#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ggq s PRO 40 N 0.00 4.31 -1.15 1.61 0.04 -1.26 -4.93 135.00 133.63 1ggq s PRO 40 Ca 0.00 2.20 -0.21 0.00 0.04 0.00 0.00 61.00 63.04 1ggq s PRO 40 Cb 0.00 -3.15 0.06 0.00 0.04 0.00 0.00 34.50 31.45 1ggq s PRO 40 CO 0.00 -0.37 1.58 1.21 0.04 0.00 0.00 177.00 179.46 1ggq s ASN 41 N 0.43 6.65 0.19 6.66 3.04 -1.26 -4.83 114.94 125.82 1ggq s ASN 41 Ca 0.59 -1.90 0.10 0.00 0.04 0.00 0.00 52.86 51.69 1ggq s ASN 41 Cb -0.40 -2.57 0.57 0.00 -1.54 0.00 0.00 41.25 37.31 1ggq s ASN 41 CO 0.40 -1.35 1.26 0.18 -3.04 0.00 0.00 177.10 174.55 1ggq n LEU 42 N 8.65 0.27 -0.07 3.21 4.32 -1.26 -1.78 117.00 130.34 1ggq n LEU 42 Ca 0.40 0.57 -0.14 0.00 -0.02 0.00 0.00 56.01 56.82 1ggq n LEU 42 Cb 0.49 -0.58 -0.13 0.00 -1.62 0.00 0.00 43.42 41.58 1ggq n LEU 42 CO 0.71 -0.66 0.39 0.74 -1.22 0.00 0.00 177.39 177.34 1ggq h THR 43 N 0.00 1.76 0.02 -5.08 2.02 -2.00 -3.13 112.91 106.51 1ggq h THR 43 Ca 0.00 -2.31 -0.26 0.00 0.77 0.00 0.00 66.41 64.61 1ggq h THR 43 Cb 0.21 3.33 0.02 0.00 -1.74 0.00 0.00 68.15 69.97 1ggq h THR 43 CO 0.00 0.60 -1.03 -0.33 0.37 0.00 0.00 175.52 175.13 1ggq h GLU 44 N -0.99 0.65 -0.33 6.66 5.08 -1.90 -3.19 114.58 120.56 1ggq h GLU 44 Ca -0.00 -0.74 0.02 0.00 -1.00 0.00 0.00 59.36 57.64 1ggq h GLU 44 Cb 0.98 0.22 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 1ggq h GLU 44 CO 0.00 1.31 0.22 0.82 -1.00 0.00 0.00 179.01 180.36 1ggq h ILE 45 N 0.31 1.04 -0.32 3.13 2.04 -1.52 0.91 117.51 123.10 1ggq h ILE 45 Ca -0.14 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.54 1ggq h ILE 45 Cb 1.70 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1ggq h ILE 45 CO 0.20 0.07 -0.03 -1.28 0.00 0.00 0.00 178.15 177.11 1ggq h SER 46 N 0.37 0.58 1.19 1.72 0.87 -1.56 -0.45 113.55 116.28 1ggq h SER 46 Ca 0.13 -0.33 -0.02 0.00 -1.23 0.00 0.00 61.79 60.34 1ggq h SER 46 Cb 0.06 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1ggq h SER 46 CO -0.03 0.77 -0.10 0.50 -0.53 0.00 0.00 176.83 177.45 1ggq h LYS 47 N 0.38 0.00 -0.04 2.24 3.64 -1.37 -1.19 116.57 120.22 1ggq h LYS 47 Ca 0.09 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.26 1ggq h LYS 47 Cb 0.49 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1ggq h LYS 47 CO 0.02 0.10 -0.84 -0.22 -2.27 0.00 0.00 179.45 176.24 1ggq h LYS 48 N 0.00 0.43 -0.03 1.90 3.64 -0.33 -1.83 116.57 120.34 1ggq h LYS 48 Ca -0.00 -0.40 -0.10 0.00 -1.27 0.00 0.00 60.65 58.88 1ggq h LYS 48 Cb 0.72 0.10 0.01 0.00 -0.41 0.00 0.00 32.23 32.65 1ggq h LYS 48 CO 0.01 1.05 -0.38 0.82 -2.27 0.00 0.00 179.45 178.69 1ggq h ILE 49 N 0.27 1.46 -0.99 2.00 2.04 -0.77 -2.48 117.51 119.04 1ggq h ILE 49 Ca -0.06 -1.87 0.03 0.00 1.00 0.00 0.00 64.86 63.96 1ggq h ILE 49 Cb 1.45 2.51 -0.05 0.00 -0.74 0.00 0.00 36.82 39.98 1ggq h ILE 49 CO 0.15 0.53 0.65 0.74 0.00 0.00 0.00 178.15 180.22 1ggq h THR 50 N -0.23 1.20 0.08 -0.27 2.02 -1.26 -1.30 112.91 113.15 1ggq h THR 50 Ca -0.04 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 1ggq h THR 50 Cb 1.07 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1ggq h THR 50 CO 0.08 0.23 -0.04 0.44 0.37 0.00 0.00 175.52 176.60 1ggq h ASP 51 N 1.29 -0.09 0.02 4.18 3.45 -1.38 -2.77 116.42 121.12 1ggq h ASP 51 Ca 0.38 -0.50 -0.02 0.00 0.43 0.00 0.00 57.03 57.32 1ggq h ASP 51 Cb -0.06 0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 38.72 1ggq h ASP 51 CO -0.11 0.50 -0.05 0.77 -1.57 0.00 0.00 179.24 178.79 1ggq h SER 52 N -0.73 0.07 -0.05 6.45 4.64 -1.42 -1.81 113.55 120.70 1ggq h SER 52 Ca -0.01 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.16 1ggq h SER 52 Cb 0.58 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1ggq h SER 52 CO 0.02 0.13 -0.45 -1.13 -0.87 0.00 0.00 176.83 174.53 1ggq h ASN 53 N 0.07 0.64 -0.70 4.97 -1.24 -1.27 -1.80 115.58 116.26 1ggq h ASN 53 Ca 0.02 -0.30 -0.07 0.00 0.71 0.00 0.00 56.30 56.65 1ggq h ASN 53 Cb 0.14 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 38.98 1ggq h ASN 53 CO 0.01 1.00 0.17 0.00 -1.29 0.00 0.00 177.43 177.31 1ggq h ALA 54 N 1.02 0.92 -0.43 1.57 0.00 -1.04 -1.67 119.26 119.63 1ggq h ALA 54 Ca 0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1ggq h ALA 54 Cb 0.97 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1ggq h ALA 54 CO 0.09 0.65 0.14 0.28 0.00 0.00 0.00 179.25 180.41 1ggq h VAL 55 N 1.05 1.22 -0.43 0.00 2.07 -1.27 -2.32 116.25 116.57 1ggq h VAL 55 Ca 0.22 -0.70 0.03 0.00 0.82 0.00 0.00 66.70 67.07 1ggq h VAL 55 Cb 0.38 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 1ggq h VAL 55 CO 0.00 0.25 0.21 0.25 0.02 0.00 0.00 177.57 178.31 1ggq h LEU 56 N 0.56 0.31 -0.64 2.57 5.85 -1.00 -1.11 115.31 121.84 1ggq h LEU 56 Ca 0.14 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1ggq h LEU 56 Cb 0.25 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 1ggq h LEU 56 CO -0.01 0.22 0.39 -0.07 -0.34 0.00 0.00 178.44 178.63 1ggq h LEU 57 N 0.43 0.64 -0.76 2.25 4.07 -1.15 0.47 115.31 121.24 1ggq h LEU 57 Ca 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.14 1ggq h LEU 57 Cb 0.09 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 41.67 1ggq h LEU 57 CO -0.13 0.44 0.45 0.00 -1.08 0.00 0.00 178.44 178.12 1ggq h ALA 58 N 1.28 0.97 -0.19 1.53 0.00 -0.87 -0.31 119.26 121.68 1ggq h ALA 58 Ca 0.26 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1ggq h ALA 58 Cb 0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1ggq h ALA 58 CO -0.11 0.45 -0.22 0.28 0.00 0.00 0.00 179.25 179.65 1ggq h VAL 59 N 1.04 1.33 -0.49 0.00 2.07 -0.63 -3.11 116.25 116.47 1ggq h VAL 59 Ca 0.27 -1.40 0.05 0.00 0.82 0.00 0.00 66.70 66.45 1ggq h VAL 59 Cb -0.02 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1ggq h VAL 59 CO -0.05 0.42 0.33 0.50 0.02 0.00 0.00 177.57 178.79 1ggq h LYS 60 N 0.15 0.45 -0.54 1.57 1.63 0.27 -1.22 116.57 118.87 1ggq h LYS 60 Ca 0.03 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 59.76 1ggq h LYS 60 Cb 0.77 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.28 1ggq h LYS 60 CO 0.05 0.30 0.18 1.49 -3.45 0.00 0.00 179.45 178.02 1ggq h GLU 61 N 0.46 0.83 -0.54 1.90 4.81 -0.99 0.13 114.58 121.18 1ggq h GLU 61 Ca 0.21 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 1ggq h GLU 61 Cb 0.24 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1ggq h GLU 61 CO -0.05 0.75 0.08 0.28 -0.73 0.00 0.00 179.01 179.34 1ggq h VAL 62 N 0.74 1.24 -0.23 0.32 2.07 -1.24 0.31 116.25 119.46 1ggq h VAL 62 Ca 0.18 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 1ggq h VAL 62 Cb 0.26 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1ggq h VAL 62 CO -0.01 0.34 0.09 -0.08 0.02 0.00 0.00 177.57 177.93 1ggq h GLU 63 N 0.81 0.34 -0.73 1.57 4.81 -0.72 -1.07 114.58 119.61 1ggq h GLU 63 Ca 0.17 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 1ggq h GLU 63 Cb 0.38 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 1ggq h GLU 63 CO 0.01 0.39 0.37 0.00 -0.73 0.00 0.00 179.01 179.05 1ggq h ALA 64 N 0.94 0.93 -0.57 2.92 0.00 -0.32 -0.87 119.26 122.29 1ggq h ALA 64 Ca 0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1ggq h ALA 64 Cb 0.17 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1ggq h ALA 64 CO -0.01 0.48 0.30 -0.07 0.00 0.00 0.00 179.25 179.95 1ggq h LEU 65 N 1.01 0.71 -0.98 0.00 3.38 -0.65 -0.13 115.31 118.65 1ggq h LEU 65 Ca 0.25 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 1ggq h LEU 65 Cb 0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1ggq h LEU 65 CO -0.04 0.58 -0.18 -0.07 0.09 0.00 0.00 178.44 178.83 1ggq h LEU 66 N 0.80 0.53 -1.24 1.67 3.38 -0.37 -2.52 115.31 117.56 1ggq h LEU 66 Ca 0.20 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1ggq h LEU 66 Cb 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1ggq h LEU 66 CO -0.03 0.72 -0.10 0.77 0.09 0.00 0.00 178.44 179.89 1ggq h SER 67 N 0.48 0.38 0.10 -0.43 4.64 0.32 -2.38 113.55 116.66 1ggq h SER 67 Ca 0.08 -0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1ggq h SER 67 Cb 0.59 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1ggq h SER 67 CO 0.04 0.52 -0.28 0.77 -0.87 0.00 0.00 176.83 177.01 1ggq h SER 68 N 0.38 0.29 0.17 4.97 4.64 -0.92 0.61 113.55 123.69 1ggq h SER 68 Ca 0.08 -0.10 -0.15 0.00 -0.47 0.00 0.00 61.79 61.15 1ggq h SER 68 Cb 0.41 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1ggq h SER 68 CO 0.02 0.57 -0.54 0.40 -0.87 0.00 0.00 176.83 176.42 1ggq h ILE 69 N 0.26 1.34 -0.30 0.95 2.04 -1.33 -1.93 117.51 118.55 1ggq h ILE 69 Ca 0.04 -1.80 -0.18 0.00 1.00 0.00 0.00 64.86 63.92 1ggq h ILE 69 Cb 0.64 1.82 -0.00 0.00 -0.74 0.00 0.00 36.82 38.54 1ggq h ILE 69 CO 0.05 0.55 -0.52 0.44 0.00 0.00 0.00 178.15 178.66 1ggq h ASP 70 N 0.31 0.96 -0.17 1.72 3.32 -1.06 -2.12 116.42 119.39 1ggq h ASP 70 Ca 0.01 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 56.55 1ggq h ASP 70 Cb 1.04 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 1ggq h ASP 70 CO 0.09 1.30 0.08 -0.08 -1.72 0.00 0.00 179.24 178.91 1ggq h GLU 71 N 0.67 0.24 -0.10 3.56 4.57 -0.74 -0.92 114.58 121.86 1ggq h GLU 71 Ca 0.02 -0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.06 1ggq h GLU 71 Cb 1.13 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 1ggq h GLU 71 CO 0.12 0.26 -0.41 -0.84 -1.18 0.00 0.00 179.01 176.96 1ggq h ILE 72 N 0.15 1.31 -0.15 2.32 3.07 -1.38 -0.52 117.51 122.31 1ggq h ILE 72 Ca 0.06 -1.51 -0.02 0.00 1.55 0.00 0.00 64.86 64.94 1ggq h ILE 72 Cb 0.10 1.69 -0.01 0.00 -0.27 0.00 0.00 36.82 38.34 1ggq h ILE 72 CO -0.01 0.45 0.01 0.00 -1.05 0.00 0.00 178.15 177.55 1ggq h ALA 73 N 1.39 0.20 0.00 0.16 0.00 -1.16 0.76 119.26 120.62 1ggq h ALA 73 Ca 0.02 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1ggq h ALA 73 Cb 0.81 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1ggq h ALA 73 CO 0.06 -0.12 -0.59 0.00 0.00 0.00 0.00 179.25 178.61 1ggq h ALA 74 N 0.78 0.75 0.00 0.00 0.00 -1.10 -3.36 119.26 116.34 1ggq h ALA 74 Ca 0.04 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 1ggq h ALA 74 Cb 0.34 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ggq h ALA 74 CO 0.01 0.74 -1.36 1.63 0.00 0.00 0.00 179.25 180.26 1ggq n LYS 75 N -3.44 2.11 -0.01 0.00 4.76 -0.21 -4.83 118.16 116.54 1ggq n LYS 75 Ca 0.00 -0.02 0.10 0.00 -2.87 0.00 0.00 58.31 55.53 1ggq n LYS 75 Cb 0.69 -1.15 -0.16 0.00 -1.84 0.00 0.00 35.03 32.57 1ggq n LYS 75 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ggq n ALA 76 N -2.05 2.87 -1.71 7.82 0.00 0.24 -4.83 120.51 122.85 1ggq n ALA 76 Ca -0.07 -0.50 -0.43 0.00 0.00 0.00 0.00 53.44 52.44 1ggq n ALA 76 Cb 0.52 -0.71 -0.03 0.00 0.00 0.00 0.00 19.45 19.23 1ggq n ALA 76 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1ggq n ILE 77 N -2.18 0.55 -2.21 0.00 5.41 -1.10 -1.61 119.36 118.22 1ggq n ILE 77 Ca -0.03 -0.14 -0.18 0.00 1.00 0.00 0.00 62.75 63.40 1ggq n ILE 77 Cb 0.53 -1.80 -0.02 0.00 -0.71 0.00 0.00 39.64 37.64 1ggq n ILE 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ggq n GLY 78 N 2.88 -0.03 3.60 7.39 0.00 -1.26 -4.99 105.19 112.78 1ggq n GLY 78 Ca 0.13 -0.14 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 1ggq n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggq s LYS 79 N -4.67 1.95 0.02 1.61 -0.14 -0.63 -1.30 119.74 116.58 1ggq s LYS 79 Ca 0.00 -2.17 -0.25 0.00 -1.36 0.00 0.00 55.97 52.20 1ggq s LYS 79 Cb 0.00 -1.22 0.06 0.00 -1.68 0.00 0.00 37.83 34.99 1ggq s LYS 79 CO 0.00 -0.26 0.57 -1.59 -0.76 0.00 0.00 175.35 173.30 1ggq s LYS 80 N -3.80 1.04 0.33 1.68 -2.85 0.16 -4.55 119.74 111.75 1ggq s LYS 80 Ca 0.24 -0.09 -0.29 0.00 -1.00 0.00 0.00 55.97 54.83 1ggq s LYS 80 Cb 0.06 0.48 -0.11 0.00 -2.06 0.00 0.00 37.83 36.20 1ggq s LYS 80 CO 0.12 -0.36 1.45 0.42 0.10 0.00 0.00 175.35 177.08 1ggq s ILE 81 N -2.09 2.32 -0.02 3.79 1.01 -1.26 -0.37 121.20 124.58 1ggq s ILE 81 Ca -0.07 0.30 0.05 0.00 0.00 0.00 0.00 60.65 60.93 1ggq s ILE 81 Cb -0.01 -3.19 -0.01 0.00 0.01 0.00 0.00 42.46 39.26 1ggq s ILE 81 CO 0.01 0.06 -0.16 -2.28 0.00 0.00 0.00 174.94 172.58 1ggq s HIS 82 N -0.78 1.51 0.46 3.97 5.65 0.19 -4.73 115.29 121.56 1ggq s HIS 82 Ca 0.54 -0.34 0.11 0.00 0.25 0.00 0.00 55.06 55.62 1ggq s HIS 82 Cb -0.44 -1.00 1.03 0.00 -1.18 0.00 0.00 32.58 30.99 1ggq s HIS 82 CO 0.55 -0.08 2.09 -0.56 -0.65 0.00 0.00 174.74 176.09 1ggq h GLN 83 N 5.96 0.28 0.00 2.88 3.07 -1.95 -2.61 115.11 122.74 1ggq h GLN 83 Ca -0.35 -0.02 -0.33 0.00 0.09 0.00 0.00 58.65 58.05 1ggq h GLN 83 Cb 1.16 -0.06 -0.05 0.00 0.08 0.00 0.00 27.48 28.61 1ggq h GLN 83 CO 0.48 0.20 -2.12 0.09 0.09 0.00 0.00 178.83 177.57 1ggq n ASN 84 N -4.49 1.75 -0.79 0.06 3.02 -1.26 -4.64 115.26 108.91 1ggq n ASN 84 Ca 0.00 0.15 0.07 0.00 -0.03 0.00 0.00 54.58 54.76 1ggq n ASN 84 Cb 0.09 -0.51 0.19 0.00 -0.61 0.00 0.00 39.78 38.93 1ggq n ASN 84 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ggq n ASN 85 N -3.66 2.29 0.00 6.41 3.02 -1.26 -4.95 115.26 117.11 1ggq n ASN 85 Ca -0.38 -2.02 0.00 0.00 -0.03 0.00 0.00 54.58 52.15 1ggq n ASN 85 Cb 0.81 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 39.68 1ggq n ASN 85 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ggq n GLY 86 N 1.14 1.40 3.31 7.41 0.00 -0.98 -4.76 105.19 112.70 1ggq n GLY 86 Ca 0.14 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1ggq n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ggq s LEU 87 N 0.00 2.06 0.16 0.99 1.43 -1.26 0.57 118.68 122.63 1ggq s LEU 87 Ca 0.00 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 1ggq s LEU 87 Cb 0.00 -1.34 -0.05 0.00 0.03 0.00 0.00 46.19 44.83 1ggq s LEU 87 CO 0.00 0.31 -0.00 -0.62 0.23 0.00 0.00 176.35 176.27 1ggq s ASP 88 N -0.58 1.15 0.23 2.29 2.15 0.50 -4.80 116.67 117.61 1ggq s ASP 88 Ca 0.09 -1.16 -0.30 0.00 0.43 0.00 0.00 52.55 51.61 1ggq s ASP 88 Cb -0.10 0.13 -0.09 0.00 -0.30 0.00 0.00 42.92 42.55 1ggq s ASP 88 CO -0.01 -0.57 1.33 -0.89 -0.17 0.00 0.00 175.17 174.87 1ggq s THR 89 N -3.68 3.04 -0.43 1.71 2.01 -1.26 -0.67 115.64 116.36 1ggq s THR 89 Ca 0.23 0.88 0.06 0.00 0.31 0.00 0.00 61.69 63.17 1ggq s THR 89 Cb 0.06 -3.56 0.18 0.00 0.01 0.00 0.00 72.50 69.19 1ggq s THR 89 CO 0.03 0.14 0.69 -0.70 -0.69 0.00 0.00 174.62 174.09 1ggq s GLU 90 N -0.40 0.82 0.34 4.92 2.56 -0.42 -4.75 118.70 121.78 1ggq s GLU 90 Ca 0.56 -0.42 -0.26 0.00 0.00 0.00 0.00 54.97 54.85 1ggq s GLU 90 Cb -0.38 0.06 -0.10 0.00 2.00 0.00 0.00 34.13 35.72 1ggq s GLU 90 CO 0.41 -1.14 0.99 -0.80 -0.56 0.00 0.00 175.26 174.16 1ggq s ASN 91 N 1.63 7.14 -1.27 -1.70 0.01 -1.25 -3.21 114.94 116.28 1ggq s ASN 91 Ca 0.19 1.94 -0.07 0.00 -0.71 0.00 0.00 52.86 54.22 1ggq s ASN 91 Cb -0.02 -2.59 0.01 0.00 0.41 0.00 0.00 41.25 39.06 1ggq s ASN 91 CO -0.07 -0.21 0.92 0.59 -1.51 0.00 0.00 177.10 176.81 1ggq n ASN 92 N 0.42 -5.88 -2.67 -1.22 3.02 -1.26 -4.93 115.26 102.74 1ggq n ASN 92 Ca 0.03 -0.42 -0.09 0.00 -0.03 0.00 0.00 54.58 54.07 1ggq n ASN 92 Cb 0.49 -4.56 0.03 0.00 -0.61 0.00 0.00 39.78 35.14 1ggq n ASN 92 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1ggq n HIS 93 N -4.65 1.46 0.86 3.10 8.25 -1.12 -3.55 115.22 119.56 1ggq n HIS 93 Ca -0.02 -2.60 0.03 0.00 -0.26 0.00 0.00 57.72 54.87 1ggq n HIS 93 Cb 0.57 -0.31 0.12 0.00 1.12 0.00 0.00 29.99 31.49 1ggq n HIS 93 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ggq n ASN 94 N -0.29 1.85 0.13 0.41 3.02 -0.80 -4.47 115.26 115.10 1ggq n ASN 94 Ca 0.13 -2.13 -0.14 0.00 -0.03 0.00 0.00 54.58 52.41 1ggq n ASN 94 Cb 0.81 -0.33 -0.08 0.00 -0.61 0.00 0.00 39.78 39.57 1ggq n ASN 94 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1ggq h GLY 95 N 5.13 -0.26 1.57 7.41 0.00 -1.31 -1.72 103.07 113.89 1ggq h GLY 95 Ca 0.00 0.10 -0.06 0.00 0.00 0.00 0.00 47.33 47.37 1ggq h GLY 95 CO 0.07 -0.10 -0.05 1.48 0.00 0.00 0.00 176.54 177.94 1ggq h SER 96 N -0.29 0.51 -0.61 0.19 4.64 -1.81 -1.79 113.55 114.39 1ggq h SER 96 Ca -0.03 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.15 1ggq h SER 96 Cb 0.23 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 1ggq h SER 96 CO 0.04 0.61 0.26 0.25 -0.87 0.00 0.00 176.83 177.12 1ggq h LEU 97 N 0.50 0.83 -1.16 5.97 5.85 -1.83 -1.66 115.31 123.82 1ggq h LEU 97 Ca 0.10 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.60 1ggq h LEU 97 Cb 0.40 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1ggq h LEU 97 CO 0.02 0.76 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.76 1ggq h LEU 98 N 0.85 0.49 -0.35 2.25 -0.00 -0.87 -1.41 115.31 116.27 1ggq h LEU 98 Ca 0.21 -0.11 -0.00 0.00 -0.00 0.00 0.00 57.88 57.98 1ggq h LEU 98 Cb 0.18 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.69 1ggq h LEU 98 CO -0.02 0.60 0.22 0.00 -0.00 0.00 0.00 178.44 179.24 1ggq h ALA 99 N 1.45 0.45 -0.10 1.53 0.00 -0.70 0.18 119.26 122.08 1ggq h ALA 99 Ca 0.10 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ggq h ALA 99 Cb 0.41 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1ggq h ALA 99 CO 0.02 -0.06 -0.03 0.78 0.00 0.00 0.00 179.25 179.96 1ggq h GLY 100 N 0.47 0.06 0.51 0.00 0.00 -0.77 0.10 103.07 103.44 1ggq h GLY 100 Ca 0.13 0.04 0.07 0.00 0.00 0.00 0.00 47.33 47.57 1ggq h GLY 100 CO -0.02 -0.04 0.17 0.00 0.00 0.00 0.00 176.54 176.65 1ggq h ALA 101 N 1.09 0.61 -0.37 3.60 0.00 -0.73 0.13 119.26 123.59 1ggq h ALA 101 Ca 0.05 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1ggq h ALA 101 Cb 0.08 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1ggq h ALA 101 CO -0.11 -0.22 0.19 -0.92 0.00 0.00 0.00 179.25 178.19 1ggq h TYR 102 N 0.35 0.35 -0.93 0.00 3.20 -0.06 -0.40 116.97 119.48 1ggq h TYR 102 Ca 0.24 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.15 1ggq h TYR 102 Cb 0.26 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.38 1ggq h TYR 102 CO -0.17 0.18 0.61 0.00 -1.64 0.00 0.00 178.16 177.15 1ggq h ALA 103 N 1.19 1.38 -0.27 1.82 0.00 0.45 -1.33 119.26 122.51 1ggq h ALA 103 Ca 0.16 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1ggq h ALA 103 Cb 0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1ggq h ALA 103 CO -0.11 0.55 -0.40 0.82 0.00 0.00 0.00 179.25 180.11 1ggq h ILE 104 N 1.21 1.29 -0.55 0.00 2.04 -0.29 -2.30 117.51 118.91 1ggq h ILE 104 Ca 0.36 -1.57 -0.06 0.00 1.00 0.00 0.00 64.86 64.59 1ggq h ILE 104 Cb -0.06 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1ggq h ILE 104 CO -0.10 0.50 0.13 0.77 0.00 0.00 0.00 178.15 179.45 1ggq h SER 105 N 0.52 0.84 -0.19 1.72 4.64 -0.10 -0.06 113.55 120.92 1ggq h SER 105 Ca 0.04 -0.24 -0.09 0.00 -0.47 0.00 0.00 61.79 61.04 1ggq h SER 105 Cb 0.92 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.78 1ggq h SER 105 CO 0.08 0.86 -0.18 0.71 -0.87 0.00 0.00 176.83 177.43 1ggq h THR 106 N 0.78 1.26 -0.83 2.95 1.35 -1.21 -0.88 112.91 116.33 1ggq h THR 106 Ca 0.17 -1.19 -0.03 0.00 -0.55 0.00 0.00 66.41 64.81 1ggq h THR 106 Cb 0.35 1.19 -0.04 0.00 -1.73 0.00 0.00 68.15 67.93 1ggq h THR 106 CO 0.00 0.39 0.38 0.25 -0.25 0.00 0.00 175.52 176.30 1ggq h LEU 107 N 0.54 1.09 -0.56 3.87 5.85 -1.01 0.28 115.31 125.38 1ggq h LEU 107 Ca 0.09 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1ggq h LEU 107 Cb 0.61 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1ggq h LEU 107 CO 0.04 0.93 0.28 0.40 -0.34 0.00 0.00 178.44 179.75 1ggq h ILE 108 N 1.18 1.20 -0.79 4.05 2.04 -0.37 -0.46 117.51 124.36 1ggq h ILE 108 Ca 0.28 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1ggq h ILE 108 Cb 0.14 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1ggq h ILE 108 CO -0.03 0.23 0.50 0.50 0.00 0.00 0.00 178.15 179.35 1ggq h LYS 109 N 0.76 1.05 -0.56 2.37 1.63 -0.55 -1.17 116.57 120.10 1ggq h LYS 109 Ca 0.19 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1ggq h LYS 109 Cb 0.11 -0.23 -0.03 0.00 -0.60 0.00 0.00 32.23 31.48 1ggq h LYS 109 CO -0.03 0.71 0.36 0.37 -3.45 0.00 0.00 179.45 177.42 1ggq h GLN 110 N 1.07 0.74 -0.56 1.90 4.15 -0.36 -1.57 115.11 120.48 1ggq h GLN 110 Ca 0.29 -0.05 -0.11 0.00 0.77 0.00 0.00 58.65 59.54 1ggq h GLN 110 Cb -0.09 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.42 1ggq h GLN 110 CO -0.06 0.50 -0.09 0.87 -1.93 0.00 0.00 178.83 178.13 1ggq h LYS 111 N 0.76 1.04 -0.61 1.69 1.79 -0.53 -2.80 116.57 117.92 1ggq h LYS 111 Ca 0.20 -0.37 -0.08 0.00 -2.18 0.00 0.00 60.65 58.22 1ggq h LYS 111 Cb -0.07 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.48 1ggq h LYS 111 CO -0.04 1.07 0.06 -0.07 -1.08 0.00 0.00 179.45 179.38 1ggq h LEU 112 N 0.93 1.00 -2.06 2.94 3.38 -1.00 -2.13 115.31 118.37 1ggq h LEU 112 Ca 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1ggq h LEU 112 Cb 0.66 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1ggq h LEU 112 CO 0.05 1.02 -0.06 0.44 0.09 0.00 0.00 178.44 179.98 1ggq h ASP 113 N 0.96 0.00 1.06 -0.43 3.45 -1.17 -1.36 116.42 118.94 1ggq h ASP 113 Ca 0.18 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.64 1ggq h ASP 113 Cb 0.48 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.25 1ggq h ASP 113 CO 0.02 0.06 -0.21 0.61 -1.57 0.00 0.00 179.24 178.15 1ggq n GLY 114 N -0.58 -1.52 3.67 2.75 0.00 -0.81 -4.81 105.19 103.89 1ggq n GLY 114 Ca -0.01 -0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1ggq n GLY 114 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ggq s LEU 115 N -3.81 4.22 -0.14 0.99 1.43 -0.51 -5.01 118.68 115.85 1ggq s LEU 115 Ca 0.11 1.70 -0.00 0.00 -1.03 0.00 0.00 54.13 54.91 1ggq s LEU 115 Cb 0.15 -3.55 0.03 0.00 0.03 0.00 0.00 46.19 42.85 1ggq s LEU 115 CO 0.62 -0.64 -0.09 -0.75 0.23 0.00 0.00 176.35 175.71 1ggq s LYS 116 N 2.75 1.77 -0.30 1.70 2.47 -1.26 -5.05 119.74 121.82 1ggq s LYS 116 Ca 0.54 -0.43 -0.08 0.00 -1.56 0.00 0.00 55.97 54.43 1ggq s LYS 116 Cb -0.22 -1.87 0.17 0.00 -1.46 0.00 0.00 37.83 34.45 1ggq s LYS 116 CO 0.17 -0.30 0.82 1.21 0.16 0.00 0.00 175.35 177.41 1ggq s ASN 117 N 1.61 -0.92 0.13 1.43 3.84 -1.26 -5.06 114.94 114.71 1ggq s ASN 117 Ca 0.04 0.76 -0.25 0.00 0.21 0.00 0.00 52.86 53.61 1ggq s ASN 117 Cb -0.13 1.84 -0.06 0.00 -0.55 0.00 0.00 41.25 42.35 1ggq s ASN 117 CO -0.09 -0.17 1.41 1.21 -2.79 0.00 0.00 177.10 176.67 1ggq n GLU 118 N 5.36 -0.36 -0.17 0.43 2.13 -1.26 -0.51 120.64 126.27 1ggq n GLU 118 Ca -0.06 1.39 -0.07 0.00 0.66 0.00 0.00 57.16 59.08 1ggq n GLU 118 Cb 0.52 -2.05 0.02 0.00 0.27 0.00 0.00 31.44 30.20 1ggq n GLU 118 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1ggq h GLY 119 N 0.00 0.71 -0.04 8.31 0.00 -2.06 -3.00 103.07 107.00 1ggq h GLY 119 Ca 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1ggq h GLY 119 CO -0.76 0.28 -0.02 1.04 0.00 0.00 0.00 176.54 177.07 1ggq n LEU 120 N -4.71 1.10 -0.37 3.11 4.77 -1.01 -4.52 117.00 115.38 1ggq n LEU 120 Ca 0.02 -0.35 -0.05 0.00 -0.03 0.00 0.00 56.01 55.60 1ggq n LEU 120 Cb 0.05 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 1ggq n LEU 120 CO 0.35 0.19 0.55 0.50 -1.33 0.00 0.00 177.39 177.65 1ggq h LYS 121 N 1.70 -0.03 -0.97 3.23 3.64 -0.64 0.90 116.57 124.39 1ggq h LYS 121 Ca 0.00 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 1ggq h LYS 121 Cb 0.39 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.17 1ggq h LYS 121 CO 0.00 -0.02 0.64 0.93 -2.27 0.00 0.00 179.45 178.73 1ggq h GLU 122 N -0.03 1.26 0.00 1.90 5.08 -1.83 0.12 114.58 121.08 1ggq h GLU 122 Ca 0.27 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1ggq h GLU 122 Cb 0.54 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1ggq h GLU 122 CO -0.93 0.83 -0.26 0.87 -1.00 0.00 0.00 179.01 178.51 1ggq h LYS 123 N 1.29 0.00 0.03 2.33 1.57 -1.43 -2.56 116.57 117.81 1ggq h LYS 123 Ca 0.36 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.97 1ggq h LYS 123 Cb -0.11 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.22 1ggq h LYS 123 CO -0.09 0.26 -0.70 0.82 -0.57 0.00 0.00 179.45 179.17 1ggq h ILE 124 N 0.00 1.43 0.00 1.86 2.04 0.04 -2.88 117.51 119.99 1ggq h ILE 124 Ca -0.00 -2.20 -0.04 0.00 1.00 0.00 0.00 64.86 63.62 1ggq h ILE 124 Cb 0.91 2.71 -0.01 0.00 -0.74 0.00 0.00 36.82 39.70 1ggq h ILE 124 CO 0.03 0.64 -0.18 0.44 0.00 0.00 0.00 178.15 179.09 1ggq h ASP 125 N -0.11 0.00 -0.15 1.72 3.32 -0.95 0.59 116.42 120.85 1ggq h ASP 125 Ca -0.10 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.89 1ggq h ASP 125 Cb 1.43 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.98 1ggq h ASP 125 CO 0.14 0.18 -0.17 0.00 -1.72 0.00 0.00 179.24 177.66 1ggq h ALA 126 N 1.82 0.22 -0.68 3.45 0.00 -1.47 -1.49 119.26 121.12 1ggq h ALA 126 Ca -0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1ggq h ALA 126 Cb 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1ggq h ALA 126 CO 0.02 0.12 0.25 0.00 0.00 0.00 0.00 179.25 179.65 1ggq h ALA 127 N 0.60 0.89 -0.57 0.00 0.00 -1.17 -1.32 119.26 117.69 1ggq h ALA 127 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ggq h ALA 127 Cb 0.71 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1ggq h ALA 127 CO 0.04 0.53 0.36 0.87 0.00 0.00 0.00 179.25 181.05 1ggq h LYS 128 N 0.98 0.77 0.21 0.00 1.57 -0.86 0.41 116.57 119.64 1ggq h LYS 128 Ca 0.23 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 1ggq h LYS 128 Cb 0.24 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1ggq h LYS 128 CO -0.01 0.53 -0.10 -0.22 -0.57 0.00 0.00 179.45 179.08 1ggq h LYS 129 N 0.77 -0.27 -0.41 3.15 3.64 -0.88 -2.32 116.57 120.26 1ggq h LYS 129 Ca 0.21 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1ggq h LYS 129 Cb -0.05 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1ggq h LYS 129 CO -0.04 -0.14 0.19 0.00 -2.27 0.00 0.00 179.45 177.19 1ggq h SER 131 N 0.57 0.81 -0.46 0.00 0.87 -0.59 -1.34 113.55 113.42 1ggq h SER 131 Ca 0.14 -0.07 -0.10 0.00 -1.23 0.00 0.00 61.79 60.54 1ggq h SER 131 Cb 0.06 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 1ggq h SER 131 CO -0.02 0.64 -0.11 -0.33 -0.53 0.00 0.00 176.83 176.48 1ggq h GLU 132 N 0.91 0.88 -0.41 2.24 5.08 -0.87 -1.87 114.58 120.54 1ggq h GLU 132 Ca 0.24 -0.34 0.06 0.00 -1.00 0.00 0.00 59.36 58.32 1ggq h GLU 132 Cb -0.02 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.13 1ggq h GLU 132 CO -0.04 0.98 0.12 1.15 -1.00 0.00 0.00 179.01 180.21 1ggq h THR 133 N 0.72 0.84 0.40 1.13 2.02 -1.01 0.29 112.91 117.29 1ggq h THR 133 Ca 0.12 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 1ggq h THR 133 Cb 0.65 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1ggq h THR 133 CO 0.04 0.05 -0.19 0.15 0.37 0.00 0.00 175.52 175.94 1ggq h PHE 134 N 0.27 -0.50 -0.89 3.16 3.57 -1.13 -0.93 116.94 120.49 1ggq h PHE 134 Ca 0.20 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.76 1ggq h PHE 134 Cb 0.21 0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 1ggq h PHE 134 CO -0.17 -0.27 0.58 1.15 -2.23 0.00 0.00 178.31 177.37 1ggq h THR 135 N -0.63 1.03 0.00 4.41 2.02 -1.06 -1.92 112.91 116.77 1ggq h THR 135 Ca -0.06 -0.33 -0.12 0.00 0.77 0.00 0.00 66.41 66.67 1ggq h THR 135 Cb 0.46 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1ggq h THR 135 CO 0.09 0.18 -0.58 0.78 0.37 0.00 0.00 175.52 176.36 1ggq h ASN 136 N 0.96 0.00 -0.37 4.18 2.35 -0.25 -2.82 115.58 119.64 1ggq h ASN 136 Ca 0.39 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 56.01 1ggq h ASN 136 Cb 0.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1ggq h ASN 136 CO -0.15 0.58 -0.24 0.50 -1.65 0.00 0.00 177.43 176.46 1ggq h LYS 137 N 0.00 0.87 -0.11 0.81 1.63 -0.38 -0.39 116.57 119.01 1ggq h LYS 137 Ca -0.01 -0.37 -0.00 0.00 -0.85 0.00 0.00 60.65 59.42 1ggq h LYS 137 Cb 1.12 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.71 1ggq h LYS 137 CO 0.08 1.02 0.06 -0.07 -3.45 0.00 0.00 179.45 177.09 1ggq h LEU 138 N 0.75 0.13 -0.49 5.20 3.38 -1.36 -1.30 115.31 121.63 1ggq h LEU 138 Ca 0.10 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1ggq h LEU 138 Cb 0.79 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1ggq h LEU 138 CO 0.07 0.17 0.30 0.11 0.09 0.00 0.00 178.44 179.17 1ggq h LYS 139 N 0.09 0.59 -0.91 1.13 1.57 -1.35 -2.01 116.57 115.68 1ggq h LYS 139 Ca 0.04 -0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.90 1ggq h LYS 139 Cb 0.06 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.17 1ggq h LYS 139 CO -0.01 0.39 0.59 1.49 -0.57 0.00 0.00 179.45 181.34 1ggq h GLU 140 N 0.61 0.82 -0.84 3.15 4.81 -0.71 -0.52 114.58 121.90 1ggq h GLU 140 Ca 0.19 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1ggq h GLU 140 Cb -0.02 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 1ggq h GLU 140 CO -0.07 0.54 0.03 1.63 -0.73 0.00 0.00 179.01 180.41 1ggq n LYS 141 N -4.56 2.60 -0.36 1.92 4.76 -0.52 -4.53 118.16 117.47 1ggq n LYS 141 Ca 0.17 -1.39 0.34 0.00 -2.87 0.00 0.00 58.31 54.55 1ggq n LYS 141 Cb 0.37 -1.81 0.68 0.00 -1.84 0.00 0.00 35.03 32.44 1ggq n LYS 141 CO 0.00 0.00 0.00 1.12 -1.37 0.00 0.00 177.40 177.15 1ggq h HIS 142 N 1.62 0.23 -0.11 2.13 2.07 -0.90 0.15 115.15 120.34 1ggq h HIS 142 Ca 0.03 0.01 -0.04 0.00 -2.85 0.00 0.00 60.37 57.52 1ggq h HIS 142 Cb 1.23 -0.06 -0.01 0.00 2.57 0.00 0.00 27.41 31.14 1ggq h HIS 142 CO 0.51 -0.01 -0.14 1.15 -3.07 0.00 0.00 177.93 176.38 1ggq h THR 143 N 0.11 1.16 0.01 6.12 2.02 -1.85 1.04 112.91 121.52 1ggq h THR 143 Ca 0.63 -0.71 -0.36 0.00 0.77 0.00 0.00 66.41 66.73 1ggq h THR 143 Cb 2.21 1.23 -0.06 0.00 -1.74 0.00 0.00 68.15 69.80 1ggq h THR 143 CO -0.12 0.22 -2.27 0.47 0.37 0.00 0.00 175.52 174.18 1ggq n ASP 144 N -4.30 0.64 -0.18 4.18 10.43 0.39 -4.54 116.55 123.18 1ggq n ASP 144 Ca -0.01 0.05 0.07 0.00 2.57 0.00 0.00 54.79 57.47 1ggq n ASP 144 Cb 0.25 0.45 -0.03 0.00 1.84 0.00 0.00 41.12 43.63 1ggq n ASP 144 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1ggq n LEU 145 N -2.94 1.10 -3.61 0.64 4.77 -0.35 -4.69 117.00 111.93 1ggq n LEU 145 Ca -0.33 -0.65 -0.41 0.00 -0.03 0.00 0.00 56.01 54.60 1ggq n LEU 145 Cb 1.10 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.21 1ggq n LEU 145 CO 0.40 0.23 1.59 0.61 -1.33 0.00 0.00 177.39 178.89 1ggq n GLY 146 N 1.17 6.01 3.66 -0.72 0.00 0.36 -4.86 105.19 110.81 1ggq n GLY 146 Ca 0.04 -2.50 -0.04 0.00 0.00 0.00 0.00 46.02 43.52 1ggq n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ggq s LYS 147 N -3.86 0.94 0.12 1.61 -2.85 -1.26 -4.88 119.74 109.55 1ggq s LYS 147 Ca 0.41 -0.47 -0.12 0.00 -1.00 0.00 0.00 55.97 54.79 1ggq s LYS 147 Cb 0.19 0.35 -0.10 0.00 -2.06 0.00 0.00 37.83 36.21 1ggq s LYS 147 CO -0.13 -0.42 1.39 1.05 0.10 0.00 0.00 175.35 177.34 1ggq h GLU 148 N 2.00 0.85 -2.45 1.78 -0.00 -1.91 -3.31 114.58 111.54 1ggq h GLU 148 Ca -0.24 -0.56 -0.46 0.00 -0.00 0.00 0.00 59.36 58.11 1ggq h GLU 148 Cb 1.23 0.07 -0.05 0.00 -0.00 0.00 0.00 28.75 30.00 1ggq h GLU 148 CO 0.27 1.19 1.63 0.41 -0.00 0.00 0.00 179.01 182.51 1ggq n GLY 149 N 0.41 3.84 3.69 1.06 0.00 -1.26 -1.35 105.19 111.56 1ggq n GLY 149 Ca -0.05 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 1ggq n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggq s VAL 150 N 0.94 4.61 0.66 1.61 1.01 -1.23 -4.77 120.40 123.22 1ggq s VAL 150 Ca 0.66 1.89 -0.16 0.00 0.00 0.00 0.00 61.98 64.37 1ggq s VAL 150 Cb 0.26 -4.21 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 1ggq s VAL 150 CO -0.05 0.01 1.15 0.42 0.00 0.00 0.00 175.10 176.63 1ggq s THR 151 N 2.01 2.90 0.31 3.92 -4.23 -1.26 -1.91 115.64 117.37 1ggq s THR 151 Ca 0.51 0.46 -0.00 0.00 -1.18 0.00 0.00 61.69 61.47 1ggq s THR 151 Cb -0.21 -3.02 0.23 0.00 1.34 0.00 0.00 72.50 70.84 1ggq s THR 151 CO 0.20 -0.22 1.94 0.44 -0.54 0.00 0.00 174.62 176.44 1ggq h ASP 152 N 0.19 0.82 -0.35 3.99 3.32 -1.93 -1.19 116.42 121.26 1ggq h ASP 152 Ca -0.48 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 56.51 1ggq h ASP 152 Cb 1.27 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.59 1ggq h ASP 152 CO 0.53 0.66 0.21 0.00 -1.72 0.00 0.00 179.24 178.92 1ggq h ALA 153 N 1.48 0.45 -0.25 3.45 0.00 -2.00 -1.02 119.26 121.37 1ggq h ALA 153 Ca 0.24 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.95 1ggq h ALA 153 Cb 0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1ggq h ALA 153 CO -0.04 -0.06 -0.46 -0.44 0.00 0.00 0.00 179.25 178.25 1ggq h ASP 154 N 0.46 0.70 -0.74 0.00 3.45 -1.84 -2.70 116.42 115.75 1ggq h ASP 154 Ca 0.13 -0.34 -0.05 0.00 0.43 0.00 0.00 57.03 57.20 1ggq h ASP 154 Cb 0.00 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 38.54 1ggq h ASP 154 CO -0.02 1.06 0.27 0.00 -1.57 0.00 0.00 179.24 178.98 1ggq h ALA 155 N 0.97 0.96 -0.14 3.45 0.00 -1.03 -2.06 119.26 121.42 1ggq h ALA 155 Ca 0.03 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1ggq h ALA 155 Cb 1.00 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1ggq h ALA 155 CO 0.09 0.61 -0.17 0.87 0.00 0.00 0.00 179.25 180.65 1ggq h LYS 156 N 1.08 0.23 0.00 0.00 1.57 -1.10 -1.02 116.57 117.33 1ggq h LYS 156 Ca 0.24 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1ggq h LYS 156 Cb 0.25 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1ggq h LYS 156 CO -0.02 0.41 0.00 0.39 -0.57 0.00 0.00 179.45 179.66 1ggq n GLU 157 N -4.24 0.04 -0.09 3.15 1.02 -0.81 -2.10 120.64 117.61 1ggq n GLU 157 Ca -0.01 0.11 -0.12 0.00 -0.02 0.00 0.00 57.16 57.12 1ggq n GLU 157 Cb 0.30 -1.55 -0.11 0.00 -0.02 0.00 0.00 31.44 30.07 1ggq n GLU 157 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ggq n ALA 158 N -1.54 1.57 -0.54 0.62 0.00 -0.68 -0.96 120.51 118.98 1ggq n ALA 158 Ca 0.06 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.56 1ggq n ALA 158 Cb 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.73 1ggq n ALA 158 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1ggq n ILE 159 N -2.93 0.28 -3.51 0.00 -5.35 -0.47 -1.41 119.36 105.97 1ggq n ILE 159 Ca -0.33 -0.37 -0.42 0.00 -0.27 0.00 0.00 62.75 61.36 1ggq n ILE 159 Cb 0.93 1.07 -0.07 0.00 -1.74 0.00 0.00 39.64 39.84 1ggq n ILE 159 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1ggq s LEU 160 N -0.28 5.90 0.01 7.28 2.96 -0.89 -4.71 118.68 128.95 1ggq s LEU 160 Ca 0.00 -2.23 0.04 0.00 -0.22 0.00 0.00 54.13 51.72 1ggq s LEU 160 Cb 0.00 -2.05 0.15 0.00 0.50 0.00 0.00 46.19 44.80 1ggq s LEU 160 CO 0.00 -0.63 1.11 2.29 -1.32 0.00 0.00 176.35 177.80 1ggq n LYS 161 N 4.50 0.00 -0.08 1.98 2.85 -1.26 -1.83 118.16 124.32 1ggq n LYS 161 Ca -0.01 0.45 0.08 0.00 -1.05 0.00 0.00 58.31 57.78 1ggq n LYS 161 Cb 0.41 -1.51 0.12 0.00 -0.65 0.00 0.00 35.03 33.40 1ggq n LYS 161 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1ggq n THR 162 N -1.52 0.33 -2.04 0.58 -2.24 -1.26 -4.93 114.28 103.20 1ggq n THR 162 Ca 0.01 -0.67 -0.35 0.00 -2.27 0.00 0.00 64.05 60.78 1ggq n THR 162 Cb 0.04 1.06 0.02 0.00 -2.10 0.00 0.00 70.33 69.35 1ggq n THR 162 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ggq s ASN 163 N -1.23 5.39 0.16 3.42 3.04 -0.76 -4.96 114.94 119.98 1ggq s ASN 163 Ca 0.24 2.18 -0.16 0.00 0.04 0.00 0.00 52.86 55.16 1ggq s ASN 163 Cb 0.15 -2.58 0.05 0.00 -1.54 0.00 0.00 41.25 37.33 1ggq s ASN 163 CO 0.21 -1.45 1.78 1.23 -3.04 0.00 0.00 177.10 175.83 1ggq h GLY 164 N 0.76 0.52 -5.58 1.21 0.00 -1.94 -3.40 103.07 94.64 1ggq h GLY 164 Ca -0.49 -0.13 -0.66 0.00 0.00 0.00 0.00 47.33 46.05 1ggq h GLY 164 CO 0.55 0.10 -0.65 -0.51 0.00 0.00 0.00 176.54 176.03 1ggq s THR 165 N -6.15 4.07 -0.28 4.70 -4.23 -1.26 -5.02 115.64 107.46 1ggq s THR 165 Ca -0.13 -0.31 0.14 0.00 -1.18 0.00 0.00 61.69 60.20 1ggq s THR 165 Cb 0.12 -2.75 0.48 0.00 1.34 0.00 0.00 72.50 71.69 1ggq s THR 165 CO 0.72 0.54 1.15 0.29 -0.54 0.00 0.00 174.62 176.78 1ggq n LYS 166 N 2.90 2.78 -0.01 3.99 5.02 -1.26 -4.27 118.16 127.31 1ggq n LYS 166 Ca -0.18 -3.89 0.12 0.00 -2.02 0.00 0.00 58.31 52.35 1ggq n LYS 166 Cb 0.53 -1.98 0.66 0.00 -0.02 0.00 0.00 35.03 34.22 1ggq n LYS 166 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ggq n THR 167 N -0.64 0.03 -1.33 -0.18 -2.24 -1.25 -2.78 114.28 105.89 1ggq n THR 167 Ca 0.28 -0.08 0.08 0.00 -2.27 0.00 0.00 64.05 62.06 1ggq n THR 167 Cb 0.89 -0.18 0.15 0.00 -2.10 0.00 0.00 70.33 69.09 1ggq n THR 167 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ggq n LYS 168 N -0.60 1.30 0.00 -0.78 5.02 -0.13 -4.95 118.16 118.02 1ggq n LYS 168 Ca 0.18 -2.75 0.00 0.00 -2.02 0.00 0.00 58.31 53.73 1ggq n LYS 168 Cb 0.15 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1ggq n LYS 168 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ggq n GLY 169 N -1.22 1.16 0.29 0.72 0.00 -0.93 -4.03 105.19 101.19 1ggq n GLY 169 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.19 1ggq n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ggq h ALA 170 N 0.00 1.06 -0.23 4.61 0.00 -0.19 -0.05 119.26 124.46 1ggq h ALA 170 Ca 0.00 0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1ggq h ALA 170 Cb 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1ggq h ALA 170 CO 0.00 0.09 -0.05 1.49 0.00 0.00 0.00 179.25 180.78 1ggq h GLU 171 N 0.76 0.01 -0.17 0.00 4.57 -1.77 0.50 114.58 118.48 1ggq h GLU 171 Ca 0.36 -0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.47 1ggq h GLU 171 Cb 0.28 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 1ggq h GLU 171 CO -0.22 0.00 -0.21 0.93 -1.18 0.00 0.00 179.01 178.34 1ggq h GLU 172 N 0.01 0.29 -0.36 1.92 3.07 -1.69 -2.25 114.58 115.57 1ggq h GLU 172 Ca 0.11 -0.09 -0.10 0.00 -0.50 0.00 0.00 59.36 58.78 1ggq h GLU 172 Cb 0.17 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.03 1ggq h GLU 172 CO -0.23 0.50 -0.20 1.25 -1.40 0.00 0.00 179.01 178.93 1ggq h LEU 173 N 0.27 0.69 -0.46 1.33 5.85 -0.11 -1.34 115.31 121.54 1ggq h LEU 173 Ca 0.05 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 1ggq h LEU 173 Cb 0.53 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1ggq h LEU 173 CO 0.04 0.89 0.14 1.23 -0.34 0.00 0.00 178.44 180.39 1ggq h GLY 174 N 0.98 0.78 1.37 3.75 0.00 -0.37 -1.36 103.07 108.23 1ggq h GLY 174 Ca 0.09 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 1ggq h GLY 174 CO 0.05 0.44 -0.18 0.50 0.00 0.00 0.00 176.54 177.34 1ggq h LYS 175 N 0.62 0.73 -0.37 4.80 1.57 -1.27 -2.40 116.57 120.25 1ggq h LYS 175 Ca 0.15 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1ggq h LYS 175 Cb 0.28 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1ggq h LYS 175 CO -0.00 0.86 0.24 1.25 -0.57 0.00 0.00 179.45 181.22 1ggq h LEU 176 N 0.65 0.43 -0.49 2.94 5.85 -0.99 -0.11 115.31 123.59 1ggq h LEU 176 Ca 0.10 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.87 1ggq h LEU 176 Cb 0.67 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.52 1ggq h LEU 176 CO 0.05 0.34 0.12 -0.26 -0.34 0.00 0.00 178.44 178.34 1ggq h PHE 177 N 0.49 0.20 -0.58 1.25 -1.00 -1.00 -0.85 116.94 115.45 1ggq h PHE 177 Ca 0.13 0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.96 1ggq h PHE 177 Cb -0.03 -0.02 -0.03 0.00 3.61 0.00 0.00 35.95 39.48 1ggq h PHE 177 CO -0.04 0.03 0.37 1.49 -1.61 0.00 0.00 178.31 178.54 1ggq h GLU 178 N 0.27 0.72 -0.49 1.51 4.81 -0.90 0.67 114.58 121.17 1ggq h GLU 178 Ca 0.24 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1ggq h GLU 178 Cb 0.30 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1ggq h GLU 178 CO -0.29 0.48 0.28 0.77 -0.73 0.00 0.00 179.01 179.52 1ggq h SER 179 N 0.74 0.61 -0.16 1.04 0.02 -0.23 -1.69 113.55 113.87 1ggq h SER 179 Ca 0.22 -0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 60.94 1ggq h SER 179 Cb -0.04 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1ggq h SER 179 CO -0.07 0.51 -0.45 0.58 -1.14 0.00 0.00 176.83 176.26 1ggq h VAL 180 N 0.66 1.29 -0.37 2.27 2.07 -0.87 -2.21 116.25 119.09 1ggq h VAL 180 Ca 0.18 -1.64 -0.05 0.00 0.82 0.00 0.00 66.70 66.01 1ggq h VAL 180 Cb 0.03 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1ggq h VAL 180 CO -0.03 0.53 0.04 -0.33 0.02 0.00 0.00 177.57 177.80 1ggq h GLU 181 N 0.58 0.57 -0.37 1.57 5.08 -0.66 0.39 114.58 121.75 1ggq h GLU 181 Ca 0.04 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.18 1ggq h GLU 181 Cb 1.00 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1ggq h GLU 181 CO 0.10 0.57 -0.18 0.28 -1.00 0.00 0.00 179.01 178.77 1ggq h VAL 182 N 0.55 1.28 -0.42 3.13 2.07 -1.16 -0.58 116.25 121.13 1ggq h VAL 182 Ca 0.12 -1.31 -0.08 0.00 0.82 0.00 0.00 66.70 66.25 1ggq h VAL 182 Cb 0.29 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 1ggq h VAL 182 CO 0.00 0.43 -0.08 0.25 0.02 0.00 0.00 177.57 178.20 1ggq h LEU 183 N 0.57 0.70 -0.31 2.57 5.85 -0.78 -2.57 115.31 121.34 1ggq h LEU 183 Ca 0.08 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 1ggq h LEU 183 Cb 0.73 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 1ggq h LEU 183 CO 0.05 0.82 0.05 -1.28 -0.34 0.00 0.00 178.44 177.74 1ggq h SER 184 N 0.66 0.49 0.24 1.25 0.87 0.03 -2.31 113.55 114.78 1ggq h SER 184 Ca 0.12 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 1ggq h SER 184 Cb 0.53 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 1ggq h SER 184 CO 0.03 0.63 -0.46 0.11 -0.53 0.00 0.00 176.83 176.61 1ggq h LYS 185 N 0.34 -0.73 -0.23 2.24 1.79 -0.86 0.52 116.57 119.63 1ggq h LYS 185 Ca 0.09 0.05 0.05 0.00 -2.18 0.00 0.00 60.65 58.67 1ggq h LYS 185 Cb 0.35 0.17 -0.07 0.00 -1.58 0.00 0.00 32.23 31.09 1ggq h LYS 185 CO 0.01 -0.49 -0.42 0.00 -1.08 0.00 0.00 179.45 177.47 1ggq h ALA 186 N -0.80 -0.53 0.00 3.86 0.00 -1.47 -1.17 119.26 119.15 1ggq h ALA 186 Ca -0.03 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ggq h ALA 186 Cb 0.71 0.83 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 1ggq h ALA 186 CO -0.18 -0.90 -0.06 0.00 0.00 0.00 0.00 179.25 178.11 1ggq h ALA 187 N 0.23 1.86 -0.04 0.00 0.00 -1.31 -1.20 119.26 118.80 1ggq h ALA 187 Ca 0.10 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1ggq h ALA 187 Cb 0.61 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1ggq h ALA 187 CO -0.46 0.07 -0.64 -0.22 0.00 0.00 0.00 179.25 178.00 1ggq h LYS 188 N 0.00 0.15 0.21 0.00 1.63 0.25 -3.15 116.57 115.66 1ggq h LYS 188 Ca -0.00 -0.11 -0.32 0.00 -0.85 0.00 0.00 60.65 59.37 1ggq h LYS 188 Cb 0.10 0.02 0.03 0.00 -0.60 0.00 0.00 32.23 31.78 1ggq h LYS 188 CO 0.01 0.74 -1.41 0.93 -3.45 0.00 0.00 179.45 176.26 1ggq h GLU 189 N 0.11 0.44 -0.24 1.90 5.08 -0.42 -3.00 114.58 118.44 1ggq h GLU 189 Ca -0.01 -0.75 0.05 0.00 -1.00 0.00 0.00 59.36 57.65 1ggq h GLU 189 Cb 1.15 0.28 -0.01 0.00 0.50 0.00 0.00 28.75 30.66 1ggq h GLU 189 CO 0.09 1.36 0.17 0.52 -1.00 0.00 0.00 179.01 180.15 1ggq h MET 190 N 0.12 0.10 -0.06 2.33 2.86 -1.27 0.47 114.93 119.48 1ggq h MET 190 Ca -0.22 -0.01 -0.24 0.00 -2.06 0.00 0.00 59.70 57.18 1ggq h MET 190 Cb 2.10 -0.02 0.02 0.00 0.06 0.00 0.00 31.60 33.75 1ggq h MET 190 CO 0.25 0.07 -0.91 1.25 1.06 0.00 0.00 176.91 178.63 1ggq h LEU 191 N 0.11 0.90 -0.33 1.22 5.85 -1.58 -2.51 115.31 118.96 1ggq h LEU 191 Ca 0.11 -0.70 -0.02 0.00 0.84 0.00 0.00 57.88 58.12 1ggq h LEU 191 Cb 0.31 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1ggq h LEU 191 CO -0.01 1.47 0.14 0.00 -0.34 0.00 0.00 178.44 179.69 1ggq h ALA 192 N 0.45 0.43 -0.76 1.25 0.00 -0.82 -0.88 119.26 118.93 1ggq h ALA 192 Ca -0.10 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ggq h ALA 192 Cb 1.55 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.18 1ggq h ALA 192 CO 0.18 0.02 0.46 -0.91 0.00 0.00 0.00 179.25 179.00 1ggq h ASN 193 N 0.39 0.90 0.83 0.00 2.35 -0.19 0.18 115.58 120.04 1ggq h ASN 193 Ca 0.11 -0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 55.71 1ggq h ASN 193 Cb 0.17 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1ggq h ASN 193 CO -0.01 0.69 -0.48 0.28 -1.65 0.00 0.00 177.43 176.26 1ggq h SER 194 N 1.04 0.00 1.30 5.81 0.02 -1.18 -3.02 113.55 117.52 1ggq h SER 194 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1ggq h SER 194 Cb -0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1ggq h SER 194 CO -0.05 0.48 -0.63 0.58 -1.14 0.00 0.00 176.83 176.06 1ggq h VAL 195 N 0.00 0.00 -0.01 2.27 2.07 -0.12 -3.28 116.25 117.19 1ggq h VAL 195 Ca -0.00 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1ggq h VAL 195 Cb 1.03 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.40 1ggq h VAL 195 CO 0.06 0.00 -0.11 0.29 0.02 0.00 0.00 177.57 177.83 1ggq n LYS 196 N -2.74 0.97 0.11 1.57 5.02 0.53 -3.35 118.16 120.27 1ggq n LYS 196 Ca 0.02 -0.44 0.13 0.00 -2.02 0.00 0.00 58.31 56.00 1ggq n LYS 196 Cb 0.53 -1.49 0.41 0.00 -0.02 0.00 0.00 35.03 34.46 1ggq n LYS 196 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ggq n GLU 197 N -0.63 0.26 -0.01 1.97 1.02 -1.19 -2.89 120.64 119.17 1ggq n GLU 197 Ca 0.16 0.25 0.09 0.00 -0.02 0.00 0.00 57.16 57.64 1ggq n GLU 197 Cb 0.30 -1.82 0.49 0.00 -0.02 0.00 0.00 31.44 30.38 1ggq n GLU 197 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1ggq n LEU 198 N -2.28 0.26 -0.61 -4.62 4.77 -1.21 -3.75 117.00 109.55 1ggq n LEU 198 Ca 0.05 -0.11 -0.01 0.00 -0.03 0.00 0.00 56.01 55.92 1ggq n LEU 198 Cb 0.41 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 1ggq n LEU 198 CO 0.29 0.05 0.25 0.35 -1.33 0.00 0.00 177.39 177.00 1ggq n THR 199 N -0.60 0.00 -1.15 -5.08 -2.24 -1.15 -5.07 114.28 98.99 1ggq n THR 199 Ca 0.13 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1ggq n THR 199 Cb 0.10 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1ggq n THR 199 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30