#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 2.68 -0.16 3.15 2.01 -1.25 -4.82 115.64 117.26 2gmy s THR 3 Ca 0.00 0.67 -0.25 0.00 0.31 0.00 0.00 61.69 62.43 2gmy s THR 3 Cb 0.00 -3.43 -0.22 0.00 0.01 0.00 0.00 72.50 68.86 2gmy s THR 3 CO 0.00 0.15 0.54 0.03 -0.69 0.00 0.00 174.62 174.65 2gmy h ARG 4 N 3.57 0.00 -3.74 4.92 3.08 -1.14 -3.48 114.38 117.60 2gmy h ARG 4 Ca -0.49 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.29 2gmy h ARG 4 Cb 1.23 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.97 2gmy h ARG 4 CO 0.67 0.91 -0.73 0.42 -1.07 0.00 0.00 179.97 180.17 2gmy s ILE 5 N -2.22 0.05 -0.95 2.04 1.01 -1.24 -5.07 121.20 114.81 2gmy s ILE 5 Ca -0.21 0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.25 2gmy s ILE 5 Cb -0.00 -0.10 0.05 0.00 0.01 0.00 0.00 42.46 42.42 2gmy s ILE 5 CO 0.61 0.05 1.39 0.21 0.00 0.00 0.00 174.94 177.21 2gmy s ASN 6 N 0.39 6.43 0.29 3.58 3.84 -1.26 -4.87 114.94 123.33 2gmy s ASN 6 Ca -0.03 -1.26 0.10 0.00 0.21 0.00 0.00 52.86 51.88 2gmy s ASN 6 Cb -0.05 -2.56 0.41 0.00 -0.55 0.00 0.00 41.25 38.50 2gmy s ASN 6 CO -0.01 -1.56 1.65 0.10 -2.79 0.00 0.00 177.10 174.49 2gmy h TYR 7 N 9.81 0.06 -0.29 0.43 -0.00 -1.97 0.38 116.97 125.38 2gmy h TYR 7 Ca 0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 58.73 58.75 2gmy h TYR 7 Cb 1.02 -0.01 -0.02 0.00 0.00 0.00 0.00 36.73 37.72 2gmy h TYR 7 CO 1.24 0.60 -0.03 0.00 -0.00 0.00 0.00 178.16 179.97 2gmy h ALA 8 N 1.40 1.41 0.16 0.10 0.00 -1.89 -1.64 119.26 118.80 2gmy h ALA 8 Ca -0.00 -0.20 -0.28 0.00 0.00 0.00 0.00 54.91 54.43 2gmy h ALA 8 Cb 1.01 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.68 2gmy h ALA 8 CO 0.08 0.41 -1.35 0.87 0.00 0.00 0.00 179.25 179.26 2gmy h LYS 9 N 0.43 0.34 -0.76 0.00 1.79 -1.84 -3.05 116.57 113.48 2gmy h LYS 9 Ca 0.09 -0.58 -0.05 0.00 -2.18 0.00 0.00 60.65 57.93 2gmy h LYS 9 Cb 0.33 0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 31.17 2gmy h LYS 9 CO 0.01 1.28 0.27 0.00 -1.08 0.00 0.00 179.45 179.93 2gmy h ALA 10 N 0.05 0.99 -2.16 3.86 0.00 -0.87 -3.38 119.26 117.75 2gmy h ALA 10 Ca -0.27 -0.21 -0.48 0.00 0.00 0.00 0.00 54.91 53.95 2gmy h ALA 10 Cb 1.87 -0.29 -0.34 0.00 0.00 0.00 0.00 17.79 19.03 2gmy h ALA 10 CO 0.14 0.65 -0.81 0.45 0.00 0.00 0.00 179.25 179.68 2gmy s SER 11 N -6.36 1.44 0.36 0.00 0.15 -0.62 -5.00 113.70 103.65 2gmy s SER 11 Ca -0.12 -2.28 0.09 0.00 0.70 0.00 0.00 55.95 54.33 2gmy s SER 11 Cb 0.15 0.10 0.81 0.00 -1.71 0.00 0.00 66.02 65.38 2gmy s SER 11 CO 0.84 -0.22 1.88 -0.65 1.20 0.00 0.00 173.24 176.29 2gmy h PRO 12 N 6.33 0.67 -0.29 5.44 0.11 -1.72 -2.08 132.00 140.47 2gmy h PRO 12 Ca 0.13 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 2gmy h PRO 12 Cb 0.99 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 2gmy h PRO 12 CO 0.26 0.45 0.16 0.93 -0.21 0.00 0.00 178.00 179.58 2gmy h GLU 13 N 0.69 0.41 -0.40 1.05 4.39 -1.94 -0.66 114.58 118.12 2gmy h GLU 13 Ca 0.44 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 60.05 2gmy h GLU 13 Cb 0.69 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 2gmy h GLU 13 CO -0.19 0.36 0.11 0.00 -1.16 0.00 0.00 179.01 178.13 2gmy h ALA 14 N 1.03 0.52 -0.37 3.43 0.00 -1.84 -1.82 119.26 120.20 2gmy h ALA 14 Ca 0.10 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2gmy h ALA 14 Cb 0.07 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2gmy h ALA 14 CO -0.02 0.18 0.14 0.35 0.00 0.00 0.00 179.25 179.91 2gmy h PHE 15 N 0.50 0.25 -0.76 0.00 3.57 -1.23 -2.11 116.94 117.16 2gmy h PHE 15 Ca 0.13 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.66 2gmy h PHE 15 Cb 0.28 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.92 2gmy h PHE 15 CO 0.01 0.11 0.51 0.87 -2.23 0.00 0.00 178.31 177.58 2gmy h LYS 16 N 0.30 0.98 -0.44 1.11 1.57 -0.90 -0.28 116.57 118.90 2gmy h LYS 16 Ca 0.17 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.83 2gmy h LYS 16 Cb 0.14 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 2gmy h LYS 16 CO -0.16 0.65 0.05 0.00 -0.57 0.00 0.00 179.45 179.42 2gmy h ALA 17 N 1.53 0.59 -0.46 3.86 0.00 -0.74 0.46 119.26 124.51 2gmy h ALA 17 Ca 0.29 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 2gmy h ALA 17 Cb -0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2gmy h ALA 17 CO -0.07 0.33 -0.16 0.28 0.00 0.00 0.00 179.25 179.63 2gmy h VAL 18 N 0.60 1.27 -0.22 0.00 2.07 -1.02 -2.76 116.25 116.19 2gmy h VAL 18 Ca 0.13 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.35 2gmy h VAL 18 Cb 0.41 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 2gmy h VAL 18 CO 0.01 0.44 0.03 0.24 0.02 0.00 0.00 177.57 178.31 2gmy h MET 19 N 0.77 0.32 -0.56 1.57 2.07 -0.66 -1.27 114.93 117.17 2gmy h MET 19 Ca 0.12 -0.04 -0.09 0.00 -2.07 0.00 0.00 59.70 57.61 2gmy h MET 19 Cb 0.68 -0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 30.33 2gmy h MET 19 CO 0.05 0.32 -0.01 0.00 1.07 0.00 0.00 176.91 178.34 2gmy h ALA 20 N 1.72 0.76 -0.49 6.32 0.00 -0.64 -0.24 119.26 126.70 2gmy h ALA 20 Ca 0.08 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2gmy h ALA 20 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2gmy h ALA 20 CO 0.00 0.60 0.06 1.25 0.00 0.00 0.00 179.25 181.16 2gmy h LEU 21 N 0.89 0.79 -0.65 0.00 5.85 -1.17 -1.62 115.31 119.40 2gmy h LEU 21 Ca 0.16 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.66 2gmy h LEU 21 Cb 0.56 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 2gmy h LEU 21 CO 0.03 0.87 0.37 -0.08 -0.34 0.00 0.00 178.44 179.29 2gmy h GLU 22 N 0.69 0.67 -0.90 1.25 4.57 -1.09 -1.62 114.58 118.14 2gmy h GLU 22 Ca 0.14 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.28 2gmy h GLU 22 Cb 0.43 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 2gmy h GLU 22 CO 0.01 0.44 0.56 -0.97 -1.18 0.00 0.00 179.01 177.88 2gmy h ASN 23 N 0.69 1.07 0.02 1.04 -1.24 -0.76 -1.03 115.58 115.37 2gmy h ASN 23 Ca 0.29 -0.05 0.01 0.00 0.71 0.00 0.00 56.30 57.25 2gmy h ASN 23 Cb 0.15 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 2gmy h ASN 23 CO -0.17 0.81 -0.07 0.22 -1.29 0.00 0.00 177.43 176.94 2gmy h TYR 24 N 1.24 -0.17 -0.37 0.67 3.20 -0.61 -2.48 116.97 118.46 2gmy h TYR 24 Ca 0.33 0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.26 2gmy h TYR 24 Cb -0.08 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.21 2gmy h TYR 24 CO 0.00 -0.10 0.07 0.28 -1.64 0.00 0.00 178.16 176.77 2gmy h VAL 25 N -0.12 0.81 -0.65 1.81 2.07 -0.70 -0.83 116.25 118.64 2gmy h VAL 25 Ca 0.02 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.52 2gmy h VAL 25 Cb 0.15 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 2gmy h VAL 25 CO -0.06 0.04 0.43 1.56 0.02 0.00 0.00 177.57 179.56 2gmy h GLN 26 N 0.20 0.68 -0.36 1.57 1.08 -1.10 -2.43 115.11 114.75 2gmy h GLN 26 Ca 0.18 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 2gmy h GLN 26 Cb 0.21 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 2gmy h GLN 26 CO -0.23 0.45 0.00 -1.13 -0.95 0.00 0.00 178.83 176.97 2gmy n SER 27 N -4.47 4.13 0.27 1.46 3.41 -0.81 -4.61 113.62 112.99 2gmy n SER 27 Ca 0.09 -2.81 0.16 0.00 -0.26 0.00 0.00 58.87 56.05 2gmy n SER 27 Cb 0.19 -0.53 0.67 0.00 -0.26 0.00 0.00 64.21 64.29 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 2.39 0.00 0.00 4.04 4.64 -0.65 -3.46 113.55 120.51 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 1.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 2gmy h SER 28 CO 0.23 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.87 2gmy n GLY 29 N -0.07 1.23 3.76 -0.77 0.00 -1.26 -5.08 105.19 103.01 2gmy n GLY 29 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 4.35 0.24 0.99 1.43 -1.26 -4.92 118.68 119.50 2gmy s LEU 30 Ca 0.00 2.91 -0.31 0.00 -1.03 0.00 0.00 54.13 55.70 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 -0.82 1.25 1.21 0.23 0.00 0.00 176.35 178.22 2gmy n GLU 31 N 1.38 1.64 0.01 1.70 2.13 -1.26 -4.82 120.64 121.42 2gmy n GLU 31 Ca 0.04 0.58 0.03 0.00 0.66 0.00 0.00 57.16 58.47 2gmy n GLU 31 Cb 0.39 -2.13 0.39 0.00 0.27 0.00 0.00 31.44 30.36 2gmy n GLU 31 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2gmy h HIS 32 N 3.41 0.50 -0.96 4.31 3.86 -1.98 -1.28 115.15 123.02 2gmy h HIS 32 Ca -0.44 -0.01 0.08 0.00 -1.16 0.00 0.00 60.37 58.85 2gmy h HIS 32 Cb 1.31 -0.16 -0.07 0.00 1.06 0.00 0.00 27.41 29.55 2gmy h HIS 32 CO 0.54 0.37 0.61 -0.09 0.86 0.00 0.00 177.93 180.22 2gmy h ARG 33 N 0.52 1.05 -0.17 2.45 2.43 -1.98 0.60 114.38 119.27 2gmy h ARG 33 Ca 0.13 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 59.06 2gmy h ARG 33 Cb 0.05 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2gmy h ARG 33 CO -0.02 0.69 -0.64 0.74 -1.51 0.00 0.00 179.97 179.24 2gmy h PHE 34 N 1.08 0.80 -0.29 2.20 0.04 -1.61 -1.26 116.94 117.90 2gmy h PHE 34 Ca 0.43 -0.32 -0.01 0.00 2.80 0.00 0.00 57.97 60.87 2gmy h PHE 34 Cb 0.24 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.24 2gmy h PHE 34 CO -0.01 1.09 0.13 0.82 -0.60 0.00 0.00 178.31 179.73 2gmy h ILE 35 N 0.45 1.17 -0.45 -0.55 2.04 -0.90 -0.41 117.51 118.86 2gmy h ILE 35 Ca -0.01 -0.50 0.04 0.00 1.00 0.00 0.00 64.86 65.39 2gmy h ILE 35 Cb 1.22 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 2gmy h ILE 35 CO 0.12 0.17 0.21 0.45 0.00 0.00 0.00 178.15 179.11 2gmy h HIS 36 N 0.32 0.39 -0.16 1.37 3.86 -0.81 -1.36 115.15 118.75 2gmy h HIS 36 Ca 0.10 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 2gmy h HIS 36 Cb 0.16 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 2gmy h HIS 36 CO -0.01 0.18 0.11 1.25 0.86 0.00 0.00 177.93 180.32 2gmy h LEU 37 N 0.42 0.19 -0.29 2.43 6.46 -1.04 0.03 115.31 123.51 2gmy h LEU 37 Ca 0.20 -0.01 0.03 0.00 -0.12 0.00 0.00 57.88 57.98 2gmy h LEU 37 Cb 0.13 -0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 39.98 2gmy h LEU 37 CO -0.16 0.14 0.12 0.40 -0.62 0.00 0.00 178.44 178.33 2gmy h ILE 38 N 0.22 0.95 -0.36 4.05 2.04 -0.86 -0.99 117.51 122.57 2gmy h ILE 38 Ca 0.06 -0.09 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 2gmy h ILE 38 Cb -0.02 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2gmy h ILE 38 CO -0.01 0.05 -0.11 0.11 0.00 0.00 0.00 178.15 178.19 2gmy h LYS 39 N 0.26 0.70 -0.09 2.37 1.57 -1.02 -2.12 116.57 118.24 2gmy h LYS 39 Ca 0.12 -0.28 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 2gmy h LYS 39 Cb 0.07 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 2gmy h LYS 39 CO -0.11 0.87 -0.06 1.25 -0.57 0.00 0.00 179.45 180.83 2gmy h LEU 40 N 0.49 0.20 -0.23 2.94 5.85 -0.94 -2.17 115.31 121.46 2gmy h LEU 40 Ca 0.09 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 2gmy h LEU 40 Cb 0.62 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2gmy h LEU 40 CO 0.04 0.61 0.09 -0.09 -0.34 0.00 0.00 178.44 178.75 2gmy h ARG 41 N -0.20 0.34 -0.89 1.25 9.65 -1.20 -1.37 114.38 121.95 2gmy h ARG 41 Ca 0.02 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 58.82 2gmy h ARG 41 Cb 0.54 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.03 2gmy h ARG 41 CO 0.02 0.39 0.49 0.00 2.80 0.00 0.00 179.97 183.67 2gmy h ALA 42 N 0.93 1.14 -0.81 2.80 0.00 -1.45 -1.57 119.26 120.31 2gmy h ALA 42 Ca 0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2gmy h ALA 42 Cb 0.18 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2gmy h ALA 42 CO -0.01 0.64 0.38 0.77 0.00 0.00 0.00 179.25 181.04 2gmy h SER 43 N 1.25 1.06 -0.11 0.00 0.02 -1.10 -0.52 113.55 114.15 2gmy h SER 43 Ca 0.31 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2gmy h SER 43 Cb 0.02 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 2gmy h SER 43 CO -0.05 0.90 0.05 0.40 -1.14 0.00 0.00 176.83 176.99 2gmy h ILE 44 N 1.16 1.12 -0.67 3.27 2.04 -0.73 -0.86 117.51 122.83 2gmy h ILE 44 Ca 0.28 -0.33 0.05 0.00 1.00 0.00 0.00 64.86 65.86 2gmy h ILE 44 Cb 0.13 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.29 2gmy h ILE 44 CO -0.03 0.10 0.38 0.40 0.00 0.00 0.00 178.15 179.00 2gmy h ILE 45 N 0.05 0.99 -0.00 -0.67 2.04 -0.91 -1.92 117.51 117.09 2gmy h ILE 45 Ca 0.04 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.66 2gmy h ILE 45 Cb 0.12 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2gmy h ILE 45 CO -0.00 0.13 -0.00 0.59 0.00 0.00 0.00 178.15 178.86 2gmy n ASN 46 N -4.77 0.00 -0.45 1.72 3.02 -0.24 -4.90 115.26 109.65 2gmy n ASN 46 Ca 0.08 -0.71 -0.06 0.00 -0.03 0.00 0.00 54.58 53.86 2gmy n ASN 46 Cb 0.16 -0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.21 2gmy n ASN 46 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gmy n GLY 47 N 1.10 0.74 3.43 7.41 0.00 -0.72 -4.96 105.19 112.18 2gmy n GLY 47 Ca 0.21 -0.79 -0.44 0.00 0.00 0.00 0.00 46.02 44.99 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 8.93 1.13 -0.32 0.00 0.00 -1.93 0.53 119.26 127.60 2gmy h ALA 49 Ca 0.00 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.88 2gmy h ALA 49 Cb 1.04 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 2gmy h ALA 49 CO 1.09 0.59 -0.10 0.35 0.00 0.00 0.00 179.25 181.18 2gmy h PHE 50 N 1.22 -0.23 -0.03 0.00 3.57 -1.89 0.30 116.94 119.87 2gmy h PHE 50 Ca 0.32 0.03 -0.24 0.00 3.53 0.00 0.00 57.97 61.61 2gmy h PHE 50 Cb -0.04 0.15 0.01 0.00 2.79 0.00 0.00 35.95 38.86 2gmy h PHE 50 CO 0.00 -0.17 -0.94 0.00 -2.23 0.00 0.00 178.31 174.98 2gmy h VAL 52 N 0.35 0.99 -0.39 0.00 2.07 -0.60 0.56 116.25 119.23 2gmy h VAL 52 Ca -0.09 -0.17 0.05 0.00 0.82 0.00 0.00 66.70 67.31 2gmy h VAL 52 Cb 1.58 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 2gmy h VAL 52 CO 0.18 0.09 0.11 -0.78 0.02 0.00 0.00 177.57 177.19 2gmy h ASP 53 N 0.49 0.09 -0.33 0.57 3.58 -0.96 0.81 116.42 120.68 2gmy h ASP 53 Ca 0.20 0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.70 2gmy h ASP 53 Cb 0.08 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 2gmy h ASP 53 CO -0.13 0.09 0.20 -0.03 -2.88 0.00 0.00 179.24 176.49 2gmy h MET 54 N 0.26 0.45 0.00 0.28 4.05 -1.22 -2.84 114.93 115.90 2gmy h MET 54 Ca 0.18 -0.04 -0.12 0.00 -0.28 0.00 0.00 59.70 59.44 2gmy h MET 54 Cb 0.18 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 30.87 2gmy h MET 54 CO -0.20 0.34 -0.65 0.45 0.23 0.00 0.00 176.91 177.08 2gmy h HIS 55 N 0.43 0.00 -0.14 1.39 3.86 -0.40 -1.09 115.15 119.19 2gmy h HIS 55 Ca 0.12 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.35 2gmy h HIS 55 Cb 0.00 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 2gmy h HIS 55 CO -0.04 0.54 0.01 0.28 0.86 0.00 0.00 177.93 179.58 2gmy h VAL 56 N 0.00 0.92 -0.52 2.45 2.07 -0.87 -1.05 116.25 119.24 2gmy h VAL 56 Ca -0.02 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.41 2gmy h VAL 56 Cb 1.43 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 2gmy h VAL 56 CO 0.07 0.01 0.06 0.11 0.02 0.00 0.00 177.57 177.84 2gmy h LYS 57 N 0.07 0.88 -0.56 1.57 1.57 -1.24 -0.73 116.57 118.14 2gmy h LYS 57 Ca 0.07 -0.25 -0.03 0.00 -1.87 0.00 0.00 60.65 58.56 2gmy h LYS 57 Cb 0.07 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 2gmy h LYS 57 CO -0.10 0.88 0.22 0.93 -0.57 0.00 0.00 179.45 180.81 2gmy h GLU 58 N 0.76 0.84 -0.51 3.15 5.08 -1.16 -0.87 114.58 121.87 2gmy h GLU 58 Ca 0.16 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2gmy h GLU 58 Cb 0.44 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2gmy h GLU 58 CO 0.01 0.72 0.29 0.77 -1.00 0.00 0.00 179.01 179.81 2gmy h SER 59 N 0.77 0.63 -0.70 1.42 0.02 -0.96 -2.46 113.55 112.27 2gmy h SER 59 Ca 0.19 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2gmy h SER 59 Cb 0.20 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 2gmy h SER 59 CO -0.02 0.52 0.36 -0.09 -1.14 0.00 0.00 176.83 176.47 2gmy h ARG 60 N 0.68 0.99 -0.60 3.45 2.43 -0.95 -2.44 114.38 117.94 2gmy h ARG 60 Ca 0.18 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 2gmy h ARG 60 Cb 0.02 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 2gmy h ARG 60 CO -0.03 0.76 0.32 1.25 -1.51 0.00 0.00 179.97 180.75 2gmy h HIS 61 N 0.97 0.82 -0.18 2.20 2.76 -0.86 -1.62 115.15 119.24 2gmy h HIS 61 Ca 0.24 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 2gmy h HIS 61 Cb 0.07 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 28.77 2gmy h HIS 61 CO 0.00 0.58 0.00 -0.25 -1.30 0.00 0.00 177.93 176.96 2gmy n ASP 62 N -4.38 1.11 0.00 3.26 8.00 -0.95 -4.90 116.55 118.69 2gmy n ASP 62 Ca 0.06 -2.03 0.00 0.00 0.71 0.00 0.00 54.79 53.53 2gmy n ASP 62 Cb 0.11 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 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 0.72 0.70 3.77 0.44 0.00 -0.61 -5.05 105.19 105.15 2gmy n GLY 63 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 4.09 0.72 0.99 1.43 -0.95 -4.99 118.68 119.97 2gmy s LEU 64 Ca 0.00 2.52 -0.12 0.00 -1.03 0.00 0.00 54.13 55.50 2gmy s LEU 64 Cb 0.00 -4.08 0.03 0.00 0.03 0.00 0.00 46.19 42.17 2gmy s LEU 64 CO 0.00 -0.96 1.09 -0.94 0.23 0.00 0.00 176.35 175.76 2gmy s SER 65 N -1.02 4.91 0.45 2.29 1.04 -1.26 -4.55 113.70 115.56 2gmy s SER 65 Ca 0.61 1.81 0.14 0.00 0.48 0.00 0.00 55.95 58.99 2gmy s SER 65 Cb -0.34 -2.52 1.01 0.00 0.10 0.00 0.00 66.02 64.27 2gmy s SER 65 CO 0.43 -1.76 2.01 -0.33 0.98 0.00 0.00 173.24 174.57 2gmy h GLU 66 N -0.69 0.04 -0.14 4.02 4.39 -1.99 -1.76 114.58 118.46 2gmy h GLU 66 Ca -0.44 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.22 2gmy h GLU 66 Cb 1.23 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2gmy h GLU 66 CO 0.53 0.18 -0.02 0.37 -1.16 0.00 0.00 179.01 178.91 2gmy h GLN 67 N 0.04 0.26 -0.80 2.33 4.15 -1.98 0.22 115.11 119.34 2gmy h GLN 67 Ca 0.01 -0.10 0.09 0.00 0.77 0.00 0.00 58.65 59.43 2gmy h GLN 67 Cb 0.27 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.87 2gmy h GLN 67 CO 0.02 0.54 0.45 2.35 -1.93 0.00 0.00 178.83 180.25 2gmy h TRP 68 N -0.03 0.81 0.14 3.99 7.01 -1.83 -0.75 115.95 125.29 2gmy h TRP 68 Ca 0.04 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 2gmy h TRP 68 Cb 0.44 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.25 2gmy h TRP 68 CO 0.05 0.32 -0.07 0.82 -2.79 0.00 0.00 178.44 176.78 2gmy h ILE 69 N 0.75 1.02 0.00 2.65 2.04 -1.18 -3.31 117.51 119.48 2gmy h ILE 69 Ca 0.39 -0.96 -0.07 0.00 1.00 0.00 0.00 64.86 65.21 2gmy h ILE 69 Cb 0.36 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 2gmy h ILE 69 CO -0.25 0.22 -0.35 0.78 0.00 0.00 0.00 178.15 178.55 2gmy h ASN 70 N -0.67 0.00 -0.06 1.72 4.21 -0.38 -3.06 115.58 117.34 2gmy h ASN 70 Ca -0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.49 2gmy h ASN 70 Cb 0.50 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 2gmy h ASN 70 CO 0.03 0.35 0.00 0.18 -1.29 0.00 0.00 177.43 176.70 2gmy n LEU 71 N -3.59 1.45 0.24 1.61 4.77 -0.30 -4.10 117.00 117.06 2gmy n LEU 71 Ca -0.01 -0.53 0.10 0.00 -0.03 0.00 0.00 56.01 55.54 2gmy n LEU 71 Cb 0.47 -0.03 0.60 0.00 -2.33 0.00 0.00 43.42 42.12 2gmy n LEU 71 CO 0.36 0.26 0.89 -0.03 -1.33 0.00 0.00 177.39 177.55 2gmy h MET 72 N 2.14 0.00 0.00 3.23 4.05 -1.62 -0.82 114.93 121.91 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 0.46 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.26 2gmy h MET 72 CO 0.00 0.19 0.00 0.66 0.23 0.00 0.00 176.91 177.99 2gmy h SER 73 N 0.00 0.00 -0.32 1.39 4.64 -1.82 -3.26 113.55 114.18 2gmy h SER 73 Ca -0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 2gmy h SER 73 Cb 0.48 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.17 2gmy h SER 73 CO 0.02 0.00 -1.08 1.33 -0.87 0.00 0.00 176.83 176.23 2gmy n VAL 74 N -2.55 0.97 0.26 0.95 0.24 -0.38 -4.96 118.33 112.86 2gmy n VAL 74 Ca 0.02 -2.43 0.08 0.00 -2.04 0.00 0.00 64.34 59.97 2gmy n VAL 74 Cb 0.26 1.13 0.64 0.00 -1.47 0.00 0.00 33.84 34.40 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 2.13 0.00 -0.27 6.34 5.08 -1.43 -2.76 115.95 125.04 2gmy h TRP 75 Ca -0.15 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.82 2gmy h TRP 75 Cb 1.45 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.60 2gmy h TRP 75 CO 0.43 0.04 0.16 0.00 -1.28 0.00 0.00 178.44 177.78 2gmy h ARG 76 N 0.00 0.37 -0.56 0.12 3.08 -1.91 -1.94 114.38 113.54 2gmy h ARG 76 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2gmy h ARG 76 Cb 0.07 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2gmy h ARG 76 CO 0.00 0.27 0.00 0.39 -1.07 0.00 0.00 179.97 179.56 2gmy n GLU 77 N -4.47 2.50 -3.91 0.04 -0.58 -1.04 -4.94 120.64 108.24 2gmy n GLU 77 Ca 0.01 -2.31 -0.35 0.00 -0.42 0.00 0.00 57.16 54.09 2gmy n GLU 77 Cb 0.09 -1.51 -0.11 0.00 -0.57 0.00 0.00 31.44 29.34 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 -1.17 5.41 0.00 1.62 0.15 -0.73 -4.98 113.70 113.99 2gmy s SER 78 Ca 0.42 -0.05 0.19 0.00 0.70 0.00 0.00 55.95 57.21 2gmy s SER 78 Cb 0.23 -1.95 1.14 0.00 -1.71 0.00 0.00 66.02 63.73 2gmy s SER 78 CO 0.31 0.08 1.55 -0.81 1.20 0.00 0.00 173.24 175.56 2gmy n PRO 79 N 4.19 0.68 0.10 5.44 -0.04 -1.26 -3.90 135.00 140.21 2gmy n PRO 79 Ca -0.16 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.30 2gmy n PRO 79 Cb 0.52 -1.44 0.29 0.00 -0.04 0.00 0.00 33.50 32.83 2gmy n PRO 79 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2gmy h VAL 80 N 0.00 1.25 -3.60 0.52 3.04 -1.93 -3.44 116.25 112.08 2gmy h VAL 80 Ca 0.00 -1.19 -0.51 0.00 -1.01 0.00 0.00 66.70 63.99 2gmy h VAL 80 Cb 0.00 1.46 -0.03 0.00 -2.01 0.00 0.00 31.29 30.71 2gmy h VAL 80 CO 0.00 0.36 0.26 -0.31 -1.01 0.00 0.00 177.57 176.87 2gmy s TYR 81 N -4.42 3.91 0.90 3.17 2.02 -1.25 -5.04 117.35 116.64 2gmy s TYR 81 Ca -0.05 1.74 -0.11 0.00 -0.37 0.00 0.00 57.07 58.28 2gmy s TYR 81 Cb 0.14 -2.88 0.13 0.00 -0.40 0.00 0.00 41.96 38.95 2gmy s TYR 81 CO 0.76 0.44 1.09 0.95 -1.57 0.00 0.00 175.55 177.21 2gmy s THR 82 N -0.92 2.65 0.30 -0.71 -4.23 -1.26 -4.77 115.64 106.70 2gmy s THR 82 Ca 0.39 0.21 -0.02 0.00 -1.18 0.00 0.00 61.69 61.10 2gmy s THR 82 Cb -0.24 -2.66 0.23 0.00 1.34 0.00 0.00 72.50 71.17 2gmy s THR 82 CO 0.28 -0.28 1.93 -0.33 -0.54 0.00 0.00 174.62 175.69 2gmy h GLU 83 N -1.58 0.99 -0.24 3.99 4.39 -1.99 0.97 114.58 121.12 2gmy h GLU 83 Ca -0.49 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.10 2gmy h GLU 83 Cb 1.28 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.72 2gmy h GLU 83 CO 0.54 0.72 0.11 0.37 -1.16 0.00 0.00 179.01 179.59 2gmy h GLN 84 N 1.00 0.35 -0.82 2.33 4.15 -1.98 -0.79 115.11 119.35 2gmy h GLN 84 Ca 0.26 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.65 2gmy h GLN 84 Cb -0.00 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 27.58 2gmy h GLN 84 CO -0.04 0.36 0.53 0.93 -1.93 0.00 0.00 178.83 178.68 2gmy h GLU 85 N 0.25 1.04 -0.80 1.69 5.08 -1.76 -1.51 114.58 118.58 2gmy h GLU 85 Ca 0.08 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2gmy h GLU 85 Cb 0.13 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 2gmy h GLU 85 CO -0.01 0.69 0.48 0.00 -1.00 0.00 0.00 179.01 179.17 2gmy h ARG 86 N 1.07 1.08 -0.40 2.33 3.08 -0.53 0.19 114.38 121.19 2gmy h ARG 86 Ca 0.31 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.25 2gmy h ARG 86 Cb -0.06 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.75 2gmy h ARG 86 CO -0.09 0.75 0.14 0.00 -1.07 0.00 0.00 179.97 179.70 2gmy h ALA 87 N 1.44 0.52 -0.21 0.04 0.00 -0.58 -1.22 119.26 119.25 2gmy h ALA 87 Ca 0.29 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2gmy h ALA 87 Cb -0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2gmy h ALA 87 CO -0.05 0.14 0.06 1.25 0.00 0.00 0.00 179.25 180.64 2gmy h LEU 88 N 0.50 0.32 -0.80 0.00 5.85 -0.85 -2.90 115.31 117.42 2gmy h LEU 88 Ca 0.13 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.69 2gmy h LEU 88 Cb 0.22 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 2gmy h LEU 88 CO -0.01 0.46 0.48 -0.07 -0.34 0.00 0.00 178.44 178.96 2gmy h LEU 89 N 0.16 0.74 -1.15 2.25 3.38 -0.50 0.98 115.31 121.17 2gmy h LEU 89 Ca 0.07 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.14 2gmy h LEU 89 Cb 0.26 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 2gmy h LEU 89 CO -0.00 0.47 0.59 1.23 0.09 0.00 0.00 178.44 180.81 2gmy h GLY 90 N 0.87 1.33 0.96 0.83 0.00 -1.12 -0.04 103.07 105.90 2gmy h GLY 90 Ca 0.36 -0.40 -0.21 0.00 0.00 0.00 0.00 47.33 47.07 2gmy h GLY 90 CO -0.18 0.27 -0.85 -0.25 0.00 0.00 0.00 176.54 175.52 2gmy h TRP 91 N 0.99 0.79 -0.47 5.60 2.91 -1.04 -1.22 115.95 123.50 2gmy h TRP 91 Ca 0.40 -0.45 0.08 0.00 1.13 0.00 0.00 58.89 60.05 2gmy h TRP 91 Cb 0.27 -0.08 -0.07 0.00 -0.51 0.00 0.00 29.16 28.78 2gmy h TRP 91 CO -0.00 1.29 0.09 0.28 -1.03 0.00 0.00 178.44 179.06 2gmy h VAL 92 N 0.06 0.73 0.06 2.65 2.07 -0.51 -0.15 116.25 121.17 2gmy h VAL 92 Ca -0.12 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2gmy h VAL 92 Cb 1.55 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 2gmy h VAL 92 CO 0.17 0.04 -0.03 0.44 0.02 0.00 0.00 177.57 178.20 2gmy h ASP 93 N 0.22 -0.07 -0.84 0.57 5.19 -0.99 0.35 116.42 120.84 2gmy h ASP 93 Ca 0.23 -0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.58 2gmy h ASP 93 Cb 0.31 0.02 -0.04 0.00 0.18 0.00 0.00 39.33 39.80 2gmy h ASP 93 CO -0.31 -0.02 0.41 0.00 -3.12 0.00 0.00 179.24 176.20 2gmy h ALA 94 N 0.81 1.08 0.17 3.45 0.00 -0.89 -1.71 119.26 122.17 2gmy h ALA 94 Ca -0.01 -0.16 -0.30 0.00 0.00 0.00 0.00 54.91 54.44 2gmy h ALA 94 Cb 0.10 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.57 2gmy h ALA 94 CO 0.01 0.64 -1.39 0.28 0.00 0.00 0.00 179.25 178.79 2gmy h VAL 95 N 1.19 1.35 -0.62 0.00 2.07 -1.01 -2.67 116.25 116.56 2gmy h VAL 95 Ca 0.29 -2.89 -0.01 0.00 0.82 0.00 0.00 66.70 64.91 2gmy h VAL 95 Cb 0.11 2.94 -0.03 0.00 -1.52 0.00 0.00 31.29 32.79 2gmy h VAL 95 CO -0.04 0.86 0.34 0.74 0.02 0.00 0.00 177.57 179.49 2gmy h THR 96 N 0.10 1.19 -1.34 2.57 2.02 -0.80 -2.55 112.91 114.10 2gmy h THR 96 Ca -0.20 -0.46 -0.69 0.00 0.77 0.00 0.00 66.41 65.83 2gmy h THR 96 Cb 2.05 0.34 -0.31 0.00 -1.74 0.00 0.00 68.15 68.49 2gmy h THR 96 CO 0.22 0.21 0.64 0.29 0.37 0.00 0.00 175.52 177.25 2gmy n LYS 97 N -4.39 2.86 -0.27 6.66 5.02 -0.66 -4.80 118.16 122.60 2gmy n LYS 97 Ca 0.06 -3.55 0.11 0.00 -2.02 0.00 0.00 58.31 52.91 2gmy n LYS 97 Cb 0.09 -2.28 0.36 0.00 -0.02 0.00 0.00 35.03 33.18 2gmy n LYS 97 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 2gmy h ILE 98 N 1.57 0.87 -0.08 -0.18 6.09 -1.10 -1.04 117.51 123.65 2gmy h ILE 98 Ca 0.55 -0.26 -0.08 0.00 -1.37 0.00 0.00 64.86 63.70 2gmy h ILE 98 Cb 0.64 0.07 -0.01 0.00 0.47 0.00 0.00 36.82 37.98 2gmy h ILE 98 CO 1.40 0.14 -0.34 0.00 -3.07 0.00 0.00 178.15 176.28 2gmy h ALA 99 N 1.59 1.30 0.16 0.18 0.00 -1.87 0.02 119.26 120.65 2gmy h ALA 99 Ca 0.44 -0.34 -0.32 0.00 0.00 0.00 0.00 54.91 54.69 2gmy h ALA 99 Cb 0.62 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.34 2gmy h ALA 99 CO -0.20 0.49 -1.56 0.93 0.00 0.00 0.00 179.25 178.91 2gmy h GLU 100 N 0.13 0.35 0.00 0.00 5.08 -1.64 -3.41 114.58 115.08 2gmy h GLU 100 Ca 0.02 -0.59 -0.31 0.00 -1.00 0.00 0.00 59.36 57.47 2gmy h GLU 100 Cb 0.66 0.22 -0.06 0.00 0.50 0.00 0.00 28.75 30.08 2gmy h GLU 100 CO 0.05 1.28 -1.99 0.25 -1.00 0.00 0.00 179.01 177.60 2gmy n THR 101 N -3.75 1.44 -1.42 1.13 -2.24 -0.50 -4.99 114.28 103.95 2gmy n THR 101 Ca -0.24 -0.81 -0.15 0.00 -2.27 0.00 0.00 64.05 60.59 2gmy n THR 101 Cb 1.00 -0.74 -0.06 0.00 -2.10 0.00 0.00 70.33 68.43 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 1.62 1.46 3.24 3.38 0.00 -0.02 -4.01 105.19 110.86 2gmy n GLY 102 Ca -0.23 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.52 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 1.27 -2.63 -1.41 4.61 0.00 -1.26 -4.93 120.51 116.15 2gmy n ALA 103 Ca -0.15 0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.05 2gmy n ALA 103 Cb 0.54 -1.62 0.08 0.00 0.00 0.00 0.00 19.45 18.45 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 -3.41 2.29 0.25 0.00 0.02 -1.26 -4.81 135.00 128.09 2gmy s PRO 104 Ca 0.05 1.72 -0.03 0.00 0.02 0.00 0.00 61.00 62.77 2gmy s PRO 104 Cb -0.01 -1.86 0.51 0.00 0.02 0.00 0.00 34.50 33.17 2gmy s PRO 104 CO 0.80 -1.71 1.72 -0.44 -0.33 0.00 0.00 177.00 177.03 2gmy h ASP 105 N -0.15 0.25 -0.21 2.53 3.32 -1.96 -2.02 116.42 118.17 2gmy h ASP 105 Ca -0.48 0.12 -0.00 0.00 0.02 0.00 0.00 57.03 56.69 2gmy h ASP 105 Cb 1.29 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.94 2gmy h ASP 105 CO 0.51 0.06 0.13 0.44 -1.72 0.00 0.00 179.24 178.66 2gmy h ASP 106 N 0.41 0.26 -0.98 6.45 3.32 -1.99 0.14 116.42 124.03 2gmy h ASP 106 Ca 0.44 -0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.45 2gmy h ASP 106 Cb 0.73 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.16 2gmy h ASP 106 CO -0.45 0.24 0.65 0.00 -1.72 0.00 0.00 179.24 177.96 2gmy h ALA 107 N 1.03 1.25 -0.34 3.45 0.00 -1.85 -1.65 119.26 121.14 2gmy h ALA 107 Ca 0.08 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 2gmy h ALA 107 Cb 0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2gmy h ALA 107 CO -0.01 0.62 -0.33 0.35 0.00 0.00 0.00 179.25 179.88 2gmy h PHE 108 N 1.32 1.00 -0.53 0.00 3.57 -0.98 -2.29 116.94 119.03 2gmy h PHE 108 Ca 0.36 -0.30 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2gmy h PHE 108 Cb -0.14 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.36 2gmy h PHE 108 CO -0.00 1.09 0.33 1.49 -2.23 0.00 0.00 178.31 178.99 2gmy h GLU 109 N 0.62 0.71 -0.69 1.11 4.81 -0.46 0.26 114.58 120.94 2gmy h GLU 109 Ca 0.06 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2gmy h GLU 109 Cb 0.92 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 2gmy h GLU 109 CO 0.08 0.49 0.21 1.15 -0.73 0.00 0.00 179.01 180.22 2gmy h THR 110 N 0.71 1.26 -0.44 0.32 2.02 -1.31 -1.81 112.91 113.66 2gmy h THR 110 Ca 0.19 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.48 2gmy h THR 110 Cb -0.04 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 2gmy h THR 110 CO -0.04 0.35 0.26 0.25 0.37 0.00 0.00 175.52 176.71 2gmy h LEU 111 N 1.02 0.53 -1.92 2.58 5.85 -0.99 -2.72 115.31 119.66 2gmy h LEU 111 Ca 0.22 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2gmy h LEU 111 Cb 0.31 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 2gmy h LEU 111 CO -0.01 0.44 -0.05 0.03 -0.34 0.00 0.00 178.44 178.51 2gmy h ARG 112 N 0.58 0.00 -0.47 1.25 3.08 -0.60 -1.23 114.38 116.99 2gmy h ARG 112 Ca 0.16 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.29 2gmy h ARG 112 Cb 0.01 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 2gmy h ARG 112 CO -0.03 0.05 0.32 0.00 -1.07 0.00 0.00 179.97 179.24 2gmy h ALA 113 N 1.95 2.09 0.00 0.04 0.00 -1.00 -3.26 119.26 119.07 2gmy h ALA 113 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2gmy h ALA 113 Cb 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2gmy h ALA 113 CO 0.01 -0.19 -0.34 0.72 0.00 0.00 0.00 179.25 179.45 2gmy n HIS 114 N -4.46 0.00 -4.05 0.00 8.25 -0.52 -5.02 115.22 109.42 2gmy n HIS 114 Ca 0.07 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.40 2gmy n HIS 114 Cb 0.34 -0.01 -0.13 0.00 1.12 0.00 0.00 29.99 31.32 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 -1.63 0.40 0.88 4.41 0.08 -0.86 -5.10 117.98 116.16 2gmy s PHE 115 Ca 0.02 -0.24 -0.11 0.00 0.12 0.00 0.00 56.93 56.71 2gmy s PHE 115 Cb 0.05 -0.25 0.12 0.00 -0.57 0.00 0.00 43.02 42.36 2gmy s PHE 115 CO 0.26 -0.05 1.09 -1.54 -0.10 0.00 0.00 175.22 174.88 2gmy s SER 116 N -0.68 3.63 0.25 1.36 1.04 -1.26 -4.59 113.70 113.44 2gmy s SER 116 Ca -0.04 1.48 -0.05 0.00 0.48 0.00 0.00 55.95 57.82 2gmy s SER 116 Cb -0.05 -2.17 0.29 0.00 0.10 0.00 0.00 66.02 64.19 2gmy s SER 116 CO -0.00 -2.54 1.91 0.44 0.98 0.00 0.00 173.24 174.04 2gmy h ASP 117 N -1.48 1.11 -0.18 7.02 5.19 -1.99 0.38 116.42 126.47 2gmy h ASP 117 Ca -0.49 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 55.90 2gmy h ASP 117 Cb 1.28 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.51 2gmy h ASP 117 CO 0.55 0.78 0.11 -0.08 -3.12 0.00 0.00 179.24 177.48 2gmy h GLU 118 N 1.30 0.25 -0.85 3.56 4.81 -2.00 -1.45 114.58 120.20 2gmy h GLU 118 Ca 0.38 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.61 2gmy h GLU 118 Cb -0.07 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.21 2gmy h GLU 118 CO -0.10 0.21 0.56 0.93 -0.73 0.00 0.00 179.01 179.88 2gmy h GLU 119 N 0.22 1.09 -0.85 1.92 5.08 -1.82 -1.94 114.58 118.27 2gmy h GLU 119 Ca 0.07 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2gmy h GLU 119 Cb 0.03 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 28.99 2gmy h GLU 119 CO -0.01 0.72 0.43 0.82 -1.00 0.00 0.00 179.01 179.97 2gmy h ILE 120 N 1.12 1.26 -0.33 3.13 2.04 -0.53 0.15 117.51 124.36 2gmy h ILE 120 Ca 0.32 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 2gmy h ILE 120 Cb -0.08 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 2gmy h ILE 120 CO -0.09 0.30 0.14 0.58 0.00 0.00 0.00 178.15 179.09 2gmy h VAL 121 N 1.20 1.17 -0.41 1.67 2.07 -0.77 0.21 116.25 121.39 2gmy h VAL 121 Ca 0.29 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.34 2gmy h VAL 121 Cb 0.09 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2gmy h VAL 121 CO -0.04 0.18 0.19 0.11 0.02 0.00 0.00 177.57 178.04 2gmy h LYS 122 N 0.38 0.38 -0.45 1.57 1.57 -0.87 -0.86 116.57 118.29 2gmy h LYS 122 Ca 0.11 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.91 2gmy h LYS 122 Cb 0.15 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 2gmy h LYS 122 CO -0.01 0.25 0.21 0.82 -0.57 0.00 0.00 179.45 180.16 2gmy h ILE 123 N 0.40 0.94 -0.19 1.86 2.04 -0.49 -1.02 117.51 121.04 2gmy h ILE 123 Ca 0.18 -0.15 -0.17 0.00 1.00 0.00 0.00 64.86 65.72 2gmy h ILE 123 Cb 0.09 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 2gmy h ILE 123 CO -0.13 0.08 -0.57 0.74 0.00 0.00 0.00 178.15 178.26 2gmy h THR 124 N 0.42 1.31 -0.69 -0.27 2.02 -0.56 0.22 112.91 115.37 2gmy h THR 124 Ca 0.20 -1.82 -0.05 0.00 0.77 0.00 0.00 66.41 65.51 2gmy h THR 124 Cb 0.13 1.78 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 2gmy h THR 124 CO -0.16 0.57 0.25 0.58 0.37 0.00 0.00 175.52 177.13 2gmy h VAL 125 N 0.47 1.25 -0.81 3.16 2.07 -1.08 -1.01 116.25 120.30 2gmy h VAL 125 Ca 0.00 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.72 2gmy h VAL 125 Cb 1.14 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 2gmy h VAL 125 CO 0.11 0.32 0.53 0.00 0.02 0.00 0.00 177.57 178.56 2gmy h ALA 126 N 1.11 1.03 -0.65 1.67 0.00 -0.65 0.15 119.26 121.91 2gmy h ALA 126 Ca 0.23 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2gmy h ALA 126 Cb 0.25 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2gmy h ALA 126 CO -0.01 0.42 0.32 0.82 0.00 0.00 0.00 179.25 180.80 2gmy h ILE 127 N 1.08 1.22 -0.42 0.00 2.04 -0.69 -1.71 117.51 119.04 2gmy h ILE 127 Ca 0.30 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2gmy h ILE 127 Cb -0.11 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 2gmy h ILE 127 CO -0.07 0.25 0.28 1.23 0.00 0.00 0.00 178.15 179.84 2gmy h GLY 128 N 0.90 0.59 0.95 5.37 0.00 -0.46 -1.77 103.07 108.65 2gmy h GLY 128 Ca 0.22 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.34 2gmy h GLY 128 CO -0.03 0.22 0.13 0.00 0.00 0.00 0.00 176.54 176.85 2gmy h ALA 129 N 1.15 0.27 -0.21 3.60 0.00 -0.33 -1.27 119.26 122.47 2gmy h ALA 129 Ca 0.15 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2gmy h ALA 129 Cb -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2gmy h ALA 129 CO -0.03 -0.27 -0.31 0.97 0.00 0.00 0.00 179.25 179.60 2gmy h ILE 130 N 0.26 1.28 0.00 0.00 6.09 -1.27 -1.50 117.51 122.37 2gmy h ILE 130 Ca 0.09 -1.36 -0.03 0.00 -1.37 0.00 0.00 64.86 62.19 2gmy h ILE 130 Cb -0.00 1.46 -0.00 0.00 0.47 0.00 0.00 36.82 38.74 2gmy h ILE 130 CO -0.04 0.42 -0.13 0.78 -3.07 0.00 0.00 178.15 176.11 2gmy h ASN 131 N 0.36 0.00 0.05 2.19 2.35 -0.81 0.14 115.58 119.86 2gmy h ASN 131 Ca 0.05 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2gmy h ASN 131 Cb 0.73 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.10 2gmy h ASN 131 CO 0.06 0.13 -0.02 0.74 -1.65 0.00 0.00 177.43 176.68 2gmy h THR 132 N 0.00 1.29 -0.73 2.81 2.02 -0.43 -2.66 112.91 115.22 2gmy h THR 132 Ca -0.00 -1.27 0.06 0.00 0.77 0.00 0.00 66.41 65.97 2gmy h THR 132 Cb 0.23 2.11 -0.06 0.00 -1.74 0.00 0.00 68.15 68.69 2gmy h THR 132 CO 0.02 0.31 0.42 -0.50 0.37 0.00 0.00 175.52 176.14 2gmy h TRP 133 N -0.65 0.77 -0.85 3.16 4.06 -0.80 -1.07 115.95 120.57 2gmy h TRP 133 Ca -0.01 0.03 0.05 0.00 2.06 0.00 0.00 58.89 61.02 2gmy h TRP 133 Cb 0.56 -0.24 -0.06 0.00 -1.00 0.00 0.00 29.16 28.43 2gmy h TRP 133 CO 0.11 0.37 0.54 -0.91 -3.56 0.00 0.00 178.44 174.99 2gmy h ASN 134 N 0.76 0.86 -0.42 -3.49 2.35 -0.79 0.11 115.58 114.96 2gmy h ASN 134 Ca 0.33 0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.97 2gmy h ASN 134 Cb 0.20 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 2gmy h ASN 134 CO -0.19 0.57 -0.17 0.03 -1.65 0.00 0.00 177.43 176.02 2gmy h ARG 135 N 1.01 0.91 -0.00 0.81 3.08 -0.99 -0.36 114.38 118.83 2gmy h ARG 135 Ca 0.36 -0.35 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2gmy h ARG 135 Cb 0.10 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2gmy h ARG 135 CO -0.15 1.00 0.00 0.82 -1.07 0.00 0.00 179.97 180.58 2gmy h ILE 136 N 0.80 1.22 -0.23 2.04 2.04 -0.84 0.60 117.51 123.13 2gmy h ILE 136 Ca 0.12 -0.63 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 2gmy h ILE 136 Cb 0.71 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 2gmy h ILE 136 CO 0.05 0.16 -0.04 0.00 0.00 0.00 0.00 178.15 178.33 2gmy h ALA 137 N 0.73 0.32 -0.16 1.87 0.00 -0.73 -0.07 119.26 121.20 2gmy h ALA 137 Ca 0.00 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2gmy h ALA 137 Cb 0.27 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2gmy h ALA 137 CO 0.00 0.09 -0.18 0.28 0.00 0.00 0.00 179.25 179.44 2gmy h VAL 138 N 0.18 1.34 -1.00 0.00 2.07 -1.16 0.03 116.25 117.71 2gmy h VAL 138 Ca 0.06 -1.36 0.17 0.00 0.82 0.00 0.00 66.70 66.40 2gmy h VAL 138 Cb 0.49 1.85 -0.10 0.00 -1.52 0.00 0.00 31.29 32.02 2gmy h VAL 138 CO 0.02 0.40 0.62 1.23 0.02 0.00 0.00 177.57 179.86 2gmy h GLY 139 N 0.05 1.70 -2.23 2.17 0.00 -0.81 -1.99 103.07 101.97 2gmy h GLY 139 Ca 0.02 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2gmy h GLY 139 CO 0.04 -0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.27 2gmy n PHE 140 N -4.71 0.92 -3.90 5.60 3.72 -0.05 -4.94 117.46 114.10 2gmy n PHE 140 Ca 0.22 -0.55 -0.27 0.00 -0.05 0.00 0.00 57.45 56.80 2gmy n PHE 140 Cb 0.53 -0.08 0.01 0.00 -0.94 0.00 0.00 39.48 38.99 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 1.02 -4.54 -1.75 -1.08 5.12 -0.46 -0.73 116.66 114.24 2gmy n ARG 141 Ca 0.20 0.53 -0.42 0.00 -1.93 0.00 0.00 57.85 56.24 2gmy n ARG 141 Cb 0.63 -5.14 -0.01 0.00 -1.16 0.00 0.00 32.46 26.79 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 -2.91 3.60 -4.38 0.55 7.64 -0.13 -3.83 113.62 114.16 2gmy n SER 142 Ca -0.13 1.20 -0.36 0.00 1.01 0.00 0.00 58.87 60.59 2gmy n SER 142 Cb 0.60 -1.58 -0.13 0.00 -1.01 0.00 0.00 64.21 62.09 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 -1.55 3.49 0.57 1.43 -1.52 -1.26 -4.61 119.66 116.20 2gmy s GLN 143 Ca 0.57 -0.57 -0.16 0.00 -1.95 0.00 0.00 55.36 53.25 2gmy s GLN 143 Cb -0.50 -3.20 -0.05 0.00 -0.22 0.00 0.00 33.01 29.04 2gmy s GLN 143 CO 0.59 -0.22 1.03 -3.38 -0.25 0.00 0.00 175.29 173.07 2gmy s HIS 144 N 1.55 3.15 0.58 0.91 -3.43 -1.26 -5.03 115.29 111.77 2gmy s HIS 144 Ca 0.06 1.49 -0.19 0.00 -0.80 0.00 0.00 55.06 55.62 2gmy s HIS 144 Cb -0.15 -2.93 -0.04 0.00 -1.43 0.00 0.00 32.58 28.03 2gmy s HIS 144 CO 0.01 -0.87 1.18 -1.25 -2.00 0.00 0.00 174.74 171.80 2gmy s PRO 145 N -4.12 3.07 -0.24 -0.38 0.04 -1.26 -5.03 135.00 127.08 2gmy s PRO 145 Ca 0.62 1.73 -0.01 0.00 0.04 0.00 0.00 61.00 63.38 2gmy s PRO 145 Cb -0.14 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.48 2gmy s PRO 145 CO 0.36 -1.11 -0.08 0.08 0.04 0.00 0.00 177.00 176.29 2gmy s VAL 146 N -1.70 2.69 -0.17 -0.36 1.01 -1.26 -5.10 120.40 115.52 2gmy s VAL 146 Ca 0.75 -1.11 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 2gmy s VAL 146 Cb -0.28 -2.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.72 2gmy s VAL 146 CO 0.32 0.19 0.99 -1.61 0.00 0.00 0.00 175.10 174.99 2gmy s GLU 147 N 1.29 4.33 0.00 2.72 8.01 -1.26 -5.36 118.70 128.43 2gmy s GLU 147 Ca -0.01 1.31 0.30 0.00 0.01 0.00 0.00 54.97 56.59 2gmy s GLU 147 Cb -0.17 -3.59 1.53 0.00 -4.31 0.00 0.00 34.13 27.60 2gmy s GLU 147 CO -0.05 -0.45 2.02 0.00 0.01 0.00 0.00 175.26 176.79