#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t92 h ASN 27 N 0.00 0.44 -0.61 1.61 -0.73 -2.05 -0.13 115.58 114.11 1t92 h ASN 27 Ca 0.00 -0.43 -0.06 0.00 1.87 0.00 0.00 56.30 57.68 1t92 h ASN 27 Cb 0.00 -0.12 -0.03 0.00 0.27 0.00 0.00 38.32 38.44 1t92 h ASN 27 CO 0.00 0.78 0.17 0.50 -0.37 0.00 0.00 177.43 178.50 1t92 h LYS 28 N 0.10 0.97 -0.59 6.67 3.64 -2.05 -1.95 116.57 123.35 1t92 h LYS 28 Ca 0.04 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 1t92 h LYS 28 Cb 0.62 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.29 1t92 h LYS 28 CO 0.03 0.87 0.32 1.49 -2.27 0.00 0.00 179.45 179.90 1t92 h GLU 29 N 0.89 0.83 -0.23 1.90 4.81 -1.98 0.20 114.58 120.98 1t92 h GLU 29 Ca 0.19 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1t92 h GLU 29 Cb 0.33 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1t92 h GLU 29 CO -0.00 0.63 0.11 -0.22 -0.73 0.00 0.00 179.01 178.80 1t92 h LYS 30 N 0.80 0.34 -0.54 1.92 3.64 -0.92 -1.09 116.57 120.72 1t92 h LYS 30 Ca 0.21 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1t92 h LYS 30 Cb 0.04 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.76 1t92 h LYS 30 CO -0.03 0.35 0.29 0.00 -2.27 0.00 0.00 179.45 177.78 1t92 h ALA 31 N 0.97 0.69 -0.79 5.00 0.00 -1.00 -0.76 119.26 123.37 1t92 h ALA 31 Ca 0.08 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1t92 h ALA 31 Cb 0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1t92 h ALA 31 CO -0.01 -0.05 0.34 -0.44 0.00 0.00 0.00 179.25 179.10 1t92 h ASP 32 N 0.55 1.07 -0.29 0.00 3.32 -0.35 -1.10 116.42 119.62 1t92 h ASP 32 Ca 0.23 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 1t92 h ASP 32 Cb 0.12 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1t92 h ASP 32 CO -0.15 0.92 0.02 -0.09 -1.72 0.00 0.00 179.24 178.22 1t92 h ARG 33 N 1.14 0.49 -0.88 3.56 2.43 -0.74 -0.88 114.38 119.51 1t92 h ARG 33 Ca 0.27 -0.15 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1t92 h ARG 33 Cb 0.17 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 1t92 h ARG 33 CO -0.03 0.63 0.58 1.96 -1.51 0.00 0.00 179.97 181.61 1t92 h GLN 34 N 0.29 1.16 -0.28 0.20 4.20 -0.97 -1.36 115.11 118.35 1t92 h GLN 34 Ca 0.08 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1t92 h GLN 34 Cb 0.40 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1t92 h GLN 34 CO 0.01 0.77 0.14 -0.22 -0.67 0.00 0.00 178.83 178.86 1t92 h LYS 35 N 1.19 0.41 -0.26 1.46 3.64 -0.87 -0.07 116.57 122.08 1t92 h LYS 35 Ca 0.32 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.66 1t92 h LYS 35 Cb -0.14 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 1t92 h LYS 35 CO -0.07 0.39 0.13 0.28 -2.27 0.00 0.00 179.45 177.91 1t92 h VAL 36 N 0.32 1.00 -0.17 2.00 2.07 -0.91 0.72 116.25 121.28 1t92 h VAL 36 Ca 0.10 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1t92 h VAL 36 Cb 0.12 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1t92 h VAL 36 CO -0.01 0.05 0.01 0.58 0.02 0.00 0.00 177.57 178.21 1t92 h VAL 37 N 0.27 1.25 -0.36 2.57 2.07 -1.17 -1.08 116.25 119.79 1t92 h VAL 37 Ca 0.10 -0.82 0.04 0.00 0.82 0.00 0.00 66.70 66.85 1t92 h VAL 37 Cb 0.03 1.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 1t92 h VAL 37 CO -0.07 0.24 0.13 -1.28 0.02 0.00 0.00 177.57 176.62 1t92 h SER 38 N 0.05 0.15 -0.55 0.57 0.87 -0.87 -0.68 113.55 113.10 1t92 h SER 38 Ca 0.05 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.60 1t92 h SER 38 Cb 0.36 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 1t92 h SER 38 CO 0.01 0.12 0.17 0.44 -0.53 0.00 0.00 176.83 177.04 1t92 h ASP 39 N 0.29 0.81 -0.24 6.23 3.32 -0.76 -0.78 116.42 125.28 1t92 h ASP 39 Ca 0.16 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 1t92 h ASP 39 Cb 0.13 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1t92 h ASP 39 CO -0.16 0.80 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.90 1t92 h LEU 40 N 0.77 0.69 -0.57 1.55 3.38 -0.84 0.62 115.31 120.90 1t92 h LEU 40 Ca 0.18 -0.23 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 1t92 h LEU 40 Cb 0.28 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1t92 h LEU 40 CO -0.01 0.88 -0.44 0.58 0.09 0.00 0.00 178.44 179.55 1t92 h VAL 41 N 0.61 1.30 -0.61 1.22 2.07 -0.96 -0.45 116.25 119.42 1t92 h VAL 41 Ca 0.09 -1.62 -0.10 0.00 0.82 0.00 0.00 66.70 65.89 1t92 h VAL 41 Cb 0.66 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 1t92 h VAL 41 CO 0.05 0.52 0.01 0.00 0.02 0.00 0.00 177.57 178.16 1t92 h ALA 42 N 1.00 0.82 -0.57 1.67 0.00 -0.75 -0.49 119.26 120.93 1t92 h ALA 42 Ca 0.04 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1t92 h ALA 42 Cb 0.97 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1t92 h ALA 42 CO 0.09 0.66 0.13 -0.07 0.00 0.00 0.00 179.25 180.06 1t92 h LEU 43 N 0.98 0.87 -0.50 0.00 3.38 -0.80 -1.78 115.31 117.47 1t92 h LEU 43 Ca 0.17 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 57.98 1t92 h LEU 43 Cb 0.55 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.01 1t92 h LEU 43 CO 0.03 0.89 0.14 -0.08 0.09 0.00 0.00 178.44 179.50 1t92 h GLU 44 N 0.82 0.28 -0.30 1.13 4.81 -0.62 0.96 114.58 121.67 1t92 h GLU 44 Ca 0.18 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1t92 h GLU 44 Cb 0.36 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1t92 h GLU 44 CO 0.00 0.19 0.18 0.78 -0.73 0.00 0.00 179.01 179.43 1t92 h GLY 45 N 0.29 0.41 1.00 1.92 0.00 -0.76 -0.04 103.07 105.90 1t92 h GLY 45 Ca 0.24 -0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.44 1t92 h GLY 45 CO -0.28 0.12 0.43 0.00 0.00 0.00 0.00 176.54 176.81 1t92 h ALA 46 N 1.13 0.88 -0.86 3.60 0.00 -0.89 -0.39 119.26 122.73 1t92 h ALA 46 Ca 0.12 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1t92 h ALA 46 Cb -0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 1t92 h ALA 46 CO -0.05 0.34 0.43 -0.07 0.00 0.00 0.00 179.25 179.90 1t92 h LEU 47 N 0.94 1.10 -0.73 0.00 3.38 -0.51 -0.89 115.31 118.60 1t92 h LEU 47 Ca 0.25 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 1t92 h LEU 47 Cb -0.06 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 1t92 h LEU 47 CO -0.05 0.91 -0.09 0.44 0.09 0.00 0.00 178.44 179.74 1t92 h ASP 48 N 1.21 0.87 -0.54 -0.43 3.32 -0.48 -0.57 116.42 119.81 1t92 h ASP 48 Ca 0.30 -0.26 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 1t92 h ASP 48 Cb 0.09 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1t92 h ASP 48 CO -0.04 0.98 0.08 0.24 -1.72 0.00 0.00 179.24 178.78 1t92 h MET 49 N 0.80 0.94 -0.57 3.56 2.86 -0.58 -0.55 114.93 121.39 1t92 h MET 49 Ca 0.13 -0.24 0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1t92 h MET 49 Cb 0.60 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.12 1t92 h MET 49 CO 0.04 0.89 0.38 -0.92 1.06 0.00 0.00 176.91 178.35 1t92 h TYR 50 N 0.89 0.72 -0.28 -0.22 3.20 -0.78 -2.60 116.97 117.90 1t92 h TYR 50 Ca 0.18 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.98 1t92 h TYR 50 Cb 0.41 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 1t92 h TYR 50 CO 0.03 0.45 -0.18 -0.22 -1.64 0.00 0.00 178.16 176.60 1t92 h LYS 51 N 0.78 0.50 -0.52 1.82 3.64 -0.67 -1.52 116.57 120.59 1t92 h LYS 51 Ca 0.21 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1t92 h LYS 51 Cb -0.09 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 1t92 h LYS 51 CO -0.05 0.66 0.28 -0.07 -2.27 0.00 0.00 179.45 178.01 1t92 h LEU 52 N 0.45 0.62 0.00 5.20 3.38 -0.73 0.26 115.31 124.50 1t92 h LEU 52 Ca 0.08 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1t92 h LEU 52 Cb 0.58 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1t92 h LEU 52 CO 0.04 0.50 -0.31 0.44 0.09 0.00 0.00 178.44 179.21 1t92 h ASP 53 N 0.71 0.00 0.00 -0.43 3.32 -1.16 -3.39 116.42 115.48 1t92 h ASP 53 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1t92 h ASP 53 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1t92 h ASP 53 CO -0.03 0.14 0.00 0.59 -1.72 0.00 0.00 179.24 178.22 1t92 n ASN 54 N -3.06 0.23 0.00 6.45 3.02 -0.63 -4.69 115.26 116.58 1t92 n ASN 54 Ca 0.02 -0.58 0.00 0.00 -0.03 0.00 0.00 54.58 54.00 1t92 n ASN 54 Cb 0.59 0.59 0.00 0.00 -0.61 0.00 0.00 39.78 40.35 1t92 n ASN 54 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1t92 n SER 55 N -0.59 0.00 -3.73 6.41 3.41 0.90 -4.95 113.62 115.07 1t92 n SER 55 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 1t92 n SER 55 Cb 0.01 -1.06 -0.06 0.00 -0.26 0.00 0.00 64.21 62.84 1t92 n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t92 s ARG 56 N -0.39 0.93 0.74 4.33 1.70 -1.25 -5.02 118.95 119.98 1t92 s ARG 56 Ca 0.00 -0.72 -0.11 0.00 -0.47 0.00 0.00 55.73 54.44 1t92 s ARG 56 Cb 0.00 0.40 0.03 0.00 -0.57 0.00 0.00 34.95 34.81 1t92 s ARG 56 CO 0.00 -0.33 1.08 0.71 -1.08 0.00 0.00 175.30 175.68 1t92 s TYR 57 N -3.45 2.85 0.54 5.89 1.51 -1.26 -4.10 117.35 119.32 1t92 s TYR 57 Ca 0.01 1.47 -0.21 0.00 -1.01 0.00 0.00 57.07 57.33 1t92 s TYR 57 Cb 0.02 -2.97 -0.06 0.00 -0.11 0.00 0.00 41.96 38.85 1t92 s TYR 57 CO -0.09 -1.52 1.23 -2.30 -1.11 0.00 0.00 175.55 171.75 1t92 n PRO 58 N -3.33 1.47 -1.93 -1.71 -0.02 -1.26 -4.99 135.00 123.23 1t92 n PRO 58 Ca 0.08 0.54 -0.30 0.00 -2.02 0.00 0.00 63.50 61.81 1t92 n PRO 58 Cb 0.53 -2.41 0.05 0.00 -0.02 0.00 0.00 33.50 31.65 1t92 n PRO 58 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1t92 s THR 59 N -1.33 3.37 0.27 3.45 -4.23 -1.26 -4.74 115.64 111.16 1t92 s THR 59 Ca 0.71 0.40 -0.00 0.00 -1.18 0.00 0.00 61.69 61.62 1t92 s THR 59 Cb -0.44 -3.43 0.26 0.00 1.34 0.00 0.00 72.50 70.23 1t92 s THR 59 CO 0.50 -0.56 1.82 0.74 -0.54 0.00 0.00 174.62 176.57 1t92 h THR 60 N -0.65 0.89 -0.64 3.99 2.02 -0.87 0.28 112.91 117.93 1t92 h THR 60 Ca -0.45 -0.31 0.07 0.00 0.77 0.00 0.00 66.41 66.49 1t92 h THR 60 Cb 1.26 -0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 67.53 1t92 h THR 60 CO 0.64 0.16 0.32 -0.08 0.37 0.00 0.00 175.52 176.93 1t92 h GLU 61 N 0.89 0.57 -0.37 6.66 4.81 -1.92 -1.75 114.58 123.47 1t92 h GLU 61 Ca 0.47 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.52 1t92 h GLU 61 Cb 0.48 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1t92 h GLU 61 CO -0.27 0.37 -0.35 1.96 -0.73 0.00 0.00 179.01 180.00 1t92 h GLN 62 N 0.58 0.84 -0.75 1.92 4.20 -1.65 -3.49 115.11 116.77 1t92 h GLN 62 Ca 0.30 -0.42 0.09 0.00 0.06 0.00 0.00 58.65 58.68 1t92 h GLN 62 Cb 0.25 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1t92 h GLN 62 CO -0.22 1.05 -0.16 0.41 -0.67 0.00 0.00 178.83 179.25 1t92 n GLY 63 N 0.02 -1.71 0.32 3.46 0.00 0.88 -3.78 105.19 104.38 1t92 n GLY 63 Ca -0.01 -1.43 0.21 0.00 0.00 0.00 0.00 46.02 44.78 1t92 n GLY 63 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1t92 h LEU 64 N -0.31 0.00 -2.15 0.99 3.38 -1.87 -1.89 115.31 113.46 1t92 h LEU 64 Ca -0.00 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1t92 h LEU 64 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1t92 h LEU 64 CO 0.01 0.00 0.23 1.56 0.09 0.00 0.00 178.44 180.33 1t92 h GLN 65 N 0.00 0.00 0.00 1.13 1.08 -1.95 0.00 115.11 115.38 1t92 h GLN 65 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1t92 h GLN 65 Cb 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 1t92 h GLN 65 CO 0.00 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.88 1t92 h ALA 66 N 1.77 1.00 0.00 3.87 0.00 -1.43 -0.44 119.26 124.03 1t92 h ALA 66 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1t92 h ALA 66 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1t92 h ALA 66 CO -0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1t92 n LEU 67 N -2.63 0.78 -0.04 0.00 4.77 -0.01 -4.11 117.00 115.76 1t92 n LEU 67 Ca -0.00 0.57 -0.04 0.00 -0.03 0.00 0.00 56.01 56.51 1t92 n LEU 67 Cb 0.16 -0.33 -0.07 0.00 -2.33 0.00 0.00 43.42 40.85 1t92 n LEU 67 CO 0.19 -0.17 -0.78 1.33 -1.33 0.00 0.00 177.39 176.62 1t92 n VAL 68 N -2.23 0.58 -3.86 4.08 0.24 -0.25 -0.28 118.33 116.61 1t92 n VAL 68 Ca 0.06 -0.37 -0.12 0.00 -2.04 0.00 0.00 64.34 61.87 1t92 n VAL 68 Cb 0.43 -0.72 -0.12 0.00 -1.47 0.00 0.00 33.84 31.95 1t92 n VAL 68 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1t92 s SER 69 N -4.05 -0.03 0.12 -1.34 0.15 -0.77 -4.32 113.70 103.47 1t92 s SER 69 Ca -0.04 0.01 -0.35 0.00 0.70 0.00 0.00 55.95 56.26 1t92 s SER 69 Cb 0.03 0.20 -0.15 0.00 -1.71 0.00 0.00 66.02 64.39 1t92 s SER 69 CO 0.36 -0.16 1.49 0.00 1.20 0.00 0.00 173.24 176.13 1t92 n ALA 70 N 2.40 0.39 -1.98 5.45 0.00 -1.26 -4.18 120.51 121.33 1t92 n ALA 70 Ca -0.17 0.47 -0.42 0.00 0.00 0.00 0.00 53.44 53.33 1t92 n ALA 70 Cb 0.58 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.76 1t92 n ALA 70 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1t92 s PRO 71 N 0.82 4.32 0.16 0.00 0.04 -1.26 -4.92 135.00 134.16 1t92 s PRO 71 Ca 0.82 2.16 -0.11 0.00 0.04 0.00 0.00 61.00 63.91 1t92 s PRO 71 Cb -0.80 -3.17 0.03 0.00 0.04 0.00 0.00 34.50 30.60 1t92 s PRO 71 CO 0.42 -0.37 1.59 1.03 0.04 0.00 0.00 177.00 179.72 1t92 h SER 72 N 5.59 0.96 -3.89 6.66 0.87 -1.95 -3.43 113.55 118.37 1t92 h SER 72 Ca -0.45 -0.34 -0.48 0.00 -1.23 0.00 0.00 61.79 59.30 1t92 h SER 72 Cb 1.21 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.91 1t92 h SER 72 CO 0.80 1.07 0.39 0.00 -0.53 0.00 0.00 176.83 178.56 1t92 s ALA 73 N -4.90 3.21 0.69 6.23 0.00 -1.26 -4.97 121.76 120.76 1t92 s ALA 73 Ca -0.12 0.65 -0.14 0.00 0.00 0.00 0.00 51.96 52.35 1t92 s ALA 73 Cb 0.12 -3.24 0.02 0.00 0.00 0.00 0.00 23.12 20.02 1t92 s ALA 73 CO 0.85 -0.00 1.12 -1.21 0.00 0.00 0.00 175.76 176.52 1t92 s GLU 74 N -2.03 2.57 0.11 0.00 2.02 -1.26 -4.16 118.70 115.94 1t92 s GLU 74 Ca 0.51 1.42 -0.30 0.00 0.02 0.00 0.00 54.97 56.62 1t92 s GLU 74 Cb -0.22 -1.92 -0.06 0.00 0.10 0.00 0.00 34.13 32.03 1t92 s GLU 74 CO 0.28 -1.43 1.08 -1.25 0.02 0.00 0.00 175.26 173.96 1t92 s PRO 75 N -4.19 4.56 0.53 0.39 0.04 -1.26 -4.94 135.00 130.13 1t92 s PRO 75 Ca 0.67 1.64 -0.20 0.00 0.04 0.00 0.00 61.00 63.15 1t92 s PRO 75 Cb -0.21 -3.34 -0.06 0.00 0.04 0.00 0.00 34.50 30.92 1t92 s PRO 75 CO 0.44 -0.01 1.12 -1.01 0.04 0.00 0.00 177.00 177.58 1t92 s HIS 76 N 0.35 2.73 0.46 0.56 3.76 -1.26 -4.99 115.29 116.89 1t92 s HIS 76 Ca 0.52 1.55 -0.22 0.00 -0.15 0.00 0.00 55.06 56.76 1t92 s HIS 76 Cb -0.27 -3.26 -0.08 0.00 1.11 0.00 0.00 32.58 30.07 1t92 s HIS 76 CO 0.31 -1.46 1.07 0.00 -0.85 0.00 0.00 174.74 173.81 1t92 s ALA 77 N -1.79 2.95 -0.18 -1.40 0.00 -1.26 -5.03 121.76 115.05 1t92 s ALA 77 Ca 0.72 0.71 -0.08 0.00 0.00 0.00 0.00 51.96 53.31 1t92 s ALA 77 Cb -0.23 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 1t92 s ALA 77 CO 0.26 -0.36 0.07 -0.98 0.00 0.00 0.00 175.76 174.74 1t92 s ARG 78 N -2.89 3.98 -0.95 0.00 1.70 -1.26 -4.59 118.95 114.93 1t92 s ARG 78 Ca 0.64 -0.33 -0.11 0.00 -0.47 0.00 0.00 55.73 55.45 1t92 s ARG 78 Cb -0.21 -3.22 0.01 0.00 -0.57 0.00 0.00 34.95 30.96 1t92 s ARG 78 CO 0.25 0.29 0.67 0.09 -1.08 0.00 0.00 175.30 175.52 1t92 n ASN 79 N 3.49 -5.21 -4.74 -2.89 3.02 -1.26 -4.82 115.26 102.85 1t92 n ASN 79 Ca -0.17 -0.92 -0.41 0.00 -0.03 0.00 0.00 54.58 53.05 1t92 n ASN 79 Cb 0.52 -2.50 -0.03 0.00 -0.61 0.00 0.00 39.78 37.16 1t92 n ASN 79 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1t92 s TYR 80 N -3.19 3.20 0.51 3.10 5.04 -1.26 -4.93 117.35 119.82 1t92 s TYR 80 Ca 0.19 1.16 -0.20 0.00 -2.44 0.00 0.00 57.07 55.79 1t92 s TYR 80 Cb -0.09 -3.66 -0.07 0.00 0.35 0.00 0.00 41.96 38.49 1t92 s TYR 80 CO 0.89 -2.11 1.07 -1.25 -1.34 0.00 0.00 175.55 172.81 1t92 s PRO 81 N -0.12 3.62 0.01 4.97 0.04 -1.26 -4.94 135.00 137.32 1t92 s PRO 81 Ca 0.58 1.42 -0.34 0.00 0.04 0.00 0.00 61.00 62.69 1t92 s PRO 81 Cb -0.38 -2.06 -0.13 0.00 0.04 0.00 0.00 34.50 31.97 1t92 s PRO 81 CO 0.39 -0.59 1.74 -1.91 0.04 0.00 0.00 177.00 176.67 1t92 n GLU 82 N -1.18 2.12 -0.94 4.56 4.07 -1.26 -1.00 120.64 127.01 1t92 n GLU 82 Ca 0.10 0.77 0.00 0.00 -0.06 0.00 0.00 57.16 57.97 1t92 n GLU 82 Cb 0.52 -2.58 0.00 0.00 -0.06 0.00 0.00 31.44 29.32 1t92 n GLU 82 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1t92 n GLY 83 N 3.95 0.88 7.00 8.31 0.00 -1.26 -4.90 105.19 119.17 1t92 n GLY 83 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1t92 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t92 n GLY 84 N -2.19 0.97 0.06 -0.02 0.00 -0.17 -4.16 105.19 99.69 1t92 n GLY 84 Ca 0.00 -0.73 0.03 0.00 0.00 0.00 0.00 46.02 45.33 1t92 n GLY 84 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1t92 n TYR 85 N 4.35 0.00 -3.71 1.61 4.02 0.61 -4.76 117.16 119.28 1t92 n TYR 85 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.75 1t92 n TYR 85 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.23 1t92 n TYR 85 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 1t92 s ILE 86 N -1.45 0.01 0.13 -0.72 2.07 -1.13 -4.68 121.20 115.43 1t92 s ILE 86 Ca 0.04 -0.11 -0.25 0.00 -1.41 0.00 0.00 60.65 58.92 1t92 s ILE 86 Cb 0.06 -0.67 -0.04 0.00 0.13 0.00 0.00 42.46 41.93 1t92 s ILE 86 CO 0.25 -0.06 1.64 -0.09 -1.91 0.00 0.00 174.94 174.76 1t92 h ARG 87 N 4.81 -0.36 -3.53 3.50 2.43 -1.91 -3.43 114.38 115.89 1t92 h ARG 87 Ca -0.28 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 58.85 1t92 h ARG 87 Cb 1.17 0.08 -0.13 0.00 -0.42 0.00 0.00 29.97 30.67 1t92 h ARG 87 CO 0.28 -0.24 -0.18 -0.98 -1.51 0.00 0.00 179.97 177.34 1t92 s ARG 88 N -6.07 0.98 0.05 0.20 1.70 -1.26 -5.04 118.95 109.50 1t92 s ARG 88 Ca -0.15 -0.79 -0.30 0.00 -0.47 0.00 0.00 55.73 54.02 1t92 s ARG 88 Cb 0.09 0.42 -0.05 0.00 -0.57 0.00 0.00 34.95 34.84 1t92 s ARG 88 CO 0.66 -0.36 1.14 -0.51 -1.08 0.00 0.00 175.30 175.16 1t92 s LEU 89 N -2.79 4.37 0.69 -1.89 1.43 -1.26 -5.04 118.68 114.19 1t92 s LEU 89 Ca 0.03 1.93 -0.11 0.00 -1.03 0.00 0.00 54.13 54.95 1t92 s LEU 89 Cb 0.03 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.68 1t92 s LEU 89 CO -0.11 -0.42 1.06 -2.16 0.23 0.00 0.00 176.35 174.95 1t92 s PRO 90 N 1.04 2.99 0.24 1.29 0.04 -1.26 -5.09 135.00 134.25 1t92 s PRO 90 Ca 0.57 0.87 0.10 0.00 0.04 0.00 0.00 61.00 62.58 1t92 s PRO 90 Cb -0.27 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 1t92 s PRO 90 CO 0.29 -1.04 -0.07 -0.65 0.04 0.00 0.00 177.00 175.56 1t92 s GLN 91 N -5.09 2.09 0.92 4.56 -0.21 -1.26 -4.49 119.66 116.18 1t92 s GLN 91 Ca 0.58 -1.45 -0.12 0.00 0.02 0.00 0.00 55.36 54.39 1t92 s GLN 91 Cb -0.13 -2.08 0.14 0.00 1.00 0.00 0.00 33.01 31.94 1t92 s GLN 91 CO 0.55 0.38 1.12 0.16 -2.12 0.00 0.00 175.29 175.37 1t92 s ASP 92 N -3.39 3.37 0.31 5.90 1.47 -0.09 -4.90 116.67 119.35 1t92 s ASP 92 Ca 0.29 1.10 0.22 0.00 1.18 0.00 0.00 52.55 55.34 1t92 s ASP 92 Cb -0.07 -1.73 1.15 0.00 -0.34 0.00 0.00 42.92 41.93 1t92 s ASP 92 CO 0.17 -2.65 1.66 -2.65 0.68 0.00 0.00 175.17 172.39 1t92 n PRO 93 N -3.85 0.14 -0.33 2.11 -0.02 -1.26 -1.44 135.00 130.35 1t92 n PRO 93 Ca 0.06 0.62 0.07 0.00 -2.02 0.00 0.00 63.50 62.23 1t92 n PRO 93 Cb 0.58 -1.95 0.21 0.00 -0.02 0.00 0.00 33.50 32.32 1t92 n PRO 93 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1t92 n TRP 94 N -2.26 0.74 -0.91 6.00 8.01 -1.26 -4.96 117.44 122.80 1t92 n TRP 94 Ca -0.01 -0.72 0.00 0.00 -1.31 0.00 0.00 57.50 55.46 1t92 n TRP 94 Cb 0.05 -0.20 0.00 0.00 -2.01 0.00 0.00 31.31 29.16 1t92 n TRP 94 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1t92 n GLY 95 N -0.08 0.52 3.88 6.99 0.00 -0.52 -5.04 105.19 110.93 1t92 n GLY 95 Ca 0.17 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 1t92 n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t92 s SER 96 N -2.20 6.53 0.60 1.61 0.01 -1.26 -4.87 113.70 114.11 1t92 s SER 96 Ca 0.00 0.61 -0.19 0.00 1.31 0.00 0.00 55.95 57.68 1t92 s SER 96 Cb 0.00 -2.11 -0.03 0.00 0.21 0.00 0.00 66.02 64.09 1t92 s SER 96 CO 0.00 0.25 1.23 -1.81 0.41 0.00 0.00 173.24 173.32 1t92 s ASP 97 N -1.66 5.10 0.71 2.44 1.01 -1.26 -0.91 116.67 122.11 1t92 s ASP 97 Ca 0.28 2.45 -0.12 0.00 0.71 0.00 0.00 52.55 55.86 1t92 s ASP 97 Cb -0.13 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.22 1t92 s ASP 97 CO 0.16 -1.66 1.09 -0.31 0.21 0.00 0.00 175.17 174.66 1t92 s TYR 98 N -1.54 2.69 0.06 4.23 1.51 -1.26 -4.73 117.35 118.32 1t92 s TYR 98 Ca 0.78 1.53 0.06 0.00 -1.01 0.00 0.00 57.07 58.43 1t92 s TYR 98 Cb -0.32 -3.06 -0.03 0.00 -0.11 0.00 0.00 41.96 38.44 1t92 s TYR 98 CO 0.35 -1.64 -0.17 -0.65 -1.11 0.00 0.00 175.55 172.34 1t92 s GLN 99 N -4.58 1.02 -0.11 -0.62 -1.52 -0.21 -4.96 119.66 108.68 1t92 s GLN 99 Ca 0.63 -0.93 0.03 0.00 -1.95 0.00 0.00 55.36 53.13 1t92 s GLN 99 Cb -0.18 -1.10 -0.00 0.00 -0.22 0.00 0.00 33.01 31.50 1t92 s GLN 99 CO 0.49 0.26 -0.20 -1.17 -0.25 0.00 0.00 175.29 174.42 1t92 s LEU 100 N -1.48 2.28 -0.36 2.90 2.96 -1.26 -0.96 118.68 122.76 1t92 s LEU 100 Ca 0.03 -0.50 -0.06 0.00 -0.22 0.00 0.00 54.13 53.38 1t92 s LEU 100 Cb -0.09 -1.47 0.06 0.00 0.50 0.00 0.00 46.19 45.18 1t92 s LEU 100 CO 0.02 0.15 0.13 -0.76 -1.32 0.00 0.00 176.35 174.57 1t92 s LEU 101 N 0.41 4.53 -0.23 -0.68 1.43 -0.06 -4.56 118.68 119.51 1t92 s LEU 101 Ca -0.15 -1.33 -0.16 0.00 -1.03 0.00 0.00 54.13 51.46 1t92 s LEU 101 Cb -0.17 -1.87 0.07 0.00 0.03 0.00 0.00 46.19 44.25 1t92 s LEU 101 CO 0.07 -0.38 0.59 -0.55 0.23 0.00 0.00 176.35 176.31 1t92 s SER 102 N 1.57 -0.73 0.00 2.29 0.15 -1.26 -1.87 113.70 113.85 1t92 s SER 102 Ca -0.00 1.26 0.18 0.00 0.70 0.00 0.00 55.95 58.09 1t92 s SER 102 Cb -0.21 1.19 0.79 0.00 -1.71 0.00 0.00 66.02 66.08 1t92 s SER 102 CO 0.01 -0.22 1.57 -0.81 1.20 0.00 0.00 173.24 174.99 1t92 n PRO 103 N 3.69 0.04 0.00 5.44 -0.04 -1.26 -0.26 135.00 142.61 1t92 n PRO 103 Ca -0.18 0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1t92 n PRO 103 Cb 0.57 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 1t92 n PRO 103 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1t92 n GLY 104 N 0.33 -0.61 3.72 0.55 0.00 -1.26 -2.87 105.19 105.05 1t92 n GLY 104 Ca 0.05 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 1t92 n GLY 104 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1t92 s GLN 105 N -2.34 4.34 -1.82 1.61 0.74 -1.26 -2.59 119.66 118.35 1t92 s GLN 105 Ca 0.00 2.04 0.00 0.00 0.05 0.00 0.00 55.36 57.45 1t92 s GLN 105 Cb 0.00 -3.25 0.00 0.00 1.10 0.00 0.00 33.01 30.86 1t92 s GLN 105 CO 0.00 -0.39 0.00 0.72 -0.55 0.00 0.00 175.29 175.07 1t92 n HIS 106 N 3.76 -0.58 -1.38 1.67 8.25 -1.26 -2.15 115.22 123.53 1t92 n HIS 106 Ca 0.10 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.43 1t92 n HIS 106 Cb 0.43 -3.60 -0.06 0.00 1.12 0.00 0.00 29.99 27.88 1t92 n HIS 106 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1t92 n GLY 107 N -0.85 1.35 3.58 -1.41 0.00 -1.07 -4.98 105.19 101.81 1t92 n GLY 107 Ca -0.22 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 1t92 n GLY 107 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1t92 s GLN 108 N -3.03 3.80 -0.22 1.61 -0.21 -0.91 -4.85 119.66 115.85 1t92 s GLN 108 Ca 0.00 -0.10 -0.19 0.00 0.02 0.00 0.00 55.36 55.10 1t92 s GLN 108 Cb 0.00 -3.73 -0.03 0.00 1.00 0.00 0.00 33.01 30.25 1t92 s GLN 108 CO 0.00 -0.45 0.54 0.08 -2.12 0.00 0.00 175.29 173.34 1t92 s VAL 109 N 2.18 5.07 0.16 1.09 1.01 -1.25 -4.21 120.40 124.45 1t92 s VAL 109 Ca 0.16 0.98 0.11 0.00 0.00 0.00 0.00 61.98 63.23 1t92 s VAL 109 Cb -0.16 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 1t92 s VAL 109 CO 0.11 0.13 -0.23 -1.81 0.00 0.00 0.00 175.10 173.30 1t92 s ASP 110 N 1.29 3.51 -0.05 3.32 1.01 -0.78 -1.10 116.67 123.87 1t92 s ASP 110 Ca 0.24 -0.77 0.03 0.00 0.71 0.00 0.00 52.55 52.76 1t92 s ASP 110 Cb -0.16 -0.31 0.01 0.00 1.01 0.00 0.00 42.92 43.47 1t92 s ASP 110 CO 0.09 0.15 -0.13 -0.63 0.21 0.00 0.00 175.17 174.86 1t92 s ILE 111 N -1.42 1.14 0.09 0.77 1.01 -0.60 -0.88 121.20 121.30 1t92 s ILE 111 Ca 0.19 -0.52 -0.06 0.00 0.00 0.00 0.00 60.65 60.25 1t92 s ILE 111 Cb -0.09 -1.01 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 1t92 s ILE 111 CO 0.09 0.35 0.13 0.72 0.00 0.00 0.00 174.94 176.23 1t92 s PHE 112 N 0.35 0.29 -0.06 3.97 -0.12 -0.13 -0.49 117.98 121.79 1t92 s PHE 112 Ca -0.08 -0.75 -0.03 0.00 -0.05 0.00 0.00 56.93 56.01 1t92 s PHE 112 Cb -0.13 -0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.06 1t92 s PHE 112 CO 0.02 -0.51 0.09 0.45 -0.05 0.00 0.00 175.22 175.23 1t92 s SER 113 N -2.89 5.89 0.54 1.98 0.15 -0.18 -1.04 113.70 118.15 1t92 s SER 113 Ca 0.07 0.28 0.33 0.00 0.70 0.00 0.00 55.95 57.33 1t92 s SER 113 Cb 0.06 -1.78 1.36 0.00 -1.71 0.00 0.00 66.02 63.95 1t92 s SER 113 CO -0.09 0.34 1.98 -0.07 1.20 0.00 0.00 173.24 176.59 1t92 h LEU 114 N 4.61 0.00 -0.01 3.45 3.38 -1.86 -0.01 115.31 124.85 1t92 h LEU 114 Ca -0.51 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.47 1t92 h LEU 114 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1t92 h LEU 114 CO 0.60 0.00 -0.03 0.61 0.09 0.00 0.00 178.44 179.71 1t92 n GLY 115 N 0.03 -1.91 0.22 0.83 0.00 -1.26 -2.53 105.19 100.57 1t92 n GLY 115 Ca 0.01 -1.49 0.09 0.00 0.00 0.00 0.00 46.02 44.63 1t92 n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t92 h PRO 116 N -0.05 0.00 0.00 1.61 0.13 -1.96 -3.32 132.00 128.42 1t92 h PRO 116 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1t92 h PRO 116 Cb 0.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1t92 h PRO 116 CO 0.00 0.24 -0.00 -0.40 -0.23 0.00 0.00 178.00 177.61 1t92 n ASP 117 N -3.46 1.87 -0.64 1.44 5.75 -1.26 -4.99 116.55 115.26 1t92 n ASP 117 Ca -0.00 -1.98 -0.07 0.00 -0.01 0.00 0.00 54.79 52.73 1t92 n ASP 117 Cb 0.42 -0.02 -0.02 0.00 -1.03 0.00 0.00 41.12 40.47 1t92 n ASP 117 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1t92 n GLY 118 N -0.51 0.49 3.14 6.12 0.00 -1.05 -4.98 105.19 108.40 1t92 n GLY 118 Ca 0.01 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 1t92 n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t92 s VAL 119 N -2.29 3.64 0.49 1.61 1.01 -1.06 -4.99 120.40 118.80 1t92 s VAL 119 Ca 0.00 -2.24 -0.24 0.00 0.00 0.00 0.00 61.98 59.50 1t92 s VAL 119 Cb 0.00 -3.43 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 1t92 s VAL 119 CO 0.00 -0.77 1.36 -2.84 0.00 0.00 0.00 175.10 172.85 1t92 s PRO 120 N 0.85 3.49 -0.30 2.72 0.02 -1.24 -4.37 135.00 136.17 1t92 s PRO 120 Ca 0.10 2.25 -0.07 0.00 0.02 0.00 0.00 61.00 63.30 1t92 s PRO 120 Cb -0.23 -2.47 0.01 0.00 0.02 0.00 0.00 34.50 31.84 1t92 s PRO 120 CO -0.03 -0.91 0.08 -2.00 -0.33 0.00 0.00 177.00 173.81 1t92 s GLU 121 N -2.64 3.01 -0.10 5.54 2.56 -0.02 -4.98 118.70 122.07 1t92 s GLU 121 Ca 0.65 -0.91 0.03 0.00 0.00 0.00 0.00 54.97 54.74 1t92 s GLU 121 Cb -0.40 -3.38 0.01 0.00 2.00 0.00 0.00 34.13 32.36 1t92 s GLU 121 CO 0.50 -0.48 -0.18 0.45 -0.56 0.00 0.00 175.26 174.99 1t92 s SER 122 N 1.48 2.59 -0.47 -1.70 0.15 -1.26 -1.01 113.70 113.48 1t92 s SER 122 Ca 0.02 -0.47 -0.20 0.00 0.70 0.00 0.00 55.95 56.00 1t92 s SER 122 Cb -0.17 -1.18 0.04 0.00 -1.71 0.00 0.00 66.02 62.99 1t92 s SER 122 CO 0.02 0.07 0.66 0.21 1.20 0.00 0.00 173.24 175.41 1t92 s ASN 123 N 0.69 6.29 0.00 5.45 2.47 0.35 -4.97 114.94 125.23 1t92 s ASN 123 Ca -0.12 -0.52 -0.01 0.00 0.42 0.00 0.00 52.86 52.63 1t92 s ASN 123 Cb -0.16 -2.32 -0.04 0.00 -1.45 0.00 0.00 41.25 37.28 1t92 s ASN 123 CO 0.03 -0.85 0.14 -1.81 -3.72 0.00 0.00 177.10 170.89 1t92 s ASP 124 N 2.27 6.08 -1.25 -4.21 1.01 -1.26 -1.56 116.67 117.75 1t92 s ASP 124 Ca 0.21 0.25 -0.02 0.00 0.71 0.00 0.00 52.55 53.70 1t92 s ASP 124 Cb -0.15 -1.84 -0.01 0.00 1.01 0.00 0.00 42.92 41.93 1t92 s ASP 124 CO 0.17 0.25 0.79 -0.67 0.21 0.00 0.00 175.17 175.92 1t92 n ASP 125 N 0.95 -2.02 0.31 0.27 2.03 -0.32 -4.85 116.55 112.91 1t92 n ASP 125 Ca -0.11 -0.78 0.20 0.00 0.52 0.00 0.00 54.79 54.63 1t92 n ASP 125 Cb 0.52 -4.36 1.00 0.00 -0.72 0.00 0.00 41.12 37.56 1t92 n ASP 125 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 1t92 h ILE 126 N -1.82 0.00 -0.00 5.18 3.07 -1.38 -1.99 117.51 120.58 1t92 h ILE 126 Ca -0.61 -0.17 0.00 0.00 1.55 0.00 0.00 64.86 65.63 1t92 h ILE 126 Cb 1.35 1.15 0.00 0.00 -0.27 0.00 0.00 36.82 39.05 1t92 h ILE 126 CO 0.53 0.00 -0.01 0.61 -1.05 0.00 0.00 178.15 178.24 1t92 n GLY 127 N -0.69 -0.90 3.57 0.16 0.00 -1.26 -4.66 105.19 101.41 1t92 n GLY 127 Ca -0.02 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 1t92 n GLY 127 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1t92 s ASN 128 N -2.08 5.28 0.12 1.61 3.84 -0.75 -4.88 114.94 118.08 1t92 s ASN 128 Ca 0.44 -1.29 0.07 0.00 0.21 0.00 0.00 52.86 52.29 1t92 s ASN 128 Cb 0.22 -2.58 -0.04 0.00 -0.55 0.00 0.00 41.25 38.30 1t92 s ASN 128 CO 0.38 -2.72 -0.17 0.26 -2.79 0.00 0.00 177.10 172.06 1t92 s TRP 129 N 9.83 1.56 0.12 0.43 0.52 -1.26 -5.16 118.94 124.99 1t92 s TRP 129 Ca 0.67 -0.49 0.06 0.00 0.02 0.00 0.00 56.10 56.36 1t92 s TRP 129 Cb -0.03 -0.82 -0.04 0.00 -1.15 0.00 0.00 33.47 31.43 1t92 s TRP 129 CO 0.06 0.19 -0.14 0.95 0.02 0.00 0.00 176.95 178.03 1t92 s THR 130 N -1.77 1.33 -0.22 2.01 -4.23 -1.26 -5.12 115.64 106.38 1t92 s THR 130 Ca 0.08 -1.74 -0.02 0.00 -1.18 0.00 0.00 61.69 58.83 1t92 s THR 130 Cb -0.07 -1.55 0.01 0.00 1.34 0.00 0.00 72.50 72.22 1t92 s THR 130 CO 0.04 -0.43 -0.09 -0.63 -0.54 0.00 0.00 174.62 172.97 1t92 s ILE 131 N -2.20 2.89 0.00 2.99 -1.09 -1.26 -5.03 121.20 117.50 1t92 s ILE 131 Ca 0.09 -0.76 0.00 0.00 -2.23 0.00 0.00 60.65 57.76 1t92 s ILE 131 Cb -0.05 -2.34 0.00 0.00 -1.58 0.00 0.00 42.46 38.50 1t92 s ILE 131 CO 0.03 0.39 0.00 0.61 -1.23 0.00 0.00 174.94 174.74 1t92 n GLY 132 N 4.72 -0.12 0.53 6.18 0.00 -1.26 -5.37 105.19 109.86 1t92 n GLY 132 Ca -0.18 -1.65 0.07 0.00 0.00 0.00 0.00 46.02 44.25 1t92 n GLY 132 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01