#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y77 n GLN 3 N 0.00 0.00 -2.18 -1.24 10.64 -1.26 -4.26 117.38 119.08 1y77 n GLN 3 Ca 0.00 0.00 -0.38 0.00 -1.83 0.00 0.00 57.00 54.79 1y77 n GLN 3 Cb 0.00 0.00 0.03 0.00 -0.86 0.00 0.00 30.24 29.41 1y77 n GLN 3 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1y77 n GLU 4 N -0.30 3.39 0.00 2.61 -0.58 -1.26 -4.07 120.64 120.43 1y77 n GLU 4 Ca 0.00 -3.93 0.00 0.00 -0.42 0.00 0.00 57.16 52.81 1y77 n GLU 4 Cb 0.00 -2.31 0.00 0.00 -0.57 0.00 0.00 31.44 28.56 1y77 n GLU 4 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1y77 n ASN 5 N -0.43 2.56 0.30 1.62 2.85 -1.26 -4.45 115.26 116.45 1y77 n ASN 5 Ca 0.50 0.00 0.20 0.00 -0.11 0.00 0.00 54.58 55.17 1y77 n ASN 5 Cb 0.30 0.34 1.05 0.00 1.24 0.00 0.00 39.78 42.72 1y77 n ASN 5 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1y77 h GLU 6 N 0.00 0.00 0.00 1.20 4.57 -1.74 -0.12 114.58 118.49 1y77 h GLU 6 Ca 0.00 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.06 1y77 h GLU 6 Cb 0.34 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 1y77 h GLU 6 CO 0.00 0.00 -2.03 2.89 -1.18 0.00 0.00 179.01 178.69 1y77 n ARG 7 N -2.92 0.66 0.00 1.92 1.85 -1.26 -3.50 116.66 113.41 1y77 n ARG 7 Ca -0.02 -0.10 0.14 0.00 -1.00 0.00 0.00 57.85 56.86 1y77 n ARG 7 Cb 0.09 -1.55 0.71 0.00 -1.05 0.00 0.00 32.46 30.66 1y77 n ARG 7 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1y77 n ASN 8 N -2.47 0.00 -0.12 2.89 2.85 -0.08 -2.52 115.26 115.82 1y77 n ASN 8 Ca -0.13 -0.14 -0.23 0.00 -0.11 0.00 0.00 54.58 53.97 1y77 n ASN 8 Cb 0.76 -0.28 -0.09 0.00 1.24 0.00 0.00 39.78 41.42 1y77 n ASN 8 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1y77 n ILE 9 N -1.28 1.31 -0.42 -1.44 5.41 -1.09 -3.55 119.36 118.31 1y77 n ILE 9 Ca 0.14 -0.37 0.38 0.00 1.00 0.00 0.00 62.75 63.90 1y77 n ILE 9 Cb 0.22 -1.70 0.74 0.00 -0.71 0.00 0.00 39.64 38.19 1y77 n ILE 9 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 1y77 h SER 10 N -0.65 0.06 0.00 4.38 0.87 -1.58 0.84 113.55 117.46 1y77 h SER 10 Ca -0.58 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 59.95 1y77 h SER 10 Cb 1.59 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 63.56 1y77 h SER 10 CO -0.30 -0.01 -0.21 0.03 -0.53 0.00 0.00 176.83 175.82 1y77 h ARG 11 N 0.04 0.00 -0.91 2.24 3.08 -1.67 -3.08 114.38 114.07 1y77 h ARG 11 Ca 0.67 0.00 0.18 0.00 0.07 0.00 0.00 59.98 60.89 1y77 h ARG 11 Cb 2.56 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 32.53 1y77 h ARG 11 CO -0.06 0.98 0.59 1.25 -1.07 0.00 0.00 179.97 181.66 1y77 h LEU 12 N -1.00 0.57 0.11 3.04 5.85 -0.37 0.04 115.31 123.55 1y77 h LEU 12 Ca -0.06 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1y77 h LEU 12 Cb 1.03 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1y77 h LEU 12 CO -0.03 0.25 -0.12 -0.25 -0.34 0.00 0.00 178.44 177.95 1y77 h TRP 13 N 0.58 -0.33 -0.49 1.25 7.01 0.41 0.13 115.95 124.52 1y77 h TRP 13 Ca 0.48 0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.58 1y77 h TRP 13 Cb 0.94 0.13 -0.08 0.00 -2.10 0.00 0.00 29.16 28.04 1y77 h TRP 13 CO -0.00 -0.16 -0.05 0.00 -2.79 0.00 0.00 178.44 175.44 1y77 h ARG 14 N -0.23 0.06 -0.95 2.65 3.08 -1.37 0.49 114.38 118.11 1y77 h ARG 14 Ca -0.01 -0.00 0.28 0.00 0.07 0.00 0.00 59.98 60.31 1y77 h ARG 14 Cb 0.20 -0.01 -0.15 0.00 0.08 0.00 0.00 29.97 30.09 1y77 h ARG 14 CO -0.02 0.04 0.39 0.00 -1.07 0.00 0.00 179.97 179.31 1y77 h ALA 15 N 1.45 1.61 0.30 0.04 0.00 -0.75 0.11 119.26 122.02 1y77 h ALA 15 Ca 0.24 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1y77 h ALA 15 Cb 0.37 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1y77 h ALA 15 CO -0.44 -0.53 -0.14 0.35 0.00 0.00 0.00 179.25 178.48 1y77 h PHE 16 N 0.25 -0.37 -0.36 0.00 3.57 0.27 -3.04 116.94 117.26 1y77 h PHE 16 Ca 0.65 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 62.17 1y77 h PHE 16 Cb 1.41 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 40.23 1y77 h PHE 16 CO -0.15 -0.23 -0.21 -2.13 -2.23 0.00 0.00 178.31 173.36 1y77 n ARG 17 N -3.25 -0.16 -0.01 1.11 0.63 0.27 0.71 116.66 115.95 1y77 n ARG 17 Ca -0.05 0.54 -0.10 0.00 -0.92 0.00 0.00 57.85 57.32 1y77 n ARG 17 Cb 0.16 -0.79 -0.07 0.00 0.45 0.00 0.00 32.46 32.21 1y77 n ARG 17 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 1y77 h THR 18 N 0.00 0.00 -0.81 5.15 2.02 -1.32 -0.71 112.91 117.24 1y77 h THR 18 Ca 0.06 0.00 0.26 0.00 0.77 0.00 0.00 66.41 67.49 1y77 h THR 18 Cb 0.15 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.41 1y77 h THR 18 CO -0.34 0.00 0.13 0.52 0.37 0.00 0.00 175.52 176.21 1y77 n VAL 19 N -4.44 -0.34 0.08 3.16 0.31 0.22 -0.50 118.33 116.81 1y77 n VAL 19 Ca -0.04 1.76 -0.03 0.00 -0.01 0.00 0.00 64.34 66.02 1y77 n VAL 19 Cb 0.25 -2.64 -0.01 0.00 -0.91 0.00 0.00 33.84 30.52 1y77 n VAL 19 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1y77 h LYS 20 N 0.00 -0.19 -0.94 5.55 1.79 -0.72 -1.77 116.57 120.30 1y77 h LYS 20 Ca 0.55 0.01 0.13 0.00 -2.18 0.00 0.00 60.65 59.16 1y77 h LYS 20 Cb 1.24 0.04 -0.14 0.00 -1.58 0.00 0.00 32.23 31.79 1y77 h LYS 20 CO -0.73 -0.12 -0.40 0.39 -1.08 0.00 0.00 179.45 177.51 1y77 n GLU 21 N -2.55 -0.25 -0.25 3.15 1.02 0.34 0.95 120.64 123.04 1y77 n GLU 21 Ca -0.02 1.44 0.04 0.00 -0.02 0.00 0.00 57.16 58.59 1y77 n GLU 21 Cb 0.08 -2.13 0.16 0.00 -0.02 0.00 0.00 31.44 29.53 1y77 n GLU 21 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 1y77 h MET 22 N 0.00 0.47 0.00 3.49 4.05 -0.92 0.10 114.93 122.12 1y77 h MET 22 Ca 0.29 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.69 1y77 h MET 22 Cb 0.53 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.22 1y77 h MET 22 CO -0.92 0.31 0.00 0.28 0.23 0.00 0.00 176.91 176.81 1y77 h VAL 23 N 0.49 0.00 0.09 -5.77 2.07 0.15 -1.36 116.25 111.92 1y77 h VAL 23 Ca 0.38 -0.32 -0.35 0.00 0.82 0.00 0.00 66.70 67.23 1y77 h VAL 23 Cb 0.53 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1y77 h VAL 23 CO -0.35 0.00 -1.95 2.29 0.02 0.00 0.00 177.57 177.58 1y77 n LYS 24 N -3.03 0.72 0.23 1.57 2.85 0.21 -2.77 118.16 117.94 1y77 n LYS 24 Ca -0.01 0.26 0.11 0.00 -1.05 0.00 0.00 58.31 57.63 1y77 n LYS 24 Cb 0.22 -1.72 0.49 0.00 -0.65 0.00 0.00 35.03 33.37 1y77 n LYS 24 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 1y77 h ASP 25 N 0.05 0.00 0.26 -5.58 3.32 -0.98 -1.64 116.42 111.85 1y77 h ASP 25 Ca -0.40 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.61 1y77 h ASP 25 Cb 2.03 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.57 1y77 h ASP 25 CO 0.08 0.20 -0.18 0.03 -1.72 0.00 0.00 179.24 177.65 1y77 h ARG 26 N 0.00 0.00 0.00 3.56 3.08 -1.36 -3.46 114.38 116.20 1y77 h ARG 26 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1y77 h ARG 26 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 1y77 h ARG 26 CO 0.03 0.18 0.00 0.41 -1.07 0.00 0.00 179.97 179.52 1y77 n GLY 27 N -0.85 1.14 3.74 0.04 0.00 -0.63 -5.07 105.19 103.55 1y77 n GLY 27 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1y77 n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y77 s TYR 28 N -1.82 2.21 -0.15 1.61 1.51 -1.11 -3.54 117.35 116.06 1y77 s TYR 28 Ca 0.00 -0.77 -0.20 0.00 -1.01 0.00 0.00 57.07 55.09 1y77 s TYR 28 Cb 0.00 -1.79 -0.03 0.00 -0.11 0.00 0.00 41.96 40.03 1y77 s TYR 28 CO 0.00 0.19 0.58 0.12 -1.11 0.00 0.00 175.55 175.33 1y77 s PHE 29 N -2.75 3.46 -0.17 2.71 5.36 0.30 -4.47 117.98 122.41 1y77 s PHE 29 Ca 0.27 0.96 -0.29 0.00 -0.96 0.00 0.00 56.93 56.90 1y77 s PHE 29 Cb 0.04 -2.71 0.12 0.00 -0.34 0.00 0.00 43.02 40.13 1y77 s PHE 29 CO 0.14 -0.01 0.94 0.42 -1.46 0.00 0.00 175.22 175.26 1y77 s ILE 30 N 1.26 0.00 0.38 3.12 1.01 -1.26 -4.59 121.20 121.12 1y77 s ILE 30 Ca 0.29 0.00 0.03 0.00 0.00 0.00 0.00 60.65 60.97 1y77 s ILE 30 Cb -0.16 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.30 1y77 s ILE 30 CO 0.12 0.00 0.56 0.42 0.00 0.00 0.00 174.94 176.04 1y77 s THR 31 N -0.80 4.29 -0.53 2.92 -4.23 -1.26 -4.96 115.64 111.06 1y77 s THR 31 Ca -0.02 -0.69 0.25 0.00 -1.18 0.00 0.00 61.69 60.05 1y77 s THR 31 Cb -0.01 -3.55 0.31 0.00 1.34 0.00 0.00 72.50 70.59 1y77 s THR 31 CO 0.01 -0.31 1.72 -0.61 -0.54 0.00 0.00 174.62 174.89 1y77 h GLN 32 N 0.67 0.00 0.00 3.99 5.75 -2.02 -2.69 115.11 120.81 1y77 h GLN 32 Ca -0.47 0.00 -0.19 0.00 -0.15 0.00 0.00 58.65 57.84 1y77 h GLN 32 Cb 1.25 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.77 1y77 h GLN 32 CO 0.57 0.00 -0.92 0.93 -2.65 0.00 0.00 178.83 176.76 1y77 h GLU 33 N 0.00 0.00 -0.06 1.69 5.08 -1.98 -1.20 114.58 118.11 1y77 h GLU 33 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1y77 h GLU 33 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1y77 h GLU 33 CO 0.00 0.81 0.00 -1.91 -1.00 0.00 0.00 179.01 176.91 1y77 n GLU 34 N -3.28 1.26 0.02 2.33 2.13 -1.02 -3.92 120.64 118.15 1y77 n GLU 34 Ca -0.01 -0.39 -0.02 0.00 0.66 0.00 0.00 57.16 57.40 1y77 n GLU 34 Cb 0.89 -1.32 -0.01 0.00 0.27 0.00 0.00 31.44 31.27 1y77 n GLU 34 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1y77 n VAL 35 N -0.39 1.30 0.00 6.31 0.31 -1.14 -4.64 118.33 120.09 1y77 n VAL 35 Ca 0.14 0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.82 1y77 n VAL 35 Cb 0.16 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 1y77 n VAL 35 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1y77 n GLU 36 N -3.73 0.00 -1.51 5.55 1.02 -0.47 -4.70 120.64 116.80 1y77 n GLU 36 Ca -0.03 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.82 1y77 n GLU 36 Cb 0.13 -1.19 -0.19 0.00 -0.02 0.00 0.00 31.44 30.17 1y77 n GLU 36 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1y77 n LEU 37 N -0.59 -0.57 -4.29 -4.62 7.94 -1.25 -4.85 117.00 108.77 1y77 n LEU 37 Ca 0.00 -0.36 -0.33 0.00 -1.11 0.00 0.00 56.01 54.21 1y77 n LEU 37 Cb 0.00 -0.76 0.15 0.00 0.53 0.00 0.00 43.42 43.34 1y77 n LEU 37 CO 0.00 -1.27 -0.54 -0.81 -1.11 0.00 0.00 177.39 173.66 1y77 n PRO 38 N 6.82 -1.11 0.42 1.96 -0.04 -1.26 -4.83 135.00 136.95 1y77 n PRO 38 Ca 0.65 -0.30 -0.17 0.00 -0.04 0.00 0.00 63.50 63.64 1y77 n PRO 38 Cb 0.13 -1.68 -0.08 0.00 -0.04 0.00 0.00 33.50 31.83 1y77 n PRO 38 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1y77 h LEU 39 N -1.84 -0.96 0.00 1.53 5.85 -2.00 -3.13 115.31 114.76 1y77 h LEU 39 Ca -0.50 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1y77 h LEU 39 Cb 1.34 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.63 1y77 h LEU 39 CO 0.36 -0.66 0.00 1.21 -0.34 0.00 0.00 178.44 179.01 1y77 n GLU 40 N -4.98 0.00 0.00 1.25 0.00 -1.26 0.88 120.64 116.53 1y77 n GLU 40 Ca -0.13 0.54 0.00 0.00 0.00 0.00 0.00 57.16 57.57 1y77 n GLU 40 Cb 0.43 -0.88 0.00 0.00 0.00 0.00 0.00 31.44 30.99 1y77 n GLU 40 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1y77 n ASP 41 N -1.99 0.00 0.01 4.31 8.00 -1.25 -2.15 116.55 123.48 1y77 n ASP 41 Ca 0.00 0.40 -0.08 0.00 0.71 0.00 0.00 54.79 55.82 1y77 n ASP 41 Cb 0.00 -0.40 -0.07 0.00 -0.02 0.00 0.00 41.12 40.63 1y77 n ASP 41 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1y77 h PHE 42 N 0.00 -0.12 -0.07 1.24 3.57 0.55 -3.37 116.94 118.73 1y77 h PHE 42 Ca 0.00 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.50 1y77 h PHE 42 Cb 0.10 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1y77 h PHE 42 CO 0.00 0.31 -0.04 1.63 -2.23 0.00 0.00 178.31 177.97 1y77 n LYS 43 N -4.83 -0.03 -0.11 1.11 5.02 -0.91 -2.40 118.16 116.01 1y77 n LYS 43 Ca -0.06 1.02 -0.03 0.00 -2.02 0.00 0.00 58.31 57.22 1y77 n LYS 43 Cb 0.24 -1.53 -0.01 0.00 -0.02 0.00 0.00 35.03 33.72 1y77 n LYS 43 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y77 n ALA 44 N -3.00 1.56 0.16 7.82 0.00 -1.25 -2.76 120.51 123.02 1y77 n ALA 44 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1y77 n ALA 44 Cb 0.02 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.00 1y77 n ALA 44 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1y77 n LYS 45 N 4.24 0.00 -0.76 0.00 4.81 -1.01 -4.94 118.16 120.50 1y77 n LYS 45 Ca 0.06 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.56 1y77 n LYS 45 Cb 0.04 0.00 0.34 0.00 0.02 0.00 0.00 35.03 35.43 1y77 n LYS 45 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1y77 n TYR 46 N -3.14 1.73 -3.81 5.64 4.02 -1.12 -4.96 117.16 115.51 1y77 n TYR 46 Ca 0.00 -0.86 -0.22 0.00 -0.01 0.00 0.00 57.90 56.81 1y77 n TYR 46 Cb 0.00 -0.47 -0.04 0.00 -0.02 0.00 0.00 39.34 38.81 1y77 n TYR 46 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1y77 n ASP 48 N -1.38 0.00 0.00 0.00 5.75 -1.09 -4.86 116.55 114.97 1y77 n ASP 48 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1y77 n ASP 48 Cb 0.61 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.70 1y77 n ASP 48 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1y77 n SER 49 N 0.00 0.00 -0.31 -1.12 3.41 -1.26 -4.80 113.62 109.54 1y77 n SER 49 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 1y77 n SER 49 Cb 0.00 -0.07 0.22 0.00 -0.26 0.00 0.00 64.21 64.10 1y77 n SER 49 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1y77 h MET 50 N 0.00 0.05 0.00 4.33 -1.53 -2.06 -3.44 114.93 112.28 1y77 h MET 50 Ca 0.00 -0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.26 1y77 h MET 50 Cb 0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.04 1y77 h MET 50 CO 0.00 0.03 0.00 0.41 0.14 0.00 0.00 176.91 177.49 1y77 n GLY 51 N -1.48 0.40 3.88 1.39 0.00 -1.26 -5.16 105.19 102.96 1y77 n GLY 51 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1y77 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y77 s ARG 52 N 0.00 3.23 0.18 1.61 0.52 -1.26 -4.93 118.95 118.29 1y77 s ARG 52 Ca 0.00 -0.67 -0.31 0.00 -0.52 0.00 0.00 55.73 54.23 1y77 s ARG 52 Cb 0.00 -2.86 -0.09 0.00 0.52 0.00 0.00 34.95 32.53 1y77 s ARG 52 CO 0.00 0.52 1.37 -1.25 0.02 0.00 0.00 175.30 175.96 1y77 s PRO 53 N -3.07 4.34 -0.75 3.54 0.04 -1.26 -2.68 135.00 135.15 1y77 s PRO 53 Ca 0.33 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.49 1y77 s PRO 53 Cb -0.11 -3.20 0.18 0.00 0.04 0.00 0.00 34.50 31.42 1y77 s PRO 53 CO 0.26 -0.36 0.58 -0.65 0.04 0.00 0.00 177.00 176.87 1y77 s GLN 54 N 0.32 2.78 0.15 4.56 -1.52 0.37 -4.94 119.66 121.39 1y77 s GLN 54 Ca 0.60 -3.08 -0.16 0.00 -1.95 0.00 0.00 55.36 50.77 1y77 s GLN 54 Cb -0.38 -3.70 0.04 0.00 -0.22 0.00 0.00 33.01 28.75 1y77 s GLN 54 CO 0.36 -1.24 1.78 0.00 -0.25 0.00 0.00 175.29 175.94 1y77 h ARG 55 N 6.10 0.36 0.00 2.91 3.08 -1.88 -1.91 114.38 123.04 1y77 h ARG 55 Ca 0.09 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1y77 h ARG 55 Cb 0.83 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1y77 h ARG 55 CO 0.77 0.24 0.16 1.63 -1.07 0.00 0.00 179.97 181.70 1y77 n LYS 56 N -4.94 0.01 0.00 0.04 5.02 -1.26 0.13 118.16 117.16 1y77 n LYS 56 Ca 0.01 0.36 0.12 0.00 -2.02 0.00 0.00 58.31 56.78 1y77 n LYS 56 Cb 0.09 -1.69 0.10 0.00 -0.02 0.00 0.00 35.03 33.52 1y77 n LYS 56 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 1y77 n MET 57 N -1.41 1.16 -0.06 1.97 1.56 -0.72 -4.34 117.12 115.28 1y77 n MET 57 Ca -0.00 -0.90 -0.11 0.00 -0.27 0.00 0.00 57.70 56.42 1y77 n MET 57 Cb 0.16 -1.48 -0.15 0.00 2.15 0.00 0.00 33.22 33.90 1y77 n MET 57 CO 0.00 0.00 0.00 -1.33 -0.73 0.00 0.00 175.97 173.91 1y77 n MET 58 N -0.14 0.67 -0.99 2.12 2.81 0.34 -4.96 117.12 116.97 1y77 n MET 58 Ca 0.10 0.16 -0.34 0.00 -1.81 0.00 0.00 57.70 55.81 1y77 n MET 58 Cb 0.44 -1.66 0.03 0.00 -0.71 0.00 0.00 33.22 31.32 1y77 n MET 58 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1y77 n SER 59 N -2.97 -4.76 -3.62 7.83 7.64 -1.23 -4.97 113.62 111.53 1y77 n SER 59 Ca -0.26 0.31 -0.01 0.00 1.01 0.00 0.00 58.87 59.92 1y77 n SER 59 Cb 1.09 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1y77 n SER 59 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1y77 s PHE 60 N -1.82 -0.02 0.35 1.43 -0.00 -0.94 -5.02 117.98 111.96 1y77 s PHE 60 Ca 0.42 -0.21 0.09 0.00 -0.00 0.00 0.00 56.93 57.22 1y77 s PHE 60 Cb -0.26 0.61 -0.05 0.00 -0.00 0.00 0.00 43.02 43.31 1y77 s PHE 60 CO 0.70 -0.56 0.06 -1.14 -0.00 0.00 0.00 175.22 174.27 1y77 s GLN 61 N -2.45 2.15 0.01 1.99 0.74 -1.26 -1.43 119.66 119.41 1y77 s GLN 61 Ca 0.19 -1.72 -0.18 0.00 0.05 0.00 0.00 55.36 53.70 1y77 s GLN 61 Cb 0.00 -1.98 0.03 0.00 1.10 0.00 0.00 33.01 32.17 1y77 s GLN 61 CO 0.01 0.11 0.40 0.00 -0.55 0.00 0.00 175.29 175.25 1y77 s ALA 62 N -2.51 -1.00 0.11 1.58 0.00 -0.65 -4.96 121.76 114.34 1y77 s ALA 62 Ca 0.36 0.42 0.06 0.00 0.00 0.00 0.00 51.96 52.80 1y77 s ALA 62 Cb -0.00 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.28 1y77 s ALA 62 CO 0.20 -0.37 -0.16 -0.80 0.00 0.00 0.00 175.76 174.64 1y77 s ASN 63 N -1.66 2.07 0.63 0.00 0.01 -1.26 -2.70 114.94 112.04 1y77 s ASN 63 Ca -0.09 -0.74 -0.18 0.00 -0.71 0.00 0.00 52.86 51.14 1y77 s ASN 63 Cb -0.02 -0.08 -0.02 0.00 0.41 0.00 0.00 41.25 41.53 1y77 s ASN 63 CO 0.02 -0.08 1.15 -2.65 -1.51 0.00 0.00 177.10 174.02 1y77 n PRO 64 N 0.82 0.99 -2.78 -0.60 -0.02 -1.26 0.11 135.00 132.26 1y77 n PRO 64 Ca -0.18 0.39 -0.32 0.00 -2.02 0.00 0.00 63.50 61.37 1y77 n PRO 64 Cb 0.56 -2.37 -0.05 0.00 -0.02 0.00 0.00 33.50 31.61 1y77 n PRO 64 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1y77 s THR 65 N -1.45 4.58 -1.20 3.45 -4.23 -1.23 -4.45 115.64 111.11 1y77 s THR 65 Ca 0.80 1.10 0.02 0.00 -1.18 0.00 0.00 61.69 62.43 1y77 s THR 65 Cb -0.39 -3.66 0.03 0.00 1.34 0.00 0.00 72.50 69.81 1y77 s THR 65 CO 0.43 -0.43 0.98 -0.62 -0.54 0.00 0.00 174.62 174.43 1y77 n GLU 66 N -0.98 0.01 0.13 3.99 1.02 -1.26 -1.05 120.64 122.50 1y77 n GLU 66 Ca 0.05 0.37 -0.24 0.00 -0.02 0.00 0.00 57.16 57.32 1y77 n GLU 66 Cb 0.54 -1.50 -0.16 0.00 -0.02 0.00 0.00 31.44 30.30 1y77 n GLU 66 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1y77 h GLU 67 N 0.00 0.49 0.00 3.49 4.81 -1.96 -3.23 114.58 118.18 1y77 h GLU 67 Ca 0.00 -0.84 0.00 0.00 -0.13 0.00 0.00 59.36 58.39 1y77 h GLU 67 Cb 0.03 0.31 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1y77 h GLU 67 CO 0.00 1.40 0.00 0.43 -0.73 0.00 0.00 179.01 180.11 1y77 n SER 68 N -3.67 0.00 0.04 1.04 7.64 -0.22 -1.56 113.62 116.89 1y77 n SER 68 Ca -0.18 -0.01 0.05 0.00 1.01 0.00 0.00 58.87 59.73 1y77 n SER 68 Cb 1.10 -0.22 -0.07 0.00 -1.01 0.00 0.00 64.21 64.01 1y77 n SER 68 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1y77 n ILE 69 N -1.22 0.83 0.03 0.44 5.41 -1.22 -2.56 119.36 121.07 1y77 n ILE 69 Ca 0.07 -0.62 -0.13 0.00 1.00 0.00 0.00 62.75 63.07 1y77 n ILE 69 Cb 0.09 -0.47 -0.09 0.00 -0.71 0.00 0.00 39.64 38.46 1y77 n ILE 69 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 1y77 h SER 70 N 0.00 -0.08 0.13 4.38 0.87 -1.41 -3.35 113.55 114.10 1y77 h SER 70 Ca -0.11 -0.32 -0.31 0.00 -1.23 0.00 0.00 61.79 59.82 1y77 h SER 70 Cb 1.33 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 63.31 1y77 h SER 70 CO 0.02 0.29 -1.59 0.11 -0.53 0.00 0.00 176.83 175.13 1y77 h LYS 71 N -0.45 0.27 -4.76 2.24 1.57 -1.74 -3.43 116.57 110.26 1y77 h LYS 71 Ca -0.01 -0.47 -0.68 0.00 -1.87 0.00 0.00 60.65 57.62 1y77 h LYS 71 Cb 0.39 0.17 -0.29 0.00 0.08 0.00 0.00 32.23 32.58 1y77 h LYS 71 CO 0.02 1.22 -0.65 -0.06 -0.57 0.00 0.00 179.45 179.41 1y77 s PHE 72 N -2.51 3.20 0.00 -1.35 0.40 -1.06 -4.87 117.98 111.79 1y77 s PHE 72 Ca -0.20 -1.43 0.00 0.00 -0.60 0.00 0.00 56.93 54.70 1y77 s PHE 72 Cb 0.05 -2.20 0.00 0.00 0.51 0.00 0.00 43.02 41.38 1y77 s PHE 72 CO 0.78 -0.71 0.25 -2.30 0.70 0.00 0.00 175.22 173.94 1y77 n PRO 73 N 4.76 0.00 0.00 0.24 -0.02 -1.25 -3.80 135.00 134.92 1y77 n PRO 73 Ca -0.14 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1y77 n PRO 73 Cb 0.46 -0.75 0.00 0.00 -0.02 0.00 0.00 33.50 33.18 1y77 n PRO 73 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1y77 n ASP 74 N -0.53 0.13 -4.56 2.55 8.00 -1.26 -4.79 116.55 116.09 1y77 n ASP 74 Ca 0.00 -0.13 -0.39 0.00 0.71 0.00 0.00 54.79 54.98 1y77 n ASP 74 Cb 0.00 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.04 1y77 n ASP 74 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1y77 s MET 75 N -0.11 2.67 0.48 -1.24 1.75 -1.26 -4.96 119.30 116.64 1y77 s MET 75 Ca 0.00 0.80 -0.08 0.00 -1.25 0.00 0.00 55.69 55.16 1y77 s MET 75 Cb 0.00 -4.38 0.12 0.00 2.84 0.00 0.00 34.83 33.41 1y77 s MET 75 CO 0.00 -2.67 0.30 0.41 -0.65 0.00 0.00 175.02 172.41 1y77 n GLY 76 N 5.69 -3.64 3.91 2.11 0.00 -1.26 -4.86 105.19 107.13 1y77 n GLY 76 Ca 0.22 -1.28 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 1y77 n GLY 76 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y77 s SER 77 N -2.38 6.45 0.14 1.61 0.01 -1.26 -4.72 113.70 113.55 1y77 s SER 77 Ca 0.23 0.63 0.07 0.00 1.31 0.00 0.00 55.95 58.19 1y77 s SER 77 Cb -0.04 -2.11 -0.04 0.00 0.21 0.00 0.00 66.02 64.05 1y77 s SER 77 CO 0.19 -0.10 -0.05 -0.22 0.41 0.00 0.00 173.24 173.46 1y77 s LEU 78 N -3.28 3.18 -0.04 2.44 0.20 -1.10 -2.35 118.68 117.72 1y77 s LEU 78 Ca 0.42 -0.41 -0.02 0.00 0.69 0.00 0.00 54.13 54.81 1y77 s LEU 78 Cb -0.11 -1.89 0.02 0.00 -0.43 0.00 0.00 46.19 43.78 1y77 s LEU 78 CO 0.28 0.13 0.10 0.86 -0.29 0.00 0.00 176.35 177.43 1y77 s TRP 79 N -1.52 -0.10 0.09 5.38 -0.11 -0.67 -1.63 118.94 120.39 1y77 s TRP 79 Ca 0.25 0.30 0.08 0.00 1.22 0.00 0.00 56.10 57.95 1y77 s TRP 79 Cb -0.10 -0.05 -0.04 0.00 -1.50 0.00 0.00 33.47 31.78 1y77 s TRP 79 CO 0.16 -0.09 -0.16 0.08 -4.62 0.00 0.00 176.95 172.32 1y77 s VAL 80 N 0.59 2.98 -0.10 5.86 1.01 -0.52 -0.89 120.40 129.33 1y77 s VAL 80 Ca -0.05 -1.36 -0.10 0.00 0.00 0.00 0.00 61.98 60.48 1y77 s VAL 80 Cb -0.06 -2.35 0.03 0.00 0.00 0.00 0.00 36.38 34.00 1y77 s VAL 80 CO -0.02 0.16 0.27 -0.70 0.00 0.00 0.00 175.10 174.81 1y77 s GLU 81 N -1.98 0.32 0.49 2.72 2.12 0.03 -2.21 118.70 120.20 1y77 s GLU 81 Ca 0.18 0.38 0.04 0.00 0.36 0.00 0.00 54.97 55.93 1y77 s GLU 81 Cb -0.11 0.16 -0.01 0.00 0.26 0.00 0.00 34.13 34.43 1y77 s GLU 81 CO 0.10 -0.04 0.15 -0.06 -0.54 0.00 0.00 175.26 174.87 1y77 s PHE 82 N 0.14 1.99 -0.04 5.30 0.40 -1.26 0.02 117.98 124.53 1y77 s PHE 82 Ca -0.00 -0.83 -0.08 0.00 -0.60 0.00 0.00 56.93 55.41 1y77 s PHE 82 Cb -0.02 -1.78 0.01 0.00 0.51 0.00 0.00 43.02 41.75 1y77 s PHE 82 CO 0.00 0.04 0.20 0.00 0.70 0.00 0.00 175.22 176.16 1y77 n ASP 84 N 2.12 1.10 -4.41 0.00 10.43 -1.26 -4.73 116.55 119.79 1y77 n ASP 84 Ca -0.18 -1.39 -0.44 0.00 2.57 0.00 0.00 54.79 55.35 1y77 n ASP 84 Cb 0.57 -0.01 -0.04 0.00 1.84 0.00 0.00 41.12 43.49 1y77 n ASP 84 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 1y77 s GLU 85 N -1.98 3.27 0.54 -1.24 2.02 -1.26 -4.91 118.70 115.14 1y77 s GLU 85 Ca 0.40 -1.43 0.32 0.00 0.02 0.00 0.00 54.97 54.28 1y77 s GLU 85 Cb 0.21 -4.45 1.49 0.00 0.10 0.00 0.00 34.13 31.47 1y77 s GLU 85 CO 0.34 -1.65 1.87 -1.35 0.02 0.00 0.00 175.26 174.48 1y77 h PRO 86 N 9.05 0.00 -3.07 0.39 0.11 -1.97 -3.13 132.00 133.39 1y77 h PRO 86 Ca -0.13 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.36 1y77 h PRO 86 Cb 1.06 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.77 1y77 h PRO 86 CO 1.09 0.00 -0.70 0.45 -0.21 0.00 0.00 178.00 178.63 1y77 s SER 87 N -5.48 3.84 0.43 -2.05 0.15 -1.26 -2.52 113.70 106.81 1y77 s SER 87 Ca -0.05 -2.92 -0.22 0.00 0.70 0.00 0.00 55.95 53.46 1y77 s SER 87 Cb 0.21 -1.24 -0.09 0.00 -1.71 0.00 0.00 66.02 63.19 1y77 s SER 87 CO 0.75 -0.23 1.02 -0.69 1.20 0.00 0.00 173.24 175.30 1y77 s VAL 88 N -0.08 3.90 0.37 4.45 1.01 -1.18 -5.04 120.40 123.82 1y77 s VAL 88 Ca 0.19 1.31 0.01 0.00 0.00 0.00 0.00 61.98 63.49 1y77 s VAL 88 Cb -0.20 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 1y77 s VAL 88 CO -0.03 -0.13 0.03 0.61 0.00 0.00 0.00 175.10 175.57 1y77 n GLY 89 N -0.04 3.65 0.00 4.51 0.00 -1.26 -3.09 105.19 108.96 1y77 n GLY 89 Ca 0.07 -2.27 0.10 0.00 0.00 0.00 0.00 46.02 43.91 1y77 n GLY 89 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1y77 n VAL 90 N -0.91 0.00 -0.11 1.61 3.14 -1.26 -3.61 118.33 117.18 1y77 n VAL 90 Ca -0.14 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.05 1y77 n VAL 90 Cb 0.49 -0.48 -0.08 0.00 -1.06 0.00 0.00 33.84 32.71 1y77 n VAL 90 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 1y77 n LYS 91 N -0.88 0.55 0.00 1.45 4.81 -1.26 -4.19 118.16 118.64 1y77 n LYS 91 Ca 0.14 0.42 0.03 0.00 -0.87 0.00 0.00 58.31 58.04 1y77 n LYS 91 Cb 0.07 -1.62 0.17 0.00 0.02 0.00 0.00 35.03 33.66 1y77 n LYS 91 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1y77 n THR 92 N -4.42 0.92 0.00 3.15 -1.04 -1.24 -2.11 114.28 109.54 1y77 n THR 92 Ca -0.31 0.23 -0.17 0.00 -2.04 0.00 0.00 64.05 61.75 1y77 n THR 92 Cb 0.64 -1.12 -0.11 0.00 -1.82 0.00 0.00 70.33 67.92 1y77 n THR 92 CO 0.00 0.00 0.00 -0.03 -0.64 0.00 0.00 175.07 174.40 1y77 h MET 93 N 0.00 0.41 -0.16 -2.82 1.85 -1.73 -2.93 114.93 109.55 1y77 h MET 93 Ca 0.00 -0.44 0.05 0.00 -0.61 0.00 0.00 59.70 58.70 1y77 h MET 93 Cb 0.06 0.12 -0.01 0.00 0.43 0.00 0.00 31.60 32.21 1y77 h MET 93 CO 0.00 1.10 0.22 -0.22 -0.40 0.00 0.00 176.91 177.61 1y77 h LYS 94 N -0.11 0.00 0.01 0.39 1.63 -1.62 0.11 116.57 116.97 1y77 h LYS 94 Ca -0.07 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1y77 h LYS 94 Cb 1.31 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.94 1y77 h LYS 94 CO 0.12 0.00 -0.00 1.15 -3.45 0.00 0.00 179.45 177.26 1y77 h THR 95 N 0.00 1.10 0.11 1.00 2.02 -1.62 -2.87 112.91 112.64 1y77 h THR 95 Ca 0.07 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 1y77 h THR 95 Cb 0.52 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 1y77 h THR 95 CO -0.00 0.08 -0.05 0.15 0.37 0.00 0.00 175.52 176.06 1y77 h PHE 96 N -0.14 -0.14 -0.86 3.16 3.57 -0.97 -2.86 116.94 118.71 1y77 h PHE 96 Ca -0.00 -0.00 0.28 0.00 3.53 0.00 0.00 57.97 61.78 1y77 h PHE 96 Cb 0.13 0.05 -0.16 0.00 2.79 0.00 0.00 35.95 38.76 1y77 h PHE 96 CO -0.03 -0.09 0.19 0.28 -2.23 0.00 0.00 178.31 176.43 1y77 n VAL 97 N -4.27 -0.36 -0.05 1.41 0.31 0.15 -0.70 118.33 114.83 1y77 n VAL 97 Ca -0.02 1.83 -0.12 0.00 -0.01 0.00 0.00 64.34 66.02 1y77 n VAL 97 Cb 0.06 -2.79 -0.11 0.00 -0.91 0.00 0.00 33.84 30.09 1y77 n VAL 97 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1y77 h ILE 98 N 0.00 1.51 -1.40 2.52 2.04 -1.65 -2.97 117.51 117.56 1y77 h ILE 98 Ca 0.60 -1.95 0.45 0.00 1.00 0.00 0.00 64.86 64.95 1y77 h ILE 98 Cb 1.40 2.77 -0.10 0.00 -0.74 0.00 0.00 36.82 40.15 1y77 h ILE 98 CO -0.75 0.48 0.95 1.57 0.00 0.00 0.00 178.15 180.40 1y77 n HIS 99 N -4.69 0.36 -0.02 1.37 -0.00 0.12 0.44 115.22 112.80 1y77 n HIS 99 Ca -0.09 0.36 -0.21 0.00 0.46 0.00 0.00 57.72 58.24 1y77 n HIS 99 Cb 0.39 -0.79 -0.13 0.00 -0.12 0.00 0.00 29.99 29.34 1y77 n HIS 99 CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 1y77 h ILE 100 N 0.00 0.90 -0.22 3.57 2.04 -1.54 -3.22 117.51 119.03 1y77 h ILE 100 Ca 0.78 -2.32 0.06 0.00 1.00 0.00 0.00 64.86 64.38 1y77 h ILE 100 Cb 2.78 2.54 -0.01 0.00 -0.74 0.00 0.00 36.82 41.39 1y77 h ILE 100 CO -0.24 0.66 0.28 -0.61 0.00 0.00 0.00 178.15 178.23 1y77 h GLN 101 N -0.39 0.00 0.00 2.37 4.15 0.15 -0.61 115.11 120.78 1y77 h GLN 101 Ca -0.35 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.07 1y77 h GLN 101 Cb 1.71 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.40 1y77 h GLN 101 CO -0.00 0.00 0.00 0.39 -1.93 0.00 0.00 178.83 177.29 1y77 n GLU 102 N -3.65 0.00 -0.59 1.69 1.02 -0.70 -4.18 120.64 114.23 1y77 n GLU 102 Ca 0.03 0.29 0.47 0.00 -0.02 0.00 0.00 57.16 57.93 1y77 n GLU 102 Cb 0.41 -0.76 0.76 0.00 -0.02 0.00 0.00 31.44 31.82 1y77 n GLU 102 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1y77 h LYS 103 N 0.00 0.01 -4.21 3.49 1.79 -1.55 -3.45 116.57 112.65 1y77 h LYS 103 Ca 0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1y77 h LYS 103 Cb 0.00 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1y77 h LYS 103 CO 0.00 0.01 -0.27 -1.71 -1.08 0.00 0.00 179.45 176.40 1y77 n ASN 104 N -4.27 -5.18 0.00 0.86 4.05 -0.24 -5.10 115.26 105.38 1y77 n ASN 104 Ca 0.42 0.29 0.00 0.00 0.45 0.00 0.00 54.58 55.74 1y77 n ASN 104 Cb 1.78 -3.34 0.00 0.00 1.23 0.00 0.00 39.78 39.45 1y77 n ASN 104 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1y77 n PHE 105 N -0.39 0.00 0.00 1.20 0.99 -1.25 -4.92 117.46 113.09 1y77 n PHE 105 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.51 1y77 n PHE 105 Cb 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.72 1y77 n PHE 105 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.76 177.70 1y77 n GLN 106 N 0.00 0.00 -4.09 -1.08 7.27 -1.18 -4.59 117.38 113.72 1y77 n GLN 106 Ca 0.00 0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.75 1y77 n GLN 106 Cb 0.00 0.00 -0.16 0.00 2.41 0.00 0.00 30.24 32.49 1y77 n GLN 106 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1y77 s THR 107 N 0.00 1.93 -0.26 1.69 2.01 -0.99 -0.74 115.64 119.28 1y77 s THR 107 Ca 0.00 -0.89 0.02 0.00 0.31 0.00 0.00 61.69 61.14 1y77 s THR 107 Cb 0.00 -1.77 0.07 0.00 0.01 0.00 0.00 72.50 70.80 1y77 s THR 107 CO 0.00 0.49 -0.06 -0.83 -0.69 0.00 0.00 174.62 173.53 1y77 s GLY 108 N 1.34 1.54 -0.21 4.40 0.00 0.21 -1.67 107.32 112.92 1y77 s GLY 108 Ca 0.04 -1.71 -0.07 0.00 0.00 0.00 0.00 44.72 42.99 1y77 s GLY 108 CO -0.12 0.80 0.06 -0.42 0.00 0.00 0.00 173.10 173.42 1y77 s ILE 109 N 1.20 4.51 -0.01 0.90 1.01 -0.07 -0.70 121.20 128.04 1y77 s ILE 109 Ca -0.05 -0.12 0.08 0.00 0.00 0.00 0.00 60.65 60.56 1y77 s ILE 109 Cb -0.19 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.19 1y77 s ILE 109 CO -0.06 0.40 -0.25 0.12 0.00 0.00 0.00 174.94 175.14 1y77 s PHE 110 N 0.97 2.26 -0.32 3.97 5.36 -1.07 -0.79 117.98 128.36 1y77 s PHE 110 Ca 0.04 -0.42 0.01 0.00 -0.96 0.00 0.00 56.93 55.59 1y77 s PHE 110 Cb -0.14 -1.44 0.08 0.00 -0.34 0.00 0.00 43.02 41.18 1y77 s PHE 110 CO 0.03 -0.01 0.03 0.08 -1.46 0.00 0.00 175.22 173.89 1y77 s VAL 111 N -0.63 2.60 0.41 3.12 1.01 0.10 -2.13 120.40 124.88 1y77 s VAL 111 Ca 0.10 -1.90 -0.09 0.00 0.00 0.00 0.00 61.98 60.09 1y77 s VAL 111 Cb -0.10 -2.70 -0.06 0.00 0.00 0.00 0.00 36.38 33.52 1y77 s VAL 111 CO -0.00 -0.37 0.76 -0.72 0.00 0.00 0.00 175.10 174.77 1y77 s TYR 112 N 1.07 3.49 0.00 5.22 -0.85 -0.95 -3.85 117.35 121.48 1y77 s TYR 112 Ca 0.02 0.97 0.00 0.00 -0.52 0.00 0.00 57.07 57.54 1y77 s TYR 112 Cb -0.20 -2.39 0.00 0.00 0.38 0.00 0.00 41.96 39.75 1y77 s TYR 112 CO -0.05 -0.12 0.00 1.04 -1.52 0.00 0.00 175.55 174.90 1y77 n GLN 113 N -1.43 0.00 0.05 -3.49 6.02 -1.26 -2.39 117.38 114.88 1y77 n GLN 113 Ca 0.02 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.97 1y77 n GLN 113 Cb 0.54 -0.18 -0.09 0.00 1.02 0.00 0.00 30.24 31.54 1y77 n GLN 113 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 1y77 h ASN 114 N 0.00 0.00 0.00 1.08 -0.26 -1.80 -3.38 115.58 111.21 1y77 h ASN 114 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1y77 h ASN 114 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1y77 h ASN 114 CO 0.00 0.80 0.00 -0.46 -1.06 0.00 0.00 177.43 176.71 1y77 n ASN 115 N -3.14 0.00 -4.55 5.81 6.94 -1.26 -5.09 115.26 113.97 1y77 n ASN 115 Ca -0.06 0.00 -0.24 0.00 -0.02 0.00 0.00 54.58 54.26 1y77 n ASN 115 Cb 0.90 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 38.23 1y77 n ASN 115 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1y77 s ILE 116 N -2.00 2.82 -0.16 1.53 1.01 -1.26 -3.23 121.20 119.90 1y77 s ILE 116 Ca 0.00 -2.19 -0.25 0.00 0.00 0.00 0.00 60.65 58.21 1y77 s ILE 116 Cb 0.00 -2.55 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 1y77 s ILE 116 CO 0.00 -0.37 0.82 -0.89 0.00 0.00 0.00 174.94 174.50 1y77 s THR 117 N -2.45 4.89 -0.71 2.92 2.01 -1.18 -4.91 115.64 116.21 1y77 s THR 117 Ca 0.31 1.61 0.00 0.00 0.31 0.00 0.00 61.69 63.92 1y77 s THR 117 Cb -0.05 -4.13 0.00 0.00 0.01 0.00 0.00 72.50 68.33 1y77 s THR 117 CO 0.17 0.04 0.67 -2.65 -0.69 0.00 0.00 174.62 172.16 1y77 n PRO 118 N 5.15 0.00 0.01 4.92 -0.02 -1.26 0.24 135.00 144.04 1y77 n PRO 118 Ca 0.04 0.22 -0.05 0.00 -2.02 0.00 0.00 63.50 61.69 1y77 n PRO 118 Cb 0.49 -1.66 -0.11 0.00 -0.02 0.00 0.00 33.50 32.20 1y77 n PRO 118 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1y77 h SER 119 N 0.00 0.00 0.06 2.55 0.02 -1.98 -3.39 113.55 110.82 1y77 h SER 119 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1y77 h SER 119 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1y77 h SER 119 CO 0.00 0.83 -0.03 0.00 -1.14 0.00 0.00 176.83 176.49 1y77 h ALA 120 N 1.17 -0.10 -1.34 3.77 0.00 0.27 -3.37 119.26 119.66 1y77 h ALA 120 Ca -0.20 -0.02 0.47 0.00 0.00 0.00 0.00 54.91 55.16 1y77 h ALA 120 Cb 1.81 0.03 -0.14 0.00 0.00 0.00 0.00 17.79 19.49 1y77 h ALA 120 CO 0.07 -0.09 0.85 -1.33 0.00 0.00 0.00 179.25 178.75 1y77 n MET 121 N -4.32 -0.04 -1.12 0.00 2.81 -1.05 -2.34 117.12 111.06 1y77 n MET 121 Ca -0.01 1.27 -0.28 0.00 -1.81 0.00 0.00 57.70 56.87 1y77 n MET 121 Cb 0.03 -2.48 -0.07 0.00 -0.71 0.00 0.00 33.22 30.00 1y77 n MET 121 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1y77 n LYS 122 N -4.78 2.92 0.00 0.03 5.02 -1.26 -2.83 118.16 117.26 1y77 n LYS 122 Ca 0.40 -1.71 0.00 0.00 -2.02 0.00 0.00 58.31 54.98 1y77 n LYS 122 Cb 1.54 -2.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 1y77 n LYS 122 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1y77 n LEU 123 N 3.33 0.00 -0.03 -0.35 4.77 -0.99 -4.94 117.00 118.79 1y77 n LEU 123 Ca 0.62 -0.06 -0.16 0.00 -0.03 0.00 0.00 56.01 56.38 1y77 n LEU 123 Cb 0.41 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.37 1y77 n LEU 123 CO 0.61 0.20 0.30 0.58 -1.33 0.00 0.00 177.39 177.75 1y77 h VAL 124 N 1.38 1.70 -0.15 4.08 2.07 -1.77 -3.34 116.25 120.23 1y77 h VAL 124 Ca 0.00 -2.36 -0.09 0.00 0.82 0.00 0.00 66.70 65.07 1y77 h VAL 124 Cb 0.59 3.29 -0.04 0.00 -1.52 0.00 0.00 31.29 33.61 1y77 h VAL 124 CO 0.00 0.63 0.12 -0.81 0.02 0.00 0.00 177.57 177.53 1y77 n PRO 125 N -4.47 1.23 -0.04 1.57 -0.04 -1.26 -4.01 135.00 127.97 1y77 n PRO 125 Ca -0.11 -0.47 0.02 0.00 -0.04 0.00 0.00 63.50 62.90 1y77 n PRO 125 Cb 0.57 -1.18 0.04 0.00 -0.04 0.00 0.00 33.50 32.89 1y77 n PRO 125 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1y77 n SER 126 N 0.96 2.22 -3.05 3.54 3.41 -1.25 -4.82 113.62 114.62 1y77 n SER 126 Ca 0.09 -2.11 -0.16 0.00 -0.26 0.00 0.00 58.87 56.43 1y77 n SER 126 Cb 0.56 -0.08 -0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1y77 n SER 126 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1y77 n ILE 127 N -0.41 -0.21 -2.11 -1.33 -5.35 -1.26 -5.14 119.36 103.56 1y77 n ILE 127 Ca 0.04 -3.54 -0.33 0.00 -0.27 0.00 0.00 62.75 58.65 1y77 n ILE 127 Cb 0.32 -0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.22 1y77 n ILE 127 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1y77 s PRO 128 N -1.36 3.43 0.10 6.28 0.04 -1.26 -3.25 135.00 138.99 1y77 s PRO 128 Ca 0.34 1.16 -0.28 0.00 0.04 0.00 0.00 61.00 62.26 1y77 s PRO 128 Cb 0.30 -2.05 -0.12 0.00 0.04 0.00 0.00 34.50 32.66 1y77 s PRO 128 CO -0.09 -0.71 1.65 -1.00 0.04 0.00 0.00 177.00 176.89 1y77 h PRO 129 N 0.53 -0.50 0.00 0.56 0.13 -2.00 -3.51 132.00 127.20 1y77 h PRO 129 Ca -0.47 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1y77 h PRO 129 Cb 1.21 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1y77 h PRO 129 CO 0.58 -0.33 0.00 0.00 -0.23 0.00 0.00 178.00 178.02 1y77 n ALA 130 N -2.50 -0.46 -2.52 -0.56 0.00 -1.20 -4.97 120.51 108.30 1y77 n ALA 130 Ca -0.08 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.11 1y77 n ALA 130 Cb 0.27 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.59 1y77 n ALA 130 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1y77 s THR 131 N 0.00 1.56 0.12 0.00 -4.23 0.08 -4.79 115.64 108.39 1y77 s THR 131 Ca 0.00 -1.21 0.05 0.00 -1.18 0.00 0.00 61.69 59.35 1y77 s THR 131 Cb 0.00 -1.38 -0.04 0.00 1.34 0.00 0.00 72.50 72.42 1y77 s THR 131 CO 0.00 0.12 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.45 1y77 s ILE 132 N -0.87 1.20 0.04 2.99 1.01 -1.26 -0.62 121.20 123.69 1y77 s ILE 132 Ca 0.06 -1.77 -0.00 0.00 0.00 0.00 0.00 60.65 58.94 1y77 s ILE 132 Cb -0.09 -1.55 -0.03 0.00 0.01 0.00 0.00 42.46 40.80 1y77 s ILE 132 CO 0.02 -0.53 -0.04 -1.61 0.00 0.00 0.00 174.94 172.79 1y77 s GLU 133 N -2.93 0.49 -0.13 2.79 2.02 0.12 -4.93 118.70 116.13 1y77 s GLU 133 Ca 0.10 -0.93 0.01 0.00 0.02 0.00 0.00 54.97 54.17 1y77 s GLU 133 Cb -0.03 0.10 0.02 0.00 0.10 0.00 0.00 34.13 34.32 1y77 s GLU 133 CO 0.02 -0.07 -0.16 0.95 0.02 0.00 0.00 175.26 176.03 1y77 s THR 134 N -2.64 1.60 -0.05 3.63 -4.23 -1.26 -2.61 115.64 110.07 1y77 s THR 134 Ca -0.04 -0.68 0.04 0.00 -1.18 0.00 0.00 61.69 59.83 1y77 s THR 134 Cb -0.01 -1.47 -0.00 0.00 1.34 0.00 0.00 72.50 72.36 1y77 s THR 134 CO -0.05 0.46 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.97 1y77 s PHE 135 N 1.19 1.67 0.30 3.99 0.40 -0.91 -5.02 117.98 119.60 1y77 s PHE 135 Ca -0.02 -0.51 -0.21 0.00 -0.60 0.00 0.00 56.93 55.59 1y77 s PHE 135 Cb -0.14 -1.14 -0.09 0.00 0.51 0.00 0.00 43.02 42.15 1y77 s PHE 135 CO -0.06 -0.19 0.83 1.21 0.70 0.00 0.00 175.22 177.71 1y77 s ASN 136 N 0.16 7.09 0.08 1.36 3.84 -1.26 -2.24 114.94 123.96 1y77 s ASN 136 Ca -0.06 1.57 -0.32 0.00 0.21 0.00 0.00 52.86 54.26 1y77 s ASN 136 Cb -0.12 -2.48 -0.15 0.00 -0.55 0.00 0.00 41.25 37.95 1y77 s ASN 136 CO 0.03 -0.09 1.50 -0.33 -2.79 0.00 0.00 177.10 175.41 1y77 h GLU 137 N 2.95 -0.82 -0.31 0.43 5.08 -1.66 -2.96 114.58 117.28 1y77 h GLU 137 Ca -0.48 0.06 0.09 0.00 -1.00 0.00 0.00 59.36 58.03 1y77 h GLU 137 Cb 1.19 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 1y77 h GLU 137 CO 0.65 -0.55 0.78 0.00 -1.00 0.00 0.00 179.01 178.89 1y77 h ALA 138 N -0.92 2.08 -0.00 3.43 0.00 -1.89 0.32 119.26 122.28 1y77 h ALA 138 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1y77 h ALA 138 Cb 0.76 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1y77 h ALA 138 CO -0.10 -0.95 -0.60 0.00 0.00 0.00 0.00 179.25 177.60 1y77 n ALA 139 N -1.92 3.82 0.02 0.00 0.00 -1.12 -3.96 120.51 117.35 1y77 n ALA 139 Ca 0.06 -0.45 0.06 0.00 0.00 0.00 0.00 53.44 53.12 1y77 n ALA 139 Cb 0.90 -1.00 0.13 0.00 0.00 0.00 0.00 19.45 19.48 1y77 n ALA 139 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1y77 n LEU 140 N -1.27 2.73 -0.02 0.00 4.77 0.11 -4.49 117.00 118.83 1y77 n LEU 140 Ca 0.06 -1.70 -0.05 0.00 -0.03 0.00 0.00 56.01 54.29 1y77 n LEU 140 Cb 0.35 -0.18 0.15 0.00 -2.33 0.00 0.00 43.42 41.40 1y77 n LEU 140 CO 0.35 0.64 0.70 0.58 -1.33 0.00 0.00 177.39 178.34 1y77 h VAL 141 N 2.31 1.27 -4.48 4.08 2.07 -1.65 -3.36 116.25 116.49 1y77 h VAL 141 Ca 0.00 -1.34 -0.67 0.00 0.82 0.00 0.00 66.70 65.51 1y77 h VAL 141 Cb 0.69 1.33 -0.29 0.00 -1.52 0.00 0.00 31.29 31.50 1y77 h VAL 141 CO 0.00 0.43 -0.88 -0.69 0.02 0.00 0.00 177.57 176.45 1y77 s VAL 142 N -4.50 1.94 -0.28 2.57 1.01 -1.26 -4.26 120.40 115.63 1y77 s VAL 142 Ca -0.08 -1.11 -0.26 0.00 0.00 0.00 0.00 61.98 60.53 1y77 s VAL 142 Cb 0.13 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.89 1y77 s VAL 142 CO 0.81 0.49 0.91 0.21 0.00 0.00 0.00 175.10 177.52 1y77 s ASN 143 N -0.73 6.85 0.50 3.32 3.84 -1.26 -4.90 114.94 122.56 1y77 s ASN 143 Ca 0.10 0.99 0.24 0.00 0.21 0.00 0.00 52.86 54.40 1y77 s ASN 143 Cb -0.09 -2.47 1.32 0.00 -0.55 0.00 0.00 41.25 39.45 1y77 s ASN 143 CO -0.00 -0.65 2.04 0.16 -2.79 0.00 0.00 177.10 175.86 1y77 h ILE 144 N 5.55 0.72 0.00 -5.21 3.07 -1.97 -2.68 117.51 116.99 1y77 h ILE 144 Ca -0.22 -0.60 0.00 0.00 1.55 0.00 0.00 64.86 65.59 1y77 h ILE 144 Cb 1.08 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 39.00 1y77 h ILE 144 CO 0.93 0.14 0.00 0.35 -1.05 0.00 0.00 178.15 178.52 1y77 n THR 145 N -3.80 0.97 1.43 0.16 -2.24 -1.26 -2.42 114.28 107.12 1y77 n THR 145 Ca -0.02 0.25 0.14 0.00 -2.27 0.00 0.00 64.05 62.15 1y77 n THR 145 Cb 0.25 -1.06 0.49 0.00 -2.10 0.00 0.00 70.33 67.91 1y77 n THR 145 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1y77 n HIS 146 N -1.71 0.00 -2.52 4.78 8.25 -1.01 -4.88 115.22 118.13 1y77 n HIS 146 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.07 1y77 n HIS 146 Cb 0.18 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 1y77 n HIS 146 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1y77 s HIS 147 N -2.16 3.54 0.15 4.41 5.04 -1.02 -4.92 115.29 120.34 1y77 s HIS 147 Ca 0.34 1.49 -0.03 0.00 -1.54 0.00 0.00 55.06 55.31 1y77 s HIS 147 Cb 0.20 -3.30 0.27 0.00 0.04 0.00 0.00 32.58 29.80 1y77 s HIS 147 CO 0.39 -0.76 0.82 -1.91 -2.34 0.00 0.00 174.74 170.94 1y77 n GLU 148 N 3.48 -0.05 0.07 2.88 2.13 -1.26 -1.97 120.64 125.92 1y77 n GLU 148 Ca 0.06 0.81 -0.03 0.00 0.66 0.00 0.00 57.16 58.66 1y77 n GLU 148 Cb 0.47 -1.23 -0.02 0.00 0.27 0.00 0.00 31.44 30.94 1y77 n GLU 148 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1y77 h LEU 149 N 0.00 -0.18 -8.50 4.31 3.38 -1.95 -3.44 115.31 108.93 1y77 h LEU 149 Ca 0.27 0.01 -0.70 0.00 0.09 0.00 0.00 57.88 57.54 1y77 h LEU 149 Cb 0.44 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1y77 h LEU 149 CO -0.53 -0.01 1.33 0.52 0.09 0.00 0.00 178.44 179.84 1y77 n VAL 150 N -3.24 0.16 -2.06 1.22 0.31 -0.83 -4.93 118.33 108.96 1y77 n VAL 150 Ca -0.03 -0.17 -0.28 0.00 -0.01 0.00 0.00 64.34 63.86 1y77 n VAL 150 Cb 0.08 -1.33 0.10 0.00 -0.91 0.00 0.00 33.84 31.79 1y77 n VAL 150 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1y77 s PRO 151 N 5.81 1.81 0.14 5.55 0.04 -1.26 -4.62 135.00 142.47 1y77 s PRO 151 Ca 1.10 -0.19 -0.23 0.00 0.04 0.00 0.00 61.00 61.72 1y77 s PRO 151 Cb -1.03 -2.04 -0.08 0.00 0.04 0.00 0.00 34.50 31.39 1y77 s PRO 151 CO 0.55 -1.59 0.71 -1.59 0.04 0.00 0.00 177.00 175.12 1y77 s LYS 152 N -5.48 4.43 0.46 4.56 -2.85 -1.26 -4.98 119.74 114.62 1y77 s LYS 152 Ca 0.64 1.00 0.07 0.00 -1.00 0.00 0.00 55.97 56.68 1y77 s LYS 152 Cb -0.09 -3.21 0.00 0.00 -2.06 0.00 0.00 37.83 32.47 1y77 s LYS 152 CO 0.48 0.57 0.43 -1.01 0.10 0.00 0.00 175.35 175.92 1y77 s HIS 153 N -1.18 2.32 -0.24 1.78 3.76 -1.26 -2.77 115.29 117.70 1y77 s HIS 153 Ca 0.34 -0.60 -0.17 0.00 -0.15 0.00 0.00 55.06 54.49 1y77 s HIS 153 Cb -0.21 -2.12 0.07 0.00 1.11 0.00 0.00 32.58 31.43 1y77 s HIS 153 CO 0.24 -0.31 0.61 0.42 -0.85 0.00 0.00 174.74 174.84 1y77 s ILE 154 N -2.56 -0.01 0.41 0.60 1.01 -1.04 -4.94 121.20 114.67 1y77 s ILE 154 Ca 0.46 0.02 -0.24 0.00 0.00 0.00 0.00 60.65 60.89 1y77 s ILE 154 Cb -0.03 -0.87 -0.08 0.00 0.01 0.00 0.00 42.46 41.48 1y77 s ILE 154 CO 0.27 0.01 1.11 -0.13 0.00 0.00 0.00 174.94 176.20 1y77 s ARG 155 N 1.10 4.07 -0.11 2.79 0.52 -1.26 -0.97 118.95 125.08 1y77 s ARG 155 Ca -0.06 1.68 0.01 0.00 -0.52 0.00 0.00 55.73 56.84 1y77 s ARG 155 Cb -0.05 -2.58 -0.02 0.00 0.52 0.00 0.00 34.95 32.82 1y77 s ARG 155 CO -0.11 -0.27 -0.14 -0.51 0.02 0.00 0.00 175.30 174.30 1y77 s LEU 156 N -2.62 2.69 0.56 2.53 1.43 -0.94 -4.89 118.68 117.44 1y77 s LEU 156 Ca 0.58 -0.32 -0.21 0.00 -1.03 0.00 0.00 54.13 53.15 1y77 s LEU 156 Cb -0.26 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 1y77 s LEU 156 CO 0.33 0.20 1.35 -0.94 0.23 0.00 0.00 176.35 177.51 1y77 s SER 157 N 0.16 5.20 0.00 2.29 1.04 -1.26 -4.62 113.70 116.51 1y77 s SER 157 Ca -0.07 2.74 0.00 0.00 0.48 0.00 0.00 55.95 59.09 1y77 s SER 157 Cb -0.15 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.34 1y77 s SER 157 CO 0.05 -1.61 0.46 -1.54 0.98 0.00 0.00 173.24 171.58 1y77 n SER 158 N -1.12 0.00 -0.11 7.02 3.41 -1.26 -0.22 113.62 121.34 1y77 n SER 158 Ca 0.11 0.04 -0.17 0.00 -0.26 0.00 0.00 58.87 58.60 1y77 n SER 158 Cb 0.45 -0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.30 1y77 n SER 158 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1y77 n ASP 159 N -0.96 1.94 -0.02 4.04 8.00 -1.26 -3.61 116.55 124.67 1y77 n ASP 159 Ca 0.00 0.35 0.22 0.00 0.71 0.00 0.00 54.79 56.07 1y77 n ASP 159 Cb 0.01 -0.78 0.71 0.00 -0.02 0.00 0.00 41.12 41.04 1y77 n ASP 159 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1y77 h GLU 160 N -1.00 0.00 0.15 -1.24 5.08 -0.92 -2.40 114.58 114.26 1y77 h GLU 160 Ca -0.26 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 1y77 h GLU 160 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1y77 h GLU 160 CO -0.16 0.00 -0.07 -0.22 -1.00 0.00 0.00 179.01 177.56 1y77 h LYS 161 N 0.00 -0.19 0.00 2.33 3.64 -1.00 -2.49 116.57 118.86 1y77 h LYS 161 Ca 0.28 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 1y77 h LYS 161 Cb 1.15 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1y77 h LYS 161 CO -0.00 -0.06 0.21 -2.13 -2.27 0.00 0.00 179.45 175.20 1y77 n ARG 162 N -4.90 0.00 -0.12 1.90 0.63 -0.94 -0.02 116.66 113.21 1y77 n ARG 162 Ca -0.03 0.27 -0.25 0.00 -0.92 0.00 0.00 57.85 56.92 1y77 n ARG 162 Cb 0.11 -1.71 -0.11 0.00 0.45 0.00 0.00 32.46 31.20 1y77 n ARG 162 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1y77 n GLU 163 N -1.27 0.58 -0.34 -0.14 4.07 -0.97 -3.61 120.64 118.96 1y77 n GLU 163 Ca 0.00 0.46 0.20 0.00 -0.06 0.00 0.00 57.16 57.76 1y77 n GLU 163 Cb 0.21 -1.65 0.43 0.00 -0.06 0.00 0.00 31.44 30.37 1y77 n GLU 163 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1y77 h LEU 164 N -0.99 0.59 0.35 4.31 5.85 0.05 0.64 115.31 126.12 1y77 h LEU 164 Ca -0.48 0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.34 1y77 h LEU 164 Cb 1.43 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.49 1y77 h LEU 164 CO -0.29 0.09 -0.17 -0.07 -0.34 0.00 0.00 178.44 177.66 1y77 h LEU 165 N 0.51 -0.40 -2.11 2.25 3.38 -1.65 -2.98 115.31 114.31 1y77 h LEU 165 Ca 0.63 -0.15 0.08 0.00 0.09 0.00 0.00 57.88 58.53 1y77 h LEU 165 Cb 1.35 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 1y77 h LEU 165 CO -0.42 0.02 0.30 0.50 0.09 0.00 0.00 178.44 178.93 1y77 h LYS 166 N -0.91 0.00 0.00 1.13 3.64 -1.26 0.38 116.57 119.55 1y77 h LYS 166 Ca -0.05 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 1y77 h LYS 166 Cb 0.53 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1y77 h LYS 166 CO 0.08 0.00 -0.84 0.00 -2.27 0.00 0.00 179.45 176.42 1y77 h ARG 167 N 0.00 0.00 -0.21 1.90 2.47 -0.93 -3.30 114.38 114.30 1y77 h ARG 167 Ca 0.14 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 1y77 h ARG 167 Cb 0.74 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.06 1y77 h ARG 167 CO -0.00 0.20 0.00 0.66 0.56 0.00 0.00 179.97 181.39 1y77 n TYR 168 N -2.94 0.27 -3.39 3.04 0.53 -0.52 -4.96 117.16 109.19 1y77 n TYR 168 Ca -0.02 -0.25 -0.25 0.00 -1.02 0.00 0.00 57.90 56.37 1y77 n TYR 168 Cb 0.68 -0.01 0.02 0.00 -1.03 0.00 0.00 39.34 38.99 1y77 n TYR 168 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 1y77 n ARG 169 N 0.72 -4.37 -3.41 -0.72 1.74 0.12 -4.94 116.66 105.80 1y77 n ARG 169 Ca 0.11 0.63 -0.31 0.00 -0.77 0.00 0.00 57.85 57.50 1y77 n ARG 169 Cb 0.39 -5.43 -0.05 0.00 -1.02 0.00 0.00 32.46 26.35 1y77 n ARG 169 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1y77 s LEU 170 N -6.73 4.15 0.23 0.55 1.43 -0.81 -5.02 118.68 112.48 1y77 s LEU 170 Ca 0.44 0.86 0.01 0.00 -1.03 0.00 0.00 54.13 54.41 1y77 s LEU 170 Cb -0.22 -3.64 -0.04 0.00 0.03 0.00 0.00 46.19 42.33 1y77 s LEU 170 CO 0.54 -0.09 0.40 -0.54 0.23 0.00 0.00 176.35 176.89 1y77 s LYS 171 N -2.94 3.49 0.24 1.70 -0.14 -1.26 -4.73 119.74 116.10 1y77 s LYS 171 Ca 0.46 -0.43 -0.05 0.00 -1.36 0.00 0.00 55.97 54.60 1y77 s LYS 171 Cb -0.11 -2.83 0.42 0.00 -1.68 0.00 0.00 37.83 33.62 1y77 s LYS 171 CO 0.23 0.38 1.77 1.49 -0.76 0.00 0.00 175.35 178.45 1y77 h GLU 172 N 1.69 0.57 0.00 1.68 4.81 -1.99 -2.52 114.58 118.82 1y77 h GLU 172 Ca -0.49 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.69 1y77 h GLU 172 Cb 1.20 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.45 1y77 h GLU 172 CO 0.66 0.38 -0.08 0.66 -0.73 0.00 0.00 179.01 179.90 1y77 h SER 173 N 0.59 0.00 -0.07 1.04 4.64 -2.03 -2.83 113.55 114.89 1y77 h SER 173 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 1y77 h SER 173 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1y77 h SER 173 CO -0.32 0.08 0.00 0.00 -0.87 0.00 0.00 176.83 175.72 1y77 n GLN 174 N -3.36 1.23 -3.65 4.77 6.02 -0.95 -4.85 117.38 116.59 1y77 n GLN 174 Ca -0.01 -0.35 -0.37 0.00 -0.01 0.00 0.00 57.00 56.25 1y77 n GLN 174 Cb 0.24 -1.23 -0.06 0.00 1.02 0.00 0.00 30.24 30.22 1y77 n GLN 174 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1y77 s LEU 175 N -1.35 4.43 0.20 1.08 1.43 -1.07 -4.98 118.68 118.43 1y77 s LEU 175 Ca 0.20 0.76 -0.32 0.00 -1.03 0.00 0.00 54.13 53.75 1y77 s LEU 175 Cb 0.10 -2.46 -0.12 0.00 0.03 0.00 0.00 46.19 43.75 1y77 s LEU 175 CO 0.16 0.34 1.70 -2.84 0.23 0.00 0.00 176.35 175.93 1y77 s PRO 176 N -1.18 4.14 0.28 1.29 0.02 -1.26 -4.73 135.00 133.57 1y77 s PRO 176 Ca 0.22 2.57 0.07 0.00 0.02 0.00 0.00 61.00 63.88 1y77 s PRO 176 Cb -0.15 -3.09 -0.03 0.00 0.02 0.00 0.00 34.50 31.25 1y77 s PRO 176 CO 0.11 -0.73 0.23 1.03 -0.33 0.00 0.00 177.00 177.30 1y77 s ARG 177 N 1.17 2.84 0.07 5.54 0.52 -1.26 -0.32 118.95 127.50 1y77 s ARG 177 Ca 0.74 -1.14 0.07 0.00 -0.52 0.00 0.00 55.73 54.87 1y77 s ARG 177 Cb -0.49 -2.53 -0.03 0.00 0.52 0.00 0.00 34.95 32.43 1y77 s ARG 177 CO 0.32 0.29 -0.18 -1.50 0.02 0.00 0.00 175.30 174.25 1y77 s ILE 178 N -2.20 1.48 0.35 1.52 2.07 0.12 -4.79 121.20 119.75 1y77 s ILE 178 Ca 0.36 -1.28 -0.28 0.00 -1.41 0.00 0.00 60.65 58.04 1y77 s ILE 178 Cb -0.07 -1.33 -0.09 0.00 0.13 0.00 0.00 42.46 41.09 1y77 s ILE 178 CO 0.25 0.01 1.22 -1.10 -1.91 0.00 0.00 174.94 173.41 1y77 s GLN 179 N -1.49 4.30 0.57 3.50 -1.52 -1.26 -2.83 119.66 120.93 1y77 s GLN 179 Ca 0.04 2.00 0.35 0.00 -1.95 0.00 0.00 55.36 55.80 1y77 s GLN 179 Cb -0.09 -2.96 1.71 0.00 -0.22 0.00 0.00 33.01 31.45 1y77 s GLN 179 CO 0.03 -0.16 2.13 -0.09 -0.25 0.00 0.00 175.29 176.95 1y77 h ARG 180 N 3.20 0.00 0.00 2.91 2.43 -1.97 -1.38 114.38 119.58 1y77 h ARG 180 Ca -0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1y77 h ARG 180 Cb 1.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1y77 h ARG 180 CO 0.65 0.05 -1.05 0.00 -1.51 0.00 0.00 179.97 178.10 1y77 n ALA 181 N -2.15 4.34 -1.61 2.80 0.00 -1.26 -4.67 120.51 117.96 1y77 n ALA 181 Ca -0.01 -0.55 -0.56 0.00 0.00 0.00 0.00 53.44 52.32 1y77 n ALA 181 Cb 0.22 -0.71 -0.07 0.00 0.00 0.00 0.00 19.45 18.88 1y77 n ALA 181 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1y77 n ASP 182 N -1.56 1.37 -0.34 0.00 -0.08 -0.52 -4.76 116.55 110.65 1y77 n ASP 182 Ca 0.03 1.13 -0.06 0.00 -1.51 0.00 0.00 54.79 54.37 1y77 n ASP 182 Cb 0.33 -1.09 -0.04 0.00 2.34 0.00 0.00 41.12 42.66 1y77 n ASP 182 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1y77 n PRO 183 N 2.94 -0.31 0.20 -0.67 -0.02 -1.26 -0.28 135.00 135.60 1y77 n PRO 183 Ca 0.21 1.28 0.04 0.00 -2.02 0.00 0.00 63.50 63.01 1y77 n PRO 183 Cb 0.13 -1.89 0.41 0.00 -0.02 0.00 0.00 33.50 32.13 1y77 n PRO 183 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1y77 h VAL 184 N 0.00 1.20 -0.06 -1.45 2.07 -1.96 -2.01 116.25 114.04 1y77 h VAL 184 Ca 0.19 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 1y77 h VAL 184 Cb 0.40 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1y77 h VAL 184 CO -0.81 0.31 -0.11 0.00 0.02 0.00 0.00 177.57 176.98 1y77 h ALA 185 N 1.68 1.71 0.22 1.67 0.00 -0.93 -2.29 119.26 121.33 1y77 h ALA 185 Ca -0.00 -0.14 -0.33 0.00 0.00 0.00 0.00 54.91 54.44 1y77 h ALA 185 Cb 0.57 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 18.34 1y77 h ALA 185 CO 0.04 0.22 -1.49 -0.07 0.00 0.00 0.00 179.25 177.95 1y77 h LEU 186 N 0.09 0.72 -2.44 0.00 3.38 -0.92 0.14 115.31 116.29 1y77 h LEU 186 Ca 0.02 -0.82 0.01 0.00 0.09 0.00 0.00 57.88 57.18 1y77 h LEU 186 Cb 0.25 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1y77 h LEU 186 CO 0.02 1.65 0.18 0.22 0.09 0.00 0.00 178.44 180.60 1y77 h TYR 187 N 0.13 0.00 0.00 1.13 3.20 -0.81 -1.09 116.97 119.52 1y77 h TYR 187 Ca -0.25 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.62 1y77 h TYR 187 Cb 2.12 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.39 1y77 h TYR 187 CO 0.11 0.00 -0.18 1.28 -1.64 0.00 0.00 178.16 177.74 1y77 n LEU 188 N -3.07 0.04 -2.70 2.82 4.77 -1.08 -4.78 117.00 113.00 1y77 n LEU 188 Ca -0.02 -0.43 -0.02 0.00 -0.03 0.00 0.00 56.01 55.51 1y77 n LEU 188 Cb 0.25 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1y77 n LEU 188 CO 0.18 0.01 0.20 0.61 -1.33 0.00 0.00 177.39 177.06 1y77 n GLY 189 N 1.21 -1.10 3.91 -0.72 0.00 0.35 -4.97 105.19 103.87 1y77 n GLY 189 Ca 0.00 0.55 -0.28 0.00 0.00 0.00 0.00 46.02 46.29 1y77 n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y77 s LEU 190 N -3.19 2.82 -0.02 0.99 1.43 -0.36 -5.02 118.68 115.33 1y77 s LEU 190 Ca 0.06 0.77 0.02 0.00 -1.03 0.00 0.00 54.13 53.95 1y77 s LEU 190 Cb -0.02 -3.44 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1y77 s LEU 190 CO 0.61 -1.53 -0.07 -0.54 0.23 0.00 0.00 176.35 175.05 1y77 s LYS 191 N -5.33 0.80 -0.93 1.70 1.02 -1.26 -5.02 119.74 110.72 1y77 s LYS 191 Ca 0.59 -0.25 -0.24 0.00 0.02 0.00 0.00 55.97 56.10 1y77 s LYS 191 Cb -0.11 -0.77 -0.23 0.00 -0.52 0.00 0.00 37.83 36.20 1y77 s LYS 191 CO 0.48 0.09 2.39 -2.13 -0.92 0.00 0.00 175.35 175.26 1y77 n ARG 192 N 3.31 0.00 0.00 1.68 0.63 -1.26 0.11 116.66 121.13 1y77 n ARG 192 Ca -0.18 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.75 1y77 n ARG 192 Cb 0.55 -1.28 0.00 0.00 0.45 0.00 0.00 32.46 32.17 1y77 n ARG 192 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1y77 n GLY 193 N 5.83 1.19 3.73 5.14 0.00 -1.24 -5.01 105.19 114.84 1y77 n GLY 193 Ca 0.62 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.23 1y77 n GLY 193 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y77 s GLU 194 N 0.00 4.43 0.06 1.61 2.02 0.29 -4.65 118.70 122.47 1y77 s GLU 194 Ca 0.00 1.95 -0.02 0.00 0.02 0.00 0.00 54.97 56.91 1y77 s GLU 194 Cb 0.00 -3.24 -0.04 0.00 0.10 0.00 0.00 34.13 30.95 1y77 s GLU 194 CO 0.00 -0.20 0.25 0.08 0.02 0.00 0.00 175.26 175.42 1y77 s VAL 195 N 0.23 5.33 0.04 2.63 1.01 -1.26 -2.88 120.40 125.50 1y77 s VAL 195 Ca 0.56 -0.18 0.08 0.00 0.00 0.00 0.00 61.98 62.43 1y77 s VAL 195 Cb -0.34 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 1y77 s VAL 195 CO 0.36 0.17 -0.22 -0.69 0.00 0.00 0.00 175.10 174.72 1y77 s VAL 196 N -1.49 1.76 -0.30 2.92 1.01 0.14 -2.22 120.40 122.22 1y77 s VAL 196 Ca 0.34 -1.21 -0.09 0.00 0.00 0.00 0.00 61.98 61.02 1y77 s VAL 196 Cb -0.13 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1y77 s VAL 196 CO 0.24 0.26 0.14 -0.75 0.00 0.00 0.00 175.10 174.99 1y77 s LYS 197 N -1.13 3.40 -0.38 2.72 2.20 -0.15 -0.70 119.74 125.70 1y77 s LYS 197 Ca 0.08 -0.67 -0.14 0.00 -0.36 0.00 0.00 55.97 54.88 1y77 s LYS 197 Cb -0.09 -3.53 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 1y77 s LYS 197 CO 0.02 -0.37 0.28 0.42 -0.36 0.00 0.00 175.35 175.34 1y77 s ILE 198 N 1.62 5.26 -0.40 5.43 1.01 0.36 -2.50 121.20 131.98 1y77 s ILE 198 Ca 0.05 -0.42 -0.08 0.00 0.00 0.00 0.00 60.65 60.20 1y77 s ILE 198 Cb -0.17 -3.84 0.07 0.00 0.01 0.00 0.00 42.46 38.53 1y77 s ILE 198 CO 0.06 -0.18 0.21 -0.63 0.00 0.00 0.00 174.94 174.41 1y77 s ILE 199 N 1.74 4.05 0.47 2.92 1.01 -1.12 0.12 121.20 130.39 1y77 s ILE 199 Ca 0.06 -1.37 0.03 0.00 0.00 0.00 0.00 60.65 59.37 1y77 s ILE 199 Cb -0.18 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.80 1y77 s ILE 199 CO 0.10 -0.43 0.01 0.00 0.00 0.00 0.00 174.94 174.62 1y77 s ARG 200 N 1.40 2.10 0.38 2.79 1.70 -0.97 -4.14 118.95 122.21 1y77 s ARG 200 Ca 0.02 -2.29 -0.09 0.00 -0.47 0.00 0.00 55.73 52.90 1y77 s ARG 200 Cb -0.22 -1.54 -0.06 0.00 -0.57 0.00 0.00 34.95 32.56 1y77 s ARG 200 CO 0.02 -0.25 0.73 0.15 -1.08 0.00 0.00 175.30 174.86 1y77 s LYS 201 N -3.82 3.75 -0.09 3.89 -0.14 -1.26 -1.22 119.74 120.86 1y77 s LYS 201 Ca 0.17 0.38 -0.04 0.00 -1.36 0.00 0.00 55.97 55.11 1y77 s LYS 201 Cb 0.05 -2.44 0.04 0.00 -1.68 0.00 0.00 37.83 33.80 1y77 s LYS 201 CO 0.09 0.02 0.21 0.45 -0.76 0.00 0.00 175.35 175.35 1y77 s SER 202 N -3.14 -0.21 0.00 2.83 0.15 0.23 -4.79 113.70 108.77 1y77 s SER 202 Ca 0.50 0.44 0.12 0.00 0.70 0.00 0.00 55.95 57.71 1y77 s SER 202 Cb -0.10 0.33 0.71 0.00 -1.71 0.00 0.00 66.02 65.25 1y77 s SER 202 CO 0.31 -0.16 1.23 -1.84 1.20 0.00 0.00 173.24 173.98 1y77 n GLU 203 N 4.18 0.69 -0.03 5.44 0.28 -1.26 -2.11 120.64 127.82 1y77 n GLU 203 Ca -0.25 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.72 1y77 n GLU 203 Cb 0.53 -1.27 -0.06 0.00 1.43 0.00 0.00 31.44 32.06 1y77 n GLU 203 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1y77 n THR 204 N -0.77 0.47 -3.15 3.84 5.66 -1.26 -4.96 114.28 114.12 1y77 n THR 204 Ca 0.09 -0.32 0.05 0.00 -3.05 0.00 0.00 64.05 60.82 1y77 n THR 204 Cb 0.04 -0.64 -0.01 0.00 -1.55 0.00 0.00 70.33 68.17 1y77 n THR 204 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1y77 s SER 205 N -3.85 -0.97 0.00 1.09 1.04 -0.90 -5.08 113.70 105.03 1y77 s SER 205 Ca -0.04 0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.85 1y77 s SER 205 Cb 0.03 1.75 0.00 0.00 0.10 0.00 0.00 66.02 67.90 1y77 s SER 205 CO 0.33 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.98 1y77 n GLY 206 N 5.40 0.00 3.28 7.32 0.00 -1.03 -3.86 105.19 116.31 1y77 n GLY 206 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1y77 n GLY 206 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y77 s ARG 207 N -1.22 2.00 -0.08 1.61 0.52 -1.26 0.75 118.95 121.27 1y77 s ARG 207 Ca 0.00 -0.87 0.02 0.00 -0.52 0.00 0.00 55.73 54.35 1y77 s ARG 207 Cb 0.00 -1.92 0.02 0.00 0.52 0.00 0.00 34.95 33.56 1y77 s ARG 207 CO 0.00 0.52 -0.12 -0.47 0.02 0.00 0.00 175.30 175.25 1y77 s TYR 208 N -0.56 1.56 -0.12 -0.53 5.04 -0.35 -4.88 117.35 117.50 1y77 s TYR 208 Ca 0.09 -0.64 -0.19 0.00 -2.44 0.00 0.00 57.07 53.88 1y77 s TYR 208 Cb -0.10 -1.17 -0.04 0.00 0.35 0.00 0.00 41.96 41.01 1y77 s TYR 208 CO -0.01 -0.35 0.53 0.00 -1.34 0.00 0.00 175.55 174.37 1y77 s ALA 209 N 0.89 3.46 0.12 3.97 0.00 -1.26 -2.29 121.76 126.66 1y77 s ALA 209 Ca -0.10 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.71 1y77 s ALA 209 Cb -0.15 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 1y77 s ALA 209 CO 0.01 -0.10 -0.03 0.45 0.00 0.00 0.00 175.76 176.09 1y77 s SER 210 N 0.74 1.04 0.07 0.00 0.15 0.12 -4.98 113.70 110.84 1y77 s SER 210 Ca 0.28 -1.08 0.06 0.00 0.70 0.00 0.00 55.95 55.91 1y77 s SER 210 Cb -0.16 0.13 -0.03 0.00 -1.71 0.00 0.00 66.02 64.25 1y77 s SER 210 CO 0.11 -0.53 -0.15 -0.31 1.20 0.00 0.00 173.24 173.56 1y77 s TYR 211 N -3.70 1.33 -0.12 3.44 1.51 -1.26 0.14 117.35 118.69 1y77 s TYR 211 Ca 0.16 -0.43 -0.03 0.00 -1.01 0.00 0.00 57.07 55.77 1y77 s TYR 211 Cb 0.06 -0.75 0.04 0.00 -0.11 0.00 0.00 41.96 41.20 1y77 s TYR 211 CO -0.02 0.08 0.04 1.03 -1.11 0.00 0.00 175.55 175.57 1y77 s ARG 212 N -1.63 0.42 0.72 -0.62 1.81 0.12 -4.25 118.95 115.52 1y77 s ARG 212 Ca 0.00 -0.03 -0.04 0.00 -1.72 0.00 0.00 55.73 53.94 1y77 s ARG 212 Cb -0.10 -1.38 0.10 0.00 -0.45 0.00 0.00 34.95 33.13 1y77 s ARG 212 CO 0.02 -0.47 1.01 -1.50 -0.68 0.00 0.00 175.30 173.68 1y77 s ILE 213 N 2.00 2.25 0.14 1.52 2.07 0.56 0.23 121.20 129.97 1y77 s ILE 213 Ca 0.03 -0.44 0.09 0.00 -1.41 0.00 0.00 60.65 58.91 1y77 s ILE 213 Cb -0.14 -2.81 -0.04 0.00 0.13 0.00 0.00 42.46 39.60 1y77 s ILE 213 CO -0.06 0.00 -0.14 0.00 -1.91 0.00 0.00 174.94 172.83