#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 1.36 0.00 3.17 3.41 -1.26 -4.94 113.62 115.36 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 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.92 0.00 0.00 4.04 3.41 -1.26 -4.05 113.62 113.84 2pmz n SER 3 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 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 -3.86 -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 -0.60 0.09 -0.01 3.52 1.51 -1.26 -5.06 117.35 115.55 2pmz s TYR 5 Ca 0.00 -0.60 -0.01 0.00 -1.01 0.00 0.00 57.07 55.45 2pmz s TYR 5 Cb 0.00 0.76 0.01 0.00 -0.11 0.00 0.00 41.96 42.61 2pmz s TYR 5 CO 0.00 -1.17 0.02 0.42 -1.11 0.00 0.00 175.55 173.71 2pmz s ILE 6 N -2.20 -0.01 0.00 2.71 1.01 -1.26 -5.04 121.20 116.41 2pmz s ILE 6 Ca 0.20 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.90 2pmz s ILE 6 Cb -0.04 -0.05 0.00 0.00 0.01 0.00 0.00 42.46 42.38 2pmz s ILE 6 CO 0.08 0.02 0.00 0.52 0.00 0.00 0.00 174.94 175.56 2pmz n VAL 7 N 3.35 0.00 -4.08 2.92 0.31 -1.26 -5.03 118.33 114.54 2pmz n VAL 7 Ca -0.16 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 63.92 2pmz n VAL 7 Cb 0.57 -0.02 -0.05 0.00 -0.91 0.00 0.00 33.84 33.43 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 0.24 2.94 -0.13 5.55 2.02 -1.26 -5.13 118.70 122.93 2pmz s GLU 8 Ca 0.00 -0.90 -0.10 0.00 0.02 0.00 0.00 54.97 53.99 2pmz s GLU 8 Cb 0.00 -2.64 0.04 0.00 0.10 0.00 0.00 34.13 31.63 2pmz s GLU 8 CO 0.00 0.46 0.33 -2.00 0.02 0.00 0.00 175.26 174.08 2pmz s GLU 9 N -3.31 0.35 -0.15 1.61 2.12 -1.26 -5.16 118.70 112.90 2pmz s GLU 9 Ca 0.32 0.55 -0.16 0.00 0.36 0.00 0.00 54.97 56.04 2pmz s GLU 9 Cb -0.10 0.08 0.04 0.00 0.26 0.00 0.00 34.13 34.41 2pmz s GLU 9 CO 0.24 -0.10 0.44 -1.01 -0.54 0.00 0.00 175.26 174.30 2pmz s HIS 10 N 0.68 -0.46 0.36 5.30 3.76 -1.26 -5.17 115.29 118.50 2pmz s HIS 10 Ca -0.04 1.10 -0.25 0.00 -0.15 0.00 0.00 55.06 55.71 2pmz s HIS 10 Cb -0.05 0.17 -0.09 0.00 1.11 0.00 0.00 32.58 33.71 2pmz s HIS 10 CO -0.04 -0.27 1.02 0.71 -0.85 0.00 0.00 174.74 175.31 2pmz s TYR 11 N 0.02 3.43 0.07 1.40 1.51 -1.26 -5.08 117.35 117.44 2pmz s TYR 11 Ca -0.02 1.69 0.07 0.00 -1.01 0.00 0.00 57.07 57.81 2pmz s TYR 11 Cb -0.03 -3.08 -0.04 0.00 -0.11 0.00 0.00 41.96 38.70 2pmz s TYR 11 CO 0.01 -0.35 -0.16 0.42 -1.11 0.00 0.00 175.55 174.36 2pmz s ILE 12 N -1.60 2.92 0.19 2.71 1.01 -1.26 -4.94 121.20 120.24 2pmz s ILE 12 Ca 0.54 -1.27 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 2pmz s ILE 12 Cb -0.22 -2.28 -0.08 0.00 0.01 0.00 0.00 42.46 39.89 2pmz s ILE 12 CO 0.28 0.24 0.64 -2.16 0.00 0.00 0.00 174.94 173.94 2pmz s PRO 13 N -1.74 4.12 0.03 2.79 0.04 -1.26 -4.82 135.00 134.16 2pmz s PRO 13 Ca 0.17 0.69 -0.05 0.00 0.04 0.00 0.00 61.00 61.85 2pmz s PRO 13 Cb -0.11 -2.90 -0.01 0.00 0.04 0.00 0.00 34.50 31.53 2pmz s PRO 13 CO 0.08 0.43 0.55 0.66 0.04 0.00 0.00 177.00 178.76 2pmz n TYR 14 N 0.75 -0.07 -0.37 0.56 4.02 -1.26 -0.03 117.16 120.75 2pmz n TYR 14 Ca -0.04 0.21 0.31 0.00 -0.01 0.00 0.00 57.90 58.38 2pmz n TYR 14 Cb 0.51 -0.34 0.63 0.00 -0.02 0.00 0.00 39.34 40.12 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 0.25 0.04 7.72 4.64 -1.84 -2.76 113.55 121.60 2pmz h SER 15 Ca 0.03 0.07 -0.17 0.00 -0.47 0.00 0.00 61.79 61.25 2pmz h SER 15 Cb 0.07 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 2pmz h SER 15 CO -0.16 -0.01 -0.88 0.58 -0.87 0.00 0.00 176.83 175.49 2pmz h VAL 16 N 0.18 1.25 0.00 0.95 2.07 -0.74 -3.31 116.25 116.66 2pmz h VAL 16 Ca 0.66 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.87 2pmz h VAL 16 Cb 2.11 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 34.66 2pmz h VAL 16 CO -0.23 0.54 0.00 0.00 0.02 0.00 0.00 177.57 177.90 2pmz n ALA 17 N -3.00 1.39 -0.10 1.67 0.00 -0.91 -0.50 120.51 119.06 2pmz n ALA 17 Ca -0.22 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.07 2pmz n ALA 17 Cb 0.69 -0.92 -0.09 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 -0.61 0.47 0.24 0.00 5.02 -1.21 -4.09 118.16 117.97 2pmz n LYS 18 Ca 0.00 0.12 0.07 0.00 -2.02 0.00 0.00 58.31 56.48 2pmz n LYS 18 Cb 0.00 -1.36 0.56 0.00 -0.02 0.00 0.00 35.03 34.21 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 -0.11 0.00 0.00 1.97 1.79 -0.89 0.62 116.57 119.94 2pmz h LYS 19 Ca -0.44 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 57.86 2pmz h LYS 19 Cb 1.63 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.25 2pmz h LYS 19 CO -0.10 0.15 -0.79 -0.07 -1.08 0.00 0.00 179.45 177.55 2pmz h LEU 20 N 0.00 0.00 0.00 2.94 3.38 -1.73 -3.22 115.31 116.68 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 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2pmz h LEU 20 CO 0.02 0.79 -1.00 -0.07 0.09 0.00 0.00 178.44 178.27 2pmz h LEU 21 N 0.00 0.00 -0.70 1.67 3.38 -1.45 -3.30 115.31 114.91 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 1.41 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.13 2pmz h LEU 21 CO 0.10 0.40 0.25 0.74 0.09 0.00 0.00 178.44 180.02 2pmz h THR 22 N 0.00 1.25 0.00 0.22 2.02 -0.93 0.28 112.91 115.75 2pmz h THR 22 Ca -0.08 -0.84 -0.00 0.00 0.77 0.00 0.00 66.41 66.26 2pmz h THR 22 Cb 1.38 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 2pmz h THR 22 CO 0.04 0.33 -0.01 0.44 0.37 0.00 0.00 175.52 176.69 2pmz h ASP 23 N 1.02 0.00 1.51 4.18 3.32 -1.63 -1.66 116.42 123.16 2pmz h ASP 23 Ca 0.23 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.23 2pmz h ASP 23 Cb 0.26 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2pmz h ASP 23 CO -0.01 0.01 -0.50 0.58 -1.72 0.00 0.00 179.24 177.59 2pmz h VAL 24 N 0.00 0.33 -0.17 -1.35 2.07 -0.54 -2.94 116.25 113.65 2pmz h VAL 24 Ca -0.00 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.01 2pmz h VAL 24 Cb 0.05 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2pmz h VAL 24 CO 0.00 0.19 0.00 -0.38 0.02 0.00 0.00 177.57 177.40 2pmz n ILE 25 N -3.04 0.21 0.06 4.57 5.41 -0.64 -2.57 119.36 123.36 2pmz n ILE 25 Ca 0.01 -0.38 -0.15 0.00 1.00 0.00 0.00 62.75 63.23 2pmz n ILE 25 Cb 0.64 0.49 -0.06 0.00 -0.71 0.00 0.00 39.64 40.00 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 2.56 0.47 0.00 0.38 3.08 -1.36 -3.30 114.38 116.21 2pmz h ARG 26 Ca 0.00 -0.51 0.00 0.00 0.07 0.00 0.00 59.98 59.54 2pmz h ARG 26 Cb 0.56 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.76 2pmz h ARG 26 CO 0.00 1.16 -1.38 -1.13 -1.07 0.00 0.00 179.97 177.55 2pmz n SER 27 N -3.76 0.48 0.00 7.04 3.41 -1.19 -5.05 113.62 114.55 2pmz n SER 27 Ca -0.08 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.28 2pmz n SER 27 Cb 0.85 1.25 0.00 0.00 -0.26 0.00 0.00 64.21 66.05 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 2.14 0.00 5.00 0.00 -1.06 -5.15 105.19 107.46 2pmz n GLY 28 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.58 -0.12 0.00 -0.02 0.00 -1.26 -3.79 105.19 99.42 2pmz n GLY 29 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.02 1.61 3.41 -1.26 -4.95 113.62 112.41 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 -0.01 4.04 3.41 -1.26 -4.95 113.62 114.85 2pmz n SER 31 Ca 0.00 -0.02 -0.10 0.00 -0.26 0.00 0.00 58.87 58.49 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 -0.97 -1.86 4.04 2.35 -2.03 0.42 115.58 117.52 2pmz h ASN 32 Ca 0.00 0.15 -0.73 0.00 -0.55 0.00 0.00 56.30 55.17 2pmz h ASN 32 Cb 0.00 0.42 -0.25 0.00 0.05 0.00 0.00 38.32 38.54 2pmz h ASN 32 CO 0.00 -0.35 0.99 0.18 -1.65 0.00 0.00 177.43 176.60 2pmz n LEU 33 N -5.41 7.36 0.00 1.61 4.77 -1.26 -4.18 117.00 119.89 2pmz n LEU 33 Ca -0.03 -4.77 0.00 0.00 -0.03 0.00 0.00 56.01 51.18 2pmz n LEU 33 Cb 0.32 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 2pmz n LEU 33 CO 0.15 1.79 0.00 0.18 -1.33 0.00 0.00 177.39 178.18 2pmz n LEU 34 N -0.23 0.00 -0.08 2.23 4.77 -1.07 -4.98 117.00 117.65 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 0.28 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.33 2pmz n LEU 34 CO 0.49 0.00 0.79 1.56 -1.33 0.00 0.00 177.39 178.90 2pmz h GLN 35 N 0.00 0.40 -0.85 3.23 4.20 -1.08 -3.22 115.11 117.78 2pmz h GLN 35 Ca 0.00 -0.11 0.08 0.00 0.06 0.00 0.00 58.65 58.68 2pmz h GLN 35 Cb 0.00 -0.04 -0.07 0.00 0.30 0.00 0.00 27.48 27.67 2pmz h GLN 35 CO 0.00 0.54 0.51 0.00 -0.67 0.00 0.00 178.83 179.20 2pmz h ARG 36 N 0.20 0.85 -0.01 1.46 3.08 -1.81 0.13 114.38 118.29 2pmz h ARG 36 Ca 0.07 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2pmz h ARG 36 Cb 0.34 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 2pmz h ARG 36 CO 0.01 0.56 0.01 1.15 -1.07 0.00 0.00 179.97 180.63 2pmz h THR 37 N 0.88 0.48 0.00 2.04 2.02 -1.93 2.22 112.91 118.62 2pmz h THR 37 Ca 0.39 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.57 2pmz h THR 37 Cb 0.29 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 2pmz h THR 37 CO -0.22 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.45 2pmz n TYR 38 N -3.78 0.10 0.01 3.16 0.53 0.45 -3.17 117.16 114.46 2pmz n TYR 38 Ca -0.03 0.03 -0.03 0.00 -1.02 0.00 0.00 57.90 56.86 2pmz n TYR 38 Cb 0.09 -0.55 -0.01 0.00 -1.03 0.00 0.00 39.34 37.84 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 -1.58 1.00 -0.29 7.72 9.92 0.41 -4.16 116.55 129.58 2pmz n ASP 39 Ca 0.06 0.14 0.08 0.00 -0.53 0.00 0.00 54.79 54.54 2pmz n ASP 39 Cb 0.31 -0.34 0.20 0.00 -0.64 0.00 0.00 41.12 40.65 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 -0.18 -0.05 0.34 1.24 3.20 0.29 -0.14 116.97 121.67 2pmz h TYR 40 Ca -0.04 0.06 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 2pmz h TYR 40 Cb 0.45 0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.88 2pmz h TYR 40 CO -0.06 -0.30 -0.16 -0.07 -1.64 0.00 0.00 178.16 175.93 2pmz h LEU 41 N 0.08 -0.39 -4.57 2.82 3.38 -1.72 -3.21 115.31 111.70 2pmz h LEU 41 Ca 0.47 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 2pmz h LEU 41 Cb 0.87 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2pmz h LEU 41 CO -0.75 0.05 0.26 0.59 0.09 0.00 0.00 178.44 178.68 2pmz n ASN 42 N -5.11 0.89 0.00 -0.43 4.13 -0.10 -0.33 115.26 114.31 2pmz n ASN 42 Ca -0.09 -1.55 0.00 0.00 1.68 0.00 0.00 54.58 54.62 2pmz n ASN 42 Cb 0.27 -0.23 0.00 0.00 -1.54 0.00 0.00 39.78 38.28 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 2.65 0.00 -1.11 6.41 3.41 -0.98 -4.82 113.62 119.17 2pmz n SER 43 Ca 0.05 -0.87 0.03 0.00 -0.26 0.00 0.00 58.87 57.82 2pmz n SER 43 Cb 0.14 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.11 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 0.08 -2.24 -3.33 0.31 0.55 -5.03 118.33 108.67 2pmz n VAL 44 Ca 0.00 -0.73 -0.32 0.00 -0.01 0.00 0.00 64.34 63.28 2pmz n VAL 44 Cb 0.22 0.78 -0.04 0.00 -0.91 0.00 0.00 33.84 33.88 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 -0.12 2.95 0.10 5.55 2.02 -1.23 -4.77 118.70 123.20 2pmz s GLU 45 Ca 0.22 -0.73 -0.08 0.00 0.02 0.00 0.00 54.97 54.40 2pmz s GLU 45 Cb 0.25 -5.20 -0.17 0.00 0.10 0.00 0.00 34.13 29.11 2pmz s GLU 45 CO -0.11 -3.01 1.24 0.87 0.02 0.00 0.00 175.26 174.27 2pmz h LYS 46 N 10.45 0.51 0.00 1.61 1.57 -1.94 -3.47 116.57 125.30 2pmz h LYS 46 Ca 0.16 -0.58 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2pmz h LYS 46 Cb 0.99 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2pmz h LYS 46 CO 1.29 1.21 0.00 0.00 -0.57 0.00 0.00 179.45 181.38 2pmz s ASP 48 N 0.25 1.73 0.11 0.00 1.47 -1.26 -4.71 116.67 114.27 2pmz s ASP 48 Ca 0.00 -1.70 -0.25 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 -1.01 1.66 0.00 0.68 0.00 0.00 175.17 176.50 2pmz h ALA 49 N 2.12 -0.30 0.00 2.11 0.00 -1.93 2.74 119.26 124.01 2pmz h ALA 49 Ca -0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2pmz h ALA 49 Cb 1.24 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2pmz h ALA 49 CO 0.43 -0.71 0.00 -1.91 0.00 0.00 0.00 179.25 177.06 2pmz n GLU 50 N -5.32 0.99 0.06 0.00 2.13 -1.26 -2.14 120.64 115.10 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 0.24 -1.00 0.00 0.00 0.27 0.00 0.00 31.44 30.94 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 0.69 -0.95 -0.14 4.31 3.41 -0.73 -4.87 113.62 115.34 2pmz n SER 51 Ca 0.00 0.24 -0.12 0.00 -0.26 0.00 0.00 58.87 58.73 2pmz n SER 51 Cb 0.50 1.16 -0.01 0.00 -0.26 0.00 0.00 64.21 65.59 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 0.62 0.00 7.33 0.00 0.47 0.26 119.26 127.94 2pmz h ALA 52 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 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 0.63 0.00 1.04 0.00 0.00 0.00 179.25 180.92 2pmz n GLN 53 N -4.13 0.48 -0.02 0.00 6.02 -0.91 0.05 117.38 118.87 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 0.48 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 30.14 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 -1.01 0.88 0.27 -1.09 4.81 -0.29 -3.86 118.16 117.87 2pmz n LYS 54 Ca 0.12 -0.09 0.16 0.00 -0.87 0.00 0.00 58.31 57.63 2pmz n LYS 54 Cb 0.06 -1.31 0.74 0.00 0.02 0.00 0.00 35.03 34.53 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 0.25 0.13 3.15 2.07 0.30 0.55 116.25 122.71 2pmz h VAL 55 Ca -0.10 -0.56 -0.36 0.00 0.82 0.00 0.00 66.70 66.50 2pmz h VAL 55 Cb 0.94 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2pmz h VAL 55 CO 0.01 0.07 -1.97 0.40 0.02 0.00 0.00 177.57 176.10 2pmz h ILE 56 N 0.00 0.66 0.00 4.57 2.04 -1.69 -3.31 117.51 119.77 2pmz h ILE 56 Ca -0.00 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.49 2pmz h ILE 56 Cb 0.43 2.53 0.00 0.00 -0.74 0.00 0.00 36.82 39.05 2pmz h ILE 56 CO 0.01 0.89 0.00 -0.62 0.00 0.00 0.00 178.15 178.43 2pmz n GLU 57 N -3.48 0.00 0.00 2.37 1.02 -0.81 -1.84 120.64 117.89 2pmz n GLU 57 Ca -0.31 0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 2pmz n GLU 57 Cb 1.05 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 31.27 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 -1.10 0.00 0.03 3.49 1.02 0.12 0.28 120.64 124.48 2pmz n GLU 58 Ca 0.00 0.14 -0.21 0.00 -0.02 0.00 0.00 57.16 57.06 2pmz n GLU 58 Cb 0.00 -1.62 -0.14 0.00 -0.02 0.00 0.00 31.44 29.66 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 0.48 0.00 -4.62 6.46 -1.54 -3.34 115.31 112.75 2pmz h LEU 59 Ca 0.00 -0.91 0.00 0.00 -0.12 0.00 0.00 57.88 56.85 2pmz h LEU 59 Cb 0.23 -0.15 0.00 0.00 -0.73 0.00 0.00 40.66 40.01 2pmz h LEU 59 CO 0.00 1.80 0.00 -1.54 -0.62 0.00 0.00 178.44 178.08 2pmz n SER 60 N -3.51 0.00 0.02 1.25 3.41 0.14 -1.22 113.62 113.71 2pmz n SER 60 Ca -0.28 -0.01 0.08 0.00 -0.26 0.00 0.00 58.87 58.39 2pmz n SER 60 Cb 1.06 0.00 0.34 0.00 -0.26 0.00 0.00 64.21 65.34 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 0.08 -0.05 4.04 4.13 -1.25 -0.68 115.26 120.76 2pmz n ASN 61 Ca 0.00 0.52 -0.00 0.00 1.68 0.00 0.00 54.58 56.78 2pmz n ASN 61 Cb 0.00 -0.54 -0.15 0.00 -1.54 0.00 0.00 39.78 37.55 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 -1.59 0.68 -3.59 2.41 5.41 -0.36 -5.01 119.36 117.31 2pmz n ILE 62 Ca 0.03 -0.63 -0.20 0.00 1.00 0.00 0.00 62.75 62.96 2pmz n ILE 62 Cb 0.18 -0.25 0.06 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 -2.45 -4.93 0.00 1.39 0.31 0.14 -4.99 118.33 107.79 2pmz n VAL 63 Ca -0.18 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.70 2pmz n VAL 63 Cb 0.83 -4.25 0.00 0.00 -0.91 0.00 0.00 33.84 29.51 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 -3.08 0.00 -3.58 4.52 3.41 -1.26 -5.08 113.62 108.55 2pmz n SER 64 Ca -0.27 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.17 2pmz n SER 64 Cb 0.66 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.55 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 0.97 0.28 4.33 1.81 -1.26 -5.09 118.95 119.98 2pmz s ARG 65 Ca 0.00 0.16 -0.00 0.00 -1.72 0.00 0.00 55.73 54.17 2pmz s ARG 65 Cb 0.00 0.45 0.41 0.00 -0.45 0.00 0.00 34.95 35.36 2pmz s ARG 65 CO 0.00 -0.29 1.79 1.49 -0.68 0.00 0.00 175.30 177.61 2pmz h GLU 66 N 3.23 0.71 0.00 3.54 4.81 -1.99 -3.15 114.58 121.72 2pmz h GLU 66 Ca -0.28 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2pmz h GLU 66 Cb 1.15 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.44 2pmz h GLU 66 CO 0.39 0.73 0.00 -0.25 -0.73 0.00 0.00 179.01 179.15 2pmz n ASP 67 N -4.23 0.00 -0.26 1.04 8.00 -1.26 -3.02 116.55 116.82 2pmz n ASP 67 Ca 0.02 0.87 0.28 0.00 0.71 0.00 0.00 54.79 56.67 2pmz n ASP 67 Cb 0.29 -0.37 0.65 0.00 -0.02 0.00 0.00 41.12 41.66 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 0.39 116.25 119.81 2pmz h VAL 68 Ca 0.00 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 2pmz h VAL 68 Cb 0.00 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2pmz h VAL 68 CO 0.00 0.03 -0.02 0.03 0.02 0.00 0.00 177.57 177.63 2pmz h ARG 69 N 0.15 0.00 -0.04 1.57 3.08 -1.50 -2.14 114.38 115.51 2pmz h ARG 69 Ca 0.51 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.39 2pmz h ARG 69 Cb 1.73 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.79 2pmz h ARG 69 CO -0.10 0.02 -0.62 0.00 -1.07 0.00 0.00 179.97 178.20 2pmz h ALA 70 N 1.98 0.12 0.00 0.04 0.00 -0.13 -2.14 119.26 119.14 2pmz h ALA 70 Ca -0.00 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2pmz h ALA 70 Cb 0.04 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2pmz h ALA 70 CO 0.00 0.41 0.00 -0.89 0.00 0.00 0.00 179.25 178.77 2pmz n ILE 71 N -4.18 0.26 -0.08 0.00 5.41 -0.83 -2.45 119.36 117.49 2pmz n ILE 71 Ca -0.10 0.07 -0.12 0.00 1.00 0.00 0.00 62.75 63.60 2pmz n ILE 71 Cb 0.67 -0.87 -0.07 0.00 -0.71 0.00 0.00 39.64 38.66 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 -1.11 2.75 -0.98 1.39 4.77 -1.02 -3.40 117.00 119.39 2pmz n LEU 72 Ca 0.08 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2pmz n LEU 72 Cb 0.06 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 2pmz n LEU 72 CO 0.08 0.71 0.45 0.00 -1.33 0.00 0.00 177.39 177.30 2pmz n ALA 73 N -3.08 2.41 0.10 -1.18 0.00 -0.81 -1.62 120.51 116.33 2pmz n ALA 73 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.15 2pmz n ALA 73 Cb 0.79 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.24 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 0.52 -0.15 0.09 0.00 3.41 -1.19 -4.35 113.62 111.96 2pmz n SER 74 Ca 0.00 0.33 -0.05 0.00 -0.26 0.00 0.00 58.87 58.89 2pmz n SER 74 Cb 0.45 0.30 0.11 0.00 -0.26 0.00 0.00 64.21 64.81 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 1.40 -6.00 -1.33 1.08 -1.62 -3.40 117.51 107.64 2pmz h ILE 75 Ca 0.00 -2.05 0.00 0.00 -0.39 0.00 0.00 64.86 62.42 2pmz h ILE 75 Cb 0.00 2.06 -0.02 0.00 -3.07 0.00 0.00 36.82 35.79 2pmz h ILE 75 CO 0.00 0.60 -0.64 0.00 -0.69 0.00 0.00 178.15 177.42 2pmz n PRO 77 N 1.83 -1.83 0.00 0.00 -0.04 -1.26 -5.06 135.00 128.64 2pmz n PRO 77 Ca -0.05 -0.92 0.00 0.00 -0.04 0.00 0.00 63.50 62.49 2pmz n PRO 77 Cb 0.26 -0.81 0.00 0.00 -0.04 0.00 0.00 33.50 32.91 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 -3.56 0.00 -4.09 0.52 -1.04 -1.26 -5.03 114.28 99.81 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 0.15 -0.07 0.00 -1.82 0.00 0.00 70.33 68.90 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 -0.65 0.00 -2.00 12.58 2.01 -1.26 -5.00 115.64 121.33 2pmz s THR 79 Ca 0.00 -1.66 0.06 0.00 0.31 0.00 0.00 61.69 60.41 2pmz s THR 79 Cb 0.00 -2.41 0.18 0.00 0.01 0.00 0.00 72.50 70.27 2pmz s THR 79 CO 0.00 0.00 0.77 -1.54 -0.69 0.00 0.00 174.62 173.16 2pmz n SER 80 N -0.65 0.00 -0.10 3.53 3.41 -1.26 -1.52 113.62 117.02 2pmz n SER 80 Ca 0.01 -0.39 -0.21 0.00 -0.26 0.00 0.00 58.87 58.01 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 1.49 0.32 4.04 8.00 -1.26 -2.95 116.55 125.36 2pmz n ASP 81 Ca 0.05 0.23 0.21 0.00 0.71 0.00 0.00 54.79 55.99 2pmz n ASP 81 Cb 0.02 -0.58 1.07 0.00 -0.02 0.00 0.00 41.12 41.61 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 -0.69 0.00 0.00 -1.24 5.08 -1.82 0.70 114.58 116.61 2pmz h GLU 82 Ca -0.51 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.75 2pmz h GLU 82 Cb 1.46 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.70 2pmz h GLU 82 CO -0.30 0.00 -1.30 0.28 -1.00 0.00 0.00 179.01 176.69 2pmz n VAL 83 N -3.12 0.90 0.03 3.13 0.31 -0.58 -4.13 118.33 114.87 2pmz n VAL 83 Ca -0.02 -0.63 -0.13 0.00 -0.01 0.00 0.00 64.34 63.55 2pmz n VAL 83 Cb 0.14 -0.53 -0.09 0.00 -0.91 0.00 0.00 33.84 32.44 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 -0.10 -0.78 5.55 2.43 0.42 -3.10 114.38 118.80 2pmz h ARG 84 Ca -0.10 0.01 0.22 0.00 -0.81 0.00 0.00 59.98 59.30 2pmz h ARG 84 Cb 1.33 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.87 2pmz h ARG 84 CO 0.02 0.34 0.55 0.66 -1.51 0.00 0.00 179.97 180.04 2pmz h SER 85 N -0.57 0.06 1.62 -3.80 4.64 -1.14 0.28 113.55 114.63 2pmz h SER 85 Ca -0.01 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2pmz h SER 85 Cb 0.48 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2pmz h SER 85 CO 0.02 0.02 -0.01 0.40 -0.87 0.00 0.00 176.83 176.39 2pmz h ILE 86 N 0.06 0.00 -1.00 0.95 2.04 -1.70 -3.42 117.51 114.44 2pmz h ILE 86 Ca 0.37 -0.62 -0.37 0.00 1.00 0.00 0.00 64.86 65.24 2pmz h ILE 86 Cb 1.41 1.62 -0.05 0.00 -0.74 0.00 0.00 36.82 39.05 2pmz h ILE 86 CO -0.03 0.00 0.94 -0.22 0.00 0.00 0.00 178.15 178.84 2pmz s LEU 87 N -5.00 3.23 1.25 1.44 0.20 0.99 -4.96 118.68 115.84 2pmz s LEU 87 Ca 0.10 -0.63 -0.20 0.00 0.69 0.00 0.00 54.13 54.08 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 0.62 -2.50 1.07 -0.69 -0.29 0.00 0.00 176.35 174.57 2pmz s VAL 88 N 9.11 1.51 -2.00 1.68 1.01 -1.26 -5.05 120.40 125.40 2pmz s VAL 88 Ca 0.65 0.00 0.11 0.00 0.00 0.00 0.00 61.98 62.74 2pmz s VAL 88 Cb -0.07 -2.40 0.31 0.00 0.00 0.00 0.00 36.38 34.22 2pmz s VAL 88 CO 0.01 0.00 1.09 0.23 0.00 0.00 0.00 175.10 176.44