#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b7e n ALA 2 N 0.00 6.12 -0.02 4.61 0.00 -1.26 -4.49 120.51 125.47 2b7e n ALA 2 Ca 0.00 -3.14 -0.16 0.00 0.00 0.00 0.00 53.44 50.14 2b7e n ALA 2 Cb 0.00 -1.72 -0.11 0.00 0.00 0.00 0.00 19.45 17.62 2b7e n ALA 2 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2b7e h MET 3 N 1.99 0.28 -0.33 0.00 4.05 -2.05 0.11 114.93 118.97 2b7e h MET 3 Ca 0.54 -0.27 -0.06 0.00 -0.28 0.00 0.00 59.70 59.64 2b7e h MET 3 Cb 0.77 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.63 2b7e h MET 3 CO 1.40 0.95 -0.01 1.49 0.23 0.00 0.00 176.91 180.97 2b7e h GLU 4 N -0.30 0.59 -0.79 0.39 4.81 -2.01 -1.46 114.58 115.82 2b7e h GLU 4 Ca -0.04 -0.19 0.01 0.00 -0.13 0.00 0.00 59.36 59.01 2b7e h GLU 4 Cb 1.06 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.35 2b7e h GLU 4 CO 0.07 0.73 0.52 0.00 -0.73 0.00 0.00 179.01 179.60 2b7e h ALA 5 N 0.85 1.00 -0.40 2.92 0.00 -1.86 -2.46 119.26 119.30 2b7e h ALA 5 Ca 0.09 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2b7e h ALA 5 Cb 0.47 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2b7e h ALA 5 CO 0.02 0.42 0.20 1.49 0.00 0.00 0.00 179.25 181.38 2b7e h GLU 6 N 1.07 0.39 -0.22 0.00 4.81 -0.71 0.17 114.58 120.10 2b7e h GLU 6 Ca 0.29 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.54 2b7e h GLU 6 Cb -0.12 -0.09 -0.07 0.00 0.63 0.00 0.00 28.75 29.10 2b7e h GLU 6 CO -0.06 0.26 -0.45 0.87 -0.73 0.00 0.00 179.01 178.89 2b7e h LYS 7 N 0.40 -0.44 0.00 1.92 1.79 -0.80 0.29 116.57 119.73 2b7e h LYS 7 Ca 0.17 0.03 -0.14 0.00 -2.18 0.00 0.00 60.65 58.53 2b7e h LYS 7 Cb 0.08 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 2b7e h LYS 7 CO -0.12 -0.30 -0.66 0.93 -1.08 0.00 0.00 179.45 178.22 2b7e h GLU 8 N -0.46 0.00 -0.95 3.15 5.08 -1.35 -2.46 114.58 117.58 2b7e h GLU 8 Ca 0.08 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.47 2b7e h GLU 8 Cb 0.63 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 2b7e h GLU 8 CO -0.46 0.66 0.62 0.35 -1.00 0.00 0.00 179.01 179.18 2b7e h PHE 9 N 0.00 1.17 -0.20 4.33 3.04 0.08 0.16 116.94 125.52 2b7e h PHE 9 Ca -0.01 0.03 -0.17 0.00 3.98 0.00 0.00 57.97 61.80 2b7e h PHE 9 Cb 1.18 -0.39 -0.00 0.00 2.56 0.00 0.00 35.95 39.29 2b7e h PHE 9 CO 0.00 0.69 -0.58 0.82 -2.02 0.00 0.00 178.31 177.22 2b7e h ILE 10 N 1.22 1.31 -0.68 1.41 1.08 -0.80 -2.44 117.51 118.62 2b7e h ILE 10 Ca 0.37 -1.82 -0.06 0.00 -0.39 0.00 0.00 64.86 62.96 2b7e h ILE 10 Cb -0.03 1.78 -0.03 0.00 -3.07 0.00 0.00 36.82 35.47 2b7e h ILE 10 CO -0.11 0.57 0.20 0.74 -0.69 0.00 0.00 178.15 178.86 2b7e h THR 11 N 0.47 1.26 0.00 -0.27 2.02 -0.81 -2.02 112.91 113.55 2b7e h THR 11 Ca 0.00 -0.90 -0.06 0.00 0.77 0.00 0.00 66.41 66.22 2b7e h THR 11 Cb 1.14 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2b7e h THR 11 CO 0.11 0.35 -0.28 0.00 0.37 0.00 0.00 175.52 176.07 2b7e h MET 12 N 1.01 0.00 -0.45 6.66 -0.00 -0.70 -0.53 114.93 120.92 2b7e h MET 12 Ca 0.22 0.00 -0.14 0.00 -0.00 0.00 0.00 59.70 59.78 2b7e h MET 12 Cb 0.32 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.91 2b7e h MET 12 CO -0.00 0.28 -0.28 -0.07 -0.00 0.00 0.00 176.91 176.84 2b7e h LEU 13 N 0.00 1.02 -0.29 -0.10 3.38 -0.91 -0.61 115.31 117.80 2b7e h LEU 13 Ca -0.00 -0.42 -0.19 0.00 0.09 0.00 0.00 57.88 57.36 2b7e h LEU 13 Cb 1.00 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2b7e h LEU 13 CO 0.04 1.22 -0.58 0.11 0.09 0.00 0.00 178.44 179.32 2b7e h LYS 14 N 0.83 0.86 0.00 1.13 6.56 -1.00 0.11 116.57 125.06 2b7e h LYS 14 Ca 0.09 -0.56 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 2b7e h LYS 14 Cb 0.87 0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.60 2b7e h LYS 14 CO 0.08 1.20 0.00 0.39 -2.06 0.00 0.00 179.45 179.05 2b7e n GLU 15 N -4.00 0.20 -0.59 3.15 1.02 -0.24 -2.27 120.64 117.92 2b7e n GLU 15 Ca -0.05 0.29 0.08 0.00 -0.02 0.00 0.00 57.16 57.46 2b7e n GLU 15 Cb 0.64 -1.80 0.30 0.00 -0.02 0.00 0.00 31.44 30.57 2b7e n GLU 15 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2b7e n ASN 16 N -2.17 4.41 -2.60 1.62 4.05 -0.24 -4.95 115.26 115.38 2b7e n ASN 16 Ca 0.04 -3.01 -0.21 0.00 0.45 0.00 0.00 54.58 51.85 2b7e n ASN 16 Cb 0.33 -0.59 0.00 0.00 1.23 0.00 0.00 39.78 40.76 2b7e n ASN 16 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2b7e n GLN 17 N -0.20 -2.72 -2.61 1.20 6.02 -0.96 -4.93 117.38 113.18 2b7e n GLN 17 Ca 0.24 0.98 -0.42 0.00 -0.01 0.00 0.00 57.00 57.78 2b7e n GLN 17 Cb 0.99 -5.71 -0.03 0.00 1.02 0.00 0.00 30.24 26.51 2b7e n GLN 17 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2b7e s VAL 18 N -3.09 4.60 0.00 5.09 1.01 0.39 -4.95 120.40 123.45 2b7e s VAL 18 Ca 0.10 1.87 0.00 0.00 0.00 0.00 0.00 61.98 63.94 2b7e s VAL 18 Cb -0.04 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2b7e s VAL 18 CO 0.12 0.11 0.00 -0.90 0.00 0.00 0.00 175.10 174.43 2b7e n ASP 19 N 4.20 0.00 0.00 3.32 5.75 -1.26 -4.70 116.55 123.86 2b7e n ASP 19 Ca 0.08 0.00 0.04 0.00 -0.01 0.00 0.00 54.79 54.89 2b7e n ASP 19 Cb 0.49 0.00 0.18 0.00 -1.03 0.00 0.00 41.12 40.76 2b7e n ASP 19 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2b7e n SER 20 N 0.00 0.00 0.16 -1.12 7.64 -1.26 -1.15 113.62 117.89 2b7e n SER 20 Ca 0.00 0.42 0.13 0.00 1.01 0.00 0.00 58.87 60.43 2b7e n SER 20 Cb 0.00 -0.45 0.33 0.00 -1.01 0.00 0.00 64.21 63.08 2b7e n SER 20 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2b7e h THR 21 N 0.00 0.00 -3.37 0.44 1.35 -1.94 -3.43 112.91 105.95 2b7e h THR 21 Ca 0.00 -0.66 -0.60 0.00 -0.55 0.00 0.00 66.41 64.60 2b7e h THR 21 Cb 0.12 1.65 -0.10 0.00 -1.73 0.00 0.00 68.15 68.09 2b7e h THR 21 CO 0.00 0.00 0.35 0.26 -0.25 0.00 0.00 175.52 175.88 2b7e s TRP 22 N -3.18 3.29 0.65 4.73 0.52 -0.30 -5.06 118.94 119.59 2b7e s TRP 22 Ca 0.09 0.98 -0.08 0.00 0.02 0.00 0.00 56.10 57.11 2b7e s TRP 22 Cb 0.09 -2.99 0.02 0.00 -1.15 0.00 0.00 33.47 29.44 2b7e s TRP 22 CO 0.61 -0.39 0.99 -1.12 0.02 0.00 0.00 176.95 177.06 2b7e s SER 23 N 1.42 5.41 -0.02 2.95 0.01 -1.26 -4.92 113.70 117.29 2b7e s SER 23 Ca 0.31 0.82 0.02 0.00 1.31 0.00 0.00 55.95 58.41 2b7e s SER 23 Cb -0.15 -1.69 0.09 0.00 0.21 0.00 0.00 66.02 64.48 2b7e s SER 23 CO 0.08 -1.25 0.80 0.33 0.41 0.00 0.00 173.24 173.62 2b7e n PHE 24 N -2.79 0.21 -0.03 2.43 7.35 -1.26 -1.19 117.46 122.19 2b7e n PHE 24 Ca 0.06 -0.08 -0.11 0.00 -0.76 0.00 0.00 57.45 56.56 2b7e n PHE 24 Cb 0.58 -0.10 -0.14 0.00 0.35 0.00 0.00 39.48 40.17 2b7e n PHE 24 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2b7e n SER 25 N -0.03 0.98 0.08 -2.13 2.88 -1.26 -3.11 113.62 111.03 2b7e n SER 25 Ca 0.03 0.33 -0.09 0.00 -1.33 0.00 0.00 58.87 57.82 2b7e n SER 25 Cb 0.27 -0.07 0.01 0.00 -0.75 0.00 0.00 64.21 63.67 2b7e n SER 25 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 2b7e h ARG 26 N 0.01 0.25 -0.48 -1.46 2.43 -1.53 0.36 114.38 113.96 2b7e h ARG 26 Ca -0.34 -0.24 -0.08 0.00 -0.81 0.00 0.00 59.98 58.52 2b7e h ARG 26 Cb 2.04 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 31.64 2b7e h ARG 26 CO 0.07 0.94 0.00 0.82 -1.51 0.00 0.00 179.97 180.29 2b7e h ILE 27 N 0.15 1.26 -0.06 1.20 2.04 -1.66 0.33 117.51 120.77 2b7e h ILE 27 Ca -0.04 -1.06 -0.16 0.00 1.00 0.00 0.00 64.86 64.60 2b7e h ILE 27 Cb 1.42 1.00 0.01 0.00 -0.74 0.00 0.00 36.82 38.51 2b7e h ILE 27 CO 0.13 0.37 -0.60 0.40 0.00 0.00 0.00 178.15 178.45 2b7e h ILE 28 N 0.70 1.38 0.20 -0.67 2.04 -1.48 -0.60 117.51 119.09 2b7e h ILE 28 Ca 0.14 -1.97 -0.33 0.00 1.00 0.00 0.00 64.86 63.70 2b7e h ILE 28 Cb 0.50 2.36 0.02 0.00 -0.74 0.00 0.00 36.82 38.96 2b7e h ILE 28 CO 0.02 0.59 -1.56 -1.28 0.00 0.00 0.00 178.15 175.92 2b7e h SER 29 N 0.07 0.67 0.00 1.72 0.87 -0.23 -3.26 113.55 113.39 2b7e h SER 29 Ca -0.06 -0.82 -0.31 0.00 -1.23 0.00 0.00 61.79 59.37 2b7e h SER 29 Cb 1.27 -0.22 -0.06 0.00 -0.44 0.00 0.00 62.40 62.96 2b7e h SER 29 CO 0.12 1.67 -2.16 -0.62 -0.53 0.00 0.00 176.83 175.31 2b7e n GLU 30 N -3.62 0.87 0.03 2.24 -0.58 0.10 -4.54 120.64 115.14 2b7e n GLU 30 Ca -0.19 0.07 -0.17 0.00 -0.42 0.00 0.00 57.16 56.45 2b7e n GLU 30 Cb 1.08 -1.42 -0.14 0.00 -0.57 0.00 0.00 31.44 30.39 2b7e n GLU 30 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2b7e h LEU 31 N 0.00 0.34 -0.06 -4.62 5.85 -0.99 -2.55 115.31 113.28 2b7e h LEU 31 Ca -0.46 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 57.67 2b7e h LEU 31 Cb 1.84 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.76 2b7e h LEU 31 CO -0.03 1.52 0.04 1.23 -0.34 0.00 0.00 178.44 180.86 2b7e h GLY 32 N 1.79 0.09 1.66 3.75 0.00 -1.15 -2.11 103.07 107.10 2b7e h GLY 32 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 46.97 2b7e h GLY 32 CO 0.12 0.04 -0.17 -1.30 0.00 0.00 0.00 176.54 175.23 2b7e n THR 33 N -5.03 0.01 0.01 4.70 -2.24 -1.25 -3.79 114.28 106.69 2b7e n THR 33 Ca -0.06 -0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.52 2b7e n THR 33 Cb 0.04 -0.25 -0.14 0.00 -2.10 0.00 0.00 70.33 67.88 2b7e n THR 33 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2b7e h ARG 34 N 0.00 0.22 -3.65 -0.78 2.43 -1.20 -3.46 114.38 107.93 2b7e h ARG 34 Ca 0.00 -0.38 -0.35 0.00 -0.81 0.00 0.00 59.98 58.44 2b7e h ARG 34 Cb 0.50 0.14 -0.35 0.00 -0.42 0.00 0.00 29.97 29.85 2b7e h ARG 34 CO 0.00 1.18 -0.75 0.34 -1.51 0.00 0.00 179.97 179.24 2b7e s ASP 35 N -6.91 0.53 0.18 -3.80 -1.08 -0.82 -5.02 116.67 99.75 2b7e s ASP 35 Ca -0.18 -0.01 0.18 0.00 -0.52 0.00 0.00 52.55 52.02 2b7e s ASP 35 Cb 0.02 -0.21 0.82 0.00 -1.46 0.00 0.00 42.92 42.10 2b7e s ASP 35 CO 0.77 -0.12 1.56 -2.65 0.52 0.00 0.00 175.17 175.25 2b7e n PRO 36 N 4.32 0.12 0.30 4.34 -0.02 -1.26 -2.57 135.00 140.22 2b7e n PRO 36 Ca -0.23 0.43 0.20 0.00 -2.02 0.00 0.00 63.50 61.88 2b7e n PRO 36 Cb 0.50 -1.76 0.94 0.00 -0.02 0.00 0.00 33.50 33.17 2b7e n PRO 36 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b7e h ARG 37 N 0.00 0.00 0.00 -0.52 3.08 -1.92 0.13 114.38 115.14 2b7e h ARG 37 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 2b7e h ARG 37 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2b7e h ARG 37 CO 0.00 0.00 -0.23 -0.92 -1.07 0.00 0.00 179.97 177.75 2b7e h TYR 38 N 0.00 0.00 0.00 3.04 3.20 -1.80 -3.05 116.97 118.35 2b7e h TYR 38 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2b7e h TYR 38 Cb 0.22 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.49 2b7e h TYR 38 CO 0.00 0.23 -1.81 0.91 -1.64 0.00 0.00 178.16 175.85 2b7e n TRP 39 N -3.46 0.00 -0.20 -3.82 7.02 0.20 -4.27 117.44 112.91 2b7e n TRP 39 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2b7e n TRP 39 Cb 0.41 -0.41 0.11 0.00 -2.42 0.00 0.00 31.31 28.99 2b7e n TRP 39 CO 0.00 0.00 0.00 1.98 -2.02 0.00 0.00 177.69 177.65 2b7e h MET 40 N 0.00 0.29 -6.03 -0.99 4.05 -0.77 -3.36 114.93 108.12 2b7e h MET 40 Ca 0.00 -0.02 -0.57 0.00 -0.28 0.00 0.00 59.70 58.83 2b7e h MET 40 Cb 0.87 -0.07 -0.06 0.00 -0.80 0.00 0.00 31.60 31.55 2b7e h MET 40 CO 0.00 0.19 -0.03 0.54 0.23 0.00 0.00 176.91 177.85 2b7e s VAL 41 N -6.10 4.96 0.46 -5.77 0.11 -1.24 -5.04 120.40 107.78 2b7e s VAL 41 Ca -0.13 1.21 -0.25 0.00 -2.93 0.00 0.00 61.98 59.88 2b7e s VAL 41 Cb 0.17 -3.92 -0.08 0.00 -1.53 0.00 0.00 36.38 31.02 2b7e s VAL 41 CO 0.74 0.39 1.41 -0.90 -3.33 0.00 0.00 175.10 173.41 2b7e n ASP 42 N 2.93 3.17 -4.52 3.54 5.75 -1.26 -4.84 116.55 121.32 2b7e n ASP 42 Ca -0.07 1.11 -0.42 0.00 -0.01 0.00 0.00 54.79 55.40 2b7e n ASP 42 Cb 0.51 -1.59 -0.03 0.00 -1.03 0.00 0.00 41.12 38.98 2b7e n ASP 42 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2b7e s ASP 43 N -0.51 6.26 -0.49 -1.12 2.15 -1.26 -4.93 116.67 116.76 2b7e s ASP 43 Ca 0.62 -0.86 -0.13 0.00 0.43 0.00 0.00 52.55 52.61 2b7e s ASP 43 Cb -0.45 -2.52 0.11 0.00 -0.30 0.00 0.00 42.92 39.76 2b7e s ASP 43 CO 0.57 -1.64 0.40 -0.62 -0.17 0.00 0.00 175.17 173.71 2b7e s ASP 44 N 3.95 5.94 0.59 -0.34 -1.08 -1.26 -4.95 116.67 119.51 2b7e s ASP 44 Ca 0.34 -1.73 0.29 0.00 -0.52 0.00 0.00 52.55 50.93 2b7e s ASP 44 Cb -0.08 -2.11 1.76 0.00 -1.46 0.00 0.00 42.92 41.03 2b7e s ASP 44 CO 0.08 -0.73 2.22 -0.65 0.52 0.00 0.00 175.17 176.60 2b7e h PRO 45 N 8.65 0.00 -0.03 4.34 0.11 -1.97 0.27 132.00 143.38 2b7e h PRO 45 Ca -0.26 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.60 2b7e h PRO 45 Cb 1.09 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.22 2b7e h PRO 45 CO 0.92 0.00 -0.98 1.25 -0.21 0.00 0.00 178.00 178.97 2b7e h LEU 46 N 0.00 0.86 -0.09 2.35 7.12 -1.98 -0.33 115.31 123.24 2b7e h LEU 46 Ca 0.02 -0.67 -0.25 0.00 0.13 0.00 0.00 57.88 57.12 2b7e h LEU 46 Cb 0.12 -0.26 0.01 0.00 -0.53 0.00 0.00 40.66 40.00 2b7e h LEU 46 CO -0.00 1.47 -0.97 -0.25 -0.13 0.00 0.00 178.44 178.56 2b7e h TRP 47 N 0.40 0.89 -0.27 1.25 7.01 -1.70 0.80 115.95 124.32 2b7e h TRP 47 Ca -0.11 -0.47 -0.03 0.00 2.11 0.00 0.00 58.89 60.39 2b7e h TRP 47 Cb 1.63 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 28.57 2b7e h TRP 47 CO 0.09 1.30 0.03 0.87 -2.79 0.00 0.00 178.44 177.94 2b7e h LYS 48 N 0.35 0.40 -0.01 2.65 6.56 -0.52 0.24 116.57 126.24 2b7e h LYS 48 Ca -0.10 -0.06 -0.23 0.00 -1.06 0.00 0.00 60.65 59.20 2b7e h LYS 48 Cb 1.61 -0.07 0.02 0.00 -0.57 0.00 0.00 32.23 33.22 2b7e h LYS 48 CO 0.18 0.40 -0.88 0.87 -2.06 0.00 0.00 179.45 177.96 2b7e h LYS 49 N 0.39 0.61 -0.17 3.15 1.57 -0.93 -2.24 116.57 118.96 2b7e h LYS 49 Ca 0.09 -0.65 -0.00 0.00 -1.87 0.00 0.00 60.65 58.22 2b7e h LYS 49 Cb 0.21 0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2b7e h LYS 49 CO 0.00 1.25 0.09 0.93 -0.57 0.00 0.00 179.45 181.16 2b7e h GLU 50 N 0.24 0.24 0.00 3.15 5.08 -0.34 0.03 114.58 122.98 2b7e h GLU 50 Ca -0.11 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.10 2b7e h GLU 50 Cb 1.55 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.74 2b7e h GLU 50 CO 0.17 0.23 -0.59 0.00 -1.00 0.00 0.00 179.01 177.83 2b7e h MET 51 N 0.17 0.00 -0.07 2.33 -0.00 -0.63 -1.15 114.93 115.58 2b7e h MET 51 Ca 0.06 0.00 -0.24 0.00 -0.00 0.00 0.00 59.70 59.52 2b7e h MET 51 Cb 0.07 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 31.68 2b7e h MET 51 CO -0.01 0.59 -0.89 0.35 -0.00 0.00 0.00 176.91 176.95 2b7e h PHE 52 N 0.00 0.96 0.00 -0.10 3.57 -1.20 0.91 116.94 121.08 2b7e h PHE 52 Ca -0.01 -0.47 -0.04 0.00 3.53 0.00 0.00 57.97 60.98 2b7e h PHE 52 Cb 1.22 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.82 2b7e h PHE 52 CO 0.00 1.30 -0.20 0.93 -2.23 0.00 0.00 178.31 178.11 2b7e h GLU 53 N 0.43 0.00 -0.14 1.11 5.08 -0.87 -0.80 114.58 119.38 2b7e h GLU 53 Ca -0.08 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.07 2b7e h GLU 53 Cb 1.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.78 2b7e h GLU 53 CO 0.17 0.20 -0.74 -0.22 -1.00 0.00 0.00 179.01 177.42 2b7e h LYS 54 N 0.00 0.69 0.00 2.33 1.63 -1.02 -1.88 116.57 118.32 2b7e h LYS 54 Ca -0.00 -0.55 -0.04 0.00 -0.85 0.00 0.00 60.65 59.21 2b7e h LYS 54 Cb 0.80 0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.54 2b7e h LYS 54 CO 0.03 1.16 -0.18 -0.92 -3.45 0.00 0.00 179.45 176.09 2b7e h TYR 55 N 0.48 0.00 0.05 1.91 3.20 -0.05 0.36 116.97 122.92 2b7e h TYR 55 Ca -0.04 0.00 -0.32 0.00 3.14 0.00 0.00 58.73 61.51 2b7e h TYR 55 Cb 1.35 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.59 2b7e h TYR 55 CO 0.07 0.18 -1.77 -0.07 -1.64 0.00 0.00 178.16 174.93 2b7e h LEU 56 N 0.00 0.17 0.00 2.82 3.38 -1.15 -3.19 115.31 117.33 2b7e h LEU 56 Ca -0.00 -0.36 -0.25 0.00 0.09 0.00 0.00 57.88 57.36 2b7e h LEU 56 Cb 0.73 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 2b7e h LEU 56 CO 0.02 1.32 -1.60 -0.24 0.09 0.00 0.00 178.44 178.03 2b7e n SER 57 N -3.23 1.91 0.00 -0.43 2.88 -0.71 -4.63 113.62 109.41 2b7e n SER 57 Ca -0.21 0.40 -0.11 0.00 -1.33 0.00 0.00 58.87 57.62 2b7e n SER 57 Cb 1.05 -0.85 -0.08 0.00 -0.75 0.00 0.00 64.21 63.57 2b7e n SER 57 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2b7e h ASN 58 N -1.00 -0.10 0.00 -3.46 -0.00 -0.58 -3.50 115.58 106.94 2b7e h ASN 58 Ca -0.37 -0.50 0.00 0.00 -0.00 0.00 0.00 56.30 55.43 2b7e h ASN 58 Cb 1.25 0.02 0.00 0.00 -0.00 0.00 0.00 38.32 39.60 2b7e h ASN 58 CO -0.23 0.56 0.00 0.54 -0.00 0.00 0.00 177.43 178.30