#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gmy s THR 3 N 0.00 3.71 -0.12 0.58 2.01 -1.25 -4.83 115.64 115.73 2gmy s THR 3 Ca 0.00 1.45 -0.28 0.00 0.31 0.00 0.00 61.69 63.17 2gmy s THR 3 Cb 0.00 -3.93 -0.25 0.00 0.01 0.00 0.00 72.50 68.33 2gmy s THR 3 CO 0.00 0.24 0.86 0.03 -0.69 0.00 0.00 174.62 175.06 2gmy h ARG 4 N 5.17 0.01 -3.38 4.92 3.08 -1.13 -3.47 114.38 119.58 2gmy h ARG 4 Ca -0.44 -0.01 -0.25 0.00 0.07 0.00 0.00 59.98 59.34 2gmy h ARG 4 Cb 1.21 0.00 -0.31 0.00 0.08 0.00 0.00 29.97 30.95 2gmy h ARG 4 CO 0.73 0.91 -0.64 0.42 -1.07 0.00 0.00 179.97 180.33 2gmy s ILE 5 N -2.60 -0.04 -0.99 2.04 1.01 -1.24 -5.07 121.20 114.31 2gmy s ILE 5 Ca -0.18 0.16 -0.23 0.00 0.00 0.00 0.00 60.65 60.39 2gmy s ILE 5 Cb -0.02 -0.18 0.03 0.00 0.01 0.00 0.00 42.46 42.30 2gmy s ILE 5 CO 0.69 0.06 1.53 0.21 0.00 0.00 0.00 174.94 177.44 2gmy s ASN 6 N 0.93 6.26 0.29 3.58 3.84 -1.26 -4.88 114.94 123.70 2gmy s ASN 6 Ca -0.07 -1.30 0.04 0.00 0.21 0.00 0.00 52.86 51.74 2gmy s ASN 6 Cb -0.10 -2.57 0.45 0.00 -0.55 0.00 0.00 41.25 38.48 2gmy s ASN 6 CO -0.04 -1.73 1.72 0.10 -2.79 0.00 0.00 177.10 174.36 2gmy h TYR 7 N 10.07 0.43 -0.07 0.43 -0.00 -1.96 -1.17 116.97 124.70 2gmy h TYR 7 Ca 0.17 -0.10 -0.05 0.00 0.00 0.00 0.00 58.73 58.76 2gmy h TYR 7 Cb 1.01 -0.10 -0.01 0.00 0.00 0.00 0.00 36.73 37.63 2gmy h TYR 7 CO 1.27 0.65 -0.17 0.00 -0.00 0.00 0.00 178.16 179.91 2gmy h ALA 8 N 1.35 1.59 0.18 0.10 0.00 -1.90 -1.87 119.26 118.71 2gmy h ALA 8 Ca 0.04 -0.19 -0.33 0.00 0.00 0.00 0.00 54.91 54.43 2gmy h ALA 8 Cb 0.70 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2gmy h ALA 8 CO 0.05 0.30 -1.59 -0.22 0.00 0.00 0.00 179.25 177.79 2gmy h LYS 9 N 0.11 0.37 -0.39 0.00 3.64 -1.87 -3.03 116.57 115.40 2gmy h LYS 9 Ca 0.02 -0.64 -0.16 0.00 -1.27 0.00 0.00 60.65 58.60 2gmy h LYS 9 Cb 0.37 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 2gmy h LYS 9 CO 0.02 1.28 -0.37 0.00 -2.27 0.00 0.00 179.45 178.10 2gmy h ALA 10 N 0.28 0.57 -2.32 5.00 0.00 -1.05 -3.38 119.26 118.35 2gmy h ALA 10 Ca -0.28 -0.45 -0.54 0.00 0.00 0.00 0.00 54.91 53.64 2gmy h ALA 10 Cb 2.08 -0.12 -0.36 0.00 0.00 0.00 0.00 17.79 19.39 2gmy h ALA 10 CO 0.20 0.67 -0.88 0.45 0.00 0.00 0.00 179.25 179.69 2gmy s SER 11 N -6.82 1.77 0.39 0.00 0.15 -0.72 -5.00 113.70 103.47 2gmy s SER 11 Ca -0.11 -2.52 0.13 0.00 0.70 0.00 0.00 55.95 54.15 2gmy s SER 11 Cb 0.11 -0.18 0.94 0.00 -1.71 0.00 0.00 66.02 65.18 2gmy s SER 11 CO 0.88 -0.22 1.89 -0.65 1.20 0.00 0.00 173.24 176.33 2gmy h PRO 12 N 6.25 0.53 -0.40 5.44 0.11 -1.73 -1.95 132.00 140.26 2gmy h PRO 12 Ca 0.16 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 66.10 2gmy h PRO 12 Cb 0.96 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 2gmy h PRO 12 CO 0.29 0.35 -0.28 0.93 -0.21 0.00 0.00 178.00 179.09 2gmy h GLU 13 N 0.55 0.89 -0.39 1.05 3.07 -1.94 -0.74 114.58 117.08 2gmy h GLU 13 Ca 0.42 -0.43 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 2gmy h GLU 13 Cb 0.83 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.72 2gmy h GLU 13 CO -0.17 1.08 0.06 0.00 -1.40 0.00 0.00 179.01 178.58 2gmy h ALA 14 N 0.80 0.51 -0.55 3.43 0.00 -1.82 -1.52 119.26 120.10 2gmy h ALA 14 Ca 0.08 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2gmy h ALA 14 Cb 0.86 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2gmy h ALA 14 CO 0.08 0.22 0.32 0.35 0.00 0.00 0.00 179.25 180.22 2gmy h PHE 15 N 0.49 0.60 -0.91 0.00 3.57 -1.30 -2.26 116.94 117.13 2gmy h PHE 15 Ca 0.12 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.67 2gmy h PHE 15 Cb 0.36 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.86 2gmy h PHE 15 CO 0.02 0.33 0.59 -0.22 -2.23 0.00 0.00 178.31 176.81 2gmy h LYS 16 N 0.64 1.11 -0.62 1.11 3.64 -0.98 -0.94 116.57 120.54 2gmy h LYS 16 Ca 0.23 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.49 2gmy h LYS 16 Cb 0.05 -0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 2gmy h LYS 16 CO -0.11 0.74 0.18 0.00 -2.27 0.00 0.00 179.45 177.99 2gmy h ALA 17 N 1.37 0.81 -0.35 5.00 0.00 -0.79 0.61 119.26 125.91 2gmy h ALA 17 Ca 0.36 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 2gmy h ALA 17 Cb -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2gmy h ALA 17 CO -0.12 0.49 -0.36 0.28 0.00 0.00 0.00 179.25 179.55 2gmy h VAL 18 N 0.89 1.28 -0.63 0.00 2.07 -1.03 -2.88 116.25 115.94 2gmy h VAL 18 Ca 0.20 -1.53 -0.04 0.00 0.82 0.00 0.00 66.70 66.15 2gmy h VAL 18 Cb 0.31 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2gmy h VAL 18 CO -0.00 0.51 0.23 -0.03 0.02 0.00 0.00 177.57 178.29 2gmy h MET 19 N 0.68 0.94 -0.67 1.57 -1.53 -0.94 -1.65 114.93 113.33 2gmy h MET 19 Ca 0.06 -0.16 0.10 0.00 -3.44 0.00 0.00 59.70 56.26 2gmy h MET 19 Cb 0.92 -0.16 -0.07 0.00 -0.55 0.00 0.00 31.60 31.74 2gmy h MET 19 CO 0.08 0.78 0.29 0.00 0.14 0.00 0.00 176.91 178.21 2gmy h ALA 20 N 1.33 0.90 -0.41 0.39 0.00 -0.68 0.32 119.26 121.11 2gmy h ALA 20 Ca 0.21 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 2gmy h ALA 20 Cb 0.21 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2gmy h ALA 20 CO -0.01 -0.13 0.07 1.25 0.00 0.00 0.00 179.25 180.42 2gmy h LEU 21 N 0.50 0.65 -0.63 0.00 5.85 -1.23 -1.44 115.31 119.00 2gmy h LEU 21 Ca 0.34 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.89 2gmy h LEU 21 Cb 0.40 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 2gmy h LEU 21 CO -0.30 0.75 0.26 -0.08 -0.34 0.00 0.00 178.44 178.73 2gmy h GLU 22 N 0.53 0.45 -0.77 1.25 4.57 -0.69 -1.69 114.58 118.24 2gmy h GLU 22 Ca 0.12 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.24 2gmy h GLU 22 Cb 0.37 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 2gmy h GLU 22 CO 0.01 0.30 0.32 -0.91 -1.18 0.00 0.00 179.01 177.55 2gmy h ASN 23 N 0.46 1.04 -0.09 1.04 2.35 -0.01 -1.55 115.58 118.82 2gmy h ASN 23 Ca 0.31 -0.15 0.01 0.00 -0.55 0.00 0.00 56.30 55.93 2gmy h ASN 23 Cb 0.37 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 2gmy h ASN 23 CO -0.29 0.91 0.02 0.22 -1.65 0.00 0.00 177.43 176.64 2gmy h TYR 24 N 1.12 0.03 -0.57 1.19 3.20 -0.73 -2.73 116.97 118.47 2gmy h TYR 24 Ca 0.26 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.21 2gmy h TYR 24 Cb 0.18 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.40 2gmy h TYR 24 CO 0.02 0.01 0.25 0.28 -1.64 0.00 0.00 178.16 177.07 2gmy h VAL 25 N 0.05 0.85 -0.82 1.81 2.07 -0.73 0.41 116.25 119.91 2gmy h VAL 25 Ca 0.04 -0.16 0.05 0.00 0.82 0.00 0.00 66.70 67.45 2gmy h VAL 25 Cb 0.03 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 2gmy h VAL 25 CO -0.05 0.08 0.53 1.56 0.02 0.00 0.00 177.57 179.71 2gmy h GLN 26 N 0.46 0.91 -0.29 1.57 1.08 -1.19 -2.47 115.11 115.18 2gmy h GLN 26 Ca 0.27 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.42 2gmy h GLN 26 Cb 0.27 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 2gmy h GLN 26 CO -0.24 0.61 0.00 -1.13 -0.95 0.00 0.00 178.83 177.11 2gmy n SER 27 N -4.47 3.13 0.29 1.46 3.41 -0.66 -4.52 113.62 112.25 2gmy n SER 27 Ca 0.11 -1.95 0.19 0.00 -0.26 0.00 0.00 58.87 56.96 2gmy n SER 27 Cb 0.17 -0.18 0.87 0.00 -0.26 0.00 0.00 64.21 64.80 2gmy n SER 27 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2gmy h SER 28 N 4.21 0.00 0.00 4.04 4.64 -0.45 -3.46 113.55 122.53 2gmy h SER 28 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gmy h SER 28 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2gmy h SER 28 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2gmy n GLY 29 N -0.42 0.66 3.77 -0.77 0.00 -1.26 -5.06 105.19 102.10 2gmy n GLY 29 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2gmy n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gmy s LEU 30 N 0.00 4.36 0.25 0.99 1.43 -1.26 -4.94 118.68 119.51 2gmy s LEU 30 Ca 0.00 2.89 -0.30 0.00 -1.03 0.00 0.00 54.13 55.69 2gmy s LEU 30 Cb 0.00 -3.65 -0.14 0.00 0.03 0.00 0.00 46.19 42.43 2gmy s LEU 30 CO 0.00 -0.77 1.23 -0.62 0.23 0.00 0.00 176.35 176.42 2gmy n GLU 31 N 1.09 1.68 0.22 1.70 1.02 -1.26 -4.83 120.64 120.27 2gmy n GLU 31 Ca 0.03 0.60 0.07 0.00 -0.02 0.00 0.00 57.16 57.84 2gmy n GLU 31 Cb 0.40 -2.13 0.52 0.00 -0.02 0.00 0.00 31.44 30.21 2gmy n GLU 31 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2gmy h HIS 32 N 3.20 0.00 -0.94 -0.32 3.86 -1.97 -1.43 115.15 117.55 2gmy h HIS 32 Ca -0.43 0.00 0.08 0.00 -1.16 0.00 0.00 60.37 58.85 2gmy h HIS 32 Cb 1.31 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.71 2gmy h HIS 32 CO 0.53 0.24 0.59 -0.09 0.86 0.00 0.00 177.93 180.05 2gmy h ARG 33 N 0.00 1.01 -0.13 2.45 2.43 -1.98 0.86 114.38 119.01 2gmy h ARG 33 Ca -0.00 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 58.93 2gmy h ARG 33 Cb 0.49 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 2gmy h ARG 33 CO 0.03 0.67 -0.66 0.74 -1.51 0.00 0.00 179.97 179.24 2gmy h PHE 34 N 1.04 0.67 -0.29 2.20 0.04 -1.63 -1.71 116.94 117.26 2gmy h PHE 34 Ca 0.42 -0.27 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 2gmy h PHE 34 Cb 0.24 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 2gmy h PHE 34 CO -0.02 1.03 0.12 0.82 -0.60 0.00 0.00 178.31 179.66 2gmy h ILE 35 N 0.37 1.18 -0.35 -0.55 2.04 -1.03 -0.76 117.51 118.40 2gmy h ILE 35 Ca -0.02 -0.55 0.04 0.00 1.00 0.00 0.00 64.86 65.33 2gmy h ILE 35 Cb 1.23 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 38.27 2gmy h ILE 35 CO 0.12 0.19 0.14 0.45 0.00 0.00 0.00 178.15 179.05 2gmy h HIS 36 N 0.33 0.25 -0.29 1.37 3.86 -0.81 -0.94 115.15 118.92 2gmy h HIS 36 Ca 0.10 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.35 2gmy h HIS 36 Cb 0.19 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 2gmy h HIS 36 CO -0.01 0.12 0.13 1.25 0.86 0.00 0.00 177.93 180.28 2gmy h LEU 37 N 0.30 0.19 -0.01 2.43 6.46 -1.17 0.62 115.31 124.13 2gmy h LEU 37 Ca 0.16 0.02 0.01 0.00 -0.12 0.00 0.00 57.88 57.95 2gmy h LEU 37 Cb 0.11 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.01 2gmy h LEU 37 CO -0.14 0.15 -0.07 0.40 -0.62 0.00 0.00 178.44 178.15 2gmy h ILE 38 N 0.29 0.82 -0.29 4.05 2.04 -0.82 -0.73 117.51 122.86 2gmy h ILE 38 Ca 0.12 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 2gmy h ILE 38 Cb 0.06 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2gmy h ILE 38 CO -0.10 0.00 0.09 0.11 0.00 0.00 0.00 178.15 178.25 2gmy h LYS 39 N -0.12 0.46 -0.03 2.37 1.57 -0.99 -2.06 116.57 117.77 2gmy h LYS 39 Ca 0.03 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2gmy h LYS 39 Cb 0.16 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2gmy h LYS 39 CO -0.08 0.51 -0.00 1.25 -0.57 0.00 0.00 179.45 180.56 2gmy h LEU 40 N 0.31 0.05 -0.20 2.94 5.85 -0.80 -2.30 115.31 121.16 2gmy h LEU 40 Ca 0.09 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 2gmy h LEU 40 Cb 0.25 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2gmy h LEU 40 CO -0.00 0.36 0.07 -0.09 -0.34 0.00 0.00 178.44 178.44 2gmy h ARG 41 N -0.26 0.31 -0.82 1.25 9.65 -1.16 -1.25 114.38 122.10 2gmy h ARG 41 Ca 0.01 -0.06 0.02 0.00 -1.10 0.00 0.00 59.98 58.84 2gmy h ARG 41 Cb 0.34 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.83 2gmy h ARG 41 CO 0.00 0.39 0.54 0.00 2.80 0.00 0.00 179.97 183.70 2gmy h ALA 42 N 0.90 1.05 -0.69 2.80 0.00 -1.45 -1.37 119.26 120.51 2gmy h ALA 42 Ca 0.07 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2gmy h ALA 42 Cb 0.20 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2gmy h ALA 42 CO -0.00 0.41 0.26 0.77 0.00 0.00 0.00 179.25 180.69 2gmy h SER 43 N 1.08 0.95 -0.02 0.00 0.02 -1.11 -0.27 113.55 114.19 2gmy h SER 43 Ca 0.31 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2gmy h SER 43 Cb -0.08 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.21 2gmy h SER 43 CO -0.08 0.86 0.01 0.40 -1.14 0.00 0.00 176.83 176.88 2gmy h ILE 44 N 1.00 1.11 -0.73 3.27 2.04 -0.78 -0.72 117.51 122.70 2gmy h ILE 44 Ca 0.23 -0.32 0.08 0.00 1.00 0.00 0.00 64.86 65.85 2gmy h ILE 44 Cb 0.22 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 37.52 2gmy h ILE 44 CO -0.02 0.09 0.41 0.40 0.00 0.00 0.00 178.15 179.03 2gmy h ILE 45 N -0.09 0.93 -0.00 -0.67 2.04 -0.77 -1.96 117.51 116.98 2gmy h ILE 45 Ca 0.01 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2gmy h ILE 45 Cb 0.13 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 2gmy h ILE 45 CO -0.00 0.13 -0.01 0.59 0.00 0.00 0.00 178.15 178.86 2gmy n ASN 46 N -4.78 0.10 -0.70 1.72 5.03 -0.16 -4.90 115.26 111.57 2gmy n ASN 46 Ca 0.11 -0.75 -0.09 0.00 0.87 0.00 0.00 54.58 54.72 2gmy n ASN 46 Cb 0.22 -0.09 -0.03 0.00 -1.02 0.00 0.00 39.78 38.86 2gmy n ASN 46 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2gmy n GLY 47 N 1.11 0.97 3.44 7.41 0.00 -0.67 -4.96 105.19 112.49 2gmy n GLY 47 Ca 0.20 -0.63 -0.44 0.00 0.00 0.00 0.00 46.02 45.16 2gmy n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gmy h ALA 49 N 9.19 1.26 -0.19 0.00 0.00 -1.93 0.20 119.26 127.79 2gmy h ALA 49 Ca -0.08 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.72 2gmy h ALA 49 Cb 1.05 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2gmy h ALA 49 CO 1.14 0.56 -0.02 0.35 0.00 0.00 0.00 179.25 181.29 2gmy h PHE 50 N 0.98 -0.04 -0.15 0.00 3.57 -1.89 0.25 116.94 119.66 2gmy h PHE 50 Ca 0.24 0.01 -0.23 0.00 3.53 0.00 0.00 57.97 61.52 2gmy h PHE 50 Cb 0.13 0.05 0.01 0.00 2.79 0.00 0.00 35.95 38.93 2gmy h PHE 50 CO 0.01 -0.04 -0.80 0.00 -2.23 0.00 0.00 178.31 175.25 2gmy h VAL 52 N 0.54 0.93 -0.41 0.00 2.07 -0.77 0.15 116.25 118.76 2gmy h VAL 52 Ca -0.06 -0.15 0.06 0.00 0.82 0.00 0.00 66.70 67.38 2gmy h VAL 52 Cb 1.43 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.61 2gmy h VAL 52 CO 0.16 0.08 0.09 -0.78 0.02 0.00 0.00 177.57 177.14 2gmy h ASP 53 N 0.43 0.02 -0.28 0.57 3.58 -0.96 0.06 116.42 119.83 2gmy h ASP 53 Ca 0.21 0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.71 2gmy h ASP 53 Cb 0.15 0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 2gmy h ASP 53 CO -0.17 0.05 0.12 -0.03 -2.88 0.00 0.00 179.24 176.33 2gmy h MET 54 N 0.22 0.42 0.00 0.28 4.05 -1.24 -2.73 114.93 115.93 2gmy h MET 54 Ca 0.20 -0.07 -0.13 0.00 -0.28 0.00 0.00 59.70 59.42 2gmy h MET 54 Cb 0.24 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 30.95 2gmy h MET 54 CO -0.26 0.42 -0.64 0.45 0.23 0.00 0.00 176.91 177.12 2gmy h HIS 55 N 0.31 0.00 -0.07 1.39 3.86 -0.57 -0.33 115.15 119.74 2gmy h HIS 55 Ca 0.10 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 2gmy h HIS 55 Cb 0.16 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 2gmy h HIS 55 CO -0.01 0.64 0.03 0.28 0.86 0.00 0.00 177.93 179.73 2gmy h VAL 56 N 0.00 0.99 -0.45 2.45 2.07 -1.00 -0.76 116.25 119.55 2gmy h VAL 56 Ca -0.01 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 2gmy h VAL 56 Cb 1.39 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 2gmy h VAL 56 CO 0.08 0.01 0.09 0.11 0.02 0.00 0.00 177.57 177.89 2gmy h LYS 57 N 0.07 0.73 -0.30 1.57 1.57 -1.16 -1.59 116.57 117.47 2gmy h LYS 57 Ca 0.03 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2gmy h LYS 57 Cb 0.01 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2gmy h LYS 57 CO -0.02 0.74 0.20 0.93 -0.57 0.00 0.00 179.45 180.72 2gmy h GLU 58 N 0.60 0.39 -0.65 3.15 5.08 -1.04 -1.03 114.58 121.10 2gmy h GLU 58 Ca 0.14 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 2gmy h GLU 58 Cb 0.35 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 2gmy h GLU 58 CO 0.01 0.27 0.39 0.77 -1.00 0.00 0.00 179.01 179.44 2gmy h SER 59 N 0.40 0.62 -0.24 1.42 0.02 -0.98 -1.97 113.55 112.83 2gmy h SER 59 Ca 0.11 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2gmy h SER 59 Cb -0.04 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 2gmy h SER 59 CO -0.02 0.43 0.12 -0.09 -1.14 0.00 0.00 176.83 176.13 2gmy h ARG 60 N 0.75 0.34 -0.78 3.45 2.43 -1.11 -1.73 114.38 117.74 2gmy h ARG 60 Ca 0.27 -0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.50 2gmy h ARG 60 Cb 0.06 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 2gmy h ARG 60 CO -0.12 0.33 0.51 1.25 -1.51 0.00 0.00 179.97 180.43 2gmy h HIS 61 N 0.26 0.70 -0.27 2.20 2.76 -0.79 -0.11 115.15 119.90 2gmy h HIS 61 Ca 0.08 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 2gmy h HIS 61 Cb 0.10 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 28.83 2gmy h HIS 61 CO -0.03 0.31 0.00 -0.25 -1.30 0.00 0.00 177.93 176.66 2gmy n ASP 62 N -4.50 1.65 -0.15 3.26 8.00 -0.78 -4.91 116.55 119.11 2gmy n ASP 62 Ca 0.13 -2.04 -0.02 0.00 0.71 0.00 0.00 54.79 53.58 2gmy n ASP 62 Cb 0.38 -0.23 -0.01 0.00 -0.02 0.00 0.00 41.12 41.24 2gmy n ASP 62 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gmy n GLY 63 N 0.87 0.50 3.77 0.44 0.00 -0.05 -5.03 105.19 105.67 2gmy n GLY 63 Ca 0.10 -0.98 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 2gmy n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gmy s LEU 64 N -0.44 4.45 0.66 0.99 1.43 -0.68 -5.01 118.68 120.08 2gmy s LEU 64 Ca 0.00 1.98 -0.15 0.00 -1.03 0.00 0.00 54.13 54.93 2gmy s LEU 64 Cb 0.00 -3.84 -0.00 0.00 0.03 0.00 0.00 46.19 42.38 2gmy s LEU 64 CO 0.00 -0.06 1.11 -0.94 0.23 0.00 0.00 176.35 176.69 2gmy s SER 65 N -1.34 5.10 0.26 2.29 1.04 -1.26 -4.47 113.70 115.32 2gmy s SER 65 Ca 0.47 2.00 -0.04 0.00 0.48 0.00 0.00 55.95 58.87 2gmy s SER 65 Cb -0.24 -2.55 0.34 0.00 0.10 0.00 0.00 66.02 63.67 2gmy s SER 65 CO 0.30 -1.63 1.91 -0.33 0.98 0.00 0.00 173.24 174.47 2gmy h GLU 66 N 0.04 1.23 -0.44 4.02 4.39 -1.99 -2.07 114.58 119.76 2gmy h GLU 66 Ca -0.47 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.15 2gmy h GLU 66 Cb 1.25 -0.28 -0.02 0.00 -0.10 0.00 0.00 28.75 29.60 2gmy h GLU 66 CO 0.54 0.81 0.23 1.96 -1.16 0.00 0.00 179.01 181.39 2gmy h GLN 67 N 1.27 0.61 -0.97 2.33 4.20 -1.97 0.45 115.11 121.02 2gmy h GLN 67 Ca 0.39 -0.08 0.09 0.00 0.06 0.00 0.00 58.65 59.12 2gmy h GLN 67 Cb -0.01 -0.12 -0.08 0.00 0.30 0.00 0.00 27.48 27.58 2gmy h GLN 67 CO -0.12 0.50 0.61 2.35 -0.67 0.00 0.00 178.83 181.50 2gmy h TRP 68 N 0.57 1.12 0.09 2.96 7.01 -1.83 -0.67 115.95 125.20 2gmy h TRP 68 Ca 0.15 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.18 2gmy h TRP 68 Cb 0.07 -0.36 0.00 0.00 -2.10 0.00 0.00 29.16 26.78 2gmy h TRP 68 CO -0.02 0.50 -0.05 0.82 -2.79 0.00 0.00 178.44 176.91 2gmy h ILE 69 N 1.03 1.11 0.00 2.65 2.04 -0.99 -3.32 117.51 120.04 2gmy h ILE 69 Ca 0.45 -1.30 -0.05 0.00 1.00 0.00 0.00 64.86 64.96 2gmy h ILE 69 Cb 0.34 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.29 2gmy h ILE 69 CO -0.22 0.29 -0.26 0.78 0.00 0.00 0.00 178.15 178.74 2gmy h ASN 70 N -0.78 0.00 -0.06 1.72 -0.26 0.15 -2.93 115.58 113.41 2gmy h ASN 70 Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 2gmy h ASN 70 Cb 0.58 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.84 2gmy h ASN 70 CO 0.02 0.26 0.00 0.18 -1.06 0.00 0.00 177.43 176.83 2gmy n LEU 71 N -4.21 1.80 0.21 1.61 7.99 -0.28 -4.31 117.00 119.81 2gmy n LEU 71 Ca -0.02 -0.64 0.06 0.00 -0.01 0.00 0.00 56.01 55.39 2gmy n LEU 71 Cb 0.31 -0.03 0.47 0.00 -0.11 0.00 0.00 43.42 44.06 2gmy n LEU 71 CO 0.37 0.32 0.82 -0.03 -1.51 0.00 0.00 177.39 177.36 2gmy h MET 72 N 2.70 0.00 0.00 3.23 4.05 -1.61 -1.09 114.93 122.21 2gmy h MET 72 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2gmy h MET 72 Cb 0.58 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.38 2gmy h MET 72 CO 0.00 0.27 0.00 0.66 0.23 0.00 0.00 176.91 178.07 2gmy h SER 73 N 0.00 0.00 -0.43 1.39 4.64 -1.82 -3.25 113.55 114.07 2gmy h SER 73 Ca -0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 2gmy h SER 73 Cb 0.53 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.23 2gmy h SER 73 CO 0.04 0.00 -1.05 1.33 -0.87 0.00 0.00 176.83 176.27 2gmy n VAL 74 N -3.01 1.37 0.16 0.95 0.24 -0.47 -4.95 118.33 112.62 2gmy n VAL 74 Ca -0.01 -2.95 0.07 0.00 -2.04 0.00 0.00 64.34 59.41 2gmy n VAL 74 Cb 0.22 0.87 0.56 0.00 -1.47 0.00 0.00 33.84 34.02 2gmy n VAL 74 CO 0.00 0.00 0.00 4.11 -2.14 0.00 0.00 176.83 178.80 2gmy h TRP 75 N 2.36 0.19 -0.29 6.34 5.08 -1.46 -2.90 115.95 125.27 2gmy h TRP 75 Ca -0.07 0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.93 2gmy h TRP 75 Cb 1.37 -0.06 -0.01 0.00 -3.00 0.00 0.00 29.16 27.45 2gmy h TRP 75 CO 0.53 0.12 0.19 0.00 -1.28 0.00 0.00 178.44 178.00 2gmy h ARG 76 N 0.20 0.32 -0.44 0.12 3.08 -1.91 -1.59 114.38 114.16 2gmy h ARG 76 Ca 0.06 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2gmy h ARG 76 Cb -0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2gmy h ARG 76 CO -0.01 0.21 0.00 0.39 -1.07 0.00 0.00 179.97 179.49 2gmy n GLU 77 N -4.49 2.48 -3.83 0.04 -0.58 -1.10 -4.94 120.64 108.22 2gmy n GLU 77 Ca 0.02 -2.29 -0.35 0.00 -0.42 0.00 0.00 57.16 54.11 2gmy n GLU 77 Cb 0.12 -1.49 -0.10 0.00 -0.57 0.00 0.00 31.44 29.40 2gmy n GLU 77 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2gmy s SER 78 N -1.31 5.79 0.00 1.62 0.15 -0.60 -4.98 113.70 114.37 2gmy s SER 78 Ca 0.38 0.07 0.18 0.00 0.70 0.00 0.00 55.95 57.28 2gmy s SER 78 Cb 0.22 -2.02 1.08 0.00 -1.71 0.00 0.00 66.02 63.59 2gmy s SER 78 CO 0.30 0.11 1.57 -0.81 1.20 0.00 0.00 173.24 175.61 2gmy n PRO 79 N 3.96 0.81 -0.30 5.44 -0.04 -1.26 -3.88 135.00 139.73 2gmy n PRO 79 Ca -0.16 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.26 2gmy n PRO 79 Cb 0.52 -1.35 0.10 0.00 -0.04 0.00 0.00 33.50 32.74 2gmy n PRO 79 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2gmy h VAL 80 N 0.00 1.25 -3.67 0.52 2.07 -1.93 -3.44 116.25 111.04 2gmy h VAL 80 Ca 0.00 -0.69 -0.50 0.00 0.82 0.00 0.00 66.70 66.33 2gmy h VAL 80 Cb 0.00 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 2gmy h VAL 80 CO 0.00 0.30 0.33 -0.31 0.02 0.00 0.00 177.57 177.91 2gmy s TYR 81 N -5.71 3.93 0.85 1.57 2.02 -1.25 -5.05 117.35 113.72 2gmy s TYR 81 Ca -0.12 1.85 -0.11 0.00 -0.37 0.00 0.00 57.07 58.31 2gmy s TYR 81 Cb 0.17 -2.97 0.10 0.00 -0.40 0.00 0.00 41.96 38.86 2gmy s TYR 81 CO 0.83 0.41 1.09 0.95 -1.57 0.00 0.00 175.55 177.25 2gmy s THR 82 N -0.88 2.89 0.27 -0.71 -4.23 -1.26 -4.80 115.64 106.92 2gmy s THR 82 Ca 0.42 0.29 -0.03 0.00 -1.18 0.00 0.00 61.69 61.18 2gmy s THR 82 Cb -0.25 -2.82 0.27 0.00 1.34 0.00 0.00 72.50 71.04 2gmy s THR 82 CO 0.31 -0.38 1.93 -0.33 -0.54 0.00 0.00 174.62 175.61 2gmy h GLU 83 N -1.37 1.18 -0.50 3.99 4.39 -1.99 0.37 114.58 120.66 2gmy h GLU 83 Ca -0.48 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.11 2gmy h GLU 83 Cb 1.27 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 29.63 2gmy h GLU 83 CO 0.55 0.78 0.13 0.37 -1.16 0.00 0.00 179.01 179.67 2gmy h GLN 84 N 1.21 0.79 -0.82 2.33 4.15 -1.98 -1.24 115.11 119.56 2gmy h GLN 84 Ca 0.37 -0.19 -0.03 0.00 0.77 0.00 0.00 58.65 59.57 2gmy h GLN 84 Cb -0.03 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.52 2gmy h GLN 84 CO -0.11 0.76 0.39 0.93 -1.93 0.00 0.00 178.83 178.87 2gmy h GLU 85 N 0.68 1.18 -0.65 1.69 5.08 -1.76 -1.54 114.58 119.27 2gmy h GLU 85 Ca 0.16 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2gmy h GLU 85 Cb 0.32 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2gmy h GLU 85 CO 0.00 0.91 0.22 0.00 -1.00 0.00 0.00 179.01 179.15 2gmy h ARG 86 N 1.16 0.97 -0.50 2.33 3.08 -0.71 0.32 114.38 121.04 2gmy h ARG 86 Ca 0.28 -0.18 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 2gmy h ARG 86 Cb 0.13 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 2gmy h ARG 86 CO -0.03 0.82 0.21 0.00 -1.07 0.00 0.00 179.97 179.89 2gmy h ALA 87 N 1.30 0.64 -0.33 0.04 0.00 -0.86 -0.72 119.26 119.33 2gmy h ALA 87 Ca 0.21 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2gmy h ALA 87 Cb 0.24 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2gmy h ALA 87 CO -0.01 0.24 0.03 1.25 0.00 0.00 0.00 179.25 180.76 2gmy h LEU 88 N 0.66 0.54 -0.87 0.00 5.85 -0.87 -2.87 115.31 117.74 2gmy h LEU 88 Ca 0.17 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2gmy h LEU 88 Cb 0.18 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2gmy h LEU 88 CO -0.01 0.69 0.56 -0.07 -0.34 0.00 0.00 178.44 179.26 2gmy h LEU 89 N 0.38 1.02 -1.22 2.25 3.38 -0.21 0.14 115.31 121.05 2gmy h LEU 89 Ca 0.10 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.07 2gmy h LEU 89 Cb 0.39 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 2gmy h LEU 89 CO 0.01 0.76 0.54 1.23 0.09 0.00 0.00 178.44 181.08 2gmy h GLY 90 N 1.19 1.18 0.81 0.83 0.00 -1.06 -0.12 103.07 105.90 2gmy h GLY 90 Ca 0.32 -0.39 -0.14 0.00 0.00 0.00 0.00 47.33 47.12 2gmy h GLY 90 CO -0.06 0.31 -0.50 -0.25 0.00 0.00 0.00 176.54 176.04 2gmy h TRP 91 N 0.98 0.62 -0.60 5.60 2.91 -1.14 -1.58 115.95 122.74 2gmy h TRP 91 Ca 0.34 -0.29 0.09 0.00 1.13 0.00 0.00 58.89 60.16 2gmy h TRP 91 Cb 0.12 -0.09 -0.07 0.00 -0.51 0.00 0.00 29.16 28.61 2gmy h TRP 91 CO -0.00 1.08 0.22 0.28 -1.03 0.00 0.00 178.44 178.98 2gmy h VAL 92 N -0.00 0.76 -0.02 2.65 2.07 -0.40 0.39 116.25 121.70 2gmy h VAL 92 Ca -0.04 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 2gmy h VAL 92 Cb 1.16 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2gmy h VAL 92 CO 0.10 0.07 0.00 0.44 0.02 0.00 0.00 177.57 178.21 2gmy h ASP 93 N 0.40 0.03 -0.54 0.57 5.19 -1.00 0.24 116.42 121.31 2gmy h ASP 93 Ca 0.31 -0.28 0.01 0.00 -0.62 0.00 0.00 57.03 56.45 2gmy h ASP 93 Cb 0.38 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 39.86 2gmy h ASP 93 CO -0.31 0.30 0.35 0.00 -3.12 0.00 0.00 179.24 176.46 2gmy h ALA 94 N 0.73 0.68 -0.01 3.45 0.00 -1.05 -1.72 119.26 121.35 2gmy h ALA 94 Ca 0.01 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.64 2gmy h ALA 94 Cb 0.28 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.87 2gmy h ALA 94 CO 0.00 0.11 -0.98 0.28 0.00 0.00 0.00 179.25 178.66 2gmy h VAL 95 N 0.72 1.34 -0.67 0.00 2.07 -0.90 -2.51 116.25 116.30 2gmy h VAL 95 Ca 0.20 -2.34 -0.00 0.00 0.82 0.00 0.00 66.70 65.38 2gmy h VAL 95 Cb -0.08 2.38 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 2gmy h VAL 95 CO -0.05 0.71 0.41 0.74 0.02 0.00 0.00 177.57 179.40 2gmy h THR 96 N 0.31 1.19 -1.37 2.57 2.02 -0.87 -2.73 112.91 114.03 2gmy h THR 96 Ca -0.10 -0.40 -0.70 0.00 0.77 0.00 0.00 66.41 65.98 2gmy h THR 96 Cb 1.62 0.24 -0.30 0.00 -1.74 0.00 0.00 68.15 67.97 2gmy h THR 96 CO 0.18 0.19 0.74 0.29 0.37 0.00 0.00 175.52 177.29 2gmy n LYS 97 N -4.41 2.82 -0.21 6.66 4.76 -0.65 -4.79 118.16 122.34 2gmy n LYS 97 Ca 0.07 -3.50 0.10 0.00 -2.87 0.00 0.00 58.31 52.10 2gmy n LYS 97 Cb 0.07 -2.28 0.38 0.00 -1.84 0.00 0.00 35.03 31.36 2gmy n LYS 97 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2gmy h ILE 98 N 1.53 0.92 -0.07 -0.18 6.09 -1.12 -0.98 117.51 123.70 2gmy h ILE 98 Ca 0.56 -0.24 -0.07 0.00 -1.37 0.00 0.00 64.86 63.75 2gmy h ILE 98 Cb 0.58 0.18 -0.01 0.00 0.47 0.00 0.00 36.82 38.04 2gmy h ILE 98 CO 1.44 0.13 -0.27 0.00 -3.07 0.00 0.00 178.15 176.38 2gmy h ALA 99 N 1.61 1.42 0.10 0.18 0.00 -1.87 -0.02 119.26 120.67 2gmy h ALA 99 Ca 0.37 -0.28 -0.27 0.00 0.00 0.00 0.00 54.91 54.73 2gmy h ALA 99 Cb 0.51 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2gmy h ALA 99 CO -0.14 0.42 -1.40 1.49 0.00 0.00 0.00 179.25 179.61 2gmy h GLU 100 N 0.11 0.21 0.01 0.00 4.81 -1.59 -3.41 114.58 114.71 2gmy h GLU 100 Ca 0.02 -0.35 -0.33 0.00 -0.13 0.00 0.00 59.36 58.56 2gmy h GLU 100 Cb 0.55 0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.00 2gmy h GLU 100 CO 0.04 1.17 -2.03 0.25 -0.73 0.00 0.00 179.01 177.71 2gmy n THR 101 N -3.97 1.53 -1.33 0.32 -2.24 -0.50 -4.98 114.28 103.11 2gmy n THR 101 Ca -0.26 -0.80 -0.11 0.00 -2.27 0.00 0.00 64.05 60.60 2gmy n THR 101 Cb 0.87 -0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 68.19 2gmy n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gmy n GLY 102 N 1.69 1.18 3.19 3.38 0.00 -0.03 -4.04 105.19 110.56 2gmy n GLY 102 Ca -0.25 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.49 2gmy n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gmy n ALA 103 N 1.21 -2.68 -1.27 4.61 0.00 -1.26 -4.95 120.51 116.17 2gmy n ALA 103 Ca -0.11 0.34 -0.33 0.00 0.00 0.00 0.00 53.44 53.33 2gmy n ALA 103 Cb 0.50 -2.12 0.09 0.00 0.00 0.00 0.00 19.45 17.92 2gmy n ALA 103 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2gmy s PRO 104 N -3.17 2.12 0.21 0.00 0.02 -1.26 -4.82 135.00 128.10 2gmy s PRO 104 Ca 0.12 1.57 -0.09 0.00 0.02 0.00 0.00 61.00 62.62 2gmy s PRO 104 Cb -0.03 -1.85 0.30 0.00 0.02 0.00 0.00 34.50 32.95 2gmy s PRO 104 CO 0.80 -1.81 1.73 -0.44 -0.33 0.00 0.00 177.00 176.94 2gmy h ASP 105 N -0.58 0.13 -0.40 2.53 3.32 -1.96 -2.30 116.42 117.16 2gmy h ASP 105 Ca -0.46 0.10 0.02 0.00 0.02 0.00 0.00 57.03 56.71 2gmy h ASP 105 Cb 1.27 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.89 2gmy h ASP 105 CO 0.49 0.07 0.22 0.44 -1.72 0.00 0.00 179.24 178.75 2gmy h ASP 106 N 0.34 0.34 -0.86 6.45 5.19 -1.99 0.80 116.42 126.70 2gmy h ASP 106 Ca 0.32 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.72 2gmy h ASP 106 Cb 0.44 -0.06 -0.04 0.00 0.18 0.00 0.00 39.33 39.86 2gmy h ASP 106 CO -0.36 0.25 0.45 0.00 -3.12 0.00 0.00 179.24 176.46 2gmy h ALA 107 N 1.19 1.18 -0.21 3.45 0.00 -1.86 -1.50 119.26 121.51 2gmy h ALA 107 Ca 0.16 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2gmy h ALA 107 Cb 0.04 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2gmy h ALA 107 CO -0.09 0.65 -0.11 0.35 0.00 0.00 0.00 179.25 180.05 2gmy h PHE 108 N 1.21 0.51 -0.49 0.00 3.57 -0.83 -2.25 116.94 118.66 2gmy h PHE 108 Ca 0.30 -0.13 -0.10 0.00 3.53 0.00 0.00 57.97 61.57 2gmy h PHE 108 Cb 0.06 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2gmy h PHE 108 CO 0.01 0.73 -0.09 0.93 -2.23 0.00 0.00 178.31 177.66 2gmy h GLU 109 N 0.14 0.88 -0.71 1.11 4.39 -0.77 -0.23 114.58 119.38 2gmy h GLU 109 Ca 0.04 -0.30 -0.00 0.00 0.34 0.00 0.00 59.36 59.45 2gmy h GLU 109 Cb 0.61 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.15 2gmy h GLU 109 CO 0.03 0.93 0.44 1.15 -1.16 0.00 0.00 179.01 180.40 2gmy h THR 110 N 0.79 1.20 -0.50 1.13 2.02 -1.28 -1.94 112.91 114.33 2gmy h THR 110 Ca 0.13 -0.44 -0.03 0.00 0.77 0.00 0.00 66.41 66.84 2gmy h THR 110 Cb 0.60 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2gmy h THR 110 CO 0.04 0.21 0.19 0.25 0.37 0.00 0.00 175.52 176.57 2gmy h LEU 111 N 0.97 0.70 -2.23 2.58 5.85 -1.04 -2.84 115.31 119.29 2gmy h LEU 111 Ca 0.26 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 2gmy h LEU 111 Cb -0.04 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 2gmy h LEU 111 CO -0.05 0.69 -0.00 0.03 -0.34 0.00 0.00 178.44 178.77 2gmy h ARG 112 N 0.67 0.00 0.00 1.25 3.08 -0.63 -1.48 114.38 117.27 2gmy h ARG 112 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2gmy h ARG 112 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2gmy h ARG 112 CO -0.01 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.89 2gmy h ALA 113 N 2.00 1.00 0.00 0.04 0.00 -1.11 -3.29 119.26 117.90 2gmy h ALA 113 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2gmy h ALA 113 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2gmy h ALA 113 CO 0.00 0.00 -0.05 0.72 0.00 0.00 0.00 179.25 179.92 2gmy n HIS 114 N -2.50 0.00 -4.00 0.00 8.25 -0.64 -5.07 115.22 111.27 2gmy n HIS 114 Ca 0.02 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.37 2gmy n HIS 114 Cb 0.25 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.24 2gmy n HIS 114 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2gmy s PHE 115 N -0.84 0.34 0.77 4.41 0.08 -0.70 -5.08 117.98 116.96 2gmy s PHE 115 Ca 0.00 -0.42 -0.11 0.00 0.12 0.00 0.00 56.93 56.51 2gmy s PHE 115 Cb 0.00 -0.22 0.05 0.00 -0.57 0.00 0.00 43.02 42.28 2gmy s PHE 115 CO 0.00 -0.13 1.09 -1.54 -0.10 0.00 0.00 175.22 174.54 2gmy s SER 116 N -1.21 4.73 0.25 1.36 1.04 -1.26 -4.53 113.70 114.08 2gmy s SER 116 Ca -0.11 1.38 -0.06 0.00 0.48 0.00 0.00 55.95 57.63 2gmy s SER 116 Cb -0.08 -2.15 0.26 0.00 0.10 0.00 0.00 66.02 64.15 2gmy s SER 116 CO -0.00 -1.82 1.92 0.44 0.98 0.00 0.00 173.24 174.75 2gmy h ASP 117 N -0.99 1.10 -0.41 7.02 3.32 -1.98 0.49 116.42 124.97 2gmy h ASP 117 Ca -0.46 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 56.59 2gmy h ASP 117 Cb 1.25 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.50 2gmy h ASP 117 CO 0.59 0.79 0.23 -0.08 -1.72 0.00 0.00 179.24 179.05 2gmy h GLU 118 N 1.30 0.46 -0.75 3.56 4.81 -2.00 -0.64 114.58 121.32 2gmy h GLU 118 Ca 0.36 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.56 2gmy h GLU 118 Cb -0.12 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.12 2gmy h GLU 118 CO -0.09 0.30 0.43 0.93 -0.73 0.00 0.00 179.01 179.85 2gmy h GLU 119 N 0.47 1.03 -0.91 1.92 5.08 -1.78 -2.24 114.58 118.15 2gmy h GLU 119 Ca 0.17 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2gmy h GLU 119 Cb 0.03 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 2gmy h GLU 119 CO -0.09 0.75 0.56 0.82 -1.00 0.00 0.00 179.01 180.06 2gmy h ILE 120 N 1.03 1.25 -0.23 3.13 2.04 -0.39 0.17 117.51 124.51 2gmy h ILE 120 Ca 0.27 -0.52 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 2gmy h ILE 120 Cb 0.00 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.03 2gmy h ILE 120 CO -0.05 0.26 0.08 0.58 0.00 0.00 0.00 178.15 179.02 2gmy h VAL 121 N 1.25 1.18 -0.70 1.67 2.07 -0.86 -0.58 116.25 120.28 2gmy h VAL 121 Ca 0.33 -0.55 0.02 0.00 0.82 0.00 0.00 66.70 67.32 2gmy h VAL 121 Cb -0.07 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 2gmy h VAL 121 CO -0.06 0.18 0.45 0.11 0.02 0.00 0.00 177.57 178.27 2gmy h LYS 122 N 0.20 0.88 -0.40 1.57 1.57 -0.99 -0.97 116.57 118.44 2gmy h LYS 122 Ca 0.07 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.84 2gmy h LYS 122 Cb 0.20 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 2gmy h LYS 122 CO -0.00 0.58 0.19 0.82 -0.57 0.00 0.00 179.45 180.46 2gmy h ILE 123 N 0.91 0.95 -0.17 1.86 2.04 -0.50 -1.00 117.51 121.59 2gmy h ILE 123 Ca 0.27 -0.13 -0.17 0.00 1.00 0.00 0.00 64.86 65.83 2gmy h ILE 123 Cb -0.06 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2gmy h ILE 123 CO -0.08 0.07 -0.58 0.74 0.00 0.00 0.00 178.15 178.30 2gmy h THR 124 N 0.38 1.32 -0.76 -0.27 2.02 -0.73 0.32 112.91 115.20 2gmy h THR 124 Ca 0.17 -1.84 -0.05 0.00 0.77 0.00 0.00 66.41 65.46 2gmy h THR 124 Cb 0.10 1.82 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 2gmy h THR 124 CO -0.14 0.57 0.29 0.58 0.37 0.00 0.00 175.52 177.20 2gmy h VAL 125 N 0.42 1.26 -0.60 3.16 2.07 -1.08 -1.15 116.25 120.32 2gmy h VAL 125 Ca 0.00 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 2gmy h VAL 125 Cb 1.13 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 2gmy h VAL 125 CO 0.11 0.33 0.32 0.00 0.02 0.00 0.00 177.57 178.35 2gmy h ALA 126 N 1.15 0.77 -0.70 1.67 0.00 -0.72 0.80 119.26 122.23 2gmy h ALA 126 Ca 0.25 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2gmy h ALA 126 Cb 0.23 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2gmy h ALA 126 CO -0.02 0.30 0.45 0.82 0.00 0.00 0.00 179.25 180.80 2gmy h ILE 127 N 0.82 1.19 -0.20 0.00 2.04 -0.71 -1.71 117.51 118.94 2gmy h ILE 127 Ca 0.21 -0.38 0.03 0.00 1.00 0.00 0.00 64.86 65.72 2gmy h ILE 127 Cb 0.06 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.29 2gmy h ILE 127 CO -0.03 0.19 0.02 1.23 0.00 0.00 0.00 178.15 179.56 2gmy h GLY 128 N 0.95 0.21 0.67 5.37 0.00 -0.62 -1.57 103.07 108.08 2gmy h GLY 128 Ca 0.25 -0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.61 2gmy h GLY 128 CO -0.05 -0.02 -0.06 0.00 0.00 0.00 0.00 176.54 176.42 2gmy h ALA 129 N 1.15 0.06 -0.29 3.60 0.00 -0.38 -0.69 119.26 122.72 2gmy h ALA 129 Ca 0.09 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2gmy h ALA 129 Cb 0.10 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2gmy h ALA 129 CO -0.13 -0.50 -0.24 0.97 0.00 0.00 0.00 179.25 179.34 2gmy h ILE 130 N -0.04 1.27 -0.16 0.00 6.09 -1.28 -1.54 117.51 121.86 2gmy h ILE 130 Ca 0.07 -1.27 0.00 0.00 -1.37 0.00 0.00 64.86 62.30 2gmy h ILE 130 Cb 0.15 1.31 -0.01 0.00 0.47 0.00 0.00 36.82 38.74 2gmy h ILE 130 CO -0.16 0.41 0.10 0.78 -3.07 0.00 0.00 178.15 176.21 2gmy h ASN 131 N 0.48 0.17 0.05 2.19 2.35 -0.70 0.76 115.58 120.89 2gmy h ASN 131 Ca 0.07 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 2gmy h ASN 131 Cb 0.67 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.00 2gmy h ASN 131 CO 0.05 0.12 -0.02 0.74 -1.65 0.00 0.00 177.43 176.67 2gmy h THR 132 N 0.20 1.29 -0.72 2.81 2.02 -0.33 -2.71 112.91 115.47 2gmy h THR 132 Ca 0.06 -1.18 0.10 0.00 0.77 0.00 0.00 66.41 66.16 2gmy h THR 132 Cb -0.01 2.05 -0.07 0.00 -1.74 0.00 0.00 68.15 68.38 2gmy h THR 132 CO -0.01 0.29 0.35 -0.50 0.37 0.00 0.00 175.52 176.02 2gmy h TRP 133 N -0.60 0.62 -0.86 3.16 -0.00 -0.91 -1.35 115.95 116.01 2gmy h TRP 133 Ca -0.01 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.90 2gmy h TRP 133 Cb 0.53 -0.17 -0.04 0.00 -0.00 0.00 0.00 29.16 29.48 2gmy h TRP 133 CO 0.10 0.21 0.49 -0.91 -0.00 0.00 0.00 178.44 178.33 2gmy h ASN 134 N 0.58 1.06 -0.23 -3.49 2.35 -0.93 0.58 115.58 115.50 2gmy h ASN 134 Ca 0.36 -0.08 -0.13 0.00 -0.55 0.00 0.00 56.30 55.90 2gmy h ASN 134 Cb 0.41 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 2gmy h ASN 134 CO -0.29 0.84 -0.31 0.03 -1.65 0.00 0.00 177.43 176.05 2gmy h ARG 135 N 1.20 0.74 -0.05 0.81 3.08 -1.02 -1.07 114.38 118.07 2gmy h ARG 135 Ca 0.31 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2gmy h ARG 135 Cb -0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 2gmy h ARG 135 CO -0.05 0.95 -0.01 0.82 -1.07 0.00 0.00 179.97 180.61 2gmy h ILE 136 N 0.63 1.29 -0.11 2.04 2.04 -0.87 0.51 117.51 123.04 2gmy h ILE 136 Ca 0.07 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 65.00 2gmy h ILE 136 Cb 0.83 1.80 -0.00 0.00 -0.74 0.00 0.00 36.82 38.71 2gmy h ILE 136 CO 0.07 0.25 -0.01 0.00 0.00 0.00 0.00 178.15 178.46 2gmy h ALA 137 N 0.66 0.14 -0.39 1.87 0.00 -0.87 -0.09 119.26 120.59 2gmy h ALA 137 Ca 0.01 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2gmy h ALA 137 Cb 0.40 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2gmy h ALA 137 CO 0.01 -0.15 -0.04 0.28 0.00 0.00 0.00 179.25 179.35 2gmy h VAL 138 N -0.11 1.27 -0.95 0.00 2.07 -1.30 -0.41 116.25 116.82 2gmy h VAL 138 Ca 0.03 -1.08 0.10 0.00 0.82 0.00 0.00 66.70 66.56 2gmy h VAL 138 Cb 0.40 1.19 -0.07 0.00 -1.52 0.00 0.00 31.29 31.29 2gmy h VAL 138 CO 0.01 0.36 0.61 1.23 0.02 0.00 0.00 177.57 179.80 2gmy h GLY 139 N 0.52 1.45 -2.02 2.17 0.00 -0.75 -2.24 103.07 102.20 2gmy h GLY 139 Ca 0.10 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2gmy h GLY 139 CO 0.03 0.22 0.00 0.69 0.00 0.00 0.00 176.54 177.48 2gmy n PHE 140 N -4.55 0.71 -3.83 5.60 3.72 -0.06 -4.95 117.46 114.11 2gmy n PHE 140 Ca 0.16 -0.48 -0.26 0.00 -0.05 0.00 0.00 57.45 56.82 2gmy n PHE 140 Cb 0.29 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 38.85 2gmy n PHE 140 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2gmy n ARG 141 N 1.12 -5.14 -1.77 -1.08 5.12 -0.38 -0.73 116.66 113.81 2gmy n ARG 141 Ca 0.18 0.59 -0.41 0.00 -1.93 0.00 0.00 57.85 56.28 2gmy n ARG 141 Cb 0.53 -5.30 -0.00 0.00 -1.16 0.00 0.00 32.46 26.52 2gmy n ARG 141 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 2gmy n SER 142 N -2.93 3.86 -4.37 0.55 7.64 -0.30 -3.86 113.62 114.19 2gmy n SER 142 Ca -0.12 1.21 -0.36 0.00 1.01 0.00 0.00 58.87 60.61 2gmy n SER 142 Cb 0.60 -1.62 -0.13 0.00 -1.01 0.00 0.00 64.21 62.05 2gmy n SER 142 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2gmy s GLN 143 N -1.65 3.46 0.60 1.43 -1.52 -1.26 -4.59 119.66 116.13 2gmy s GLN 143 Ca 0.56 -0.59 -0.15 0.00 -1.95 0.00 0.00 55.36 53.23 2gmy s GLN 143 Cb -0.48 -3.19 -0.03 0.00 -0.22 0.00 0.00 33.01 29.09 2gmy s GLN 143 CO 0.60 -0.23 1.05 -3.38 -0.25 0.00 0.00 175.29 173.07 2gmy s HIS 144 N 1.54 3.11 0.51 0.91 -3.43 -1.26 -5.01 115.29 111.67 2gmy s HIS 144 Ca 0.06 1.48 -0.21 0.00 -0.80 0.00 0.00 55.06 55.58 2gmy s HIS 144 Cb -0.15 -2.94 -0.06 0.00 -1.43 0.00 0.00 32.58 28.01 2gmy s HIS 144 CO 0.00 -1.01 1.21 -2.14 -2.00 0.00 0.00 174.74 170.81 2gmy s PRO 145 N -4.32 3.43 0.00 -0.38 0.02 -1.26 -5.10 135.00 127.39 2gmy s PRO 145 Ca 0.61 1.86 0.08 0.00 0.02 0.00 0.00 61.00 63.57 2gmy s PRO 145 Cb -0.14 -2.23 0.06 0.00 0.02 0.00 0.00 34.50 32.20 2gmy s PRO 145 CO 0.41 -0.84 0.74 0.28 -0.33 0.00 0.00 177.00 177.25