#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pmz n SER 2 N 0.00 1.27 0.00 3.17 3.41 -1.26 -4.94 113.62 115.27 2pmz n SER 2 Ca 0.00 -1.34 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 2pmz n SER 2 Cb 0.00 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 2pmz n SER 2 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2pmz n SER 3 N -2.02 0.00 0.00 4.04 3.41 -1.26 -4.05 113.62 113.74 2pmz n SER 3 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2pmz n SER 3 Cb 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2pmz n SER 3 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2pmz n VAL 4 N 0.00 0.00 -3.85 -3.33 0.31 -1.26 -5.16 118.33 105.03 2pmz n VAL 4 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 2pmz n VAL 4 Cb 0.00 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 32.95 2pmz n VAL 4 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2pmz s TYR 5 N -0.67 0.09 -0.01 3.52 1.51 -1.26 -5.05 117.35 115.48 2pmz s TYR 5 Ca 0.00 -0.60 -0.00 0.00 -1.01 0.00 0.00 57.07 55.46 2pmz s TYR 5 Cb 0.00 0.75 0.01 0.00 -0.11 0.00 0.00 41.96 42.61 2pmz s TYR 5 CO 0.00 -1.17 0.01 0.42 -1.11 0.00 0.00 175.55 173.70 2pmz s ILE 6 N -2.22 -0.01 0.00 2.71 1.01 -1.26 -5.04 121.20 116.39 2pmz s ILE 6 Ca 0.19 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2pmz s ILE 6 Cb -0.04 -0.04 0.00 0.00 0.01 0.00 0.00 42.46 42.40 2pmz s ILE 6 CO 0.08 0.02 0.00 0.52 0.00 0.00 0.00 174.94 175.55 2pmz n VAL 7 N 3.30 0.00 -4.04 2.92 0.31 -1.26 -5.03 118.33 114.54 2pmz n VAL 7 Ca -0.15 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 63.93 2pmz n VAL 7 Cb 0.58 -0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.47 2pmz n VAL 7 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2pmz s GLU 8 N 0.29 3.11 -0.13 5.55 2.02 -1.26 -5.13 118.70 123.15 2pmz s GLU 8 Ca 0.00 -0.82 -0.09 0.00 0.02 0.00 0.00 54.97 54.08 2pmz s GLU 8 Cb 0.00 -2.74 0.04 0.00 0.10 0.00 0.00 34.13 31.53 2pmz s GLU 8 CO 0.00 0.47 0.32 -2.00 0.02 0.00 0.00 175.26 174.08 2pmz s GLU 9 N -3.35 0.33 -0.14 1.61 2.12 -1.26 -5.16 118.70 112.84 2pmz s GLU 9 Ca 0.33 0.56 -0.15 0.00 0.36 0.00 0.00 54.97 56.07 2pmz s GLU 9 Cb -0.10 0.04 0.04 0.00 0.26 0.00 0.00 34.13 34.37 2pmz s GLU 9 CO 0.26 -0.11 0.41 -1.01 -0.54 0.00 0.00 175.26 174.27 2pmz s HIS 10 N 0.82 -0.44 0.38 5.30 3.76 -1.26 -5.17 115.29 118.69 2pmz s HIS 10 Ca -0.05 1.03 -0.25 0.00 -0.15 0.00 0.00 55.06 55.64 2pmz s HIS 10 Cb -0.06 0.16 -0.09 0.00 1.11 0.00 0.00 32.58 33.69 2pmz s HIS 10 CO -0.06 -0.25 1.03 0.71 -0.85 0.00 0.00 174.74 175.33 2pmz s TYR 11 N 0.03 3.35 0.08 1.40 1.51 -1.26 -5.08 117.35 117.37 2pmz s TYR 11 Ca -0.02 1.67 0.08 0.00 -1.01 0.00 0.00 57.07 57.79 2pmz s TYR 11 Cb -0.03 -3.10 -0.04 0.00 -0.11 0.00 0.00 41.96 38.68 2pmz s TYR 11 CO 0.01 -0.49 -0.17 0.42 -1.11 0.00 0.00 175.55 174.21 2pmz s ILE 12 N -1.63 2.86 0.19 2.71 1.01 -1.26 -4.95 121.20 120.13 2pmz s ILE 12 Ca 0.56 -1.32 -0.16 0.00 0.00 0.00 0.00 60.65 59.73 2pmz s ILE 12 Cb -0.22 -2.26 -0.08 0.00 0.01 0.00 0.00 42.46 39.92 2pmz s ILE 12 CO 0.28 0.23 0.62 -2.16 0.00 0.00 0.00 174.94 173.90 2pmz s PRO 13 N -1.78 4.06 0.03 2.79 0.04 -1.26 -4.82 135.00 134.06 2pmz s PRO 13 Ca 0.16 0.61 -0.07 0.00 0.04 0.00 0.00 61.00 61.75 2pmz s PRO 13 Cb -0.11 -2.84 -0.02 0.00 0.04 0.00 0.00 34.50 31.58 2pmz s PRO 13 CO 0.08 0.41 0.63 0.66 0.04 0.00 0.00 177.00 178.81 2pmz n TYR 14 N 0.59 -0.10 -0.37 0.56 4.02 -1.26 -0.03 117.16 120.57 2pmz n TYR 14 Ca -0.03 0.27 0.32 0.00 -0.01 0.00 0.00 57.90 58.45 2pmz n TYR 14 Cb 0.52 -0.38 0.64 0.00 -0.02 0.00 0.00 39.34 40.10 2pmz n TYR 14 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2pmz h SER 15 N 0.00 0.22 0.05 7.72 4.64 -1.84 -2.63 113.55 121.71 2pmz h SER 15 Ca 0.03 0.06 -0.20 0.00 -0.47 0.00 0.00 61.79 61.22 2pmz h SER 15 Cb 0.09 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 2pmz h SER 15 CO -0.20 -0.00 -1.03 0.58 -0.87 0.00 0.00 176.83 175.30 2pmz h VAL 16 N 0.17 1.17 0.00 0.95 2.07 -0.74 -3.32 116.25 116.54 2pmz h VAL 16 Ca 0.65 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.86 2pmz h VAL 16 Cb 2.14 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 34.62 2pmz h VAL 16 CO -0.20 0.55 0.00 0.00 0.02 0.00 0.00 177.57 177.94 2pmz n ALA 17 N -3.04 1.46 -0.09 1.67 0.00 -0.87 -0.67 120.51 118.97 2pmz n ALA 17 Ca -0.24 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.07 2pmz n ALA 17 Cb 0.73 -0.97 -0.08 0.00 0.00 0.00 0.00 19.45 19.13 2pmz n ALA 17 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2pmz n LYS 18 N -0.59 0.43 0.23 0.00 5.02 -1.20 -4.15 118.16 117.90 2pmz n LYS 18 Ca 0.00 0.11 0.07 0.00 -2.02 0.00 0.00 58.31 56.47 2pmz n LYS 18 Cb 0.00 -1.33 0.55 0.00 -0.02 0.00 0.00 35.03 34.23 2pmz n LYS 18 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2pmz h LYS 19 N -0.08 0.00 0.00 1.97 1.79 -1.01 0.77 116.57 120.02 2pmz h LYS 19 Ca -0.40 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 57.89 2pmz h LYS 19 Cb 1.58 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.21 2pmz h LYS 19 CO -0.09 0.16 -0.82 -0.07 -1.08 0.00 0.00 179.45 177.54 2pmz h LEU 20 N 0.00 0.00 0.00 2.94 3.38 -1.75 -3.22 115.31 116.66 2pmz h LEU 20 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 2pmz h LEU 20 Cb 0.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2pmz h LEU 20 CO 0.02 0.82 -1.00 -0.07 0.09 0.00 0.00 178.44 178.31 2pmz h LEU 21 N 0.00 0.00 -0.75 1.67 3.38 -1.48 -3.27 115.31 114.86 2pmz h LEU 21 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2pmz h LEU 21 Cb 1.49 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.20 2pmz h LEU 21 CO 0.11 0.42 0.26 0.74 0.09 0.00 0.00 178.44 180.06 2pmz h THR 22 N 0.00 1.26 0.00 0.22 2.02 -0.91 0.33 112.91 115.84 2pmz h THR 22 Ca -0.08 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.23 2pmz h THR 22 Cb 1.39 0.41 -0.00 0.00 -1.74 0.00 0.00 68.15 68.21 2pmz h THR 22 CO 0.04 0.35 -0.01 0.44 0.37 0.00 0.00 175.52 176.71 2pmz h ASP 23 N 1.10 0.00 1.48 4.18 3.32 -1.61 -1.71 116.42 123.18 2pmz h ASP 23 Ca 0.25 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.23 2pmz h ASP 23 Cb 0.27 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2pmz h ASP 23 CO -0.01 0.01 -0.53 0.58 -1.72 0.00 0.00 179.24 177.57 2pmz h VAL 24 N 0.00 0.42 -0.21 -1.35 2.07 -0.41 -2.94 116.25 113.81 2pmz h VAL 24 Ca -0.00 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 65.89 2pmz h VAL 24 Cb 0.07 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 2pmz h VAL 24 CO 0.00 0.24 0.00 -0.38 0.02 0.00 0.00 177.57 177.45 2pmz n ILE 25 N -3.06 0.27 0.07 4.57 5.41 -0.66 -2.63 119.36 123.34 2pmz n ILE 25 Ca 0.01 -0.41 -0.19 0.00 1.00 0.00 0.00 62.75 63.15 2pmz n ILE 25 Cb 0.66 0.44 -0.10 0.00 -0.71 0.00 0.00 39.64 39.92 2pmz n ILE 25 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 2pmz h ARG 26 N 2.50 0.57 0.00 0.38 3.08 -1.38 -3.31 114.38 116.21 2pmz h ARG 26 Ca 0.00 -0.70 0.00 0.00 0.07 0.00 0.00 59.98 59.35 2pmz h ARG 26 Cb 0.55 0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.82 2pmz h ARG 26 CO 0.00 1.30 -1.25 -1.13 -1.07 0.00 0.00 179.97 177.81 2pmz n SER 27 N -3.78 0.54 0.00 7.04 3.41 -1.19 -5.05 113.62 114.60 2pmz n SER 27 Ca -0.11 -0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 2pmz n SER 27 Cb 0.93 1.06 0.00 0.00 -0.26 0.00 0.00 64.21 65.94 2pmz n SER 27 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2pmz n GLY 28 N 1.34 2.09 0.00 5.00 0.00 -1.08 -5.15 105.19 107.38 2pmz n GLY 28 Ca 0.01 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2pmz n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pmz n GLY 29 N -0.55 -0.18 0.00 -0.02 0.00 -1.26 -3.83 105.19 99.35 2pmz n GLY 29 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2pmz n GLY 29 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2pmz n SER 30 N 0.00 0.00 -0.14 1.61 3.41 -1.26 -4.95 113.62 112.29 2pmz n SER 30 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2pmz n SER 30 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2pmz n SER 30 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2pmz n SER 31 N 0.00 0.00 -0.02 4.04 3.41 -1.26 -4.95 113.62 114.84 2pmz n SER 31 Ca 0.00 -0.14 -0.10 0.00 -0.26 0.00 0.00 58.87 58.37 2pmz n SER 31 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 2pmz n SER 31 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2pmz h ASN 32 N 0.00 -1.04 -1.81 4.04 2.35 -2.03 0.15 115.58 117.24 2pmz h ASN 32 Ca 0.00 0.16 -0.72 0.00 -0.55 0.00 0.00 56.30 55.18 2pmz h ASN 32 Cb 0.00 0.45 -0.26 0.00 0.05 0.00 0.00 38.32 38.56 2pmz h ASN 32 CO 0.00 -0.36 0.95 0.18 -1.65 0.00 0.00 177.43 176.56 2pmz n LEU 33 N -5.41 7.37 0.00 1.61 4.77 -1.26 -4.16 117.00 119.92 2pmz n LEU 33 Ca -0.03 -4.69 0.00 0.00 -0.03 0.00 0.00 56.01 51.26 2pmz n LEU 33 Cb 0.33 -1.09 0.00 0.00 -2.33 0.00 0.00 43.42 40.33 2pmz n LEU 33 CO 0.14 1.74 0.00 0.18 -1.33 0.00 0.00 177.39 178.12 2pmz n LEU 34 N -0.32 0.00 -0.08 2.23 4.77 -1.02 -4.98 117.00 117.60 2pmz n LEU 34 Ca 0.53 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.40 2pmz n LEU 34 Cb 0.30 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.34 2pmz n LEU 34 CO 0.49 0.00 0.80 1.56 -1.33 0.00 0.00 177.39 178.91 2pmz h GLN 35 N 0.00 0.39 -0.83 3.23 4.20 -0.87 -3.24 115.11 117.99 2pmz h GLN 35 Ca 0.00 -0.11 0.07 0.00 0.06 0.00 0.00 58.65 58.68 2pmz h GLN 35 Cb 0.00 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 27.67 2pmz h GLN 35 CO 0.00 0.53 0.50 0.00 -0.67 0.00 0.00 178.83 179.19 2pmz h ARG 36 N 0.20 0.85 -0.06 1.46 3.08 -1.81 0.65 114.38 118.75 2pmz h ARG 36 Ca 0.07 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.09 2pmz h ARG 36 Cb 0.33 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 2pmz h ARG 36 CO 0.01 0.56 0.06 1.15 -1.07 0.00 0.00 179.97 180.68 2pmz h THR 37 N 0.88 0.57 0.00 2.04 2.02 -1.93 2.42 112.91 118.91 2pmz h THR 37 Ca 0.38 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.56 2pmz h THR 37 Cb 0.25 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 2pmz h THR 37 CO -0.20 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.47 2pmz n TYR 38 N -3.93 0.00 0.02 3.16 0.53 0.21 -2.99 117.16 114.15 2pmz n TYR 38 Ca -0.02 0.00 -0.02 0.00 -1.02 0.00 0.00 57.90 56.85 2pmz n TYR 38 Cb 0.16 -0.49 -0.01 0.00 -1.03 0.00 0.00 39.34 37.98 2pmz n TYR 38 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 2pmz n ASP 39 N -1.49 0.96 -0.28 7.72 9.92 0.39 -4.14 116.55 129.63 2pmz n ASP 39 Ca 0.06 0.13 0.06 0.00 -0.53 0.00 0.00 54.79 54.51 2pmz n ASP 39 Cb 0.28 -0.31 0.15 0.00 -0.64 0.00 0.00 41.12 40.60 2pmz n ASP 39 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2pmz h TYR 40 N -0.13 -0.22 0.37 1.24 3.20 0.34 -0.22 116.97 121.55 2pmz h TYR 40 Ca -0.03 0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 2pmz h TYR 40 Cb 0.39 0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.89 2pmz h TYR 40 CO -0.04 -0.32 -0.18 -0.07 -1.64 0.00 0.00 178.16 175.91 2pmz h LEU 41 N 0.04 -0.43 -4.51 2.82 3.38 -1.71 -3.21 115.31 111.70 2pmz h LEU 41 Ca 0.43 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 2pmz h LEU 41 Cb 0.75 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2pmz h LEU 41 CO -0.78 -0.01 0.24 0.59 0.09 0.00 0.00 178.44 178.57 2pmz n ASN 42 N -5.14 0.80 0.00 -0.43 4.13 -0.13 -0.56 115.26 113.93 2pmz n ASN 42 Ca -0.09 -1.50 0.00 0.00 1.68 0.00 0.00 54.58 54.67 2pmz n ASN 42 Cb 0.28 -0.20 0.00 0.00 -1.54 0.00 0.00 39.78 38.32 2pmz n ASN 42 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2pmz n SER 43 N 2.59 0.00 -1.12 6.41 3.41 -1.00 -4.83 113.62 119.07 2pmz n SER 43 Ca 0.04 -0.92 0.03 0.00 -0.26 0.00 0.00 58.87 57.76 2pmz n SER 43 Cb 0.12 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.08 2pmz n SER 43 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2pmz n VAL 44 N 0.00 0.04 -2.21 -3.33 0.31 0.27 -5.03 118.33 108.38 2pmz n VAL 44 Ca 0.00 -0.68 -0.32 0.00 -0.01 0.00 0.00 64.34 63.33 2pmz n VAL 44 Cb 0.24 0.80 -0.04 0.00 -0.91 0.00 0.00 33.84 33.93 2pmz n VAL 44 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2pmz s GLU 45 N -0.06 2.90 0.11 5.55 2.02 -1.24 -4.76 118.70 123.22 2pmz s GLU 45 Ca 0.22 -0.74 -0.08 0.00 0.02 0.00 0.00 54.97 54.40 2pmz s GLU 45 Cb 0.25 -5.19 -0.15 0.00 0.10 0.00 0.00 34.13 29.14 2pmz s GLU 45 CO -0.11 -3.10 1.26 0.87 0.02 0.00 0.00 175.26 174.20 2pmz h LYS 46 N 10.44 0.51 0.00 1.61 1.57 -1.95 -3.47 116.57 125.28 2pmz h LYS 46 Ca 0.16 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2pmz h LYS 46 Cb 0.99 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2pmz h LYS 46 CO 1.28 1.19 0.00 0.00 -0.57 0.00 0.00 179.45 181.35 2pmz s ASP 48 N 0.38 1.74 0.11 0.00 1.47 -1.26 -4.71 116.67 114.40 2pmz s ASP 48 Ca 0.00 -1.69 -0.26 0.00 1.18 0.00 0.00 52.55 51.78 2pmz s ASP 48 Cb 0.00 0.52 -0.08 0.00 -0.34 0.00 0.00 42.92 43.02 2pmz s ASP 48 CO 0.00 -1.00 1.65 0.00 0.68 0.00 0.00 175.17 176.50 2pmz h ALA 49 N 2.12 -0.37 0.00 2.11 0.00 -1.93 2.80 119.26 123.99 2pmz h ALA 49 Ca -0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2pmz h ALA 49 Cb 1.24 0.38 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2pmz h ALA 49 CO 0.43 -0.76 0.00 -1.91 0.00 0.00 0.00 179.25 177.02 2pmz n GLU 50 N -5.35 0.96 0.07 0.00 2.13 -1.26 -2.02 120.64 115.16 2pmz n GLU 50 Ca -0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.76 2pmz n GLU 50 Cb 0.27 -1.02 0.00 0.00 0.27 0.00 0.00 31.44 30.95 2pmz n GLU 50 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2pmz n SER 51 N 0.68 -0.99 -0.14 4.31 3.41 -0.73 -4.87 113.62 115.28 2pmz n SER 51 Ca 0.00 0.25 -0.12 0.00 -0.26 0.00 0.00 58.87 58.75 2pmz n SER 51 Cb 0.48 1.19 -0.01 0.00 -0.26 0.00 0.00 64.21 65.60 2pmz n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pmz h ALA 52 N 0.00 0.60 0.00 7.33 0.00 0.49 0.30 119.26 127.99 2pmz h ALA 52 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2pmz h ALA 52 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2pmz h ALA 52 CO 0.00 0.57 0.00 1.04 0.00 0.00 0.00 179.25 180.86 2pmz n GLN 53 N -4.19 0.47 -0.02 0.00 6.02 -0.85 0.19 117.38 118.99 2pmz n GLN 53 Ca -0.01 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 57.01 2pmz n GLN 53 Cb 0.44 -1.47 -0.09 0.00 1.02 0.00 0.00 30.24 30.13 2pmz n GLN 53 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2pmz n LYS 54 N -0.97 0.87 0.26 -1.09 4.81 -0.27 -3.93 118.16 117.84 2pmz n LYS 54 Ca 0.11 -0.08 0.14 0.00 -0.87 0.00 0.00 58.31 57.61 2pmz n LYS 54 Cb 0.05 -1.28 0.70 0.00 0.02 0.00 0.00 35.03 34.52 2pmz n LYS 54 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2pmz h VAL 55 N 0.00 0.37 0.14 3.15 2.07 0.34 0.49 116.25 122.81 2pmz h VAL 55 Ca -0.08 -0.62 -0.36 0.00 0.82 0.00 0.00 66.70 66.46 2pmz h VAL 55 Cb 0.86 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 2pmz h VAL 55 CO 0.00 0.10 -1.90 0.40 0.02 0.00 0.00 177.57 176.20 2pmz h ILE 56 N 0.00 0.73 0.00 4.57 2.04 -1.70 -3.31 117.51 119.84 2pmz h ILE 56 Ca -0.00 -2.39 0.00 0.00 1.00 0.00 0.00 64.86 63.47 2pmz h ILE 56 Cb 0.44 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 39.11 2pmz h ILE 56 CO 0.01 0.88 0.00 -0.62 0.00 0.00 0.00 178.15 178.42 2pmz n GLU 57 N -3.55 0.00 0.00 2.37 1.02 -0.84 -1.84 120.64 117.80 2pmz n GLU 57 Ca -0.30 0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2pmz n GLU 57 Cb 1.05 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 31.19 2pmz n GLU 57 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2pmz n GLU 58 N -1.34 0.00 0.04 3.49 1.02 0.10 0.07 120.64 124.02 2pmz n GLU 58 Ca 0.00 0.16 -0.21 0.00 -0.02 0.00 0.00 57.16 57.08 2pmz n GLU 58 Cb 0.00 -1.60 -0.14 0.00 -0.02 0.00 0.00 31.44 29.68 2pmz n GLU 58 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2pmz h LEU 59 N 0.00 0.49 0.00 -4.62 6.46 -1.51 -3.34 115.31 112.78 2pmz h LEU 59 Ca 0.00 -0.89 0.00 0.00 -0.12 0.00 0.00 57.88 56.87 2pmz h LEU 59 Cb 0.20 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 39.97 2pmz h LEU 59 CO 0.00 1.78 0.00 -1.54 -0.62 0.00 0.00 178.44 178.06 2pmz n SER 60 N -3.51 0.00 0.03 1.25 3.41 0.11 -1.13 113.62 113.77 2pmz n SER 60 Ca -0.28 -0.02 0.08 0.00 -0.26 0.00 0.00 58.87 58.40 2pmz n SER 60 Cb 1.06 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 65.36 2pmz n SER 60 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2pmz n ASN 61 N -0.76 0.13 -0.06 4.04 4.13 -1.25 -0.78 115.26 120.71 2pmz n ASN 61 Ca 0.00 0.53 -0.01 0.00 1.68 0.00 0.00 54.58 56.78 2pmz n ASN 61 Cb 0.00 -0.56 -0.16 0.00 -1.54 0.00 0.00 39.78 37.53 2pmz n ASN 61 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2pmz n ILE 62 N -1.64 0.76 -3.57 2.41 5.41 -0.29 -5.01 119.36 117.43 2pmz n ILE 62 Ca 0.03 -0.67 -0.20 0.00 1.00 0.00 0.00 62.75 62.91 2pmz n ILE 62 Cb 0.19 -0.27 0.07 0.00 -0.71 0.00 0.00 39.64 38.91 2pmz n ILE 62 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2pmz n VAL 63 N -2.50 -4.89 0.00 1.39 0.31 0.04 -5.00 118.33 107.68 2pmz n VAL 63 Ca -0.20 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.72 2pmz n VAL 63 Cb 0.88 -4.34 0.00 0.00 -0.91 0.00 0.00 33.84 29.47 2pmz n VAL 63 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2pmz n SER 64 N -3.07 0.00 -3.60 4.52 3.41 -1.26 -5.08 113.62 108.53 2pmz n SER 64 Ca -0.24 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.21 2pmz n SER 64 Cb 0.65 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.53 2pmz n SER 64 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2pmz s ARG 65 N 0.00 0.94 0.28 4.33 1.81 -1.26 -5.09 118.95 119.96 2pmz s ARG 65 Ca 0.00 0.07 0.00 0.00 -1.72 0.00 0.00 55.73 54.09 2pmz s ARG 65 Cb 0.00 0.44 0.41 0.00 -0.45 0.00 0.00 34.95 35.35 2pmz s ARG 65 CO 0.00 -0.29 1.77 1.49 -0.68 0.00 0.00 175.30 177.59 2pmz h GLU 66 N 3.24 0.65 0.00 3.54 4.81 -1.99 -3.15 114.58 121.67 2pmz h GLU 66 Ca -0.28 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2pmz h GLU 66 Cb 1.16 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2pmz h GLU 66 CO 0.40 0.72 0.00 -0.25 -0.73 0.00 0.00 179.01 179.15 2pmz n ASP 67 N -4.20 0.00 -0.25 1.04 8.00 -1.26 -3.13 116.55 116.75 2pmz n ASP 67 Ca 0.01 0.87 0.28 0.00 0.71 0.00 0.00 54.79 56.67 2pmz n ASP 67 Cb 0.32 -0.37 0.67 0.00 -0.02 0.00 0.00 41.12 41.72 2pmz n ASP 67 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2pmz h VAL 68 N 0.00 0.52 0.00 2.53 2.07 -1.95 0.34 116.25 119.76 2pmz h VAL 68 Ca 0.00 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2pmz h VAL 68 Cb 0.00 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2pmz h VAL 68 CO 0.00 0.02 -0.04 0.03 0.02 0.00 0.00 177.57 177.60 2pmz h ARG 69 N 0.12 0.00 -0.04 1.57 3.08 -1.51 -2.31 114.38 115.29 2pmz h ARG 69 Ca 0.50 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.41 2pmz h ARG 69 Cb 1.77 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.82 2pmz h ARG 69 CO -0.08 0.04 -0.52 0.00 -1.07 0.00 0.00 179.97 178.35 2pmz h ALA 70 N 1.96 0.11 0.00 0.04 0.00 -0.26 -1.84 119.26 119.27 2pmz h ALA 70 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2pmz h ALA 70 Cb 0.09 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2pmz h ALA 70 CO 0.01 0.32 0.00 -0.89 0.00 0.00 0.00 179.25 178.69 2pmz n ILE 71 N -4.26 0.24 -0.07 0.00 5.41 -0.90 -2.23 119.36 117.55 2pmz n ILE 71 Ca -0.09 0.06 -0.11 0.00 1.00 0.00 0.00 62.75 63.61 2pmz n ILE 71 Cb 0.62 -0.89 -0.07 0.00 -0.71 0.00 0.00 39.64 38.60 2pmz n ILE 71 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2pmz n LEU 72 N -1.09 2.74 -1.01 1.39 4.77 -1.04 -3.44 117.00 119.32 2pmz n LEU 72 Ca 0.07 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2pmz n LEU 72 Cb 0.05 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 2pmz n LEU 72 CO 0.07 0.69 0.45 0.00 -1.33 0.00 0.00 177.39 177.27 2pmz n ALA 73 N -3.03 2.40 0.07 -1.18 0.00 -0.70 -1.70 120.51 116.37 2pmz n ALA 73 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2pmz n ALA 73 Cb 0.77 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.22 2pmz n ALA 73 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2pmz n SER 74 N 0.57 -0.15 0.10 0.00 3.41 -1.17 -4.33 113.62 112.05 2pmz n SER 74 Ca 0.00 0.24 -0.03 0.00 -0.26 0.00 0.00 58.87 58.82 2pmz n SER 74 Cb 0.44 0.25 0.19 0.00 -0.26 0.00 0.00 64.21 64.84 2pmz n SER 74 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2pmz h ILE 75 N 0.00 1.34 -6.00 -1.33 1.08 -1.62 -3.41 117.51 107.58 2pmz h ILE 75 Ca 0.00 -1.71 0.00 0.00 -0.39 0.00 0.00 64.86 62.76 2pmz h ILE 75 Cb 0.00 1.83 -0.02 0.00 -3.07 0.00 0.00 36.82 35.56 2pmz h ILE 75 CO 0.00 0.50 -0.58 0.00 -0.69 0.00 0.00 178.15 177.38 2pmz n PRO 77 N 1.92 -1.76 0.00 0.00 -0.04 -1.26 -5.06 135.00 128.79 2pmz n PRO 77 Ca -0.05 -0.93 0.00 0.00 -0.04 0.00 0.00 63.50 62.48 2pmz n PRO 77 Cb 0.24 -0.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.89 2pmz n PRO 77 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2pmz n THR 78 N -3.52 0.00 -4.11 0.52 -1.04 -1.26 -5.04 114.28 99.83 2pmz n THR 78 Ca 0.08 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.97 2pmz n THR 78 Cb 0.30 0.13 -0.07 0.00 -1.82 0.00 0.00 70.33 68.87 2pmz n THR 78 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2pmz s THR 79 N -0.74 0.00 -2.00 12.58 2.01 -1.26 -5.00 115.64 121.23 2pmz s THR 79 Ca 0.00 -1.70 0.06 0.00 0.31 0.00 0.00 61.69 60.36 2pmz s THR 79 Cb 0.00 -2.43 0.17 0.00 0.01 0.00 0.00 72.50 70.25 2pmz s THR 79 CO 0.00 0.00 0.76 -1.54 -0.69 0.00 0.00 174.62 173.15 2pmz n SER 80 N -0.67 0.00 -0.10 3.53 3.41 -1.26 -1.47 113.62 117.06 2pmz n SER 80 Ca 0.01 -0.36 -0.20 0.00 -0.26 0.00 0.00 58.87 58.05 2pmz n SER 80 Cb 0.63 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.51 2pmz n SER 80 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2pmz n ASP 81 N -0.84 1.52 0.32 4.04 8.00 -1.26 -2.96 116.55 125.37 2pmz n ASP 81 Ca 0.05 0.20 0.21 0.00 0.71 0.00 0.00 54.79 55.96 2pmz n ASP 81 Cb 0.02 -0.55 1.07 0.00 -0.02 0.00 0.00 41.12 41.64 2pmz n ASP 81 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2pmz h GLU 82 N -0.63 0.00 0.00 -1.24 5.08 -1.82 0.76 114.58 116.73 2pmz h GLU 82 Ca -0.49 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.76 2pmz h GLU 82 Cb 1.46 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.69 2pmz h GLU 82 CO -0.28 0.01 -1.28 0.28 -1.00 0.00 0.00 179.01 176.74 2pmz n VAL 83 N -3.14 0.97 0.01 3.13 0.31 -0.54 -4.09 118.33 114.98 2pmz n VAL 83 Ca -0.02 -0.64 -0.13 0.00 -0.01 0.00 0.00 64.34 63.54 2pmz n VAL 83 Cb 0.13 -0.58 -0.09 0.00 -0.91 0.00 0.00 33.84 32.39 2pmz n VAL 83 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2pmz h ARG 84 N 0.00 -0.07 -0.66 5.55 2.43 0.54 -3.08 114.38 119.09 2pmz h ARG 84 Ca -0.10 0.00 0.19 0.00 -0.81 0.00 0.00 59.98 59.26 2pmz h ARG 84 Cb 1.37 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.91 2pmz h ARG 84 CO 0.03 0.38 0.49 0.66 -1.51 0.00 0.00 179.97 180.02 2pmz h SER 85 N -0.54 0.00 1.58 -3.80 4.64 -1.11 0.31 113.55 114.64 2pmz h SER 85 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2pmz h SER 85 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2pmz h SER 85 CO 0.01 0.00 -0.06 0.40 -0.87 0.00 0.00 176.83 176.31 2pmz h ILE 86 N 0.00 0.00 -0.92 0.95 2.04 -1.69 -3.42 117.51 114.47 2pmz h ILE 86 Ca 0.31 -0.64 -0.36 0.00 1.00 0.00 0.00 64.86 65.17 2pmz h ILE 86 Cb 1.29 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 38.92 2pmz h ILE 86 CO -0.00 0.00 0.90 -0.22 0.00 0.00 0.00 178.15 178.82 2pmz s LEU 87 N -5.02 3.22 1.26 1.44 0.20 0.11 -4.96 118.68 114.93 2pmz s LEU 87 Ca 0.09 -0.67 -0.20 0.00 0.69 0.00 0.00 54.13 54.04 2pmz s LEU 87 Cb 0.10 -2.56 0.31 0.00 -0.43 0.00 0.00 46.19 43.61 2pmz s LEU 87 CO 0.63 -2.54 1.07 -0.69 -0.29 0.00 0.00 176.35 174.53 2pmz s VAL 88 N 9.27 1.49 -2.00 1.68 1.01 -1.26 -5.05 120.40 125.54 2pmz s VAL 88 Ca 0.66 0.00 0.11 0.00 0.00 0.00 0.00 61.98 62.75 2pmz s VAL 88 Cb -0.06 -2.38 0.31 0.00 0.00 0.00 0.00 36.38 34.24 2pmz s VAL 88 CO 0.00 0.00 1.09 0.23 0.00 0.00 0.00 175.10 176.43