#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntm n ARG 2 N 0.00 0.00 -1.63 1.61 1.85 -1.26 -5.15 116.66 112.08 1ntm n ARG 2 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1ntm n ARG 2 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1ntm n ARG 2 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1ntm n GLN 3 N 0.00 -4.57 -2.00 2.89 6.02 -1.26 -4.54 117.38 113.93 1ntm n GLN 3 Ca 0.00 3.30 -0.39 0.00 -0.01 0.00 0.00 57.00 59.90 1ntm n GLN 3 Cb 0.00 -3.64 0.00 0.00 1.02 0.00 0.00 30.24 27.63 1ntm n GLN 3 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1ntm s PHE 4 N -1.94 2.69 0.00 1.08 0.40 -1.26 -2.48 117.98 116.47 1ntm s PHE 4 Ca 0.00 1.39 0.00 0.00 -0.60 0.00 0.00 56.93 57.72 1ntm s PHE 4 Cb 0.00 -3.70 0.00 0.00 0.51 0.00 0.00 43.02 39.83 1ntm s PHE 4 CO 0.00 -2.28 0.00 0.41 0.70 0.00 0.00 175.22 174.05 1ntm n GLY 5 N 0.63 3.14 0.24 4.36 0.00 -1.26 -4.85 105.19 107.46 1ntm n GLY 5 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.11 1ntm n GLY 5 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ntm n HIS 6 N -1.41 0.00 0.01 1.61 8.25 -1.03 -4.91 115.22 117.74 1ntm n HIS 6 Ca 0.00 -0.44 -0.01 0.00 -0.26 0.00 0.00 57.72 57.01 1ntm n HIS 6 Cb 0.00 -0.08 -0.00 0.00 1.12 0.00 0.00 29.99 31.02 1ntm n HIS 6 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1ntm h LEU 7 N 0.00 -0.04 0.00 2.41 3.38 -1.80 -3.48 115.31 115.78 1ntm h LEU 7 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1ntm h LEU 7 Cb 1.12 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1ntm h LEU 7 CO 0.00 0.01 0.08 1.07 0.09 0.00 0.00 178.44 179.70 1ntm n THR 8 N -2.33 0.00 -3.90 0.22 5.66 -1.26 -5.16 114.28 107.51 1ntm n THR 8 Ca -0.01 -0.98 -0.35 0.00 -3.05 0.00 0.00 64.05 59.66 1ntm n THR 8 Cb 0.02 0.78 -0.11 0.00 -1.55 0.00 0.00 70.33 69.47 1ntm n THR 8 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 1ntm s ARG 9 N -2.28 3.89 -0.04 1.09 3.52 -1.26 -5.03 118.95 118.84 1ntm s ARG 9 Ca 0.16 -0.38 -0.03 0.00 -0.13 0.00 0.00 55.73 55.35 1ntm s ARG 9 Cb -0.03 -3.29 0.01 0.00 -1.56 0.00 0.00 34.95 30.09 1ntm s ARG 9 CO 0.12 0.10 0.10 0.08 -0.81 0.00 0.00 175.30 174.89 1ntm s VAL 10 N 0.85 -0.01 0.08 7.11 1.01 -1.26 -5.16 120.40 123.03 1ntm s VAL 10 Ca 0.04 0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1ntm s VAL 10 Cb -0.14 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 1ntm s VAL 10 CO 0.02 0.01 -0.08 -0.13 0.00 0.00 0.00 175.10 174.92 1ntm s ARG 11 N 0.18 0.76 -0.32 2.72 0.52 -1.26 -4.93 118.95 116.62 1ntm s ARG 11 Ca -0.01 -1.12 0.00 0.00 -0.52 0.00 0.00 55.73 54.08 1ntm s ARG 11 Cb -0.02 -0.35 0.00 0.00 0.52 0.00 0.00 34.95 35.10 1ntm s ARG 11 CO -0.00 0.04 0.00 0.72 0.02 0.00 0.00 175.30 176.07 1ntm n HIS 12 N 0.57 0.00 -3.83 -0.53 8.25 -1.26 -5.00 115.22 113.42 1ntm n HIS 12 Ca -0.16 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 56.94 1ntm n HIS 12 Cb 0.58 -1.20 -0.13 0.00 1.12 0.00 0.00 29.99 30.36 1ntm n HIS 12 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ntm s VAL 13 N -1.81 3.74 0.12 1.59 1.01 -1.26 -5.10 120.40 118.69 1ntm s VAL 13 Ca 0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 1ntm s VAL 13 Cb 0.00 -2.79 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 1ntm s VAL 13 CO 0.00 0.29 0.36 -0.63 0.00 0.00 0.00 175.10 175.12 1ntm s ILE 14 N 1.51 5.18 -0.22 2.22 1.01 -1.26 -5.08 121.20 124.56 1ntm s ILE 14 Ca 0.05 0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.74 1ntm s ILE 14 Cb -0.15 -3.62 0.07 0.00 0.01 0.00 0.00 42.46 38.76 1ntm s ILE 14 CO -0.00 0.10 0.03 -0.89 0.00 0.00 0.00 174.94 174.18 1ntm s THR 15 N -1.59 0.70 -0.00 2.92 2.01 -1.26 -5.12 115.64 113.29 1ntm s THR 15 Ca 0.39 -0.77 -0.23 0.00 0.31 0.00 0.00 61.69 61.39 1ntm s THR 15 Cb -0.12 -1.22 -0.05 0.00 0.01 0.00 0.00 72.50 71.11 1ntm s THR 15 CO 0.23 -0.27 0.70 -0.31 -0.69 0.00 0.00 174.62 174.29 1ntm s TYR 16 N 1.77 3.68 0.15 4.92 1.51 -1.26 -5.06 117.35 123.05 1ntm s TYR 16 Ca -0.00 1.33 0.01 0.00 -1.01 0.00 0.00 57.07 57.40 1ntm s TYR 16 Cb -0.17 -2.76 -0.04 0.00 -0.11 0.00 0.00 41.96 38.87 1ntm s TYR 16 CO -0.11 0.24 0.01 -1.12 -1.11 0.00 0.00 175.55 173.46 1ntm s SER 17 N 0.16 0.91 -0.00 2.29 0.01 -1.26 -5.17 113.70 110.64 1ntm s SER 17 Ca 0.36 -1.15 0.02 0.00 1.31 0.00 0.00 55.95 56.48 1ntm s SER 17 Cb -0.19 0.17 -0.00 0.00 0.21 0.00 0.00 66.02 66.20 1ntm s SER 17 CO 0.20 -0.60 -0.05 -0.22 0.41 0.00 0.00 173.24 172.98 1ntm s LEU 18 N -3.11 2.00 0.30 2.44 2.96 -1.26 -5.12 118.68 116.89 1ntm s LEU 18 Ca 0.22 -0.09 -0.30 0.00 -0.22 0.00 0.00 54.13 53.74 1ntm s LEU 18 Cb 0.06 -0.26 -0.11 0.00 0.50 0.00 0.00 46.19 46.38 1ntm s LEU 18 CO 0.02 0.06 1.60 -0.55 -1.32 0.00 0.00 176.35 176.16 1ntm s SER 19 N -0.11 6.35 0.56 3.68 0.15 -1.26 -4.89 113.70 118.19 1ntm s SER 19 Ca 0.02 2.97 0.30 0.00 0.70 0.00 0.00 55.95 59.94 1ntm s SER 19 Cb -0.02 -2.64 1.66 0.00 -1.71 0.00 0.00 66.02 63.32 1ntm s SER 19 CO -0.00 -0.93 2.16 1.55 1.20 0.00 0.00 173.24 177.22 1ntm h PRO 20 N 4.81 0.00 -0.01 5.44 0.13 -2.00 0.85 132.00 141.22 1ntm h PRO 20 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ntm h PRO 20 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1ntm h PRO 20 CO 0.79 0.07 0.00 1.19 -0.23 0.00 0.00 178.00 179.82 1ntm n PHE 21 N -3.64 0.02 0.14 1.56 3.01 -1.26 -3.25 117.46 114.05 1ntm n PHE 21 Ca -0.02 -0.01 0.03 0.00 1.01 0.00 0.00 57.45 58.46 1ntm n PHE 21 Cb 0.17 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.60 1ntm n PHE 21 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1ntm n GLU 22 N -0.70 2.52 -4.59 -1.08 -0.58 0.29 -5.05 120.64 111.44 1ntm n GLU 22 Ca 0.15 -0.03 -0.27 0.00 -0.42 0.00 0.00 57.16 56.59 1ntm n GLU 22 Cb 0.10 -0.98 -0.11 0.00 -0.57 0.00 0.00 31.44 29.88 1ntm n GLU 22 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 1ntm s GLN 23 N -2.03 1.91 0.12 3.49 -2.07 -1.17 -5.03 119.66 114.88 1ntm s GLN 23 Ca -0.00 -2.07 -0.11 0.00 -1.82 0.00 0.00 55.36 51.36 1ntm s GLN 23 Cb 0.04 -1.52 -0.06 0.00 -1.09 0.00 0.00 33.01 30.38 1ntm s GLN 23 CO 0.26 -0.06 0.46 -0.98 -1.32 0.00 0.00 175.29 173.65 1ntm s ARG 24 N -3.73 3.83 0.44 9.60 1.70 -1.26 -4.94 118.95 124.58 1ntm s ARG 24 Ca 0.35 0.28 0.24 0.00 -0.47 0.00 0.00 55.73 56.13 1ntm s ARG 24 Cb 0.10 -2.94 0.85 0.00 -0.57 0.00 0.00 34.95 32.39 1ntm s ARG 24 CO 0.18 0.51 1.79 0.00 -1.08 0.00 0.00 175.30 176.70 1ntm h ALA 25 N 3.53 0.98 -2.30 7.88 0.00 -2.01 -3.35 119.26 124.00 1ntm h ALA 25 Ca -0.49 -0.19 -0.59 0.00 0.00 0.00 0.00 54.91 53.65 1ntm h ALA 25 Cb 1.19 -0.03 -0.40 0.00 0.00 0.00 0.00 17.79 18.55 1ntm h ALA 25 CO 0.67 0.26 -0.86 1.19 0.00 0.00 0.00 179.25 180.51 1ntm n PHE 26 N -3.32 1.15 -2.37 0.00 3.01 -1.26 -5.09 117.46 109.57 1ntm n PHE 26 Ca 0.01 -3.78 -0.42 0.00 1.01 0.00 0.00 57.45 54.26 1ntm n PHE 26 Cb 0.45 -0.32 -0.03 0.00 -0.01 0.00 0.00 39.48 39.58 1ntm n PHE 26 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1ntm s PRO 27 N -1.31 4.30 -1.29 -1.08 0.05 -1.26 -3.85 135.00 130.56 1ntm s PRO 27 Ca 0.34 1.77 -0.11 0.00 0.05 0.00 0.00 61.00 63.05 1ntm s PRO 27 Cb 0.10 -3.63 0.00 0.00 0.05 0.00 0.00 34.50 31.03 1ntm s PRO 27 CO -0.11 -0.56 0.57 0.72 0.05 0.00 0.00 177.00 177.67 1ntm n HIS 28 N 5.65 -1.70 -0.20 0.56 8.25 -1.26 -4.85 115.22 121.67 1ntm n HIS 28 Ca 0.12 0.56 -0.05 0.00 -0.26 0.00 0.00 57.72 58.09 1ntm n HIS 28 Cb 0.45 -3.50 0.05 0.00 1.12 0.00 0.00 29.99 28.11 1ntm n HIS 28 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1ntm h TYR 29 N -1.94 0.69 0.03 4.41 5.03 -1.99 -2.42 116.97 120.78 1ntm h TYR 29 Ca -0.65 0.02 -0.37 0.00 2.58 0.00 0.00 58.73 60.30 1ntm h TYR 29 Cb 1.37 -0.23 -0.06 0.00 1.55 0.00 0.00 36.73 39.37 1ntm h TYR 29 CO 0.42 0.41 -2.29 1.19 -1.32 0.00 0.00 178.16 176.58 1ntm n PHE 30 N -4.72 0.39 -0.13 -3.82 3.72 -1.26 -2.60 117.46 109.03 1ntm n PHE 30 Ca 0.05 0.09 -0.10 0.00 -0.05 0.00 0.00 57.45 57.44 1ntm n PHE 30 Cb 0.06 -1.05 -0.07 0.00 -0.94 0.00 0.00 39.48 37.47 1ntm n PHE 30 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1ntm h SER 31 N 0.02 -1.39 0.51 4.37 0.02 -1.93 -2.18 113.55 112.96 1ntm h SER 31 Ca -0.51 0.19 -0.17 0.00 -0.84 0.00 0.00 61.79 60.45 1ntm h SER 31 Cb 2.00 0.58 -0.03 0.00 0.14 0.00 0.00 62.40 65.09 1ntm h SER 31 CO -0.01 -0.27 -1.63 0.29 -1.14 0.00 0.00 176.83 174.06 1ntm n LYS 32 N -4.64 0.64 0.01 3.45 5.02 -0.92 -4.53 118.16 117.19 1ntm n LYS 32 Ca -0.02 0.12 -0.01 0.00 -2.02 0.00 0.00 58.31 56.38 1ntm n LYS 32 Cb 0.24 -1.72 -0.01 0.00 -0.02 0.00 0.00 35.03 33.52 1ntm n LYS 32 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1ntm h GLY 33 N 3.81 -1.11 0.20 0.72 0.00 -1.28 -2.83 103.07 102.58 1ntm h GLY 33 Ca -0.20 0.49 0.09 0.00 0.00 0.00 0.00 47.33 47.71 1ntm h GLY 33 CO 0.03 -0.41 -0.05 1.19 0.00 0.00 0.00 176.54 177.31 1ntm h ILE 34 N -0.06 0.61 -0.72 2.60 2.10 -1.56 -2.14 117.51 118.34 1ntm h ILE 34 Ca -0.00 -0.02 0.15 0.00 1.08 0.00 0.00 64.86 66.07 1ntm h ILE 34 Cb 0.06 0.54 -0.13 0.00 -1.09 0.00 0.00 36.82 36.20 1ntm h ILE 34 CO -0.02 0.01 -0.11 -0.65 -1.08 0.00 0.00 178.15 176.30 1ntm h PRO 35 N 0.06 0.03 -0.31 2.19 0.11 -1.79 -0.28 132.00 132.02 1ntm h PRO 35 Ca 0.22 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.38 1ntm h PRO 35 Cb 0.33 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 31.39 1ntm h PRO 35 CO -0.41 0.02 -0.00 -0.91 -0.21 0.00 0.00 178.00 176.49 1ntm h ASN 36 N 0.03 -0.13 -0.61 -2.05 2.35 -1.14 -1.65 115.58 112.38 1ntm h ASN 36 Ca 0.36 0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 56.15 1ntm h ASN 36 Cb 0.59 0.13 -0.03 0.00 0.05 0.00 0.00 38.32 39.06 1ntm h ASN 36 CO -0.70 -0.03 0.25 1.62 -1.65 0.00 0.00 177.43 176.91 1ntm h VAL 37 N 0.09 1.23 -0.04 2.81 3.04 -0.70 0.03 116.25 122.71 1ntm h VAL 37 Ca 0.15 -0.73 0.01 0.00 -1.01 0.00 0.00 66.70 65.13 1ntm h VAL 37 Cb 0.20 0.47 -0.02 0.00 -2.01 0.00 0.00 31.29 29.94 1ntm h VAL 37 CO -0.25 0.29 -0.04 -0.07 -1.01 0.00 0.00 177.57 176.48 1ntm h LEU 38 N 0.93 -0.13 -0.74 3.16 3.38 -0.95 -0.05 115.31 120.91 1ntm h LEU 38 Ca 0.22 0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.32 1ntm h LEU 38 Cb 0.20 0.07 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 1ntm h LEU 38 CO -0.02 -0.06 0.36 -0.09 0.09 0.00 0.00 178.44 178.72 1ntm h ARG 39 N -0.06 0.57 -0.41 1.13 2.43 -0.49 0.23 114.38 117.77 1ntm h ARG 39 Ca 0.03 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.02 1ntm h ARG 39 Cb 0.11 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1ntm h ARG 39 CO -0.08 0.38 -0.33 0.00 -1.51 0.00 0.00 179.97 178.43 1ntm h ARG 40 N 0.59 0.93 0.13 0.20 3.08 -0.53 -0.21 114.38 118.57 1ntm h ARG 40 Ca 0.38 -0.46 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1ntm h ARG 40 Cb 0.44 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1ntm h ARG 40 CO -0.30 1.11 -0.06 1.15 -1.07 0.00 0.00 179.97 180.80 1ntm h THR 41 N 0.78 0.89 -0.53 2.04 2.02 0.43 -2.36 112.91 116.19 1ntm h THR 41 Ca 0.08 -0.06 0.07 0.00 0.77 0.00 0.00 66.41 67.27 1ntm h THR 41 Cb 0.91 0.93 -0.06 0.00 -1.74 0.00 0.00 68.15 68.19 1ntm h THR 41 CO 0.08 0.02 0.20 -0.09 0.37 0.00 0.00 175.52 176.10 1ntm h ARG 42 N -0.20 0.37 -0.12 6.66 2.43 -0.52 0.21 114.38 123.20 1ntm h ARG 42 Ca -0.02 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.16 1ntm h ARG 42 Cb 0.16 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1ntm h ARG 42 CO 0.03 0.24 0.12 0.00 -1.51 0.00 0.00 179.97 178.85 1ntm h ALA 43 N 1.35 1.82 -0.00 2.80 0.00 -0.74 -3.24 119.26 121.25 1ntm h ALA 43 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ntm h ALA 43 Cb 0.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ntm h ALA 43 CO -0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 179.25 178.81 1ntm h ILE 45 N 0.02 0.91 0.00 0.00 3.07 -0.71 -0.25 117.51 120.56 1ntm h ILE 45 Ca 0.00 -0.07 0.00 0.00 1.55 0.00 0.00 64.86 66.34 1ntm h ILE 45 Cb 0.01 0.68 0.00 0.00 -0.27 0.00 0.00 36.82 37.24 1ntm h ILE 45 CO 0.00 0.04 0.00 -0.07 -1.05 0.00 0.00 178.15 177.07 1ntm h LEU 46 N 0.21 0.00 0.00 0.16 3.38 -1.86 0.51 115.31 117.71 1ntm h LEU 46 Ca 0.13 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.75 1ntm h LEU 46 Cb 0.11 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.79 1ntm h LEU 46 CO -0.14 0.00 -2.33 0.54 0.09 0.00 0.00 178.44 176.60 1ntm n ARG 47 N -2.68 0.82 -0.10 1.13 1.74 -0.76 -4.57 116.66 112.24 1ntm n ARG 47 Ca -0.02 0.03 -0.21 0.00 -0.77 0.00 0.00 57.85 56.88 1ntm n ARG 47 Cb 0.07 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 29.92 1ntm n ARG 47 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1ntm n VAL 48 N -2.84 1.53 0.18 1.55 0.31 -0.18 -4.70 118.33 114.17 1ntm n VAL 48 Ca -0.34 -0.02 -0.14 0.00 -0.01 0.00 0.00 64.34 63.82 1ntm n VAL 48 Cb 1.08 -2.06 -0.07 0.00 -0.91 0.00 0.00 33.84 31.88 1ntm n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ntm h ALA 49 N -0.55 -0.55 -0.97 3.52 0.00 -1.13 -3.34 119.26 116.24 1ntm h ALA 49 Ca -0.34 -0.08 0.32 0.00 0.00 0.00 0.00 54.91 54.81 1ntm h ALA 49 Cb 1.26 0.38 -0.17 0.00 0.00 0.00 0.00 17.79 19.26 1ntm h ALA 49 CO -0.21 -0.84 0.32 -1.35 0.00 0.00 0.00 179.25 177.18 1ntm h PRO 50 N -0.56 0.09 -0.21 0.00 0.11 -1.81 0.17 132.00 129.80 1ntm h PRO 50 Ca -0.01 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.96 1ntm h PRO 50 Cb 0.52 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 1ntm h PRO 50 CO -0.06 0.06 -0.44 -1.35 -0.21 0.00 0.00 178.00 176.00 1ntm h PRO 51 N 0.09 0.51 -0.26 1.05 0.11 -1.86 -2.16 132.00 129.49 1ntm h PRO 51 Ca 0.69 -0.27 -0.05 0.00 0.11 0.00 0.00 66.00 66.48 1ntm h PRO 51 Cb 1.61 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.72 1ntm h PRO 51 CO -0.77 0.85 -0.04 0.74 -0.21 0.00 0.00 178.00 178.57 1ntm h PHE 52 N 0.42 0.54 -0.48 0.65 0.04 -0.83 -1.46 116.94 115.81 1ntm h PHE 52 Ca 0.03 -0.11 -0.06 0.00 2.80 0.00 0.00 57.97 60.63 1ntm h PHE 52 Cb 0.94 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.93 1ntm h PHE 52 CO 0.03 0.68 0.06 -0.39 -0.60 0.00 0.00 178.31 178.10 1ntm h VAL 53 N 0.24 1.22 -0.89 -0.55 -1.51 -1.39 0.22 116.25 113.59 1ntm h VAL 53 Ca 0.07 -0.87 0.07 0.00 -1.23 0.00 0.00 66.70 64.74 1ntm h VAL 53 Cb 0.50 0.79 -0.07 0.00 -2.13 0.00 0.00 31.29 30.39 1ntm h VAL 53 CO 0.02 0.31 0.55 0.00 -1.23 0.00 0.00 177.57 177.23 1ntm h ALA 54 N 1.35 1.24 0.03 5.19 0.00 -1.18 0.34 119.26 126.24 1ntm h ALA 54 Ca 0.15 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ntm h ALA 54 Cb 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ntm h ALA 54 CO 0.01 0.29 -0.02 0.35 0.00 0.00 0.00 179.25 179.88 1ntm h PHE 55 N 0.99 -0.04 -0.62 0.00 3.04 -0.53 -2.36 116.94 117.41 1ntm h PHE 55 Ca 0.40 -0.00 0.13 0.00 3.98 0.00 0.00 57.97 62.48 1ntm h PHE 55 Cb 0.21 0.01 -0.10 0.00 2.56 0.00 0.00 35.95 38.63 1ntm h PHE 55 CO -0.03 0.29 0.01 -0.92 -2.02 0.00 0.00 178.31 175.64 1ntm h TYR 56 N -0.38 -0.03 -0.36 0.41 5.03 0.12 0.39 116.97 122.15 1ntm h TYR 56 Ca -0.00 0.05 -0.02 0.00 2.58 0.00 0.00 58.73 61.33 1ntm h TYR 56 Cb 0.35 0.11 -0.02 0.00 1.55 0.00 0.00 36.73 38.72 1ntm h TYR 56 CO 0.04 -0.16 0.14 -0.07 -1.32 0.00 0.00 178.16 176.79 1ntm h LEU 57 N 0.12 0.50 -1.84 2.82 3.38 -0.38 -1.57 115.31 118.35 1ntm h LEU 57 Ca 0.33 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1ntm h LEU 57 Cb 0.53 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 1ntm h LEU 57 CO -0.53 0.54 -0.13 0.58 0.09 0.00 0.00 178.44 178.99 1ntm h VAL 58 N 0.44 0.55 0.02 1.22 2.07 -0.70 -2.00 116.25 117.85 1ntm h VAL 58 Ca 0.12 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 1ntm h VAL 58 Cb 0.19 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1ntm h VAL 58 CO -0.01 0.12 -0.01 0.22 0.02 0.00 0.00 177.57 177.91 1ntm h TYR 59 N 0.00 -0.03 -0.37 1.57 3.20 0.50 -2.16 116.97 119.68 1ntm h TYR 59 Ca -0.00 -0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.71 1ntm h TYR 59 Cb 0.37 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1ntm h TYR 59 CO 0.00 0.64 -0.40 1.79 -1.64 0.00 0.00 178.16 178.55 1ntm h THR 60 N -0.74 1.27 0.71 1.81 1.35 -1.22 -2.06 112.91 114.04 1ntm h THR 60 Ca -0.00 -1.57 -0.03 0.00 -0.55 0.00 0.00 66.41 64.25 1ntm h THR 60 Cb 0.68 1.41 0.01 0.00 -1.73 0.00 0.00 68.15 68.51 1ntm h THR 60 CO 0.00 0.52 -0.34 -0.25 -0.25 0.00 0.00 175.52 175.21 1ntm h TRP 61 N 0.74 -0.89 -1.17 4.73 7.01 -1.49 -1.49 115.95 123.39 1ntm h TRP 61 Ca 0.06 -0.02 0.33 0.00 2.11 0.00 0.00 58.89 61.37 1ntm h TRP 61 Cb 0.98 0.29 -0.08 0.00 -2.10 0.00 0.00 29.16 28.25 1ntm h TRP 61 CO 0.06 -0.55 0.78 0.78 -2.79 0.00 0.00 178.44 176.72 1ntm h GLY 62 N -1.01 0.81 0.67 2.65 0.00 -1.44 0.58 103.07 105.32 1ntm h GLY 62 Ca -0.10 -0.12 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 1ntm h GLY 62 CO 0.16 -0.14 -0.15 -0.84 0.00 0.00 0.00 176.54 175.58 1ntm h THR 63 N 0.20 1.38 -0.73 4.70 2.02 -1.25 -2.75 112.91 116.48 1ntm h THR 63 Ca 0.64 -1.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.41 1ntm h THR 63 Cb 2.01 2.05 -0.03 0.00 -1.74 0.00 0.00 68.15 70.44 1ntm h THR 63 CO -0.22 0.39 0.33 1.56 0.37 0.00 0.00 175.52 177.96 1ntm h GLN 64 N -0.16 1.07 -0.09 6.66 4.20 0.11 -1.97 115.11 124.93 1ntm h GLN 64 Ca 0.01 -0.17 -0.06 0.00 0.06 0.00 0.00 58.65 58.49 1ntm h GLN 64 Cb 0.70 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1ntm h GLN 64 CO 0.03 0.85 -0.23 1.49 -0.67 0.00 0.00 178.83 180.31 1ntm h GLU 65 N 1.04 0.15 0.60 1.46 4.57 -0.98 -1.09 114.58 120.33 1ntm h GLU 65 Ca 0.25 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 1ntm h GLU 65 Cb 0.15 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1ntm h GLU 65 CO -0.03 0.38 -0.29 0.35 -1.18 0.00 0.00 179.01 178.24 1ntm h PHE 66 N 0.14 -0.75 -0.85 0.92 3.57 -1.06 -2.19 116.94 116.72 1ntm h PHE 66 Ca 0.02 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.60 1ntm h PHE 66 Cb 0.49 0.25 -0.07 0.00 2.79 0.00 0.00 35.95 39.40 1ntm h PHE 66 CO 0.00 -0.43 0.49 0.93 -2.23 0.00 0.00 178.31 177.08 1ntm h GLU 67 N -1.15 0.80 -0.00 1.11 5.08 -1.30 -1.79 114.58 117.33 1ntm h GLU 67 Ca -0.08 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1ntm h GLU 67 Cb 0.66 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1ntm h GLU 67 CO 0.14 0.53 -0.10 1.63 -1.00 0.00 0.00 179.01 180.21 1ntm n LYS 68 N -4.72 0.41 0.09 2.33 5.02 -0.42 -3.06 118.16 117.81 1ntm n LYS 68 Ca 0.14 -0.10 0.12 0.00 -2.02 0.00 0.00 58.31 56.45 1ntm n LYS 68 Cb 0.28 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 33.98 1ntm n LYS 68 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1ntm h SER 69 N 0.24 0.00 -1.67 4.39 0.87 -0.64 -3.37 113.55 113.37 1ntm h SER 69 Ca 0.00 -0.13 -0.73 0.00 -1.23 0.00 0.00 61.79 59.70 1ntm h SER 69 Cb 0.38 0.00 -0.29 0.00 -0.44 0.00 0.00 62.40 62.05 1ntm h SER 69 CO 0.00 0.06 0.84 0.29 -0.53 0.00 0.00 176.83 177.49 1ntm n LYS 70 N -2.30 2.81 -3.82 2.24 5.02 -1.17 -4.87 118.16 116.06 1ntm n LYS 70 Ca 0.03 -3.55 -0.10 0.00 -2.02 0.00 0.00 58.31 52.68 1ntm n LYS 70 Cb 0.46 -2.27 -0.06 0.00 -0.02 0.00 0.00 35.03 33.14 1ntm n LYS 70 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1ntm s ARG 71 N -3.96 1.10 0.00 1.97 0.52 -1.26 -5.09 118.95 112.24 1ntm s ARG 71 Ca 0.55 -0.96 -0.04 0.00 -0.52 0.00 0.00 55.73 54.77 1ntm s ARG 71 Cb 0.45 0.42 -0.01 0.00 0.52 0.00 0.00 34.95 36.34 1ntm s ARG 71 CO -0.28 -0.42 0.06 0.21 0.02 0.00 0.00 175.30 174.89 1ntm s LYS 72 N -3.89 0.35 0.00 3.54 2.47 -1.26 -5.09 119.74 115.87 1ntm s LYS 72 Ca 0.09 -0.40 0.00 0.00 -1.56 0.00 0.00 55.97 54.10 1ntm s LYS 72 Cb 0.03 0.14 0.00 0.00 -1.46 0.00 0.00 37.83 36.54 1ntm s LYS 72 CO -0.06 -0.07 0.00 -1.71 0.16 0.00 0.00 175.35 173.67 1ntm n ASN 73 N 1.76 0.00 -3.13 1.43 2.85 -1.26 -5.10 115.26 111.81 1ntm n ASN 73 Ca -0.22 0.00 -0.18 0.00 -0.11 0.00 0.00 54.58 54.08 1ntm n ASN 73 Cb 0.56 0.00 0.15 0.00 1.24 0.00 0.00 39.78 41.73 1ntm n ASN 73 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1ntm n PRO 74 N 0.00 -2.14 -0.69 1.20 -0.02 -1.26 -5.35 135.00 126.74 1ntm n PRO 74 Ca 0.00 -1.05 0.00 0.00 -2.02 0.00 0.00 63.50 60.43 1ntm n PRO 74 Cb 0.00 -0.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 1ntm n PRO 74 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48