#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rg0 n SER 26 N 0.00 2.42 0.08 4.38 2.88 -1.26 -4.87 113.62 117.24 1rg0 n SER 26 Ca 0.00 1.10 0.13 0.00 -1.33 0.00 0.00 58.87 58.77 1rg0 n SER 26 Cb 0.00 -1.31 0.46 0.00 -0.75 0.00 0.00 64.21 62.61 1rg0 n SER 26 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1rg0 n GLU 27 N 3.11 0.18 -0.01 -1.46 1.02 -1.26 -1.78 120.64 120.45 1rg0 n GLU 27 Ca 0.18 0.19 -0.17 0.00 -0.02 0.00 0.00 57.16 57.34 1rg0 n GLU 27 Cb 0.24 -1.73 -0.10 0.00 -0.02 0.00 0.00 31.44 29.83 1rg0 n GLU 27 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1rg0 h PHE 28 N 0.00 0.64 -0.25 -0.32 -1.00 -1.99 -2.57 116.94 111.45 1rg0 h PHE 28 Ca 0.00 -0.32 -0.11 0.00 2.81 0.00 0.00 57.97 60.35 1rg0 h PHE 28 Cb 0.62 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 40.08 1rg0 h PHE 28 CO 0.00 1.12 -0.31 0.00 -1.61 0.00 0.00 178.31 177.51 1rg0 h ALA 29 N 0.38 1.00 -0.62 2.45 0.00 -1.93 -2.43 119.26 118.10 1rg0 h ALA 29 Ca -0.06 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1rg0 h ALA 29 Cb 1.25 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1rg0 h ALA 29 CO 0.11 0.60 0.18 0.00 0.00 0.00 0.00 179.25 180.14 1rg0 h ARG 30 N 0.44 0.98 -0.12 0.00 3.08 -1.38 -2.91 114.38 114.48 1rg0 h ARG 30 Ca 0.06 -0.22 -0.12 0.00 0.07 0.00 0.00 59.98 59.76 1rg0 h ARG 30 Cb 0.76 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 1rg0 h ARG 30 CO 0.06 0.88 -0.45 0.00 -1.07 0.00 0.00 179.97 179.39 1rg0 h ALA 31 N 1.06 1.02 -0.19 0.04 0.00 -1.38 -2.51 119.26 117.30 1rg0 h ALA 31 Ca 0.20 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 1rg0 h ALA 31 Cb 0.32 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1rg0 h ALA 31 CO -0.00 0.62 -0.13 1.96 0.00 0.00 0.00 179.25 181.70 1rg0 h GLN 32 N 0.23 0.43 0.00 0.00 4.20 -1.28 -1.20 115.11 117.49 1rg0 h GLN 32 Ca 0.02 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1rg0 h GLN 32 Cb 0.88 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.66 1rg0 h GLN 32 CO 0.07 0.75 0.00 -0.07 -0.67 0.00 0.00 178.83 178.91 1rg0 h LEU 33 N 0.11 0.00 -0.30 1.46 3.38 -1.49 -0.98 115.31 117.49 1rg0 h LEU 33 Ca 0.04 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.81 1rg0 h LEU 33 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1rg0 h LEU 33 CO 0.04 0.00 -0.84 0.28 0.09 0.00 0.00 178.44 178.00 1rg0 h SER 34 N 0.00 0.40 0.32 -0.43 0.02 -1.13 -2.78 113.55 109.94 1rg0 h SER 34 Ca 0.00 -0.30 -0.02 0.00 -0.84 0.00 0.00 61.79 60.63 1rg0 h SER 34 Cb 0.34 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1rg0 h SER 34 CO 0.00 1.07 -0.15 -0.08 -1.14 0.00 0.00 176.83 176.53 1rg0 h GLU 35 N 0.19 -0.41 -0.76 3.45 4.81 0.07 -2.75 114.58 119.18 1rg0 h GLU 35 Ca -0.05 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.32 1rg0 h GLU 35 Cb 1.45 0.09 -0.13 0.00 0.63 0.00 0.00 28.75 30.80 1rg0 h GLU 35 CO 0.14 -0.21 -0.41 0.00 -0.73 0.00 0.00 179.01 177.80 1rg0 h ALA 36 N 0.13 -0.10 -0.69 2.92 0.00 -1.50 -0.51 119.26 119.51 1rg0 h ALA 36 Ca -0.04 0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.09 1rg0 h ALA 36 Cb 0.39 0.97 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 1rg0 h ALA 36 CO 0.07 -0.73 0.42 1.98 0.00 0.00 0.00 179.25 180.99 1rg0 h MET 37 N -0.11 0.77 -0.37 0.00 1.85 -1.48 -0.07 114.93 115.52 1rg0 h MET 37 Ca 0.25 -0.05 -0.11 0.00 -0.61 0.00 0.00 59.70 59.18 1rg0 h MET 37 Cb 0.56 -0.17 -0.01 0.00 0.43 0.00 0.00 31.60 32.40 1rg0 h MET 37 CO -0.81 0.51 -0.24 1.15 -0.40 0.00 0.00 176.91 177.12 1rg0 h THR 38 N 0.80 1.27 -0.07 -0.77 2.02 -0.89 0.48 112.91 115.74 1rg0 h THR 38 Ca 0.29 -1.34 -0.14 0.00 0.77 0.00 0.00 66.41 65.98 1rg0 h THR 38 Cb 0.09 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 1rg0 h THR 38 CO -0.14 0.45 -0.59 -0.07 0.37 0.00 0.00 175.52 175.54 1rg0 h LEU 39 N 0.65 0.28 0.00 2.58 3.38 -0.67 -2.40 115.31 119.13 1rg0 h LEU 39 Ca 0.09 -0.16 -0.18 0.00 0.09 0.00 0.00 57.88 57.72 1rg0 h LEU 39 Cb 0.74 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.42 1rg0 h LEU 39 CO 0.06 0.81 -0.70 0.00 0.09 0.00 0.00 178.44 178.69 1rg0 h ALA 40 N 1.20 0.08 -0.95 1.53 0.00 -0.67 -3.20 119.26 117.24 1rg0 h ALA 40 Ca -0.00 -0.60 0.20 0.00 0.00 0.00 0.00 54.91 54.50 1rg0 h ALA 40 Cb 1.09 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.84 1rg0 h ALA 40 CO 0.09 0.42 0.61 0.77 0.00 0.00 0.00 179.25 181.14 1rg0 h SER 41 N -0.01 0.55 0.00 0.00 0.02 -0.03 0.53 113.55 114.62 1rg0 h SER 41 Ca -0.09 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1rg0 h SER 41 Cb 1.40 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.90 1rg0 h SER 41 CO 0.14 0.21 0.18 0.61 -1.14 0.00 0.00 176.83 176.83 1rg0 n GLY 42 N -1.45 -0.65 0.53 -3.77 0.00 -0.91 -1.63 105.19 97.31 1rg0 n GLY 42 Ca 0.21 0.13 0.05 0.00 0.00 0.00 0.00 46.02 46.41 1rg0 n GLY 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rg0 n LEU 43 N -2.01 2.88 0.50 0.99 4.77 0.18 -4.78 117.00 119.52 1rg0 n LEU 43 Ca -0.01 -2.22 -0.20 0.00 -0.03 0.00 0.00 56.01 53.55 1rg0 n LEU 43 Cb 0.20 -0.25 -0.09 0.00 -2.33 0.00 0.00 43.42 40.95 1rg0 n LEU 43 CO 0.06 0.68 0.52 0.11 -1.33 0.00 0.00 177.39 177.42 1rg0 h LYS 44 N 1.49 -1.23 -0.73 3.23 1.57 -1.43 -1.53 116.57 117.94 1rg0 h LYS 44 Ca 0.00 0.08 0.16 0.00 -1.87 0.00 0.00 60.65 59.02 1rg0 h LYS 44 Cb 0.82 0.28 -0.13 0.00 0.08 0.00 0.00 32.23 33.27 1rg0 h LYS 44 CO 0.04 -0.82 -0.08 1.79 -0.57 0.00 0.00 179.45 179.81 1rg0 h THR 45 N -1.31 0.32 -0.35 -0.16 1.35 -1.86 0.14 112.91 111.03 1rg0 h THR 45 Ca -0.13 -0.02 -0.05 0.00 -0.55 0.00 0.00 66.41 65.66 1rg0 h THR 45 Cb 0.98 0.26 -0.02 0.00 -1.73 0.00 0.00 68.15 67.64 1rg0 h THR 45 CO 0.21 0.01 -0.00 0.11 -0.25 0.00 0.00 175.52 175.60 1rg0 h LYS 46 N 0.05 0.54 0.08 4.72 1.57 -1.85 -1.84 116.57 119.84 1rg0 h LYS 46 Ca 0.38 -0.12 -0.31 0.00 -1.87 0.00 0.00 60.65 58.73 1rg0 h LYS 46 Cb 0.63 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1rg0 h LYS 46 CO -0.69 0.57 -1.70 0.28 -0.57 0.00 0.00 179.45 177.34 1rg0 h VAL 47 N 0.52 0.93 0.00 0.50 2.07 -0.09 -3.25 116.25 116.92 1rg0 h VAL 47 Ca 0.11 -2.66 -0.06 0.00 0.82 0.00 0.00 66.70 64.91 1rg0 h VAL 47 Cb 0.34 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 1rg0 h VAL 47 CO 0.01 0.74 -0.28 0.77 0.02 0.00 0.00 177.57 178.83 1rg0 h SER 48 N 0.05 0.00 0.53 0.57 4.64 -0.80 -2.77 113.55 115.77 1rg0 h SER 48 Ca -0.30 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.83 1rg0 h SER 48 Cb 2.01 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.09 1rg0 h SER 48 CO 0.12 0.28 -0.84 0.44 -0.87 0.00 0.00 176.83 175.95 1rg0 h ASP 49 N 0.00 0.28 0.81 4.97 3.45 -1.45 -2.61 116.42 121.87 1rg0 h ASP 49 Ca -0.00 -0.22 -0.24 0.00 0.43 0.00 0.00 57.03 57.00 1rg0 h ASP 49 Cb 1.04 -0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 39.70 1rg0 h ASP 49 CO 0.04 1.00 -1.15 0.40 -1.57 0.00 0.00 179.24 177.95 1rg0 h ILE 50 N 0.13 1.57 -0.42 0.35 2.04 -1.58 -2.85 117.51 116.74 1rg0 h ILE 50 Ca -0.04 -3.23 -0.06 0.00 1.00 0.00 0.00 64.86 62.53 1rg0 h ILE 50 Cb 1.45 2.86 -0.02 0.00 -0.74 0.00 0.00 36.82 40.38 1rg0 h ILE 50 CO 0.13 0.92 0.03 0.15 0.00 0.00 0.00 178.15 179.38 1rg0 h PHE 51 N 0.03 0.78 0.00 1.37 3.04 -1.50 0.14 116.94 120.81 1rg0 h PHE 51 Ca -0.08 -0.12 0.00 0.00 3.98 0.00 0.00 57.97 61.75 1rg0 h PHE 51 Cb 1.87 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 40.17 1rg0 h PHE 51 CO 0.03 0.77 -0.64 -1.13 -2.02 0.00 0.00 178.31 175.31 1rg0 n SER 52 N -4.45 0.59 -0.08 0.41 3.41 -0.99 -1.52 113.62 110.99 1rg0 n SER 52 Ca -0.00 -0.22 -0.17 0.00 -0.26 0.00 0.00 58.87 58.22 1rg0 n SER 52 Cb 0.27 0.37 -0.13 0.00 -0.26 0.00 0.00 64.21 64.46 1rg0 n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rg0 n GLN 53 N -1.69 0.68 -0.00 4.33 1.13 -1.07 -4.68 117.38 116.08 1rg0 n GLN 53 Ca 0.04 0.17 0.04 0.00 -1.94 0.00 0.00 57.00 55.31 1rg0 n GLN 53 Cb 0.37 -1.59 -0.05 0.00 0.11 0.00 0.00 30.24 29.09 1rg0 n GLN 53 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1rg0 n ASP 54 N -3.23 0.45 0.00 1.08 8.00 0.48 -5.02 116.55 118.31 1rg0 n ASP 54 Ca -0.38 -0.67 0.00 0.00 0.71 0.00 0.00 54.79 54.45 1rg0 n ASP 54 Cb 1.03 1.01 0.00 0.00 -0.02 0.00 0.00 41.12 43.15 1rg0 n ASP 54 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rg0 n GLY 55 N 1.21 0.77 3.43 0.44 0.00 -0.58 -5.02 105.19 105.45 1rg0 n GLY 55 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1rg0 n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rg0 s SER 56 N -2.91 2.18 -0.21 1.61 1.04 -1.25 -4.93 113.70 109.24 1rg0 s SER 56 Ca 0.00 -1.41 -0.09 0.00 0.48 0.00 0.00 55.95 54.93 1rg0 s SER 56 Cb 0.00 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.11 1rg0 s SER 56 CO 0.00 -0.67 0.10 0.00 0.98 0.00 0.00 173.24 173.65 1rg0 s PRO 58 N 0.67 4.68 -0.09 0.00 0.04 -1.26 -4.86 135.00 134.18 1rg0 s PRO 58 Ca 0.05 1.60 0.04 0.00 0.04 0.00 0.00 61.00 62.73 1rg0 s PRO 58 Cb -0.13 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.28 1rg0 s PRO 58 CO 0.01 0.32 -0.22 0.00 0.04 0.00 0.00 177.00 177.15 1rg0 s ALA 59 N -1.26 1.99 -0.37 8.56 0.00 -1.26 -2.33 121.76 127.09 1rg0 s ALA 59 Ca 0.45 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.58 1rg0 s ALA 59 Cb -0.27 -0.73 0.46 0.00 0.00 0.00 0.00 23.12 22.57 1rg0 s ALA 59 CO 0.34 0.28 1.38 0.27 0.00 0.00 0.00 175.76 178.03 1rg0 n ASN 60 N 3.46 5.47 0.13 0.00 6.94 -1.25 -4.64 115.26 125.36 1rg0 n ASN 60 Ca -0.19 -3.76 0.12 0.00 -0.02 0.00 0.00 54.58 50.73 1rg0 n ASN 60 Cb 0.53 -0.48 0.48 0.00 -2.36 0.00 0.00 39.78 37.94 1rg0 n ASN 60 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1rg0 n THR 61 N -0.76 0.77 -5.08 5.53 -2.24 -1.26 -1.73 114.28 109.50 1rg0 n THR 61 Ca 0.48 0.12 -0.28 0.00 -2.27 0.00 0.00 64.05 62.09 1rg0 n THR 61 Cb 0.90 -1.04 -0.16 0.00 -2.10 0.00 0.00 70.33 67.94 1rg0 n THR 61 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rg0 s ALA 62 N -3.27 1.86 0.57 6.98 0.00 -1.26 -4.78 121.76 121.85 1rg0 s ALA 62 Ca 0.06 -0.97 -0.18 0.00 0.00 0.00 0.00 51.96 50.86 1rg0 s ALA 62 Cb 0.10 -0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.66 1rg0 s ALA 62 CO 0.44 0.45 0.47 0.00 0.00 0.00 0.00 175.76 177.12 1rg0 n ALA 63 N 2.48 -1.33 -3.64 0.00 0.00 -1.26 -4.77 120.51 111.99 1rg0 n ALA 63 Ca -0.16 -0.04 -0.08 0.00 0.00 0.00 0.00 53.44 53.17 1rg0 n ALA 63 Cb 0.52 -1.79 -0.07 0.00 0.00 0.00 0.00 19.45 18.11 1rg0 n ALA 63 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1rg0 s THR 64 N -1.75 0.00 0.00 0.00 -1.32 -0.91 -4.96 115.64 106.70 1rg0 s THR 64 Ca 0.68 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.16 1rg0 s THR 64 Cb -0.44 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.55 1rg0 s THR 64 CO 0.55 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.96 1rg0 n ALA 65 N 3.89 -0.35 -0.88 11.08 0.00 -1.26 0.67 120.51 133.66 1rg0 n ALA 65 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1rg0 n ALA 65 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1rg0 n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rg0 n GLY 66 N -0.02 0.54 3.09 0.00 0.00 -1.26 -5.05 105.19 102.49 1rg0 n GLY 66 Ca 0.00 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 1rg0 n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rg0 s ILE 67 N -2.00 1.21 0.68 -0.61 1.01 0.21 -5.08 121.20 116.63 1rg0 s ILE 67 Ca 0.00 -0.59 -0.11 0.00 0.00 0.00 0.00 60.65 59.95 1rg0 s ILE 67 Cb 0.00 -1.05 0.01 0.00 0.01 0.00 0.00 42.46 41.42 1rg0 s ILE 67 CO 0.00 0.36 1.07 -0.70 0.00 0.00 0.00 174.94 175.67 1rg0 s GLU 68 N 0.13 2.95 0.22 2.79 2.56 -1.26 -2.14 118.70 123.96 1rg0 s GLU 68 Ca -0.04 0.45 -0.31 0.00 0.00 0.00 0.00 54.97 55.07 1rg0 s GLU 68 Cb -0.11 -2.05 -0.10 0.00 2.00 0.00 0.00 34.13 33.86 1rg0 s GLU 68 CO 0.02 -0.95 1.53 0.21 -0.56 0.00 0.00 175.26 175.51 1rg0 s LYS 69 N -5.30 4.21 0.24 4.30 2.20 -1.26 -4.71 119.74 119.42 1rg0 s LYS 69 Ca 0.57 2.39 -0.12 0.00 -0.36 0.00 0.00 55.97 58.45 1rg0 s LYS 69 Cb -0.11 -3.11 0.33 0.00 -1.51 0.00 0.00 37.83 33.43 1rg0 s LYS 69 CO 0.51 -0.55 1.58 0.38 -0.36 0.00 0.00 175.35 176.91 1rg0 h ASP 70 N 5.85 -0.93 0.58 1.43 -0.00 -1.50 1.49 116.42 123.36 1rg0 h ASP 70 Ca -0.45 0.26 0.00 0.00 -0.00 0.00 0.00 57.03 56.85 1rg0 h ASP 70 Cb 1.21 0.57 0.00 0.00 -0.00 0.00 0.00 39.33 41.11 1rg0 h ASP 70 CO 0.85 -0.29 0.00 0.71 -0.00 0.00 0.00 179.24 180.51 1rg0 h THR 71 N -0.02 0.00 0.00 1.15 1.35 -1.85 -1.02 112.91 112.53 1rg0 h THR 71 Ca 0.39 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 66.00 1rg0 h THR 71 Cb 0.62 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 1rg0 h THR 71 CO -0.88 0.00 -0.23 0.44 -0.25 0.00 0.00 175.52 174.59 1rg0 h ASP 72 N 0.00 0.00 -2.77 5.36 3.32 0.18 -3.43 116.42 119.08 1rg0 h ASP 72 Ca 0.00 -0.01 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 1rg0 h ASP 72 Cb 0.29 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.68 1rg0 h ASP 72 CO 0.00 0.00 0.38 -0.63 -1.72 0.00 0.00 179.24 177.27 1rg0 s ILE 73 N -3.24 4.51 0.34 0.35 1.01 -0.46 -4.94 121.20 118.77 1rg0 s ILE 73 Ca 0.06 -0.57 -0.18 0.00 0.00 0.00 0.00 60.65 59.96 1rg0 s ILE 73 Cb 0.07 -4.61 0.04 0.00 0.01 0.00 0.00 42.46 37.97 1rg0 s ILE 73 CO 0.69 -1.32 0.75 0.54 0.00 0.00 0.00 174.94 175.60 1rg0 s ASN 74 N 3.62 -0.09 0.00 3.58 2.20 -1.26 -2.72 114.94 120.27 1rg0 s ASN 74 Ca 0.18 -0.92 0.00 0.00 -0.94 0.00 0.00 52.86 51.18 1rg0 s ASN 74 Cb -0.19 0.79 0.00 0.00 -2.00 0.00 0.00 41.25 39.85 1rg0 s ASN 74 CO 0.09 -1.53 0.00 0.61 -2.94 0.00 0.00 177.10 173.33 1rg0 n GLY 75 N -0.50 3.35 0.27 0.45 0.00 -0.99 -4.97 105.19 102.80 1rg0 n GLY 75 Ca -0.06 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 1rg0 n GLY 75 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1rg0 h LYS 76 N 0.00 0.72 0.00 1.61 1.63 -2.01 -3.30 116.57 115.22 1rg0 h LYS 76 Ca 0.00 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1rg0 h LYS 76 Cb 0.00 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.47 1rg0 h LYS 76 CO 0.00 0.48 -0.94 0.66 -3.45 0.00 0.00 179.45 176.20 1rg0 n TYR 77 N -4.76 0.00 -3.61 1.91 4.01 -1.26 -4.96 117.16 108.49 1rg0 n TYR 77 Ca 0.10 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.48 1rg0 n TYR 77 Cb 0.19 -0.10 -0.07 0.00 -0.31 0.00 0.00 39.34 39.04 1rg0 n TYR 77 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1rg0 s VAL 78 N -2.18 5.34 0.00 -0.72 1.01 -1.24 -1.92 120.40 120.69 1rg0 s VAL 78 Ca -0.01 0.42 -0.16 0.00 0.00 0.00 0.00 61.98 62.24 1rg0 s VAL 78 Cb 0.05 -3.57 -0.34 0.00 0.00 0.00 0.00 36.38 32.52 1rg0 s VAL 78 CO 0.30 0.41 0.91 0.00 0.00 0.00 0.00 175.10 176.73 1rg0 h ALA 79 N 6.62 -0.09 -2.26 5.51 0.00 -1.09 -2.64 119.26 125.31 1rg0 h ALA 79 Ca -0.41 -0.91 0.03 0.00 0.00 0.00 0.00 54.91 53.62 1rg0 h ALA 79 Cb 1.16 0.24 -0.17 0.00 0.00 0.00 0.00 17.79 19.02 1rg0 h ALA 79 CO 0.75 0.73 0.37 -1.59 0.00 0.00 0.00 179.25 179.51 1rg0 s LYS 80 N -2.57 0.94 -0.22 0.00 -2.85 -1.17 -4.69 119.74 109.19 1rg0 s LYS 80 Ca -0.11 -0.13 -0.01 0.00 -1.00 0.00 0.00 55.97 54.72 1rg0 s LYS 80 Cb 0.04 0.44 0.06 0.00 -2.06 0.00 0.00 37.83 36.31 1rg0 s LYS 80 CO 0.91 -0.37 -0.02 0.08 0.10 0.00 0.00 175.35 176.05 1rg0 s VAL 81 N -2.47 1.12 -0.14 1.79 1.01 -0.74 -0.27 120.40 120.70 1rg0 s VAL 81 Ca -0.01 -0.93 -0.06 0.00 0.00 0.00 0.00 61.98 60.98 1rg0 s VAL 81 Cb -0.01 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1rg0 s VAL 81 CO -0.04 -0.13 0.07 -0.89 0.00 0.00 0.00 175.10 174.11 1rg0 s THR 82 N 1.59 4.86 0.22 3.92 2.01 0.04 -4.16 115.64 124.11 1rg0 s THR 82 Ca -0.04 -0.02 0.04 0.00 0.31 0.00 0.00 61.69 61.98 1rg0 s THR 82 Cb -0.18 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 1rg0 s THR 82 CO -0.07 0.54 0.34 0.42 -0.69 0.00 0.00 174.62 175.16 1rg0 s THR 83 N -0.30 5.28 0.00 -0.82 -4.23 -1.26 0.07 115.64 114.38 1rg0 s THR 83 Ca 0.09 -0.89 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 1rg0 s THR 83 Cb -0.12 -3.83 0.00 0.00 1.34 0.00 0.00 72.50 69.89 1rg0 s THR 83 CO 0.02 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1rg0 n GLY 84 N -1.17 -0.58 0.08 3.99 0.00 -0.02 -3.82 105.19 103.67 1rg0 n GLY 84 Ca -0.08 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1rg0 n GLY 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rg0 n GLY 85 N 0.00 -3.40 3.12 -0.02 0.00 -1.26 0.42 105.19 104.05 1rg0 n GLY 85 Ca 0.00 -1.86 -0.33 0.00 0.00 0.00 0.00 46.02 43.84 1rg0 n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rg0 s THR 86 N -0.97 2.21 0.22 2.61 2.01 -1.26 -4.79 115.64 115.66 1rg0 s THR 86 Ca 0.00 -1.10 -0.30 0.00 0.31 0.00 0.00 61.69 60.60 1rg0 s THR 86 Cb 0.00 -2.04 -0.10 0.00 0.01 0.00 0.00 72.50 70.37 1rg0 s THR 86 CO 0.00 0.37 1.48 0.00 -0.69 0.00 0.00 174.62 175.78 1rg0 s ALA 87 N 1.25 3.67 0.16 7.40 0.00 -1.26 -4.51 121.76 128.47 1rg0 s ALA 87 Ca 0.01 1.34 -0.01 0.00 0.00 0.00 0.00 51.96 53.31 1rg0 s ALA 87 Cb -0.15 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 1rg0 s ALA 87 CO -0.10 -0.76 0.07 0.00 0.00 0.00 0.00 175.76 174.97 1rg0 s ALA 88 N 0.33 1.02 0.20 0.00 0.00 0.50 -5.01 121.76 118.79 1rg0 s ALA 88 Ca 0.62 -1.56 -0.20 0.00 0.00 0.00 0.00 51.96 50.82 1rg0 s ALA 88 Cb -0.42 0.98 0.15 0.00 0.00 0.00 0.00 23.12 23.82 1rg0 s ALA 88 CO 0.40 -0.50 1.57 0.00 0.00 0.00 0.00 175.76 177.23 1rg0 h ALA 89 N 2.77 -0.01 -0.00 0.00 0.00 -2.01 -0.74 119.26 119.26 1rg0 h ALA 89 Ca -0.36 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1rg0 h ALA 89 Cb 1.21 0.91 0.00 0.00 0.00 0.00 0.00 17.79 19.91 1rg0 h ALA 89 CO 0.58 -0.68 -0.35 -1.13 0.00 0.00 0.00 179.25 177.67 1rg0 n SER 90 N -5.44 0.50 0.00 0.00 3.41 -1.26 -4.21 113.62 106.62 1rg0 n SER 90 Ca 0.06 -0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 1rg0 n SER 90 Cb 0.37 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1rg0 n SER 90 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rg0 n GLY 91 N 1.45 0.57 0.00 5.00 0.00 -0.29 -0.51 105.19 111.41 1rg0 n GLY 91 Ca 0.08 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1rg0 n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rg0 n GLY 92 N 0.00 2.58 3.76 -0.02 0.00 -0.30 -0.37 105.19 110.83 1rg0 n GLY 92 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1rg0 n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rg0 s THR 94 N -1.13 2.42 -0.35 0.00 -4.23 0.17 -2.14 115.64 110.37 1rg0 s THR 94 Ca 0.55 -1.47 0.02 0.00 -1.18 0.00 0.00 61.69 59.60 1rg0 s THR 94 Cb -0.48 -2.02 0.10 0.00 1.34 0.00 0.00 72.50 71.44 1rg0 s THR 94 CO 0.63 0.24 0.10 -0.63 -0.54 0.00 0.00 174.62 174.42 1rg0 s ILE 95 N -0.95 1.69 -0.34 2.99 1.01 0.01 -0.84 121.20 124.76 1rg0 s ILE 95 Ca 0.14 -2.07 -0.09 0.00 0.00 0.00 0.00 60.65 58.64 1rg0 s ILE 95 Cb -0.10 -2.24 0.02 0.00 0.01 0.00 0.00 42.46 40.14 1rg0 s ILE 95 CO 0.05 -0.67 0.15 -0.69 0.00 0.00 0.00 174.94 173.78 1rg0 s VAL 96 N 1.05 4.28 -0.11 2.92 1.01 0.11 -1.88 120.40 127.77 1rg0 s VAL 96 Ca 0.11 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 61.10 1rg0 s VAL 96 Cb -0.19 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1rg0 s VAL 96 CO -0.13 -0.11 0.49 0.00 0.00 0.00 0.00 175.10 175.35 1rg0 s ALA 97 N 1.52 3.47 -0.20 5.51 0.00 -0.70 -0.78 121.76 130.58 1rg0 s ALA 97 Ca 0.02 -0.16 -0.07 0.00 0.00 0.00 0.00 51.96 51.75 1rg0 s ALA 97 Cb -0.18 -2.67 -0.03 0.00 0.00 0.00 0.00 23.12 20.23 1rg0 s ALA 97 CO 0.05 0.01 0.05 0.99 0.00 0.00 0.00 175.76 176.85 1rg0 s THR 98 N 0.59 4.47 0.50 0.00 2.01 0.62 -2.09 115.64 121.75 1rg0 s THR 98 Ca 0.27 -0.14 -0.20 0.00 0.31 0.00 0.00 61.69 61.93 1rg0 s THR 98 Cb -0.15 -3.03 -0.08 0.00 0.01 0.00 0.00 72.50 69.25 1rg0 s THR 98 CO 0.11 0.43 1.06 -0.04 -0.69 0.00 0.00 174.62 175.49 1rg0 s MET 99 N 0.77 3.68 0.79 4.92 -1.94 0.45 -0.59 119.30 127.37 1rg0 s MET 99 Ca 0.03 1.42 -0.14 0.00 -1.71 0.00 0.00 55.69 55.29 1rg0 s MET 99 Cb -0.14 -2.07 0.07 0.00 2.01 0.00 0.00 34.83 34.71 1rg0 s MET 99 CO 0.02 -0.55 1.22 1.63 -0.01 0.00 0.00 175.02 177.34 1rg0 n LYS 100 N -1.07 0.30 -0.01 2.03 5.02 -0.81 -3.10 118.16 120.53 1rg0 n LYS 100 Ca 0.10 0.18 0.13 0.00 -2.02 0.00 0.00 58.31 56.70 1rg0 n LYS 100 Cb 0.52 -2.46 0.73 0.00 -0.02 0.00 0.00 35.03 33.81 1rg0 n LYS 100 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rg0 n ALA 101 N -3.13 2.64 -3.50 7.82 0.00 -1.26 -2.52 120.51 120.55 1rg0 n ALA 101 Ca 0.14 -0.24 -0.11 0.00 0.00 0.00 0.00 53.44 53.23 1rg0 n ALA 101 Cb 0.50 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 1rg0 n ALA 101 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1rg0 s SER 102 N -1.85 -0.44 -1.22 0.00 1.04 -1.26 -4.89 113.70 105.07 1rg0 s SER 102 Ca 0.40 0.16 -0.04 0.00 0.48 0.00 0.00 55.95 56.95 1rg0 s SER 102 Cb 0.19 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.75 1rg0 s SER 102 CO 0.31 -0.64 1.04 0.47 0.98 0.00 0.00 173.24 175.40 1rg0 n ASP 103 N 0.05 -3.86 -3.66 7.02 9.92 -1.26 -5.00 116.55 119.75 1rg0 n ASP 103 Ca -0.12 -0.56 -0.14 0.00 -0.53 0.00 0.00 54.79 53.44 1rg0 n ASP 103 Cb 0.61 -4.91 -0.08 0.00 -0.64 0.00 0.00 41.12 36.10 1rg0 n ASP 103 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1rg0 s VAL 104 N -3.33 0.00 -0.26 2.53 1.01 -1.26 -4.89 120.40 114.20 1rg0 s VAL 104 Ca 0.25 -0.03 -0.43 0.00 0.00 0.00 0.00 61.98 61.77 1rg0 s VAL 104 Cb -0.11 -0.82 -0.19 0.00 0.00 0.00 0.00 36.38 35.26 1rg0 s VAL 104 CO 0.70 -0.02 1.43 0.00 0.00 0.00 0.00 175.10 177.21 1rg0 n ALA 105 N 2.49 -1.93 -0.27 5.51 0.00 -1.26 -4.71 120.51 120.34 1rg0 n ALA 105 Ca -0.15 0.52 0.07 0.00 0.00 0.00 0.00 53.44 53.88 1rg0 n ALA 105 Cb 0.56 -1.92 0.20 0.00 0.00 0.00 0.00 19.45 18.29 1rg0 n ALA 105 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1rg0 h THR 106 N 4.25 0.37 0.00 0.00 1.35 -2.00 0.27 112.91 117.15 1rg0 h THR 106 Ca -0.47 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 1rg0 h THR 106 Cb 1.38 0.19 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 1rg0 h THR 106 CO 0.85 0.03 0.00 -0.65 -0.25 0.00 0.00 175.52 175.50 1rg0 h PRO 107 N 0.17 0.00 -0.01 4.72 0.11 -2.04 -2.85 132.00 132.09 1rg0 h PRO 107 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 1rg0 h PRO 107 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1rg0 h PRO 107 CO -0.63 0.00 -0.31 1.28 -0.21 0.00 0.00 178.00 178.13 1rg0 n LEU 108 N -2.78 1.63 -4.67 2.35 4.77 0.93 -4.83 117.00 114.41 1rg0 n LEU 108 Ca -0.00 -0.54 -0.42 0.00 -0.03 0.00 0.00 56.01 55.01 1rg0 n LEU 108 Cb 0.19 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1rg0 n LEU 108 CO 0.21 0.30 1.51 -0.13 -1.33 0.00 0.00 177.39 177.94 1rg0 s ARG 109 N -2.42 4.15 0.00 3.23 0.52 -1.08 -1.81 118.95 121.54 1rg0 s ARG 109 Ca 0.23 2.49 0.00 0.00 -0.52 0.00 0.00 55.73 57.93 1rg0 s ARG 109 Cb 0.19 -3.98 0.00 0.00 0.52 0.00 0.00 34.95 31.68 1rg0 s ARG 109 CO 0.51 -0.89 0.00 0.41 0.02 0.00 0.00 175.30 175.35 1rg0 n GLY 110 N 4.35 1.12 3.79 -3.53 0.00 -1.05 -4.91 105.19 104.97 1rg0 n GLY 110 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1rg0 n GLY 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rg0 s LYS 111 N -0.01 1.66 0.16 1.61 -0.14 -0.75 -4.63 119.74 117.64 1rg0 s LYS 111 Ca 0.00 0.49 0.07 0.00 -1.36 0.00 0.00 55.97 55.17 1rg0 s LYS 111 Cb 0.00 -1.88 -0.04 0.00 -1.68 0.00 0.00 37.83 34.23 1rg0 s LYS 111 CO 0.00 -1.88 -0.15 0.95 -0.76 0.00 0.00 175.35 173.51 1rg0 s THR 112 N -3.21 1.58 -0.03 2.17 -4.23 -1.26 -0.41 115.64 110.25 1rg0 s THR 112 Ca 0.62 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.18 1rg0 s THR 112 Cb -0.15 -1.81 0.01 0.00 1.34 0.00 0.00 72.50 71.90 1rg0 s THR 112 CO 0.54 -0.48 -0.05 -0.22 -0.54 0.00 0.00 174.62 173.87 1rg0 s LEU 113 N -2.85 1.58 -0.13 4.79 0.20 -0.89 -1.33 118.68 120.05 1rg0 s LEU 113 Ca 0.16 -0.11 0.01 0.00 0.69 0.00 0.00 54.13 54.87 1rg0 s LEU 113 Cb -0.03 -0.38 0.02 0.00 -0.43 0.00 0.00 46.19 45.37 1rg0 s LEU 113 CO 0.05 -0.01 -0.14 -0.89 -0.29 0.00 0.00 176.35 175.07 1rg0 s THR 114 N 0.50 1.51 -0.18 3.68 2.01 0.14 -1.72 115.64 121.58 1rg0 s THR 114 Ca -0.06 -0.62 -0.07 0.00 0.31 0.00 0.00 61.69 61.25 1rg0 s THR 114 Cb -0.10 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 70.97 1rg0 s THR 114 CO -0.00 0.45 0.06 -0.76 -0.69 0.00 0.00 174.62 173.68 1rg0 s LEU 115 N 1.27 3.82 -0.15 4.42 1.43 -0.79 -0.83 118.68 127.85 1rg0 s LEU 115 Ca -0.00 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.20 1rg0 s LEU 115 Cb -0.14 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.14 1rg0 s LEU 115 CO -0.06 0.19 -0.17 -0.89 0.23 0.00 0.00 176.35 175.64 1rg0 s THR 116 N 0.30 1.75 0.35 5.49 2.01 -0.72 -0.81 115.64 124.01 1rg0 s THR 116 Ca 0.03 -0.76 -0.28 0.00 0.31 0.00 0.00 61.69 60.99 1rg0 s THR 116 Cb -0.12 -1.61 -0.10 0.00 0.01 0.00 0.00 72.50 70.68 1rg0 s THR 116 CO 0.00 0.49 1.30 -0.22 -0.69 0.00 0.00 174.62 175.50 1rg0 s LEU 117 N 1.30 4.38 0.26 4.42 2.96 -0.91 -1.88 118.68 129.21 1rg0 s LEU 117 Ca 0.02 2.67 -0.16 0.00 -0.22 0.00 0.00 54.13 56.44 1rg0 s LEU 117 Cb -0.13 -3.71 0.01 0.00 0.50 0.00 0.00 46.19 42.85 1rg0 s LEU 117 CO -0.09 -0.59 0.58 -0.83 -1.32 0.00 0.00 176.35 174.09 1rg0 s GLY 118 N -0.56 0.27 -1.07 7.98 0.00 0.17 -1.15 107.32 112.97 1rg0 s GLY 118 Ca 0.51 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.59 1rg0 s GLY 118 CO 0.52 -0.40 0.00 -2.01 0.00 0.00 0.00 173.10 171.20 1rg0 n ASN 119 N -0.41 -4.91 0.31 1.64 5.15 -1.14 -1.18 115.26 114.72 1rg0 n ASN 119 Ca -0.03 0.25 0.20 0.00 -0.60 0.00 0.00 54.58 54.40 1rg0 n ASN 119 Cb 0.61 -3.30 1.00 0.00 -0.53 0.00 0.00 39.78 37.56 1rg0 n ASN 119 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1rg0 h ALA 120 N 0.00 1.06 -0.67 5.20 0.00 -1.08 -0.14 119.26 123.63 1rg0 h ALA 120 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1rg0 h ALA 120 Cb 0.89 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1rg0 h ALA 120 CO 0.30 0.02 0.00 -0.40 0.00 0.00 0.00 179.25 179.17 1rg0 n ASP 121 N -3.20 3.99 0.00 0.00 3.85 -1.26 -4.61 116.55 115.32 1rg0 n ASP 121 Ca -0.02 -2.09 0.00 0.00 -0.71 0.00 0.00 54.79 51.97 1rg0 n ASP 121 Cb 0.16 -0.48 0.00 0.00 -1.35 0.00 0.00 41.12 39.45 1rg0 n ASP 121 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1rg0 n LYS 122 N 1.39 2.33 0.00 0.11 4.01 -0.08 -5.08 118.16 120.85 1rg0 n LYS 122 Ca 0.23 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.03 1rg0 n LYS 122 Cb 0.65 -0.81 0.00 0.00 -0.51 0.00 0.00 35.03 34.36 1rg0 n LYS 122 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1rg0 n GLY 123 N 1.68 -0.03 3.64 0.72 0.00 -1.14 -5.11 105.19 104.94 1rg0 n GLY 123 Ca 0.00 -0.66 -0.44 0.00 0.00 0.00 0.00 46.02 44.92 1rg0 n GLY 123 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rg0 n SER 124 N 0.00 1.97 -4.75 1.61 7.64 -1.26 -4.70 113.62 114.13 1rg0 n SER 124 Ca 0.00 1.18 -0.41 0.00 1.01 0.00 0.00 58.87 60.65 1rg0 n SER 124 Cb 0.00 -1.37 -0.02 0.00 -1.01 0.00 0.00 64.21 61.81 1rg0 n SER 124 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1rg0 s TYR 125 N -0.89 3.03 0.15 1.43 4.12 -1.26 -4.76 117.35 119.17 1rg0 s TYR 125 Ca 0.60 1.18 0.08 0.00 0.02 0.00 0.00 57.07 58.94 1rg0 s TYR 125 Cb -0.66 -3.76 -0.04 0.00 -1.52 0.00 0.00 41.96 35.97 1rg0 s TYR 125 CO 0.59 -2.35 -0.07 0.95 0.02 0.00 0.00 175.55 174.69 1rg0 s THR 126 N -0.42 3.40 -0.36 -0.71 -4.23 -0.33 -4.97 115.64 108.03 1rg0 s THR 126 Ca 0.55 -1.45 -0.00 0.00 -1.18 0.00 0.00 61.69 59.61 1rg0 s THR 126 Cb -0.41 -2.65 0.13 0.00 1.34 0.00 0.00 72.50 70.90 1rg0 s THR 126 CO 0.47 -0.02 0.18 0.26 -0.54 0.00 0.00 174.62 174.97 1rg0 s TRP 127 N -1.52 1.13 0.20 3.99 0.52 -1.26 0.46 118.94 122.46 1rg0 s TRP 127 Ca 0.24 -1.71 -0.30 0.00 0.02 0.00 0.00 56.10 54.35 1rg0 s TRP 127 Cb -0.10 -1.29 -0.08 0.00 -1.15 0.00 0.00 33.47 30.85 1rg0 s TRP 127 CO 0.15 -0.83 1.16 0.00 0.02 0.00 0.00 176.95 177.46 1rg0 s ALA 128 N 1.16 3.42 -0.15 0.98 0.00 -0.79 -4.73 121.76 121.66 1rg0 s ALA 128 Ca 0.15 0.92 -0.08 0.00 0.00 0.00 0.00 51.96 52.96 1rg0 s ALA 128 Cb -0.21 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.48 1rg0 s ALA 128 CO -0.10 -0.31 0.12 0.00 0.00 0.00 0.00 175.76 175.47 1rg0 s THR 130 N -0.45 0.20 0.07 0.00 -4.23 -0.01 -4.43 115.64 106.80 1rg0 s THR 130 Ca 0.12 -1.66 -0.15 0.00 -1.18 0.00 0.00 61.69 58.82 1rg0 s THR 130 Cb -0.12 -1.38 0.02 0.00 1.34 0.00 0.00 72.50 72.37 1rg0 s THR 130 CO 0.02 -0.91 0.34 -0.55 -0.54 0.00 0.00 174.62 172.97 1rg0 s SER 131 N -2.77 -0.16 -0.22 3.99 0.15 -1.26 0.26 113.70 113.70 1rg0 s SER 131 Ca 0.05 -0.25 0.15 0.00 0.70 0.00 0.00 55.95 56.60 1rg0 s SER 131 Cb 0.06 0.40 0.72 0.00 -1.71 0.00 0.00 66.02 65.49 1rg0 s SER 131 CO -0.09 -0.71 1.63 -0.46 1.20 0.00 0.00 173.24 174.81 1rg0 n ASN 132 N 0.25 5.08 -4.97 5.45 6.94 -0.44 -4.94 115.26 122.62 1rg0 n ASN 132 Ca -0.17 -2.97 -0.19 0.00 -0.02 0.00 0.00 54.58 51.23 1rg0 n ASN 132 Cb 0.61 -0.64 -0.01 0.00 -2.36 0.00 0.00 39.78 37.39 1rg0 n ASN 132 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rg0 s ALA 133 N -2.80 4.26 0.18 -2.53 0.00 -1.26 -4.85 121.76 114.76 1rg0 s ALA 133 Ca 0.50 -1.58 -0.32 0.00 0.00 0.00 0.00 51.96 50.56 1rg0 s ALA 133 Cb 0.39 -1.55 -0.12 0.00 0.00 0.00 0.00 23.12 21.85 1rg0 s ALA 133 CO 0.13 -0.12 1.74 -3.47 0.00 0.00 0.00 175.76 174.05 1rg0 n ASP 134 N -1.66 3.92 0.24 0.00 -0.08 -1.26 -4.89 116.55 112.82 1rg0 n ASP 134 Ca 0.02 1.04 0.18 0.00 -1.51 0.00 0.00 54.79 54.53 1rg0 n ASP 134 Cb 0.59 -1.55 0.86 0.00 2.34 0.00 0.00 41.12 43.35 1rg0 n ASP 134 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 1rg0 h ASN 135 N 7.16 0.00 0.46 1.67 2.35 -1.95 -0.59 115.58 124.68 1rg0 h ASN 135 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1rg0 h ASN 135 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 1rg0 h ASN 135 CO 0.95 0.00 0.00 0.07 -1.65 0.00 0.00 177.43 176.80 1rg0 h LYS 136 N 0.00 0.00 -0.01 0.81 2.10 -1.99 -1.72 116.57 115.76 1rg0 h LYS 136 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.72 1rg0 h LYS 136 Cb 0.61 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.94 1rg0 h LYS 136 CO -0.00 0.00 -0.66 0.66 -2.00 0.00 0.00 179.45 177.45 1rg0 n TYR 137 N -2.55 0.00 -3.08 0.07 4.02 -0.23 -4.90 117.16 110.48 1rg0 n TYR 137 Ca -0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.66 1rg0 n TYR 137 Cb 0.16 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.49 1rg0 n TYR 137 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1rg0 s LEU 138 N -2.60 3.74 0.76 7.72 1.43 -0.65 -4.58 118.68 124.51 1rg0 s LEU 138 Ca 0.12 0.32 -0.12 0.00 -1.03 0.00 0.00 54.13 53.42 1rg0 s LEU 138 Cb 0.15 -3.20 0.06 0.00 0.03 0.00 0.00 46.19 43.23 1rg0 s LEU 138 CO 0.64 -0.60 1.13 -2.84 0.23 0.00 0.00 176.35 174.91 1rg0 s PRO 139 N -4.49 2.14 0.24 1.29 0.02 -1.26 -4.91 135.00 128.03 1rg0 s PRO 139 Ca 0.46 1.41 -0.05 0.00 0.02 0.00 0.00 61.00 62.84 1rg0 s PRO 139 Cb -0.10 -1.87 0.45 0.00 0.02 0.00 0.00 34.50 33.00 1rg0 s PRO 139 CO 0.37 -1.76 1.72 0.87 -0.33 0.00 0.00 177.00 177.87 1rg0 h LYS 140 N -0.81 0.39 0.00 5.54 1.57 -1.98 -0.05 116.57 121.24 1rg0 h LYS 140 Ca -0.45 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1rg0 h LYS 140 Cb 1.25 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.47 1rg0 h LYS 140 CO 0.50 0.26 -0.02 1.79 -0.57 0.00 0.00 179.45 181.41 1rg0 h THR 141 N 0.41 0.20 -0.45 -0.16 1.35 -1.96 -2.44 112.91 109.87 1rg0 h THR 141 Ca 0.41 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 1rg0 h THR 141 Cb 0.63 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 1rg0 h THR 141 CO -0.42 0.02 0.00 0.00 -0.25 0.00 0.00 175.52 174.87 1rg0 s GLN 143 N -1.18 3.71 0.67 0.00 -0.21 -0.92 -4.21 119.66 117.52 1rg0 s GLN 143 Ca 0.36 0.12 -0.08 0.00 0.02 0.00 0.00 55.36 55.78 1rg0 s GLN 143 Cb 0.20 -2.67 0.03 0.00 1.00 0.00 0.00 33.01 31.57 1rg0 s GLN 143 CO 0.27 0.29 1.00 0.95 -2.12 0.00 0.00 175.29 175.68 1rg0 s THR 144 N -1.91 3.11 -0.13 -0.19 -4.23 -1.26 -5.06 115.64 105.96 1rg0 s THR 144 Ca 0.45 0.04 -0.01 0.00 -1.18 0.00 0.00 61.69 60.99 1rg0 s THR 144 Cb -0.11 -3.30 -0.02 0.00 1.34 0.00 0.00 72.50 70.41 1rg0 s THR 144 CO 0.25 -0.34 -0.10 0.00 -0.54 0.00 0.00 174.62 173.89 1rg0 s ALA 145 N -3.19 2.74 -0.10 3.99 0.00 -1.26 -5.09 121.76 118.85 1rg0 s ALA 145 Ca 0.57 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.67 1rg0 s ALA 145 Cb -0.11 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.73 1rg0 s ALA 145 CO 0.47 0.26 -0.10 0.99 0.00 0.00 0.00 175.76 177.38 1rg0 s THR 146 N 0.29 1.13 0.11 0.00 2.01 -1.26 -5.13 115.64 112.78 1rg0 s THR 146 Ca -0.08 -0.39 0.01 0.00 0.31 0.00 0.00 61.69 61.54 1rg0 s THR 146 Cb -0.15 -1.09 -0.04 0.00 0.01 0.00 0.00 72.50 71.22 1rg0 s THR 146 CO 0.05 0.37 -0.05 0.42 -0.69 0.00 0.00 174.62 174.72 1rg0 s THR 147 N 1.32 0.61 0.71 -0.82 -4.23 -1.26 -5.16 115.64 106.81 1rg0 s THR 147 Ca -0.02 -1.93 -0.11 0.00 -1.18 0.00 0.00 61.69 58.45 1rg0 s THR 147 Cb -0.14 -1.75 0.01 0.00 1.34 0.00 0.00 72.50 71.97 1rg0 s THR 147 CO -0.04 -0.81 1.08 0.42 -0.54 0.00 0.00 174.62 174.73 1rg0 s THR 148 N -3.68 3.72 0.09 3.99 -4.23 -1.26 -5.11 115.64 109.16 1rg0 s THR 148 Ca 0.14 0.56 -0.00 0.00 -1.18 0.00 0.00 61.69 61.20 1rg0 s THR 148 Cb 0.06 -3.47 -0.04 0.00 1.34 0.00 0.00 72.50 70.39 1rg0 s THR 148 CO -0.04 -0.73 -0.02 0.42 -0.54 0.00 0.00 174.62 173.72 1rg0 s THR 149 N -3.24 0.33 -2.00 3.99 -4.23 -1.26 -5.34 115.64 103.88 1rg0 s THR 149 Ca 0.58 -1.87 0.31 0.00 -1.18 0.00 0.00 61.69 59.53 1rg0 s THR 149 Cb -0.12 -1.72 0.87 0.00 1.34 0.00 0.00 72.50 72.87 1rg0 s THR 149 CO 0.53 -0.81 2.16 -0.81 -0.54 0.00 0.00 174.62 175.15