 37.83 1rw5 s ASN 196 CO 0.22 0.01 1.74 0.21 -3.72 0.00 0.00 177.10 175.57 1rw5 s ASN 197 N 1.31 6.26 -0.05 -4.21 3.84 -1.26 -3.88 114.94 116.95 1rw5 s ASN 197 Ca 0.04 1.79 0.02 0.00 0.21 0.00 0.00 52.86 54.92 1rw5 s ASN 197 Cb -0.15 -2.53 0.06 0.00 -0.55 0.00 0.00 41.25 38.09 1rw5 s ASN 197 CO 0.02 -1.33 0.77 -3.20 -2.79 0.00 0.00 177.10 170.56 1rw5 n ASN 198 N 8.78 -0.71 0.00 -4.21 2.85 -1.26 -5.06 115.26 115.64 1rw5 n ASN 198 Ca 0.20 -1.40 0.00 0.00 -0.11 0.00 0.00 54.58 53.27 1rw5 n ASN 198 Cb 0.45 0.25 0.00 0.00 1.24 0.00 0.00 39.78 41.72 1rw5 n ASN 198 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15