#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1idp s GLU 10 N 0.00 1.76 0.76 -0.67 2.02 -1.26 -4.40 118.70 116.91 1idp s GLU 10 Ca 0.00 -1.48 -0.12 0.00 0.02 0.00 0.00 54.97 53.39 1idp s GLU 10 Cb 0.00 -1.95 0.05 0.00 0.10 0.00 0.00 34.13 32.33 1idp s GLU 10 CO 0.00 0.40 1.12 0.96 0.02 0.00 0.00 175.26 177.76 1idp s ILE 11 N -1.86 2.97 0.59 -1.63 -4.36 -1.26 -4.98 121.20 110.68 1idp s ILE 11 Ca 0.24 0.37 -0.03 0.00 -0.26 0.00 0.00 60.65 60.98 1idp s ILE 11 Cb -0.08 -2.81 0.03 0.00 1.25 0.00 0.00 42.46 40.86 1idp s ILE 11 CO 0.13 -0.36 0.86 0.42 0.24 0.00 0.00 174.94 176.24 1idp s THR 12 N -2.58 2.90 0.27 8.37 -4.23 -1.26 -4.97 115.64 114.14 1idp s THR 12 Ca 0.65 -0.39 -0.03 0.00 -1.18 0.00 0.00 61.69 60.74 1idp s THR 12 Cb -0.21 -3.15 0.21 0.00 1.34 0.00 0.00 72.50 70.69 1idp s THR 12 CO 0.51 -0.13 1.88 0.15 -0.54 0.00 0.00 174.62 176.49 1idp h PHE 13 N -0.15 1.03 -0.82 3.99 3.57 -1.99 -1.12 116.94 121.46 1idp h PHE 13 Ca -0.44 -0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.07 1idp h PHE 13 Cb 1.29 -0.33 -0.05 0.00 2.79 0.00 0.00 35.95 39.65 1idp h PHE 13 CO 0.39 0.74 0.52 0.77 -2.23 0.00 0.00 178.31 178.49 1idp h SER 14 N 1.04 0.84 0.15 0.41 0.02 -2.00 -0.69 113.55 113.32 1idp h SER 14 Ca 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1idp h SER 14 Cb 0.07 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1idp h SER 14 CO -0.04 0.57 -0.12 0.44 -1.14 0.00 0.00 176.83 176.54 1idp h ASP 15 N 0.99 -0.31 -0.77 3.07 3.32 -1.79 -2.60 116.42 118.33 1idp h ASP 15 Ca 0.33 0.03 0.16 0.00 0.02 0.00 0.00 57.03 57.57 1idp h ASP 15 Cb 0.05 0.10 -0.10 0.00 0.22 0.00 0.00 39.33 39.60 1idp h ASP 15 CO -0.13 -0.19 0.30 0.22 -1.72 0.00 0.00 179.24 177.72 1idp h TYR 16 N -0.28 0.50 -0.40 4.55 3.20 -0.73 0.22 116.97 124.02 1idp h TYR 16 Ca -0.00 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.93 1idp h TYR 16 Cb 0.26 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1idp h TYR 16 CO -0.11 0.03 0.22 -0.07 -1.64 0.00 0.00 178.16 176.58 1idp h LEU 17 N 0.41 0.34 -0.50 2.82 3.38 -0.89 0.78 115.31 121.65 1idp h LEU 17 Ca 0.44 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.25 1idp h LEU 17 Cb 0.70 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1idp h LEU 17 CO -0.44 0.24 -0.62 1.23 0.09 0.00 0.00 178.44 178.95 1idp h GLY 18 N 0.44 0.51 0.94 0.83 0.00 -0.95 -1.36 103.07 103.48 1idp h GLY 18 Ca 0.17 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 1idp h GLY 18 CO -0.10 0.57 0.15 1.41 0.00 0.00 0.00 176.54 178.57 1idp h LEU 19 N 0.34 0.51 -0.84 3.11 3.38 -0.39 -0.55 115.31 120.87 1idp h LEU 19 Ca -0.01 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1idp h LEU 19 Cb 1.16 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 1idp h LEU 19 CO 0.11 0.53 0.32 0.24 0.09 0.00 0.00 178.44 179.73 1idp h MET 20 N 0.46 1.18 -0.60 1.13 2.86 -0.82 -0.59 114.93 118.55 1idp h MET 20 Ca 0.12 -0.21 0.04 0.00 -2.06 0.00 0.00 59.70 57.59 1idp h MET 20 Cb 0.18 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 1idp h MET 20 CO -0.01 0.95 0.34 1.15 1.06 0.00 0.00 176.91 180.40 1idp h THR 21 N 1.15 1.02 0.35 2.22 2.02 -1.05 -0.45 112.91 118.17 1idp h THR 21 Ca 0.26 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 67.20 1idp h THR 21 Cb 0.21 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1idp h THR 21 CO -0.02 0.12 -0.17 0.00 0.37 0.00 0.00 175.52 175.82 1idp h VAL 23 N -0.56 1.37 -0.29 0.00 3.04 -1.01 -0.43 116.25 118.37 1idp h VAL 23 Ca -0.05 -1.82 -0.04 0.00 -1.01 0.00 0.00 66.70 63.78 1idp h VAL 23 Cb 0.42 1.94 -0.01 0.00 -2.01 0.00 0.00 31.29 31.63 1idp h VAL 23 CO 0.08 0.53 0.02 0.22 -1.01 0.00 0.00 177.57 177.41 1idp h TYR 24 N 0.08 0.54 -0.35 3.17 5.03 -1.04 -1.61 116.97 122.78 1idp h TYR 24 Ca -0.00 -0.08 -0.10 0.00 2.58 0.00 0.00 58.73 61.12 1idp h TYR 24 Cb 0.97 -0.14 -0.02 0.00 1.55 0.00 0.00 36.73 39.09 1idp h TYR 24 CO 0.01 0.62 -0.20 0.93 -1.32 0.00 0.00 178.16 178.20 1idp h GLU 25 N 0.31 0.67 0.32 1.82 4.39 -0.96 0.69 114.58 121.82 1idp h GLU 25 Ca 0.09 -0.25 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 1idp h GLU 25 Cb 0.39 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 1idp h GLU 25 CO 0.01 0.82 -0.30 2.35 -1.16 0.00 0.00 179.01 180.74 1idp h TRP 26 N 0.59 -0.79 -0.40 4.33 7.01 -0.96 -0.18 115.95 125.56 1idp h TRP 26 Ca 0.09 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1idp h TRP 26 Cb 0.66 0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 28.01 1idp h TRP 26 CO 0.03 -0.43 0.22 0.00 -2.79 0.00 0.00 178.44 175.47 1idp h ALA 27 N -0.08 0.51 0.00 2.65 0.00 -1.13 -1.90 119.26 119.31 1idp h ALA 27 Ca -0.02 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1idp h ALA 27 Cb 0.58 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1idp h ALA 27 CO -0.04 0.03 -0.52 0.22 0.00 0.00 0.00 179.25 178.94 1idp h ASP 28 N 0.52 0.00 -0.27 0.00 3.58 -0.83 -1.21 116.42 118.22 1idp h ASP 28 Ca 0.14 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.50 1idp h ASP 28 Cb 0.05 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.09 1idp h ASP 28 CO -0.02 0.52 -0.19 0.28 -2.88 0.00 0.00 179.24 176.95 1idp h SER 29 N 0.00 0.63 -0.26 2.28 0.02 -0.86 -0.03 113.55 115.33 1idp h SER 29 Ca -0.01 -0.44 0.06 0.00 -0.84 0.00 0.00 61.79 60.57 1idp h SER 29 Cb 0.94 -0.17 -0.07 0.00 0.14 0.00 0.00 62.40 63.24 1idp h SER 29 CO 0.07 0.93 -0.20 1.88 -1.14 0.00 0.00 176.83 178.37 1idp h TYR 30 N 0.33 -0.53 -0.09 3.45 -1.99 -1.11 0.78 116.97 117.80 1idp h TYR 30 Ca 0.05 0.04 -0.17 0.00 2.00 0.00 0.00 58.73 60.65 1idp h TYR 30 Cb 0.73 0.27 -0.01 0.00 2.00 0.00 0.00 36.73 39.72 1idp h TYR 30 CO 0.07 -0.28 -0.65 -0.44 -0.00 0.00 0.00 178.16 176.86 1idp h ASP 31 N -0.19 0.42 -0.29 3.88 3.32 -1.03 -2.15 116.42 120.38 1idp h ASP 31 Ca 0.15 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1idp h ASP 31 Cb 0.41 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1idp h ASP 31 CO -0.38 0.96 0.00 -1.54 -1.72 0.00 0.00 179.24 176.56 1idp n SER 32 N -3.87 2.12 -4.00 6.45 3.41 -0.04 -4.75 113.62 112.94 1idp n SER 32 Ca -0.03 -1.86 -0.33 0.00 -0.26 0.00 0.00 58.87 56.40 1idp n SER 32 Cb 0.66 -0.19 -0.01 0.00 -0.26 0.00 0.00 64.21 64.41 1idp n SER 32 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1idp n LYS 33 N 0.63 -3.87 -3.25 4.33 5.02 0.06 -4.90 118.16 116.17 1idp n LYS 33 Ca 0.16 0.45 -0.46 0.00 -2.02 0.00 0.00 58.31 56.44 1idp n LYS 33 Cb 0.38 -5.23 -0.03 0.00 -0.02 0.00 0.00 35.03 30.13 1idp n LYS 33 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1idp s ASP 34 N -3.19 6.66 0.21 4.39 -1.08 -0.00 -4.92 116.67 118.74 1idp s ASP 34 Ca 0.67 -2.44 0.11 0.00 -0.52 0.00 0.00 52.55 50.37 1idp s ASP 34 Cb -0.36 -2.25 -0.01 0.00 -1.46 0.00 0.00 42.92 38.85 1idp s ASP 34 CO 0.83 -0.71 1.39 -0.50 0.52 0.00 0.00 175.17 176.71 1idp h TRP 35 N 8.12 0.00 -0.43 -5.34 -0.00 -1.91 -1.88 115.95 114.52 1idp h TRP 35 Ca 0.06 0.00 -0.14 0.00 -0.00 0.00 0.00 58.89 58.81 1idp h TRP 35 Cb 1.05 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 30.20 1idp h TRP 35 CO 1.02 0.75 -0.27 -0.44 -0.00 0.00 0.00 178.44 179.50 1idp h ASP 36 N 0.00 0.99 -0.67 -3.49 3.32 -1.98 -1.33 116.42 113.26 1idp h ASP 36 Ca -0.01 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1idp h ASP 36 Cb 1.52 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.77 1idp h ASP 36 CO 0.10 1.20 0.43 -0.09 -1.72 0.00 0.00 179.24 179.16 1idp h ARG 37 N 0.78 0.89 -0.49 3.56 2.43 -1.93 -1.57 114.38 118.05 1idp h ARG 37 Ca 0.09 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1idp h ARG 37 Cb 0.86 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1idp h ARG 37 CO 0.08 0.60 0.21 1.25 -1.51 0.00 0.00 179.97 180.59 1idp h LEU 38 N 0.91 0.67 -1.76 3.80 5.85 -1.03 -2.50 115.31 121.25 1idp h LEU 38 Ca 0.24 -0.16 0.15 0.00 0.84 0.00 0.00 57.88 58.95 1idp h LEU 38 Cb -0.08 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.74 1idp h LEU 38 CO -0.05 0.64 0.44 0.03 -0.34 0.00 0.00 178.44 179.17 1idp h ARG 39 N 0.65 0.24 0.00 1.25 3.08 -0.27 -0.96 114.38 118.37 1idp h ARG 39 Ca 0.16 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1idp h ARG 39 Cb 0.17 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1idp h ARG 39 CO -0.02 0.16 0.00 0.87 -1.07 0.00 0.00 179.97 179.91 1idp h LYS 40 N 0.25 0.00 -0.00 0.04 1.57 -0.95 -3.25 116.57 114.23 1idp h LYS 40 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1idp h LYS 40 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1idp h LYS 40 CO -0.07 0.00 -0.03 1.33 -0.57 0.00 0.00 179.45 180.11 1idp n VAL 41 N -3.01 0.00 -3.67 0.50 0.24 -0.38 -5.03 118.33 106.99 1idp n VAL 41 Ca 0.01 -0.48 -0.33 0.00 -2.04 0.00 0.00 64.34 61.49 1idp n VAL 41 Cb 0.29 1.07 -0.05 0.00 -1.47 0.00 0.00 33.84 33.68 1idp n VAL 41 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1idp s ILE 42 N -0.52 5.17 0.99 1.34 -4.36 -1.12 -0.09 121.20 122.62 1idp s ILE 42 Ca 0.04 0.17 -0.12 0.00 -0.26 0.00 0.00 60.65 60.48 1idp s ILE 42 Cb 0.03 -3.62 0.19 0.00 1.25 0.00 0.00 42.46 40.31 1idp s ILE 42 CO 0.07 0.18 1.09 0.00 0.24 0.00 0.00 174.94 176.51 1idp s ALA 43 N -1.51 0.94 0.37 2.27 0.00 -0.01 -4.80 121.76 119.02 1idp s ALA 43 Ca 0.36 -0.25 0.07 0.00 0.00 0.00 0.00 51.96 52.14 1idp s ALA 43 Cb -0.13 -3.15 0.73 0.00 0.00 0.00 0.00 23.12 20.57 1idp s ALA 43 CO 0.21 -2.84 1.92 -1.35 0.00 0.00 0.00 175.76 173.70 1idp h PRO 44 N -1.90 0.39 -4.89 0.00 0.11 -1.94 -3.40 132.00 120.36 1idp h PRO 44 Ca -0.54 -0.08 -0.29 0.00 0.11 0.00 0.00 66.00 65.20 1idp h PRO 44 Cb 1.32 -0.06 -0.15 0.00 0.11 0.00 0.00 31.00 32.22 1idp h PRO 44 CO 0.56 0.44 -0.69 0.95 -0.21 0.00 0.00 178.00 179.04 1idp s THR 45 N -4.92 0.92 -0.02 -1.15 -4.23 -1.26 -0.75 115.64 104.23 1idp s THR 45 Ca -0.07 -2.01 0.02 0.00 -1.18 0.00 0.00 61.69 58.46 1idp s THR 45 Cb 0.16 -1.89 0.00 0.00 1.34 0.00 0.00 72.50 72.11 1idp s THR 45 CO 0.74 -0.70 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.30 1idp s LEU 46 N -3.14 1.79 -0.47 4.79 1.02 0.10 -4.83 118.68 117.94 1idp s LEU 46 Ca 0.18 -0.14 -0.25 0.00 0.02 0.00 0.00 54.13 53.93 1idp s LEU 46 Cb 0.04 -0.42 0.03 0.00 0.02 0.00 0.00 46.19 45.86 1idp s LEU 46 CO 0.00 0.05 0.93 -0.60 0.02 0.00 0.00 176.35 176.75 1idp s ARG 47 N 0.19 3.51 -0.40 1.70 3.52 -0.27 -0.25 118.95 126.95 1idp s ARG 47 Ca -0.02 0.11 -0.05 0.00 -0.13 0.00 0.00 55.73 55.64 1idp s ARG 47 Cb -0.07 -3.94 0.09 0.00 -1.56 0.00 0.00 34.95 29.47 1idp s ARG 47 CO 0.00 -1.25 0.20 0.42 -0.81 0.00 0.00 175.30 173.86 1idp s ILE 48 N 3.78 3.65 -0.46 4.11 -1.09 0.08 -0.94 121.20 130.32 1idp s ILE 48 Ca 0.36 -1.67 -0.07 0.00 -2.23 0.00 0.00 60.65 57.04 1idp s ILE 48 Cb -0.10 -3.32 0.12 0.00 -1.58 0.00 0.00 42.46 37.58 1idp s ILE 48 CO 0.26 -0.52 0.31 -0.62 -1.23 0.00 0.00 174.94 173.13 1idp s ASP 49 N 1.89 5.58 -0.11 3.58 -1.08 -0.29 -1.64 116.67 124.60 1idp s ASP 49 Ca 0.04 -1.97 0.16 0.00 -0.52 0.00 0.00 52.55 50.26 1idp s ASP 49 Cb -0.23 -1.96 0.56 0.00 -1.46 0.00 0.00 42.92 39.83 1idp s ASP 49 CO -0.01 -0.65 1.47 -1.22 0.52 0.00 0.00 175.17 175.29 1idp n TYR 50 N 4.79 1.08 -0.21 -5.34 4.01 -0.14 -3.94 117.16 117.42 1idp n TYR 50 Ca -0.06 -0.67 0.18 0.00 -0.16 0.00 0.00 57.90 57.19 1idp n TYR 50 Cb 0.41 -0.22 0.51 0.00 -0.31 0.00 0.00 39.34 39.73 1idp n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1idp h ARG 51 N 2.82 0.39 -0.60 -0.72 3.08 -1.83 0.25 114.38 117.77 1idp h ARG 51 Ca 0.00 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.12 1idp h ARG 51 Cb 1.29 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 31.18 1idp h ARG 51 CO 0.18 0.26 0.22 0.66 -1.07 0.00 0.00 179.97 180.22 1idp h SER 52 N 0.40 0.22 0.00 7.04 4.64 -1.90 -2.36 113.55 121.58 1idp h SER 52 Ca 0.42 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 1idp h SER 52 Cb 1.04 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1idp h SER 52 CO -0.14 0.13 -0.47 2.22 -0.87 0.00 0.00 176.83 177.70 1idp n PHE 53 N -5.00 0.00 -0.25 4.77 1.16 -0.06 -4.71 117.46 113.36 1idp n PHE 53 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.67 1idp n PHE 53 Cb 0.27 -0.02 0.00 0.00 -1.61 0.00 0.00 39.48 38.12 1idp n PHE 53 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1idp n LEU 54 N -1.25 0.24 -3.87 5.98 4.77 0.68 -5.01 117.00 118.54 1idp n LEU 54 Ca 0.01 -0.36 -0.29 0.00 -0.03 0.00 0.00 56.01 55.33 1idp n LEU 54 Cb 0.12 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.24 1idp n LEU 54 CO 0.14 0.06 0.13 -0.67 -1.33 0.00 0.00 177.39 175.72 1idp n ASP 55 N -0.25 -5.10 -3.91 -1.43 4.64 -0.89 -4.93 116.55 104.69 1idp n ASP 55 Ca 0.00 -0.74 -0.19 0.00 -1.38 0.00 0.00 54.79 52.48 1idp n ASP 55 Cb 0.06 -4.06 -0.16 0.00 -1.04 0.00 0.00 41.12 35.93 1idp n ASP 55 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1idp s LYS 56 N -6.58 0.75 -0.06 -0.67 1.02 -1.26 -4.90 119.74 108.04 1idp s LYS 56 Ca 0.66 -0.12 -0.00 0.00 0.02 0.00 0.00 55.97 56.53 1idp s LYS 56 Cb -0.32 -0.76 0.02 0.00 -0.52 0.00 0.00 37.83 36.25 1idp s LYS 56 CO 0.81 -0.04 -0.03 -1.17 -0.92 0.00 0.00 175.35 174.01 1idp s LEU 57 N 0.70 1.02 -0.25 3.17 2.96 -1.26 -0.97 118.68 124.06 1idp s LEU 57 Ca -0.09 -0.13 -0.05 0.00 -0.22 0.00 0.00 54.13 53.64 1idp s LEU 57 Cb -0.12 -0.49 -0.00 0.00 0.50 0.00 0.00 46.19 46.07 1idp s LEU 57 CO 0.00 -0.12 0.01 0.26 -1.32 0.00 0.00 176.35 175.18 1idp s TRP 58 N 1.42 3.04 -0.00 5.38 0.51 -0.65 -5.00 118.94 123.64 1idp s TRP 58 Ca -0.03 -0.95 0.15 0.00 -2.12 0.00 0.00 56.10 53.15 1idp s TRP 58 Cb -0.13 -2.16 0.21 0.00 -0.81 0.00 0.00 33.47 30.57 1idp s TRP 58 CO -0.03 -0.55 1.51 0.93 -0.51 0.00 0.00 176.95 178.30 1idp h GLU 59 N 8.15 0.00 -0.68 4.98 5.08 -1.86 0.25 114.58 130.50 1idp h GLU 59 Ca -0.37 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.67 1idp h GLU 59 Cb 1.15 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.15 1idp h GLU 59 CO 0.60 0.56 -0.71 0.00 -1.00 0.00 0.00 179.01 178.45 1idp n ALA 60 N -2.27 0.49 -1.78 3.43 0.00 -1.20 -3.70 120.51 115.47 1idp n ALA 60 Ca 0.01 -2.14 -0.42 0.00 0.00 0.00 0.00 53.44 50.89 1idp n ALA 60 Cb 0.70 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 19.06 1idp n ALA 60 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1idp s MET 61 N -0.76 4.16 0.39 0.00 1.75 0.65 -4.55 119.30 120.94 1idp s MET 61 Ca 0.28 2.51 -0.27 0.00 -1.25 0.00 0.00 55.69 56.96 1idp s MET 61 Cb 0.33 -3.60 -0.11 0.00 2.84 0.00 0.00 34.83 34.29 1idp s MET 61 CO -0.06 -0.81 1.33 -2.30 -0.65 0.00 0.00 175.02 172.54 1idp n PRO 62 N 5.66 2.16 -0.24 4.11 -0.02 -1.26 0.03 135.00 145.44 1idp n PRO 62 Ca 0.17 0.76 -0.03 0.00 -2.02 0.00 0.00 63.50 62.38 1idp n PRO 62 Cb 0.39 -2.45 0.03 0.00 -0.02 0.00 0.00 33.50 31.45 1idp n PRO 62 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1idp h ALA 63 N 2.40 0.13 -0.51 3.55 0.00 -1.15 -0.03 119.26 123.65 1idp h ALA 63 Ca -0.48 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1idp h ALA 63 Cb 1.28 0.74 -0.03 0.00 0.00 0.00 0.00 17.79 19.79 1idp h ALA 63 CO 0.61 -0.60 0.31 0.93 0.00 0.00 0.00 179.25 180.51 1idp h GLU 64 N -0.10 0.68 -0.07 0.00 4.39 -1.91 0.34 114.58 117.91 1idp h GLU 64 Ca 0.28 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 59.77 1idp h GLU 64 Cb 0.55 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1idp h GLU 64 CO -0.73 0.48 -0.66 1.49 -1.16 0.00 0.00 179.01 178.42 1idp h GLU 65 N 0.70 0.29 -0.14 2.33 4.81 -1.50 -0.32 114.58 120.74 1idp h GLU 65 Ca 0.19 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1idp h GLU 65 Cb -0.04 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1idp h GLU 65 CO -0.04 0.85 0.03 0.35 -0.73 0.00 0.00 179.01 179.47 1idp h PHE 66 N 0.20 0.24 -0.72 0.92 3.57 0.22 -0.54 116.94 120.83 1idp h PHE 66 Ca -0.02 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 1idp h PHE 66 Cb 1.20 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.84 1idp h PHE 66 CO 0.03 0.39 0.32 0.28 -2.23 0.00 0.00 178.31 177.10 1idp h VAL 67 N 0.02 1.23 -0.68 1.41 2.07 -0.91 -0.95 116.25 118.44 1idp h VAL 67 Ca 0.04 -0.69 0.07 0.00 0.82 0.00 0.00 66.70 66.95 1idp h VAL 67 Cb 0.28 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 1idp h VAL 67 CO 0.00 0.29 0.36 1.23 0.02 0.00 0.00 177.57 179.47 1idp h GLY 68 N 1.09 1.01 0.72 2.17 0.00 -0.91 -1.18 103.07 105.96 1idp h GLY 68 Ca 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 1idp h GLY 68 CO -0.03 0.11 -0.10 1.98 0.00 0.00 0.00 176.54 178.50 1idp h MET 69 N 0.64 -0.27 -0.23 4.80 -1.53 -0.08 -2.42 114.93 115.83 1idp h MET 69 Ca 0.32 0.02 -0.09 0.00 -3.44 0.00 0.00 59.70 56.51 1idp h MET 69 Cb 0.26 0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 31.36 1idp h MET 69 CO -0.22 0.02 -0.23 0.28 0.14 0.00 0.00 176.91 176.90 1idp h VAL 70 N -0.57 1.25 -0.01 -5.77 2.07 -1.13 -3.05 116.25 109.05 1idp h VAL 70 Ca -0.03 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.30 1idp h VAL 70 Cb 0.42 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1idp h VAL 70 CO 0.05 0.38 -0.16 -1.54 0.02 0.00 0.00 177.57 176.31 1idp n SER 71 N -4.14 0.97 -4.75 0.57 3.41 -0.45 -0.54 113.62 108.68 1idp n SER 71 Ca -0.00 -0.95 -0.37 0.00 -0.26 0.00 0.00 58.87 57.29 1idp n SER 71 Cb 0.38 0.06 0.03 0.00 -0.26 0.00 0.00 64.21 64.42 1idp n SER 71 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1idp s SER 72 N -2.38 5.33 0.25 4.04 1.04 -0.92 -3.32 113.70 117.75 1idp s SER 72 Ca 0.29 2.47 0.20 0.00 0.48 0.00 0.00 55.95 59.39 1idp s SER 72 Cb 0.20 -2.61 0.97 0.00 0.10 0.00 0.00 66.02 64.68 1idp s SER 72 CO 0.47 -1.50 1.61 0.29 0.98 0.00 0.00 173.24 175.08 1idp n LYS 73 N -1.31 0.14 0.07 4.02 5.02 -1.26 -0.82 118.16 124.01 1idp n LYS 73 Ca 0.12 0.52 0.13 0.00 -2.02 0.00 0.00 58.31 57.06 1idp n LYS 73 Cb 0.48 -1.86 0.48 0.00 -0.02 0.00 0.00 35.03 34.12 1idp n LYS 73 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1idp n GLN 74 N -2.14 0.16 0.00 1.97 3.00 -1.26 -3.89 117.38 115.22 1idp n GLN 74 Ca 0.00 0.15 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1idp n GLN 74 Cb 0.11 -1.69 0.00 0.00 0.00 0.00 0.00 30.24 28.66 1idp n GLN 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1idp n VAL 75 N -1.96 0.00 0.00 5.09 0.31 -0.00 -5.01 118.33 116.76 1idp n VAL 75 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1idp n VAL 75 Cb 0.38 -0.17 0.00 0.00 -0.91 0.00 0.00 33.84 33.14 1idp n VAL 75 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1idp n LEU 76 N -0.27 0.95 -0.00 7.52 4.77 0.30 -4.67 117.00 125.60 1idp n LEU 76 Ca 0.00 -0.97 0.14 0.00 -0.03 0.00 0.00 56.01 55.15 1idp n LEU 76 Cb 0.00 0.00 0.66 0.00 -2.33 0.00 0.00 43.42 41.75 1idp n LEU 76 CO 0.00 0.24 0.97 0.61 -1.33 0.00 0.00 177.39 177.87 1idp n GLY 77 N 0.07 -1.41 3.67 -0.72 0.00 -0.52 -4.82 105.19 101.45 1idp n GLY 77 Ca 0.00 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 1idp n GLY 77 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1idp s ASP 78 N -2.85 6.63 0.25 1.61 -1.08 -1.25 -4.64 116.67 115.33 1idp s ASP 78 Ca 0.19 2.34 0.23 0.00 -0.52 0.00 0.00 52.55 54.79 1idp s ASP 78 Cb 0.19 -2.54 0.97 0.00 -1.46 0.00 0.00 42.92 40.08 1idp s ASP 78 CO 0.51 -0.93 1.70 -0.81 0.52 0.00 0.00 175.17 176.16 1idp n PRO 79 N 6.87 0.19 0.00 4.34 -0.04 -1.26 -1.47 135.00 143.62 1idp n PRO 79 Ca 0.17 0.42 0.14 0.00 -0.04 0.00 0.00 63.50 64.19 1idp n PRO 79 Cb 0.42 -1.86 0.51 0.00 -0.04 0.00 0.00 33.50 32.54 1idp n PRO 79 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1idp n THR 80 N -2.21 0.00 -3.64 0.52 -2.24 -1.26 -4.83 114.28 100.62 1idp n THR 80 Ca 0.02 -0.14 -0.36 0.00 -2.27 0.00 0.00 64.05 61.30 1idp n THR 80 Cb 0.23 0.26 -0.08 0.00 -2.10 0.00 0.00 70.33 68.64 1idp n THR 80 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1idp s LEU 81 N -2.31 4.19 -0.06 3.22 2.96 -0.54 -0.76 118.68 125.37 1idp s LEU 81 Ca 0.31 0.28 0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1idp s LEU 81 Cb 0.20 -2.19 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 1idp s LEU 81 CO 0.44 0.11 -0.12 -0.13 -1.32 0.00 0.00 176.35 175.34 1idp s ARG 82 N 0.63 2.67 0.07 1.98 1.81 0.37 -4.93 118.95 121.55 1idp s ARG 82 Ca 0.11 -0.65 0.01 0.00 -1.72 0.00 0.00 55.73 53.48 1idp s ARG 82 Cb -0.12 -2.47 -0.04 0.00 -0.45 0.00 0.00 34.95 31.87 1idp s ARG 82 CO 0.02 0.60 -0.05 0.95 -0.68 0.00 0.00 175.30 176.13 1idp s THR 83 N -0.65 0.50 -0.11 0.02 -4.23 -1.26 -1.12 115.64 108.78 1idp s THR 83 Ca 0.10 -1.71 -0.02 0.00 -1.18 0.00 0.00 61.69 58.88 1idp s THR 83 Cb -0.11 -1.38 0.04 0.00 1.34 0.00 0.00 72.50 72.38 1idp s THR 83 CO 0.01 -0.81 0.00 -1.58 -0.54 0.00 0.00 174.62 171.70 1idp s GLN 84 N -3.37 0.71 -1.24 3.99 0.74 -0.52 -4.79 119.66 115.19 1idp s GLN 84 Ca 0.05 -0.09 -0.13 0.00 0.05 0.00 0.00 55.36 55.24 1idp s GLN 84 Cb 0.03 -1.39 0.16 0.00 1.10 0.00 0.00 33.01 32.91 1idp s GLN 84 CO -0.05 -0.40 1.56 0.72 -0.55 0.00 0.00 175.29 176.56 1idp n HIS 85 N 5.10 4.53 -2.55 1.67 8.25 -1.26 -3.33 115.22 127.63 1idp n HIS 85 Ca -0.08 -3.20 -0.43 0.00 -0.26 0.00 0.00 57.72 53.75 1idp n HIS 85 Cb 0.49 -2.18 -0.02 0.00 1.12 0.00 0.00 29.99 29.40 1idp n HIS 85 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1idp s PHE 86 N 1.56 2.97 -0.23 4.41 5.36 0.15 -4.86 117.98 127.33 1idp s PHE 86 Ca 0.43 1.07 -0.20 0.00 -0.96 0.00 0.00 56.93 57.27 1idp s PHE 86 Cb 0.00 -3.75 -0.02 0.00 -0.34 0.00 0.00 43.02 38.91 1idp s PHE 86 CO 0.01 -1.16 0.60 0.42 -1.46 0.00 0.00 175.22 173.62 1idp s ILE 87 N 3.88 5.02 0.00 3.12 1.01 -1.26 -1.63 121.20 131.34 1idp s ILE 87 Ca 0.50 1.08 0.00 0.00 0.00 0.00 0.00 60.65 62.23 1idp s ILE 87 Cb -0.14 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.42 1idp s ILE 87 CO 0.18 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.80 1idp n GLY 88 N 4.07 1.36 3.74 6.18 0.00 -0.04 -5.02 105.19 115.48 1idp n GLY 88 Ca -0.02 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 1idp n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1idp n GLY 89 N 5.00 1.11 2.91 -0.02 0.00 -1.26 -4.56 105.19 108.36 1idp n GLY 89 Ca 0.00 0.40 -0.19 0.00 0.00 0.00 0.00 46.02 46.23 1idp n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1idp s THR 90 N -0.48 0.51 0.30 2.61 2.01 -1.26 -0.97 115.64 118.37 1idp s THR 90 Ca 0.60 -0.14 0.09 0.00 0.31 0.00 0.00 61.69 62.55 1idp s THR 90 Cb -0.52 -0.52 -0.06 0.00 0.01 0.00 0.00 72.50 71.41 1idp s THR 90 CO 0.55 0.20 -0.12 0.00 -0.69 0.00 0.00 174.62 174.57 1idp s ARG 91 N 0.70 1.68 0.14 4.92 1.70 -0.73 -4.99 118.95 122.38 1idp s ARG 91 Ca -0.09 -1.83 0.07 0.00 -0.47 0.00 0.00 55.73 53.41 1idp s ARG 91 Cb -0.12 -1.54 -0.04 0.00 -0.57 0.00 0.00 34.95 32.68 1idp s ARG 91 CO 0.00 0.16 -0.15 -1.58 -1.08 0.00 0.00 175.30 172.65 1idp s TRP 92 N -2.72 1.56 -0.03 5.89 0.52 -1.26 -1.07 118.94 121.82 1idp s TRP 92 Ca 0.30 -0.54 -0.01 0.00 0.02 0.00 0.00 56.10 55.87 1idp s TRP 92 Cb 0.01 -0.79 0.03 0.00 -1.15 0.00 0.00 33.47 31.57 1idp s TRP 92 CO 0.14 0.22 0.05 -1.21 0.02 0.00 0.00 176.95 176.17 1idp s GLU 93 N -2.82 -0.06 -0.21 4.98 2.02 -0.38 -5.01 118.70 117.22 1idp s GLU 93 Ca 0.12 0.32 -0.29 0.00 0.02 0.00 0.00 54.97 55.14 1idp s GLU 93 Cb -0.05 -0.40 0.00 0.00 0.10 0.00 0.00 34.13 33.79 1idp s GLU 93 CO 0.04 -0.27 1.13 0.21 0.02 0.00 0.00 175.26 176.40 1idp s LYS 94 N 1.76 4.23 -0.15 1.61 2.20 -1.26 -1.08 119.74 127.05 1idp s LYS 94 Ca -0.00 1.46 -0.15 0.00 -0.36 0.00 0.00 55.97 56.91 1idp s LYS 94 Cb -0.12 -3.70 -0.24 0.00 -1.51 0.00 0.00 37.83 32.26 1idp s LYS 94 CO -0.03 -0.68 0.37 0.28 -0.36 0.00 0.00 175.35 174.92 1idp h VAL 95 N 5.49 0.86 -2.67 4.02 2.07 -1.41 -3.47 116.25 121.15 1idp h VAL 95 Ca -0.22 -2.30 -0.04 0.00 0.82 0.00 0.00 66.70 64.97 1idp h VAL 95 Cb 1.08 2.47 -0.00 0.00 -1.52 0.00 0.00 31.29 33.32 1idp h VAL 95 CO 0.98 0.62 0.13 -1.54 0.02 0.00 0.00 177.57 177.79 1idp n SER 96 N -3.97 -1.29 0.30 0.57 3.41 -0.76 -4.96 113.62 106.91 1idp n SER 96 Ca -0.30 -1.97 0.20 0.00 -0.26 0.00 0.00 58.87 56.54 1idp n SER 96 Cb 0.86 2.18 0.92 0.00 -0.26 0.00 0.00 64.21 67.91 1idp n SER 96 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1idp h GLU 97 N 0.00 0.00 0.00 4.33 4.39 -2.03 -3.06 114.58 118.21 1idp h GLU 97 Ca -0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.51 1idp h GLU 97 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1idp h GLU 97 CO 0.25 0.01 -0.01 -0.40 -1.16 0.00 0.00 179.01 177.69 1idp n ASP 98 N -3.11 1.46 -3.89 1.42 5.75 -1.26 -4.91 116.55 112.01 1idp n ASP 98 Ca -0.01 -1.81 -0.19 0.00 -0.01 0.00 0.00 54.79 52.77 1idp n ASP 98 Cb 0.20 -0.03 -0.16 0.00 -1.03 0.00 0.00 41.12 40.10 1idp n ASP 98 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1idp s GLU 99 N -0.84 0.74 0.03 0.11 2.12 -1.16 -0.59 118.70 119.11 1idp s GLU 99 Ca 0.02 -0.10 0.04 0.00 0.36 0.00 0.00 54.97 55.29 1idp s GLU 99 Cb 0.02 -0.76 -0.02 0.00 0.26 0.00 0.00 34.13 33.63 1idp s GLU 99 CO 0.00 -0.06 -0.11 0.08 -0.54 0.00 0.00 175.26 174.63 1idp s VAL 100 N 0.81 0.88 -0.09 3.70 1.01 -0.47 -0.96 120.40 125.28 1idp s VAL 100 Ca -0.10 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 1idp s VAL 100 Cb -0.13 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 1idp s VAL 100 CO 0.00 -0.00 -0.04 0.27 0.00 0.00 0.00 175.10 175.33 1idp s ILE 101 N -0.73 3.94 -0.14 2.22 -4.36 -0.24 -0.65 121.20 121.24 1idp s ILE 101 Ca 0.00 -0.38 -0.02 0.00 -0.26 0.00 0.00 60.65 59.99 1idp s ILE 101 Cb -0.07 -2.64 -0.02 0.00 1.25 0.00 0.00 42.46 40.98 1idp s ILE 101 CO 0.01 0.59 -0.09 -0.83 0.24 0.00 0.00 174.94 174.85 1idp s GLY 102 N -0.66 1.62 -0.32 6.27 0.00 -0.48 -1.25 107.32 112.51 1idp s GLY 102 Ca 0.10 -0.86 -0.16 0.00 0.00 0.00 0.00 44.72 43.81 1idp s GLY 102 CO 0.02 -0.17 0.39 -0.19 0.00 0.00 0.00 173.10 173.16 1idp s TYR 103 N 0.29 3.21 -0.13 1.90 2.02 -0.23 -0.72 117.35 123.69 1idp s TYR 103 Ca -0.07 0.16 0.03 0.00 -0.37 0.00 0.00 57.07 56.82 1idp s TYR 103 Cb -0.15 -2.69 0.01 0.00 -0.40 0.00 0.00 41.96 38.73 1idp s TYR 103 CO 0.04 -0.39 -0.21 -1.01 -1.57 0.00 0.00 175.55 172.41 1idp s HIS 104 N 2.11 2.58 0.25 2.71 3.76 0.14 -1.77 115.29 125.06 1idp s HIS 104 Ca 0.14 -1.27 -0.31 0.00 -0.15 0.00 0.00 55.06 53.47 1idp s HIS 104 Cb -0.16 -1.76 -0.11 0.00 1.11 0.00 0.00 32.58 31.66 1idp s HIS 104 CO 0.11 -0.58 1.61 -0.65 -0.85 0.00 0.00 174.74 174.38 1idp s GLN 105 N 0.79 4.15 -0.05 1.40 -0.21 -0.14 -0.76 119.66 124.84 1idp s GLN 105 Ca -0.08 2.53 0.01 0.00 0.02 0.00 0.00 55.36 57.84 1idp s GLN 105 Cb -0.16 -3.07 0.02 0.00 1.00 0.00 0.00 33.01 30.81 1idp s GLN 105 CO -0.01 -0.64 -0.08 -1.17 -2.12 0.00 0.00 175.29 171.27 1idp s LEU 106 N 0.23 1.45 -0.11 2.90 2.96 -0.37 -0.87 118.68 124.88 1idp s LEU 106 Ca 0.67 -0.20 0.04 0.00 -0.22 0.00 0.00 54.13 54.42 1idp s LEU 106 Cb -0.47 -0.61 0.00 0.00 0.50 0.00 0.00 46.19 45.61 1idp s LEU 106 CO 0.40 -0.02 -0.23 -0.60 -1.32 0.00 0.00 176.35 174.58 1idp s ARG 107 N 0.84 3.02 -0.71 1.98 3.52 -0.64 -0.96 118.95 125.99 1idp s ARG 107 Ca -0.12 -0.87 0.02 0.00 -0.13 0.00 0.00 55.73 54.63 1idp s ARG 107 Cb -0.15 -2.31 0.17 0.00 -1.56 0.00 0.00 34.95 31.11 1idp s ARG 107 CO 0.01 0.14 0.52 0.08 -0.81 0.00 0.00 175.30 175.24 1idp s VAL 108 N 0.43 3.32 0.31 7.11 1.01 0.13 -0.68 120.40 132.02 1idp s VAL 108 Ca -0.17 -3.85 -0.29 0.00 0.00 0.00 0.00 61.98 57.67 1idp s VAL 108 Cb -0.18 -3.15 -0.12 0.00 0.00 0.00 0.00 36.38 32.93 1idp s VAL 108 CO 0.07 -0.97 1.41 -0.81 0.00 0.00 0.00 175.10 174.80 1idp n PRO 109 N 2.45 2.29 -3.88 2.72 -0.04 -1.21 -1.90 135.00 135.43 1idp n PRO 109 Ca 0.16 0.81 -0.09 0.00 -0.04 0.00 0.00 63.50 64.34 1idp n PRO 109 Cb 0.35 -2.47 -0.05 0.00 -0.04 0.00 0.00 33.50 31.29 1idp n PRO 109 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1idp s HIS 110 N -0.58 0.18 -0.15 0.54 -3.43 -0.20 -1.44 115.29 110.21 1idp s HIS 110 Ca 0.60 -0.54 -0.12 0.00 -0.80 0.00 0.00 55.06 54.21 1idp s HIS 110 Cb -0.56 0.18 0.04 0.00 -1.43 0.00 0.00 32.58 30.81 1idp s HIS 110 CO 0.56 -0.86 0.38 -1.14 -2.00 0.00 0.00 174.74 171.68 1idp s GLN 111 N -3.94 0.42 -0.07 -0.38 0.74 -0.27 -1.55 119.66 114.61 1idp s GLN 111 Ca 0.15 0.61 0.04 0.00 0.05 0.00 0.00 55.36 56.21 1idp s GLN 111 Cb 0.01 0.13 -0.02 0.00 1.10 0.00 0.00 33.01 34.23 1idp s GLN 111 CO 0.01 -0.09 -0.18 1.03 -0.55 0.00 0.00 175.29 175.50 1idp s ARG 112 N 0.62 2.68 0.21 1.67 0.52 0.24 -0.48 118.95 124.41 1idp s ARG 112 Ca -0.03 -0.78 -0.03 0.00 -0.52 0.00 0.00 55.73 54.37 1idp s ARG 112 Cb -0.05 -2.34 -0.05 0.00 0.52 0.00 0.00 34.95 33.04 1idp s ARG 112 CO -0.04 0.45 0.43 0.71 0.02 0.00 0.00 175.30 176.87 1idp s TYR 113 N -0.30 3.48 0.25 -0.53 1.51 0.06 -0.04 117.35 121.78 1idp s TYR 113 Ca 0.02 0.49 -0.05 0.00 -1.01 0.00 0.00 57.07 56.52 1idp s TYR 113 Cb -0.13 -1.97 0.32 0.00 -0.11 0.00 0.00 41.96 40.07 1idp s TYR 113 CO 0.03 0.34 1.91 -0.22 -1.11 0.00 0.00 175.55 176.49 1idp h LYS 114 N 2.17 1.22 0.00 -0.62 3.64 -0.68 -3.43 116.57 118.87 1idp h LYS 114 Ca -0.47 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 58.76 1idp h LYS 114 Cb 1.18 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1idp h LYS 114 CO 0.69 0.81 0.05 -0.40 -2.27 0.00 0.00 179.45 178.33 1idp n ASP 115 N -4.45 -1.05 0.00 4.20 3.85 -1.26 -5.04 116.55 112.80 1idp n ASP 115 Ca 0.13 -1.95 0.02 0.00 -0.71 0.00 0.00 54.79 52.28 1idp n ASP 115 Cb 0.09 1.81 0.12 0.00 -1.35 0.00 0.00 41.12 41.79 1idp n ASP 115 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1idp n THR 116 N -0.30 0.00 0.46 2.12 -2.24 -1.26 -1.57 114.28 111.49 1idp n THR 116 Ca -0.03 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.88 1idp n THR 116 Cb 0.33 -0.17 0.42 0.00 -2.10 0.00 0.00 70.33 68.81 1idp n THR 116 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1idp h THR 117 N 0.00 0.00 -5.14 4.28 1.35 -1.99 -3.47 112.91 107.94 1idp h THR 117 Ca 0.00 -0.50 -0.41 0.00 -0.55 0.00 0.00 66.41 64.95 1idp h THR 117 Cb 0.00 1.43 0.03 0.00 -1.73 0.00 0.00 68.15 67.88 1idp h THR 117 CO 0.00 0.00 -0.63 0.23 -0.25 0.00 0.00 175.52 174.87 1idp n MET 118 N -2.48 -5.15 -0.01 4.72 2.81 -0.61 -4.88 117.12 111.52 1idp n MET 118 Ca 0.04 0.76 0.05 0.00 -1.81 0.00 0.00 57.70 56.74 1idp n MET 118 Cb 0.38 -5.63 -0.09 0.00 -0.71 0.00 0.00 33.22 27.17 1idp n MET 118 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1idp n LYS 119 N -4.21 0.51 -4.01 0.03 5.02 -1.26 -4.95 118.16 109.29 1idp n LYS 119 Ca -0.05 -0.09 -0.25 0.00 -2.02 0.00 0.00 58.31 55.89 1idp n LYS 119 Cb 0.58 -1.27 -0.17 0.00 -0.02 0.00 0.00 35.03 34.15 1idp n LYS 119 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1idp s GLU 120 N -2.74 1.33 -0.20 1.97 2.02 -1.26 -5.06 118.70 114.76 1idp s GLU 120 Ca -0.04 -0.20 -0.27 0.00 0.02 0.00 0.00 54.97 54.48 1idp s GLU 120 Cb 0.07 -1.38 -0.00 0.00 0.10 0.00 0.00 34.13 32.91 1idp s GLU 120 CO 0.47 -0.21 0.94 0.08 0.02 0.00 0.00 175.26 176.55 1idp s VAL 121 N 1.52 4.78 -0.07 2.63 1.01 -1.26 0.09 120.40 129.10 1idp s VAL 121 Ca 0.01 1.84 0.14 0.00 0.00 0.00 0.00 61.98 63.96 1idp s VAL 121 Cb -0.13 -4.23 -0.21 0.00 0.00 0.00 0.00 36.38 31.81 1idp s VAL 121 CO -0.05 -0.08 0.69 0.35 0.00 0.00 0.00 175.10 176.01 1idp n THR 122 N 5.04 1.49 -3.64 3.92 -2.24 0.95 -4.86 114.28 114.94 1idp n THR 122 Ca 0.08 -0.77 -0.15 0.00 -2.27 0.00 0.00 64.05 60.94 1idp n THR 122 Cb 0.47 -0.95 -0.08 0.00 -2.10 0.00 0.00 70.33 67.68 1idp n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1idp s MET 123 N -2.68 0.81 0.19 -0.78 0.23 -1.15 -4.99 119.30 110.92 1idp s MET 123 Ca -0.04 0.30 0.08 0.00 -1.03 0.00 0.00 55.69 54.99 1idp s MET 123 Cb 0.08 0.38 -0.04 0.00 -1.53 0.00 0.00 34.83 33.72 1idp s MET 123 CO 0.82 -0.20 -0.16 0.15 -2.03 0.00 0.00 175.02 173.60 1idp s LYS 124 N -0.74 1.29 -0.09 3.16 1.02 -1.26 -0.59 119.74 122.53 1idp s LYS 124 Ca -0.08 -1.50 -0.31 0.00 0.02 0.00 0.00 55.97 54.10 1idp s LYS 124 Cb -0.03 -1.19 0.10 0.00 -0.52 0.00 0.00 37.83 36.19 1idp s LYS 124 CO 0.05 0.22 1.37 0.41 -0.92 0.00 0.00 175.35 176.48 1idp n GLY 125 N -0.09 0.08 2.81 -3.33 0.00 -0.59 -4.99 105.19 99.08 1idp n GLY 125 Ca -0.10 -1.01 -0.15 0.00 0.00 0.00 0.00 46.02 44.75 1idp n GLY 125 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1idp s HIS 126 N -2.00 0.14 -0.16 1.61 3.76 0.16 -1.04 115.29 117.76 1idp s HIS 126 Ca 0.33 0.06 -0.08 0.00 -0.15 0.00 0.00 55.06 55.21 1idp s HIS 126 Cb -0.00 -0.27 -0.04 0.00 1.11 0.00 0.00 32.58 33.38 1idp s HIS 126 CO -0.03 -0.09 0.12 0.00 -0.85 0.00 0.00 174.74 173.90 1idp s ALA 127 N 0.84 3.73 -0.18 -1.40 0.00 -0.80 -0.90 121.76 123.05 1idp s ALA 127 Ca -0.08 -0.68 -0.02 0.00 0.00 0.00 0.00 51.96 51.19 1idp s ALA 127 Cb -0.11 -2.03 -0.01 0.00 0.00 0.00 0.00 23.12 20.97 1idp s ALA 127 CO -0.02 0.38 -0.10 -1.01 0.00 0.00 0.00 175.76 175.01 1idp s HIS 128 N -0.30 2.88 0.01 0.00 3.76 -0.85 -0.70 115.29 120.10 1idp s HIS 128 Ca 0.11 -0.90 -0.01 0.00 -0.15 0.00 0.00 55.06 54.11 1idp s HIS 128 Cb -0.12 -1.97 -0.01 0.00 1.11 0.00 0.00 32.58 31.59 1idp s HIS 128 CO 0.01 -0.44 0.00 0.45 -0.85 0.00 0.00 174.74 173.92 1idp s SER 129 N 0.98 0.16 -0.49 1.40 0.15 -0.14 0.31 113.70 116.07 1idp s SER 129 Ca -0.01 -0.36 -0.16 0.00 0.70 0.00 0.00 55.95 56.12 1idp s SER 129 Cb -0.15 0.10 0.09 0.00 -1.71 0.00 0.00 66.02 64.36 1idp s SER 129 CO -0.01 -0.26 0.43 0.00 1.20 0.00 0.00 173.24 174.60 1idp s ALA 130 N -1.18 3.59 -0.30 5.45 0.00 -0.34 -1.23 121.76 127.74 1idp s ALA 130 Ca -0.13 -2.24 -0.21 0.00 0.00 0.00 0.00 51.96 49.39 1idp s ALA 130 Cb -0.08 -3.13 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 1idp s ALA 130 CO -0.00 -1.82 0.64 -0.80 0.00 0.00 0.00 175.76 173.78 1idp s ASN 131 N 2.90 6.52 -0.27 0.00 0.02 0.06 -0.83 114.94 123.33 1idp s ASN 131 Ca 0.04 0.48 -0.20 0.00 -1.02 0.00 0.00 52.86 52.16 1idp s ASN 131 Cb -0.26 -2.34 -0.02 0.00 0.02 0.00 0.00 41.25 38.66 1idp s ASN 131 CO 0.06 -0.48 0.60 -0.22 0.02 0.00 0.00 177.10 177.08 1idp s LEU 132 N 2.62 4.09 -0.06 0.60 1.98 -0.95 -0.69 118.68 126.27 1idp s LEU 132 Ca 0.26 0.58 0.01 0.00 -2.89 0.00 0.00 54.13 52.09 1idp s LEU 132 Cb -0.15 -2.80 -0.03 0.00 0.66 0.00 0.00 46.19 43.88 1idp s LEU 132 CO 0.11 -0.39 -0.08 -1.00 -1.89 0.00 0.00 176.35 173.11 1idp s HIS 133 N 2.49 2.90 -0.15 5.38 3.76 0.10 -0.26 115.29 129.52 1idp s HIS 133 Ca 0.25 -0.00 -0.09 0.00 -0.15 0.00 0.00 55.06 55.06 1idp s HIS 133 Cb -0.15 -1.69 -0.04 0.00 1.11 0.00 0.00 32.58 31.80 1idp s HIS 133 CO 0.10 0.31 0.16 -1.58 -0.85 0.00 0.00 174.74 172.88 1idp s TRP 134 N -0.81 3.53 -0.02 1.40 0.51 -0.20 -1.38 118.94 121.96 1idp s TRP 134 Ca 0.12 0.48 0.05 0.00 -2.12 0.00 0.00 56.10 54.64 1idp s TRP 134 Cb -0.11 -2.07 -0.01 0.00 -0.81 0.00 0.00 33.47 30.47 1idp s TRP 134 CO 0.02 0.53 -0.18 0.71 -0.51 0.00 0.00 176.95 177.52 1idp s TYR 135 N -0.41 1.62 -0.05 -1.98 1.51 0.18 -0.33 117.35 117.88 1idp s TYR 135 Ca 0.13 -0.34 0.03 0.00 -1.01 0.00 0.00 57.07 55.87 1idp s TYR 135 Cb -0.12 -1.06 0.01 0.00 -0.11 0.00 0.00 41.96 40.68 1idp s TYR 135 CO 0.02 -0.06 -0.12 0.15 -1.11 0.00 0.00 175.55 174.43 1idp s LYS 136 N -0.31 1.59 -0.47 -0.62 -0.14 -0.46 -1.37 119.74 117.95 1idp s LYS 136 Ca 0.04 -0.43 -0.26 0.00 -1.36 0.00 0.00 55.97 53.97 1idp s LYS 136 Cb -0.08 -1.35 0.03 0.00 -1.68 0.00 0.00 37.83 34.75 1idp s LYS 136 CO -0.00 0.08 0.95 0.21 -0.76 0.00 0.00 175.35 175.82 1idp s LYS 137 N 0.48 3.53 -0.28 1.68 2.20 0.25 -0.53 119.74 127.07 1idp s LYS 137 Ca -0.11 0.16 -0.05 0.00 -0.36 0.00 0.00 55.97 55.61 1idp s LYS 137 Cb -0.14 -3.94 0.01 0.00 -1.51 0.00 0.00 37.83 32.26 1idp s LYS 137 CO 0.03 -1.26 0.04 0.42 -0.36 0.00 0.00 175.35 174.21 1idp s ILE 138 N 3.84 3.62 -1.42 5.43 -1.09 0.65 -4.62 121.20 127.61 1idp s ILE 138 Ca 0.37 -0.80 -0.04 0.00 -2.23 0.00 0.00 60.65 57.95 1idp s ILE 138 Cb -0.10 -2.86 0.03 0.00 -1.58 0.00 0.00 42.46 37.95 1idp s ILE 138 CO 0.26 0.12 0.66 0.47 -1.23 0.00 0.00 174.94 175.21 1idp n ASP 139 N 4.80 -1.69 0.00 3.58 10.43 -1.26 -1.75 116.55 130.67 1idp n ASP 139 Ca -0.15 -0.90 0.00 0.00 2.57 0.00 0.00 54.79 56.31 1idp n ASP 139 Cb 0.48 -3.55 0.00 0.00 1.84 0.00 0.00 41.12 39.89 1idp n ASP 139 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1idp n GLY 140 N -1.73 0.88 3.23 0.44 0.00 -1.26 -5.00 105.19 101.75 1idp n GLY 140 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1idp n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1idp s VAL 141 N -3.55 2.09 0.06 1.61 1.01 -0.72 -5.09 120.40 115.82 1idp s VAL 141 Ca 0.00 -1.02 -0.31 0.00 0.00 0.00 0.00 61.98 60.66 1idp s VAL 141 Cb 0.00 -1.79 -0.06 0.00 0.00 0.00 0.00 36.38 34.53 1idp s VAL 141 CO 0.00 0.56 1.31 0.26 0.00 0.00 0.00 175.10 177.24 1idp s TRP 142 N 0.24 3.22 0.07 5.22 0.52 -1.26 -0.25 118.94 126.71 1idp s TRP 142 Ca -0.16 1.06 0.10 0.00 0.02 0.00 0.00 56.10 57.12 1idp s TRP 142 Cb -0.17 -3.57 -0.03 0.00 -1.15 0.00 0.00 33.47 28.55 1idp s TRP 142 CO 0.08 -1.95 -0.26 0.15 0.02 0.00 0.00 176.95 174.99 1idp s LYS 143 N 1.44 1.64 -0.23 4.98 -0.14 0.31 -4.77 119.74 122.97 1idp s LYS 143 Ca 0.62 -1.18 -0.29 0.00 -1.36 0.00 0.00 55.97 53.76 1idp s LYS 143 Cb -0.32 -1.92 -0.03 0.00 -1.68 0.00 0.00 37.83 33.88 1idp s LYS 143 CO 0.29 0.48 1.68 0.12 -0.76 0.00 0.00 175.35 177.16 1idp s PHE 144 N -0.89 1.99 -0.86 3.18 2.19 0.87 -1.36 117.98 123.10 1idp s PHE 144 Ca 0.12 0.51 0.09 0.00 0.33 0.00 0.00 56.93 57.98 1idp s PHE 144 Cb -0.10 -4.02 0.21 0.00 -1.31 0.00 0.00 43.02 37.80 1idp s PHE 144 CO 0.03 -3.08 1.10 0.00 1.83 0.00 0.00 175.22 175.10 1idp n ALA 145 N 8.80 2.23 0.00 11.12 0.00 0.55 -0.83 120.51 142.38 1idp n ALA 145 Ca 0.20 -0.98 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1idp n ALA 145 Cb 0.45 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1idp n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1idp n GLY 146 N 0.38 1.02 3.34 0.00 0.00 -1.14 -1.11 105.19 107.68 1idp n GLY 146 Ca 0.08 -1.94 -0.11 0.00 0.00 0.00 0.00 46.02 44.05 1idp n GLY 146 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1idp s LEU 147 N 0.00 0.22 -0.36 0.99 2.34 -0.12 -1.04 118.68 120.71 1idp s LEU 147 Ca 0.00 -0.22 0.01 0.00 0.06 0.00 0.00 54.13 53.97 1idp s LEU 147 Cb 0.00 1.97 0.14 0.00 -0.56 0.00 0.00 46.19 47.74 1idp s LEU 147 CO 0.00 -0.85 0.23 -0.75 -1.06 0.00 0.00 176.35 173.92 1idp s LYS 148 N -3.65 0.63 0.30 1.48 2.20 0.64 -1.14 119.74 120.21 1idp s LYS 148 Ca 0.02 -1.48 -0.28 0.00 -0.36 0.00 0.00 55.97 53.87 1idp s LYS 148 Cb 0.01 -1.35 -0.09 0.00 -1.51 0.00 0.00 37.83 34.88 1idp s LYS 148 CO -0.11 -1.24 1.04 -2.14 -0.36 0.00 0.00 175.35 172.55 1idp s PRO 149 N 0.89 4.58 -0.57 4.03 0.02 -1.25 -2.24 135.00 140.45 1idp s PRO 149 Ca 0.20 1.64 -0.01 0.00 0.02 0.00 0.00 61.00 62.85 1idp s PRO 149 Cb -0.19 -3.04 0.15 0.00 0.02 0.00 0.00 34.50 31.44 1idp s PRO 149 CO -0.02 0.21 0.37 0.34 -0.33 0.00 0.00 177.00 177.56 1idp s ASP 150 N -1.14 5.07 -0.34 2.53 2.15 -0.01 -4.88 116.67 120.05 1idp s ASP 150 Ca 0.47 -2.76 -0.27 0.00 0.43 0.00 0.00 52.55 50.42 1idp s ASP 150 Cb -0.28 -1.81 0.01 0.00 -0.30 0.00 0.00 42.92 40.55 1idp s ASP 150 CO 0.35 -0.37 0.98 -0.63 -0.17 0.00 0.00 175.17 175.33 1idp s ILE 151 N 0.08 4.57 -0.12 4.11 1.09 -1.26 -1.20 121.20 128.47 1idp s ILE 151 Ca 0.16 1.44 -0.06 0.00 -1.10 0.00 0.00 60.65 61.09 1idp s ILE 151 Cb -0.21 -4.35 -0.04 0.00 -1.06 0.00 0.00 42.46 36.79 1idp s ILE 151 CO -0.03 -0.48 0.06 0.03 -0.10 0.00 0.00 174.94 174.41 1idp h ARG 152 N 8.27 0.00 -2.82 2.79 -0.00 -0.51 -3.49 114.38 118.62 1idp h ARG 152 Ca -0.22 0.00 0.05 0.00 -0.50 0.00 0.00 59.98 59.31 1idp h ARG 152 Cb 1.07 0.00 -0.10 0.00 0.00 0.00 0.00 29.97 30.94 1idp h ARG 152 CO 1.00 0.15 0.29 1.67 0.00 0.00 0.00 179.97 183.07 1idp s TRP 153 N -1.80 -0.36 -0.03 3.04 1.48 -1.24 -5.04 118.94 114.99 1idp s TRP 153 Ca -0.06 0.07 0.01 0.00 -1.06 0.00 0.00 56.10 55.06 1idp s TRP 153 Cb 0.00 0.61 0.02 0.00 -1.16 0.00 0.00 33.47 32.94 1idp s TRP 153 CO 0.14 -0.92 -0.05 0.20 -4.06 0.00 0.00 176.95 172.27 1idp s GLY 154 N -2.78 0.41 0.00 3.67 0.00 -1.26 -2.01 107.32 105.34 1idp s GLY 154 Ca 0.06 -0.10 0.29 0.00 0.00 0.00 0.00 44.72 44.97 1idp s GLY 154 CO -0.05 0.26 1.83 1.18 0.00 0.00 0.00 173.10 176.32