#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ayp n LEU 2 N 0.00 0.58 -0.03 -4.53 4.77 -1.05 -1.30 117.00 115.43 1ayp n LEU 2 Ca 0.00 0.64 -0.16 0.00 -0.03 0.00 0.00 56.01 56.46 1ayp n LEU 2 Cb 0.00 -0.55 -0.13 0.00 -2.33 0.00 0.00 43.42 40.41 1ayp n LEU 2 CO 0.00 -0.49 0.31 -0.37 -1.33 0.00 0.00 177.39 175.52 1ayp h VAL 3 N 0.00 1.68 -0.25 4.08 -1.51 -1.97 -2.11 116.25 116.16 1ayp h VAL 3 Ca 0.00 -2.29 0.05 0.00 -1.23 0.00 0.00 66.70 63.23 1ayp h VAL 3 Cb 0.37 3.21 -0.08 0.00 -2.13 0.00 0.00 31.29 32.67 1ayp h VAL 3 CO 0.00 0.61 -0.47 0.78 -1.23 0.00 0.00 177.57 177.27 1ayp h ASN 4 N -0.75 -1.51 -0.81 4.19 -0.26 -1.85 0.49 115.58 115.09 1ayp h ASN 4 Ca -0.04 0.20 0.08 0.00 -0.56 0.00 0.00 56.30 55.99 1ayp h ASN 4 Cb 1.14 0.62 -0.05 0.00 -1.06 0.00 0.00 38.32 38.97 1ayp h ASN 4 CO 0.05 -0.42 0.53 0.15 -1.06 0.00 0.00 177.43 176.67 1ayp h PHE 5 N -0.45 0.84 -0.53 1.19 3.57 -1.32 -1.50 116.94 118.73 1ayp h PHE 5 Ca 0.09 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1ayp h PHE 5 Cb 0.62 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 1ayp h PHE 5 CO -0.58 0.41 0.28 1.25 -2.23 0.00 0.00 178.31 177.44 1ayp h HIS 6 N 0.80 0.75 -0.21 0.41 2.76 -0.26 -1.74 115.15 117.65 1ayp h HIS 6 Ca 0.36 -0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.38 1ayp h HIS 6 Cb 0.36 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 1ayp h HIS 6 CO -0.00 0.56 -0.39 0.00 -1.30 0.00 0.00 177.93 176.80 1ayp h ARG 7 N 0.71 0.49 0.09 5.26 -0.00 -0.11 -3.15 114.38 117.68 1ayp h ARG 7 Ca 0.19 -0.24 -0.00 0.00 -0.50 0.00 0.00 59.98 59.42 1ayp h ARG 7 Cb 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.05 1ayp h ARG 7 CO -0.03 0.80 -0.05 0.52 0.00 0.00 0.00 179.97 181.22 1ayp h MET 8 N 0.40 -0.12 -0.95 0.04 2.86 -0.92 -1.47 114.93 114.77 1ayp h MET 8 Ca 0.04 0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.74 1ayp h MET 8 Cb 0.87 0.03 -0.06 0.00 0.06 0.00 0.00 31.60 32.49 1ayp h MET 8 CO 0.07 0.06 0.61 0.82 1.06 0.00 0.00 176.91 179.53 1ayp h ILE 9 N -0.29 1.10 0.65 -1.22 2.04 -1.39 -2.37 117.51 116.03 1ayp h ILE 9 Ca -0.01 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.43 1ayp h ILE 9 Cb 0.24 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 1ayp h ILE 9 CO 0.02 0.21 -0.44 0.50 0.00 0.00 0.00 178.15 178.44 1ayp h LYS 10 N 1.13 -1.00 -0.78 2.37 1.63 -1.46 0.22 116.57 118.68 1ayp h LYS 10 Ca 0.40 0.07 0.14 0.00 -0.85 0.00 0.00 60.65 60.41 1ayp h LYS 10 Cb 0.12 0.23 -0.14 0.00 -0.60 0.00 0.00 32.23 31.84 1ayp h LYS 10 CO -0.16 -0.66 -0.28 -0.07 -3.45 0.00 0.00 179.45 174.83 1ayp h LEU 11 N -1.03 -1.01 0.00 5.20 3.38 -0.96 0.39 115.31 121.28 1ayp h LEU 11 Ca -0.09 0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.97 1ayp h LEU 11 Cb 0.84 0.57 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 1ayp h LEU 11 CO 0.06 -0.28 -0.84 0.71 0.09 0.00 0.00 178.44 178.18 1ayp h THR 12 N -0.05 1.16 0.00 0.22 1.35 -1.16 -3.39 112.91 111.03 1ayp h THR 12 Ca 0.33 -2.69 -0.11 0.00 -0.55 0.00 0.00 66.41 63.39 1ayp h THR 12 Cb 0.58 2.55 -0.02 0.00 -1.73 0.00 0.00 68.15 69.54 1ayp h THR 12 CO -0.82 0.66 -1.38 0.35 -0.25 0.00 0.00 175.52 174.08 1ayp n THR 13 N -3.23 0.38 0.00 6.82 -2.24 0.75 -4.70 114.28 112.05 1ayp n THR 13 Ca -0.01 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1ayp n THR 13 Cb 0.84 -1.25 0.00 0.00 -2.10 0.00 0.00 70.33 67.82 1ayp n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ayp n GLY 14 N 2.81 0.73 3.88 3.38 0.00 0.14 -5.02 105.19 111.11 1ayp n GLY 14 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 1ayp n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ayp s LYS 15 N -0.82 3.65 -0.37 1.61 -0.14 -1.26 -4.97 119.74 117.44 1ayp s LYS 15 Ca 0.00 -0.00 -0.28 0.00 -1.36 0.00 0.00 55.97 54.33 1ayp s LYS 15 Cb 0.00 -2.99 -0.02 0.00 -1.68 0.00 0.00 37.83 33.14 1ayp s LYS 15 CO 0.00 0.57 1.77 -2.00 -0.76 0.00 0.00 175.35 174.93 1ayp s GLU 16 N -2.05 3.28 0.18 1.68 -6.30 -1.26 -3.95 118.70 110.27 1ayp s GLU 16 Ca 0.33 1.29 -0.13 0.00 -2.50 0.00 0.00 54.97 53.96 1ayp s GLU 16 Cb -0.13 -4.20 0.12 0.00 0.00 0.00 0.00 34.13 29.92 1ayp s GLU 16 CO 0.19 -1.93 1.81 0.00 0.02 0.00 0.00 175.26 175.35 1ayp h ALA 17 N 12.90 0.69 -0.12 6.30 0.00 -1.95 -2.15 119.26 134.93 1ayp h ALA 17 Ca -0.32 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.62 1ayp h ALA 17 Cb 1.16 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1ayp h ALA 17 CO 1.06 0.00 -0.08 0.00 0.00 0.00 0.00 179.25 180.23 1ayp h ALA 18 N 1.25 0.02 0.15 0.00 0.00 -1.95 -1.06 119.26 117.67 1ayp h ALA 18 Ca 0.22 0.05 -0.35 0.00 0.00 0.00 0.00 54.91 54.83 1ayp h ALA 18 Cb 0.06 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ayp h ALA 18 CO -0.11 -0.53 -1.82 -0.07 0.00 0.00 0.00 179.25 176.71 1ayp h LEU 19 N -0.09 0.51 -1.14 0.00 -0.00 -1.99 -1.76 115.31 110.83 1ayp h LEU 19 Ca 0.08 -0.88 0.01 0.00 -0.00 0.00 0.00 57.88 57.09 1ayp h LEU 19 Cb 0.20 -0.17 -0.04 0.00 -0.00 0.00 0.00 40.66 40.65 1ayp h LEU 19 CO -0.18 1.76 0.58 0.28 -0.00 0.00 0.00 178.44 180.88 1ayp h SER 20 N 0.09 1.00 0.00 -0.43 0.02 -1.26 -3.37 113.55 109.60 1ayp h SER 20 Ca -0.36 -0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.49 1ayp h SER 20 Cb 2.07 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 64.34 1ayp h SER 20 CO 0.14 0.72 -1.32 -1.22 -1.14 0.00 0.00 176.83 174.02 1ayp n TYR 21 N -4.40 0.00 -0.38 3.45 4.01 -0.41 -4.56 117.16 114.86 1ayp n TYR 21 Ca 0.10 0.00 0.30 0.00 -0.16 0.00 0.00 57.90 58.14 1ayp n TYR 21 Cb 0.02 -0.22 0.46 0.00 -0.31 0.00 0.00 39.34 39.28 1ayp n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ayp n GLY 22 N 2.64 -0.57 0.00 2.72 0.00 -0.66 -0.99 105.19 108.32 1ayp n GLY 22 Ca -0.07 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1ayp n GLY 22 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ayp n PHE 23 N -3.04 0.00 -1.68 1.61 3.01 -1.25 -3.26 117.46 112.86 1ayp n PHE 23 Ca 0.25 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.28 1ayp n PHE 23 Cb 1.17 0.02 -0.01 0.00 -0.01 0.00 0.00 39.48 40.65 1ayp n PHE 23 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1ayp n TYR 24 N 0.00 2.12 -3.88 1.38 4.19 -0.16 -3.30 117.16 117.50 1ayp n TYR 24 Ca 0.00 0.55 0.00 0.00 3.31 0.00 0.00 57.90 61.76 1ayp n TYR 24 Cb 0.37 -2.40 0.00 0.00 0.49 0.00 0.00 39.34 37.80 1ayp n TYR 24 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1ayp n GLY 25 N 1.07 0.85 0.14 2.98 0.00 -0.13 -2.61 105.19 107.49 1ayp n GLY 25 Ca 0.07 -0.84 0.12 0.00 0.00 0.00 0.00 46.02 45.36 1ayp n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ayp n HIS 27 N -2.64 0.00 -2.91 0.00 8.25 -1.26 -2.28 115.22 114.38 1ayp n HIS 27 Ca 0.03 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.09 1ayp n HIS 27 Cb 0.51 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.56 1ayp n HIS 27 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ayp n GLY 29 N 2.02 -2.97 3.70 0.00 0.00 -1.20 -3.70 105.19 103.04 1ayp n GLY 29 Ca -0.02 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 1ayp n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ayp s VAL 30 N -0.48 3.22 0.00 1.61 0.11 -1.26 -4.70 120.40 118.90 1ayp s VAL 30 Ca 0.00 0.79 0.00 0.00 -2.93 0.00 0.00 61.98 59.84 1ayp s VAL 30 Cb 0.00 -3.51 0.00 0.00 -1.53 0.00 0.00 36.38 31.34 1ayp s VAL 30 CO 0.00 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.41 1ayp n GLY 31 N 3.68 0.48 0.00 6.54 0.00 -1.26 -5.03 105.19 109.60 1ayp n GLY 31 Ca 0.13 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1ayp n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ayp n GLY 32 N 0.00 4.59 3.24 -0.02 0.00 -1.26 -4.62 105.19 107.11 1ayp n GLY 32 Ca 0.00 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 1ayp n GLY 32 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ayp s ARG 33 N -3.40 1.03 1.24 1.61 1.70 -0.97 -4.92 118.95 115.24 1ayp s ARG 33 Ca 0.00 -1.40 0.00 0.00 -0.47 0.00 0.00 55.73 53.86 1ayp s ARG 33 Cb 0.00 -0.63 0.00 0.00 -0.57 0.00 0.00 34.95 33.75 1ayp s ARG 33 CO 0.00 0.08 0.00 0.41 -1.08 0.00 0.00 175.30 174.71 1ayp n GLY 34 N -0.04 -1.58 3.71 3.88 0.00 -1.26 -4.67 105.19 105.22 1ayp n GLY 34 Ca -0.11 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 1ayp n GLY 34 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ayp n SER 35 N -1.63 2.92 -4.68 1.61 7.64 -0.78 -3.67 113.62 115.03 1ayp n SER 35 Ca 0.00 1.21 -0.44 0.00 1.01 0.00 0.00 58.87 60.65 1ayp n SER 35 Cb 0.09 -1.50 -0.03 0.00 -1.01 0.00 0.00 64.21 61.75 1ayp n SER 35 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1ayp n PRO 36 N 0.56 2.64 0.31 1.43 -0.04 -1.26 -4.74 135.00 133.90 1ayp n PRO 36 Ca 0.04 0.96 0.19 0.00 -0.04 0.00 0.00 63.50 64.65 1ayp n PRO 36 Cb 0.36 -2.85 1.00 0.00 -0.04 0.00 0.00 33.50 31.97 1ayp n PRO 36 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1ayp h LYS 37 N 8.78 0.00 0.00 0.54 1.79 -1.91 -3.47 116.57 122.29 1ayp h LYS 37 Ca -0.47 0.00 0.07 0.00 -2.18 0.00 0.00 60.65 58.06 1ayp h LYS 37 Cb 1.24 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.88 1ayp h LYS 37 CO 0.94 0.02 0.30 -0.40 -1.08 0.00 0.00 179.45 179.23 1ayp n ASP 38 N -3.36 -1.06 0.16 0.86 5.75 -1.26 -5.01 116.55 112.63 1ayp n ASP 38 Ca -0.02 -1.60 0.06 0.00 -0.01 0.00 0.00 54.79 53.21 1ayp n ASP 38 Cb 0.13 1.74 0.52 0.00 -1.03 0.00 0.00 41.12 42.48 1ayp n ASP 38 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ayp h ALA 39 N 2.00 1.79 0.00 2.12 0.00 -1.94 -1.33 119.26 121.91 1ayp h ALA 39 Ca -0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1ayp h ALA 39 Cb 0.69 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1ayp h ALA 39 CO 0.22 0.17 -0.16 1.15 0.00 0.00 0.00 179.25 180.62 1ayp h THR 40 N 0.18 0.34 0.04 0.00 2.02 -1.91 -2.22 112.91 111.36 1ayp h THR 40 Ca 0.05 -1.13 -0.30 0.00 0.77 0.00 0.00 66.41 65.80 1ayp h THR 40 Cb 0.10 1.87 -0.04 0.00 -1.74 0.00 0.00 68.15 68.34 1ayp h THR 40 CO -0.00 0.16 -1.68 -0.78 0.37 0.00 0.00 175.52 173.59 1ayp h ASP 41 N 0.00 0.12 -0.68 4.18 3.58 -1.77 -2.89 116.42 118.96 1ayp h ASP 41 Ca -0.00 -0.23 0.08 0.00 0.42 0.00 0.00 57.03 57.30 1ayp h ASP 41 Cb 0.86 -0.04 -0.06 0.00 1.72 0.00 0.00 39.33 41.80 1ayp h ASP 41 CO 0.02 1.20 0.34 -0.09 -2.88 0.00 0.00 179.24 177.84 1ayp h ARG 42 N 0.02 0.59 -1.02 0.28 1.12 -1.27 -1.42 114.38 112.68 1ayp h ARG 42 Ca -0.28 -0.04 0.25 0.00 -1.11 0.00 0.00 59.98 58.81 1ayp h ARG 42 Cb 2.00 -0.13 -0.12 0.00 -0.01 0.00 0.00 29.97 31.71 1ayp h ARG 42 CO 0.09 0.39 0.62 0.00 -3.11 0.00 0.00 179.97 177.96 1ayp h VAL 45 N 0.00 0.28 0.03 0.00 -1.51 -0.72 -1.79 116.25 112.54 1ayp h VAL 45 Ca -0.00 -0.87 -0.29 0.00 -1.23 0.00 0.00 66.70 64.31 1ayp h VAL 45 Cb 1.16 1.68 -0.04 0.00 -2.13 0.00 0.00 31.29 31.97 1ayp h VAL 45 CO 0.04 0.11 -1.59 0.74 -1.23 0.00 0.00 177.57 175.64 1ayp h THR 46 N 0.00 1.02 -0.03 7.19 2.02 -1.53 -2.65 112.91 118.93 1ayp h THR 46 Ca -0.00 -2.80 -0.24 0.00 0.77 0.00 0.00 66.41 64.14 1ayp h THR 46 Cb 0.67 2.56 0.01 0.00 -1.74 0.00 0.00 68.15 69.65 1ayp h THR 46 CO 0.02 0.67 -0.93 -0.74 0.37 0.00 0.00 175.52 174.90 1ayp h HIS 47 N 0.02 0.85 -0.71 3.16 2.76 -1.31 -0.15 115.15 119.77 1ayp h HIS 47 Ca -0.25 -0.44 0.01 0.00 -2.20 0.00 0.00 60.37 57.50 1ayp h HIS 47 Cb 1.98 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 30.79 1ayp h HIS 47 CO 0.02 1.26 0.47 -0.44 -1.30 0.00 0.00 177.93 177.94 1ayp h ASP 48 N 0.35 0.80 -0.75 3.26 5.19 -1.47 -2.10 116.42 121.71 1ayp h ASP 48 Ca -0.09 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.27 1ayp h ASP 48 Cb 1.57 -0.20 -0.04 0.00 0.18 0.00 0.00 39.33 40.84 1ayp h ASP 48 CO 0.17 0.58 0.36 0.00 -3.12 0.00 0.00 179.24 177.23 1ayp h TYR 51 N 0.39 0.80 0.67 0.00 -1.99 -1.22 -0.24 116.97 115.38 1ayp h TYR 51 Ca -0.04 -0.21 -0.03 0.00 2.00 0.00 0.00 58.73 60.45 1ayp h TYR 51 Cb 1.27 -0.18 -0.00 0.00 2.00 0.00 0.00 36.73 39.82 1ayp h TYR 51 CO 0.10 0.92 -0.37 -0.22 -0.00 0.00 0.00 178.16 178.59 1ayp h LYS 52 N 0.58 -0.93 -0.79 4.88 3.64 -1.00 0.51 116.57 123.46 1ayp h LYS 52 Ca 0.07 0.06 0.19 0.00 -1.27 0.00 0.00 60.65 59.70 1ayp h LYS 52 Cb 0.83 0.21 -0.13 0.00 -0.41 0.00 0.00 32.23 32.73 1ayp h LYS 52 CO 0.07 -0.62 0.09 -0.09 -2.27 0.00 0.00 179.45 176.63 1ayp h ARG 53 N -0.97 0.15 -0.09 1.90 2.43 -1.28 -1.23 114.38 115.30 1ayp h ARG 53 Ca -0.09 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.95 1ayp h ARG 53 Cb 0.77 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 1ayp h ARG 53 CO 0.11 0.10 -0.50 -0.07 -1.51 0.00 0.00 179.97 178.10 1ayp h LEU 54 N 0.15 0.27 0.43 3.80 4.07 -0.06 -2.98 115.31 121.00 1ayp h LEU 54 Ca 0.46 -0.13 -0.02 0.00 0.08 0.00 0.00 57.88 58.26 1ayp h LEU 54 Cb 0.84 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.51 1ayp h LEU 54 CO -0.65 0.73 -0.21 -0.33 -1.08 0.00 0.00 178.44 176.91 1ayp h GLU 55 N 0.20 -0.56 0.00 1.13 5.08 0.95 -2.05 114.58 119.33 1ayp h GLU 55 Ca 0.01 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1ayp h GLU 55 Cb 0.96 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 1ayp h GLU 55 CO 0.08 -0.38 -0.03 0.87 -1.00 0.00 0.00 179.01 178.55 1ayp h LYS 56 N -0.59 0.00 0.00 2.33 1.57 -1.14 0.53 116.57 119.28 1ayp h LYS 56 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1ayp h LYS 56 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1ayp h LYS 56 CO 0.10 0.03 -0.40 0.54 -0.57 0.00 0.00 179.45 179.15 1ayp n ARG 57 N -3.43 0.28 0.00 3.15 1.74 -1.12 -4.90 116.66 112.37 1ayp n ARG 57 Ca -0.02 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 1ayp n ARG 57 Cb 0.14 -1.72 0.00 0.00 -1.02 0.00 0.00 32.46 29.85 1ayp n ARG 57 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ayp n GLY 58 N 1.33 0.87 3.82 -0.13 0.00 0.19 -5.07 105.19 106.19 1ayp n GLY 58 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1ayp n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ayp s GLY 60 N -2.33 2.64 0.00 0.00 0.00 -1.26 -4.46 107.32 101.91 1ayp s GLY 60 Ca 0.63 0.61 0.00 0.00 0.00 0.00 0.00 44.72 45.96 1ayp s GLY 60 CO 0.20 0.99 0.00 -1.30 0.00 0.00 0.00 173.10 172.99 1ayp n THR 61 N -0.28 0.00 0.30 0.90 -2.24 -1.26 -4.66 114.28 107.04 1ayp n THR 61 Ca 0.06 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 62.03 1ayp n THR 61 Cb 0.51 -0.60 0.88 0.00 -2.10 0.00 0.00 70.33 69.02 1ayp n THR 61 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1ayp h LYS 62 N 0.00 0.00 0.00 -0.78 1.57 -1.96 -2.60 116.57 112.81 1ayp h LYS 62 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ayp h LYS 62 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ayp h LYS 62 CO 0.00 0.01 0.00 1.19 -0.57 0.00 0.00 179.45 180.08 1ayp n PHE 63 N -3.14 0.00 -3.35 -1.35 3.72 -1.26 -2.54 117.46 109.55 1ayp n PHE 63 Ca -0.01 -0.27 -0.38 0.00 -0.05 0.00 0.00 57.45 56.74 1ayp n PHE 63 Cb 0.22 -0.03 -0.06 0.00 -0.94 0.00 0.00 39.48 38.67 1ayp n PHE 63 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1ayp s LEU 64 N -0.54 4.34 0.11 4.37 2.96 -0.98 -4.89 118.68 124.05 1ayp s LEU 64 Ca 0.00 0.89 0.01 0.00 -0.22 0.00 0.00 54.13 54.81 1ayp s LEU 64 Cb 0.00 -2.69 -0.04 0.00 0.50 0.00 0.00 46.19 43.96 1ayp s LEU 64 CO 0.00 0.09 0.26 -0.94 -1.32 0.00 0.00 176.35 174.44 1ayp s SER 65 N 0.13 6.36 0.10 3.68 1.04 -1.26 0.63 113.70 124.38 1ayp s SER 65 Ca 0.26 0.24 0.04 0.00 0.48 0.00 0.00 55.95 56.97 1ayp s SER 65 Cb -0.16 -1.94 -0.04 0.00 0.10 0.00 0.00 66.02 63.98 1ayp s SER 65 CO 0.12 0.10 -0.11 -0.72 0.98 0.00 0.00 173.24 173.61 1ayp s TYR 66 N -1.64 1.12 -0.12 5.02 -0.85 -1.26 -4.86 117.35 114.75 1ayp s TYR 66 Ca 0.35 -0.64 -0.20 0.00 -0.52 0.00 0.00 57.07 56.06 1ayp s TYR 66 Cb -0.12 -0.61 -0.04 0.00 0.38 0.00 0.00 41.96 41.58 1ayp s TYR 66 CO 0.28 0.03 0.56 0.15 -1.52 0.00 0.00 175.55 175.05 1ayp s LYS 67 N -2.79 4.34 0.28 -3.49 -0.14 -1.26 -4.92 119.74 111.76 1ayp s LYS 67 Ca 0.06 0.58 0.02 0.00 -1.36 0.00 0.00 55.97 55.27 1ayp s LYS 67 Cb -0.03 -3.47 -0.05 0.00 -1.68 0.00 0.00 37.83 32.61 1ayp s LYS 67 CO 0.01 0.06 0.12 -0.59 -0.76 0.00 0.00 175.35 174.18 1ayp s PHE 68 N 0.91 1.56 0.05 3.18 -0.71 -1.26 -2.09 117.98 119.62 1ayp s PHE 68 Ca 0.29 -1.25 0.03 0.00 -1.04 0.00 0.00 56.93 54.96 1ayp s PHE 68 Cb -0.16 -0.89 -0.02 0.00 -1.21 0.00 0.00 43.02 40.73 1ayp s PHE 68 CO 0.12 -0.40 -0.09 -1.54 -1.34 0.00 0.00 175.22 171.98 1ayp s SER 69 N -3.34 0.96 0.36 1.98 1.04 0.10 -4.94 113.70 109.87 1ayp s SER 69 Ca 0.37 -0.56 0.08 0.00 0.48 0.00 0.00 55.95 56.33 1ayp s SER 69 Cb 0.07 0.02 -0.06 0.00 0.10 0.00 0.00 66.02 66.15 1ayp s SER 69 CO 0.15 -0.19 0.02 0.54 0.98 0.00 0.00 173.24 174.74 1ayp s ASN 70 N -1.59 4.10 -0.23 7.02 4.22 -1.26 0.46 114.94 127.66 1ayp s ASN 70 Ca -0.09 -1.10 -0.04 0.00 -2.14 0.00 0.00 52.86 49.50 1ayp s ASN 70 Cb -0.10 -0.47 0.12 0.00 1.28 0.00 0.00 41.25 42.08 1ayp s ASN 70 CO 0.01 -0.31 0.42 -0.44 -2.04 0.00 0.00 177.10 174.73 1ayp s SER 71 N -3.73 -0.09 1.49 3.54 0.01 0.91 -4.94 113.70 110.89 1ayp s SER 71 Ca 0.35 0.56 0.00 0.00 1.31 0.00 0.00 55.95 58.18 1ayp s SER 71 Cb 0.02 1.31 0.00 0.00 0.21 0.00 0.00 66.02 67.56 1ayp s SER 71 CO 0.19 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.18 1ayp n GLY 72 N 5.38 2.49 0.11 3.44 0.00 -1.26 -1.76 105.19 113.59 1ayp n GLY 72 Ca -0.05 -0.06 0.04 0.00 0.00 0.00 0.00 46.02 45.95 1ayp n GLY 72 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ayp n SER 73 N 9.89 1.54 -4.78 1.61 7.64 -1.26 -4.91 113.62 123.35 1ayp n SER 73 Ca 0.00 -2.31 -0.38 0.00 1.01 0.00 0.00 58.87 57.19 1ayp n SER 73 Cb 0.00 -0.21 -0.06 0.00 -1.01 0.00 0.00 64.21 62.93 1ayp n SER 73 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1ayp s ARG 74 N -1.45 4.16 -0.02 1.43 3.00 -0.72 -4.71 118.95 120.63 1ayp s ARG 74 Ca 0.13 0.45 0.08 0.00 -1.00 0.00 0.00 55.73 55.38 1ayp s ARG 74 Cb 0.11 -3.33 -0.02 0.00 0.00 0.00 0.00 34.95 31.71 1ayp s ARG 74 CO 0.01 0.42 -0.26 0.42 0.00 0.00 0.00 175.30 175.89 1ayp s ILE 75 N -0.23 2.05 -0.19 4.11 -1.09 -1.26 -0.06 121.20 124.53 1ayp s ILE 75 Ca 0.25 -1.10 0.00 0.00 -2.23 0.00 0.00 60.65 57.57 1ayp s ILE 75 Cb -0.16 -1.70 0.04 0.00 -1.58 0.00 0.00 42.46 39.06 1ayp s ILE 75 CO 0.12 0.58 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.44 1ayp s THR 76 N -0.56 1.39 0.20 2.92 2.01 0.17 -4.96 115.64 116.82 1ayp s THR 76 Ca 0.08 -0.85 -0.30 0.00 0.31 0.00 0.00 61.69 60.93 1ayp s THR 76 Cb -0.10 -1.53 -0.08 0.00 0.01 0.00 0.00 72.50 70.80 1ayp s THR 76 CO -0.00 0.13 1.14 0.00 -0.69 0.00 0.00 174.62 175.20 1ayp s ALA 78 N -0.29 2.81 -0.37 0.00 0.00 -0.89 -4.95 121.76 118.07 1ayp s ALA 78 Ca 0.50 0.28 -0.27 0.00 0.00 0.00 0.00 51.96 52.47 1ayp s ALA 78 Cb -0.31 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 1ayp s ALA 78 CO 0.37 -0.76 2.13 0.21 0.00 0.00 0.00 175.76 177.71 1ayp s LYS 79 N -4.27 2.82 0.37 0.00 2.20 -1.26 -4.71 119.74 114.89 1ayp s LYS 79 Ca 0.61 1.54 0.06 0.00 -0.36 0.00 0.00 55.97 57.82 1ayp s LYS 79 Cb -0.14 -4.39 -0.02 0.00 -1.51 0.00 0.00 37.83 31.76 1ayp s LYS 79 CO 0.39 -2.46 0.21 1.04 -0.36 0.00 0.00 175.35 174.17 1ayp n GLN 80 N 8.81 0.49 -1.29 4.03 6.02 -1.26 -5.06 117.38 129.12 1ayp n GLN 80 Ca 0.29 -3.36 -0.35 0.00 -0.01 0.00 0.00 57.00 53.57 1ayp n GLN 80 Cb 0.49 2.27 0.11 0.00 1.02 0.00 0.00 30.24 34.13 1ayp n GLN 80 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1ayp n ASP 81 N -1.62 1.05 -0.33 1.08 5.68 -1.26 -4.44 116.55 116.72 1ayp n ASP 81 Ca 0.01 0.65 0.17 0.00 -0.50 0.00 0.00 54.79 55.12 1ayp n ASP 81 Cb 0.60 -1.49 0.37 0.00 -1.14 0.00 0.00 41.12 39.47 1ayp n ASP 81 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1ayp h SER 82 N -0.47 0.49 -0.05 -1.12 0.02 -2.00 -0.32 113.55 110.11 1ayp h SER 82 Ca -0.47 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1ayp h SER 82 Cb 1.32 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.95 1ayp h SER 82 CO 0.47 0.00 0.03 0.00 -1.14 0.00 0.00 176.83 176.20 1ayp h ARG 84 N 0.04 0.58 -0.40 0.00 3.08 -1.79 -0.54 114.38 115.36 1ayp h ARG 84 Ca 0.02 -0.59 0.00 0.00 0.07 0.00 0.00 59.98 59.48 1ayp h ARG 84 Cb 0.01 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1ayp h ARG 84 CO -0.00 1.21 0.26 0.77 -1.07 0.00 0.00 179.97 181.14 1ayp h SER 85 N 0.35 0.46 -0.08 7.04 0.02 -1.01 -1.37 113.55 118.95 1ayp h SER 85 Ca -0.09 -0.01 -0.18 0.00 -0.84 0.00 0.00 61.79 60.67 1ayp h SER 85 Cb 1.58 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 64.01 1ayp h SER 85 CO 0.18 0.34 -0.58 -0.61 -1.14 0.00 0.00 176.83 175.02 1ayp h GLN 86 N 0.54 0.68 -0.92 3.45 -0.00 -0.97 0.49 115.11 118.38 1ayp h GLN 86 Ca 0.15 -0.45 0.01 0.00 -0.00 0.00 0.00 58.65 58.36 1ayp h GLN 86 Cb -0.06 0.06 -0.05 0.00 0.00 0.00 0.00 27.48 27.43 1ayp h GLN 86 CO -0.03 1.07 0.61 1.25 0.00 0.00 0.00 178.83 181.73 1ayp h LEU 87 N 0.52 1.06 -0.63 -2.39 5.85 -1.12 0.43 115.31 119.02 1ayp h LEU 87 Ca 0.00 -0.03 -0.15 0.00 0.84 0.00 0.00 57.88 58.55 1ayp h LEU 87 Cb 1.15 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1ayp h LEU 87 CO 0.12 0.77 -0.64 0.00 -0.34 0.00 0.00 178.44 178.34 1ayp h GLU 89 N 0.13 0.00 -0.23 0.00 4.39 -0.39 -0.94 114.58 117.54 1ayp h GLU 89 Ca -0.01 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.61 1ayp h GLU 89 Cb 1.15 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.80 1ayp h GLU 89 CO 0.10 0.66 -0.15 0.00 -1.16 0.00 0.00 179.01 178.45 1ayp h ASP 91 N 0.22 0.47 -0.48 0.00 3.32 -1.03 -2.92 116.42 115.99 1ayp h ASP 91 Ca 0.05 -0.31 -0.03 0.00 0.02 0.00 0.00 57.03 56.75 1ayp h ASP 91 Cb 0.68 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 1ayp h ASP 91 CO 0.04 1.05 0.19 0.50 -1.72 0.00 0.00 179.24 179.30 1ayp h LYS 92 N 0.26 0.77 -0.43 3.56 3.64 -1.23 -0.94 116.57 122.20 1ayp h LYS 92 Ca -0.03 -0.12 -0.09 0.00 -1.27 0.00 0.00 60.65 59.14 1ayp h LYS 92 Cb 1.32 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1ayp h LYS 92 CO 0.13 0.65 -0.07 0.00 -2.27 0.00 0.00 179.45 177.89 1ayp h ALA 93 N 1.45 0.58 0.09 5.00 0.00 -1.50 0.80 119.26 125.67 1ayp h ALA 93 Ca 0.18 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ayp h ALA 93 Cb 0.19 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1ayp h ALA 93 CO -0.01 0.44 -0.04 0.00 0.00 0.00 0.00 179.25 179.63 1ayp h ALA 94 N 0.87 -0.12 -0.05 0.00 0.00 -1.34 -1.40 119.26 117.21 1ayp h ALA 94 Ca 0.11 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ayp h ALA 94 Cb 0.60 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1ayp h ALA 94 CO 0.04 -0.42 -0.18 0.00 0.00 0.00 0.00 179.25 178.68 1ayp h ALA 95 N 0.46 -0.19 -0.83 0.00 0.00 -1.11 0.13 119.26 117.73 1ayp h ALA 95 Ca -0.01 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1ayp h ALA 95 Cb 0.35 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 1ayp h ALA 95 CO 0.02 -0.66 0.54 1.79 0.00 0.00 0.00 179.25 180.94 1ayp h THR 96 N -0.27 0.96 -0.38 0.00 1.35 -0.87 -2.09 112.91 111.60 1ayp h THR 96 Ca 0.07 -0.27 -0.14 0.00 -0.55 0.00 0.00 66.41 65.52 1ayp h THR 96 Cb 0.37 0.10 -0.01 0.00 -1.73 0.00 0.00 68.15 66.88 1ayp h THR 96 CO -0.21 0.14 -0.33 0.00 -0.25 0.00 0.00 175.52 174.88 1ayp h PHE 98 N 0.72 0.69 -0.72 0.00 0.04 -0.15 -2.69 116.94 114.83 1ayp h PHE 98 Ca 0.07 -0.14 0.04 0.00 2.80 0.00 0.00 57.97 60.74 1ayp h PHE 98 Cb 0.89 -0.17 -0.05 0.00 2.20 0.00 0.00 35.95 38.82 1ayp h PHE 98 CO 0.05 0.78 0.44 0.00 -0.60 0.00 0.00 178.31 178.99 1ayp h ALA 99 N 0.81 0.95 -0.23 2.45 0.00 -1.20 -2.60 119.26 119.43 1ayp h ALA 99 Ca 0.08 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1ayp h ALA 99 Cb 0.55 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ayp h ALA 99 CO 0.03 0.21 0.19 0.00 0.00 0.00 0.00 179.25 179.67 1ayp h ARG 100 N 0.85 0.00 -0.57 0.00 2.47 -0.95 -0.18 114.38 116.01 1ayp h ARG 100 Ca 0.29 0.00 -0.38 0.00 -1.26 0.00 0.00 59.98 58.64 1ayp h ARG 100 Cb 0.05 0.00 -0.25 0.00 -1.65 0.00 0.00 29.97 28.13 1ayp h ARG 100 CO -0.12 0.00 -0.24 0.09 0.56 0.00 0.00 179.97 180.25 1ayp n ASN 101 N -4.27 4.09 0.09 7.04 3.02 -1.01 -4.74 115.26 119.47 1ayp n ASN 101 Ca 0.03 -3.79 0.02 0.00 -0.03 0.00 0.00 54.58 50.80 1ayp n ASN 101 Cb 0.33 -0.57 0.36 0.00 -0.61 0.00 0.00 39.78 39.29 1ayp n ASN 101 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1ayp h LYS 102 N 1.58 0.32 0.00 3.52 3.64 -0.66 -2.53 116.57 122.44 1ayp h LYS 102 Ca 0.32 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1ayp h LYS 102 Cb 1.43 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.21 1ayp h LYS 102 CO 0.68 0.42 0.00 0.25 -2.27 0.00 0.00 179.45 178.53 1ayp n THR 103 N -4.28 0.42 0.44 1.00 -2.24 -1.26 -2.67 114.28 105.69 1ayp n THR 103 Ca -0.00 0.10 0.09 0.00 -2.27 0.00 0.00 64.05 61.97 1ayp n THR 103 Cb 0.26 -0.73 0.12 0.00 -2.10 0.00 0.00 70.33 67.88 1ayp n THR 103 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1ayp n THR 104 N -1.42 0.28 -1.73 4.28 -1.04 -0.96 -4.93 114.28 108.76 1ayp n THR 104 Ca 0.07 -0.64 -0.41 0.00 -2.04 0.00 0.00 64.05 61.04 1ayp n THR 104 Cb 0.23 1.12 -0.03 0.00 -1.82 0.00 0.00 70.33 69.83 1ayp n THR 104 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 1ayp s TYR 105 N -1.31 1.33 -0.30 -1.42 6.14 -1.09 -4.93 117.35 115.78 1ayp s TYR 105 Ca 0.24 0.87 -0.25 0.00 0.64 0.00 0.00 57.07 58.57 1ayp s TYR 105 Cb 0.15 -3.89 0.00 0.00 0.42 0.00 0.00 41.96 38.65 1ayp s TYR 105 CO 0.22 -3.23 0.88 1.21 0.64 0.00 0.00 175.55 175.28 1ayp s ASN 106 N 8.86 6.78 0.41 4.32 3.84 -1.26 -4.94 114.94 132.95 1ayp s ASN 106 Ca 0.92 0.85 0.10 0.00 0.21 0.00 0.00 52.86 54.93 1ayp s ASN 106 Cb -0.24 -2.45 0.87 0.00 -0.55 0.00 0.00 41.25 38.88 1ayp s ASN 106 CO 0.31 -0.68 1.98 0.11 -2.79 0.00 0.00 177.10 176.04 1ayp h LYS 107 N 8.02 0.28 -0.82 0.43 1.79 -2.01 -0.72 116.57 123.52 1ayp h LYS 107 Ca -0.23 -0.04 0.20 0.00 -2.18 0.00 0.00 60.65 58.40 1ayp h LYS 107 Cb 1.08 -0.05 -0.14 0.00 -1.58 0.00 0.00 32.23 31.54 1ayp h LYS 107 CO 0.93 0.32 0.07 0.87 -1.08 0.00 0.00 179.45 180.55 1ayp h LYS 108 N 0.27 0.12 -0.17 3.15 1.57 -2.01 -0.45 116.57 119.05 1ayp h LYS 108 Ca 0.06 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1ayp h LYS 108 Cb 0.22 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1ayp h LYS 108 CO 0.01 0.08 0.00 0.66 -0.57 0.00 0.00 179.45 179.62 1ayp n TYR 109 N -5.34 0.22 -0.22 -1.35 4.01 -0.28 -4.39 117.16 109.80 1ayp n TYR 109 Ca 0.17 -0.11 -0.02 0.00 -0.16 0.00 0.00 57.90 57.78 1ayp n TYR 109 Cb 0.57 0.00 0.17 0.00 -0.31 0.00 0.00 39.34 39.77 1ayp n TYR 109 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 1ayp h GLN 110 N 1.46 1.02 -0.68 -0.72 4.15 -1.07 -0.25 115.11 119.02 1ayp h GLN 110 Ca 0.00 -0.13 -0.45 0.00 0.77 0.00 0.00 58.65 58.84 1ayp h GLN 110 Cb 0.32 -0.19 -0.42 0.00 0.21 0.00 0.00 27.48 27.40 1ayp h GLN 110 CO 0.00 0.78 -0.92 0.66 -1.93 0.00 0.00 178.83 177.42 1ayp n TYR 111 N -4.34 2.27 -1.94 3.99 4.01 -1.26 -1.81 117.16 118.09 1ayp n TYR 111 Ca 0.07 -2.24 -0.41 0.00 -0.16 0.00 0.00 57.90 55.16 1ayp n TYR 111 Cb 0.13 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 38.84 1ayp n TYR 111 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1ayp s TYR 112 N -3.65 1.67 -0.20 -0.72 5.04 -1.05 -4.89 117.35 113.55 1ayp s TYR 112 Ca 0.43 0.74 -0.30 0.00 -2.44 0.00 0.00 57.07 55.49 1ayp s TYR 112 Cb 0.38 -4.06 -0.07 0.00 0.35 0.00 0.00 41.96 38.56 1ayp s TYR 112 CO 0.01 -2.85 2.15 0.43 -1.34 0.00 0.00 175.55 173.95 1ayp n SER 113 N 11.44 3.17 0.02 4.32 7.64 -1.26 -4.56 113.62 134.38 1ayp n SER 113 Ca 0.24 0.41 0.01 0.00 1.01 0.00 0.00 58.87 60.54 1ayp n SER 113 Cb 0.49 -1.48 0.07 0.00 -1.01 0.00 0.00 64.21 62.28 1ayp n SER 113 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1ayp n ASN 114 N 10.32 0.06 -0.28 6.43 4.13 -1.26 -1.68 115.26 132.97 1ayp n ASN 114 Ca 0.30 0.48 0.21 0.00 1.68 0.00 0.00 54.58 57.25 1ayp n ASN 114 Cb 0.38 -0.49 0.51 0.00 -1.54 0.00 0.00 39.78 38.65 1ayp n ASN 114 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1ayp h LYS 115 N 0.00 0.39 0.00 3.52 1.57 -1.99 -2.20 116.57 117.86 1ayp h LYS 115 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1ayp h LYS 115 Cb 0.11 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1ayp h LYS 115 CO 0.00 0.26 0.00 0.72 -0.57 0.00 0.00 179.45 179.86 1ayp n HIS 116 N -4.55 0.00 -3.20 -1.35 8.25 -0.68 -4.85 115.22 108.84 1ayp n HIS 116 Ca 0.22 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.28 1ayp n HIS 116 Cb 0.78 -0.01 -0.07 0.00 1.12 0.00 0.00 29.99 31.81 1ayp n HIS 116 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ayp s ARG 118 N 2.37 2.00 0.38 0.00 1.70 -1.26 -4.50 118.95 119.64 1ayp s ARG 118 Ca 0.22 -2.13 0.00 0.00 -0.47 0.00 0.00 55.73 53.35 1ayp s ARG 118 Cb -0.16 -1.65 0.00 0.00 -0.57 0.00 0.00 34.95 32.58 1ayp s ARG 118 CO 0.09 -0.09 0.00 0.41 -1.08 0.00 0.00 175.30 174.63 1ayp n GLY 119 N -1.02 -1.81 3.71 3.88 0.00 -1.26 -1.94 105.19 106.75 1ayp n GLY 119 Ca -0.06 -1.88 -0.33 0.00 0.00 0.00 0.00 46.02 43.75 1ayp n GLY 119 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ayp s SER 120 N -4.00 5.28 0.16 1.61 0.15 -1.26 -4.17 113.70 111.47 1ayp s SER 120 Ca 0.00 0.05 -0.31 0.00 0.70 0.00 0.00 55.95 56.39 1ayp s SER 120 Cb 0.00 -1.43 -0.09 0.00 -1.71 0.00 0.00 66.02 62.80 1ayp s SER 120 CO 0.00 0.29 1.37 -0.89 1.20 0.00 0.00 173.24 175.21 1ayp s THR 121 N -1.09 3.16 0.08 6.45 2.01 -1.24 -1.86 115.64 123.15 1ayp s THR 121 Ca 0.20 0.89 -0.22 0.00 0.31 0.00 0.00 61.69 62.87 1ayp s THR 121 Cb -0.12 -3.57 -0.12 0.00 0.01 0.00 0.00 72.50 68.70 1ayp s THR 121 CO 0.10 0.10 1.64 -0.65 -0.69 0.00 0.00 174.62 175.12 1ayp h PRO 122 N 6.07 0.14 -2.95 4.92 0.11 -1.96 -3.48 132.00 134.85 1ayp h PRO 122 Ca -0.44 -0.02 0.19 0.00 0.11 0.00 0.00 66.00 65.85 1ayp h PRO 122 Cb 1.21 -0.02 -0.11 0.00 0.11 0.00 0.00 31.00 32.19 1ayp h PRO 122 CO 0.82 0.22 -0.88 0.54 -0.21 0.00 0.00 178.00 178.49 1ayp n ARG 123 N -4.95 -2.55 0.00 1.05 1.74 -1.26 -5.20 116.66 105.49 1ayp n ARG 123 Ca -0.06 2.06 0.00 0.00 -0.77 0.00 0.00 57.85 59.09 1ayp n ARG 123 Cb 0.09 -2.99 0.00 0.00 -1.02 0.00 0.00 32.46 28.54 1ayp n ARG 123 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11