#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ayp h LEU 2 N 0.00 0.00 0.18 1.20 3.38 -1.41 -1.78 115.31 116.89 1ayp h LEU 2 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1ayp h LEU 2 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1ayp h LEU 2 CO 0.00 0.07 -0.09 0.58 0.09 0.00 0.00 178.44 179.09 1ayp h VAL 3 N 0.00 0.83 -0.67 1.22 2.07 -1.96 0.80 116.25 118.55 1ayp h VAL 3 Ca -0.00 -1.03 0.14 0.00 0.82 0.00 0.00 66.70 66.63 1ayp h VAL 3 Cb 0.74 1.36 -0.12 0.00 -1.52 0.00 0.00 31.29 31.75 1ayp h VAL 3 CO 0.01 0.20 -0.04 0.78 0.02 0.00 0.00 177.57 178.54 1ayp h ASN 4 N -0.83 -0.39 -0.27 0.57 2.35 -1.93 0.23 115.58 115.31 1ayp h ASN 4 Ca -0.03 0.18 0.03 0.00 -0.55 0.00 0.00 56.30 55.94 1ayp h ASN 4 Cb 0.52 0.33 -0.03 0.00 0.05 0.00 0.00 38.32 39.19 1ayp h ASN 4 CO 0.04 -0.16 0.06 0.15 -1.65 0.00 0.00 177.43 175.87 1ayp h PHE 5 N 0.08 0.10 -0.16 1.19 3.57 -1.26 -1.10 116.94 119.36 1ayp h PHE 5 Ca 0.35 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.90 1ayp h PHE 5 Cb 0.57 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.27 1ayp h PHE 5 CO -0.43 0.03 -0.10 1.25 -2.23 0.00 0.00 178.31 176.84 1ayp h HIS 6 N 0.16 -0.23 -0.10 0.41 2.76 0.19 -1.21 115.15 117.13 1ayp h HIS 6 Ca 0.12 0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.19 1ayp h HIS 6 Cb 0.12 0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.19 1ayp h HIS 6 CO -0.15 -0.15 -0.49 0.00 -1.30 0.00 0.00 177.93 175.83 1ayp h ARG 7 N -0.09 0.25 -0.77 5.26 3.08 -1.10 -2.25 114.38 118.76 1ayp h ARG 7 Ca 0.09 -0.14 0.11 0.00 0.07 0.00 0.00 59.98 60.12 1ayp h ARG 7 Cb 0.23 0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.21 1ayp h ARG 7 CO -0.22 0.69 0.40 1.98 -1.07 0.00 0.00 179.97 181.75 1ayp h MET 8 N 0.20 0.62 -0.13 0.04 4.05 -0.43 -2.14 114.93 117.14 1ayp h MET 8 Ca 0.01 -0.04 -0.14 0.00 -0.28 0.00 0.00 59.70 59.25 1ayp h MET 8 Cb 0.94 -0.14 0.01 0.00 -0.80 0.00 0.00 31.60 31.61 1ayp h MET 8 CO 0.08 0.41 -0.47 0.82 0.23 0.00 0.00 176.91 177.98 1ayp h ILE 9 N 0.63 1.36 -0.32 1.77 2.04 -0.93 -3.11 117.51 118.95 1ayp h ILE 9 Ca 0.39 -1.76 0.06 0.00 1.00 0.00 0.00 64.86 64.55 1ayp h ILE 9 Cb 0.46 2.10 -0.05 0.00 -0.74 0.00 0.00 36.82 38.59 1ayp h ILE 9 CO -0.30 0.53 0.01 0.50 0.00 0.00 0.00 178.15 178.90 1ayp h LYS 10 N 0.16 0.10 -0.48 2.37 1.63 -1.08 -0.30 116.57 118.97 1ayp h LYS 10 Ca -0.02 -0.01 0.10 0.00 -0.85 0.00 0.00 60.65 59.87 1ayp h LYS 10 Cb 1.10 -0.02 -0.09 0.00 -0.60 0.00 0.00 32.23 32.61 1ayp h LYS 10 CO 0.10 0.07 -0.11 -0.07 -3.45 0.00 0.00 179.45 175.99 1ayp h LEU 11 N 0.11 -0.42 0.01 5.20 3.38 -1.33 0.35 115.31 122.61 1ayp h LEU 11 Ca 0.16 0.14 -0.24 0.00 0.09 0.00 0.00 57.88 58.02 1ayp h LEU 11 Cb 0.20 0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1ayp h LEU 11 CO -0.25 -0.15 -1.26 0.71 0.09 0.00 0.00 178.44 177.58 1ayp h THR 12 N 0.01 1.41 0.00 0.22 1.35 -1.42 -3.38 112.91 111.10 1ayp h THR 12 Ca 0.23 -3.15 0.00 0.00 -0.55 0.00 0.00 66.41 62.94 1ayp h THR 12 Cb 0.36 2.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 1ayp h THR 12 CO -0.49 0.82 0.00 0.35 -0.25 0.00 0.00 175.52 175.95 1ayp n THR 13 N -3.28 0.00 -0.64 6.82 -2.24 -0.16 -4.64 114.28 110.14 1ayp n THR 13 Ca -0.07 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1ayp n THR 13 Cb 0.98 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 70.22 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 0.79 0.12 3.91 3.38 0.00 0.12 -4.97 105.19 108.54 1ayp n GLY 14 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.02 3.60 -0.88 1.61 -0.14 -1.26 -4.96 119.74 116.70 1ayp s LYS 15 Ca 0.00 0.11 -0.22 0.00 -1.36 0.00 0.00 55.97 54.50 1ayp s LYS 15 Cb 0.00 -2.50 0.08 0.00 -1.68 0.00 0.00 37.83 33.73 1ayp s LYS 15 CO 0.00 -0.01 1.23 -1.21 -0.76 0.00 0.00 175.35 174.60 1ayp s GLU 16 N -4.19 3.44 0.46 1.68 8.01 -1.26 -4.08 118.70 122.75 1ayp s GLU 16 Ca 0.46 -1.13 0.29 0.00 0.01 0.00 0.00 54.97 54.60 1ayp s GLU 16 Cb -0.10 -4.82 1.37 0.00 -4.31 0.00 0.00 34.13 26.27 1ayp s GLU 16 CO 0.37 -1.99 1.70 0.00 0.01 0.00 0.00 175.26 175.36 1ayp h ALA 17 N 9.49 2.75 -0.60 5.21 0.00 -1.94 -2.77 119.26 131.40 1ayp h ALA 17 Ca 0.02 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1ayp h ALA 17 Cb 1.03 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1ayp h ALA 17 CO 1.26 -1.24 0.38 0.00 0.00 0.00 0.00 179.25 179.65 1ayp h ALA 18 N 1.52 0.78 0.04 0.00 0.00 -1.94 -1.45 119.26 118.20 1ayp h ALA 18 Ca 0.70 -0.03 -0.37 0.00 0.00 0.00 0.00 54.91 55.22 1ayp h ALA 18 Cb 2.27 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 19.80 1ayp h ALA 18 CO -0.26 0.14 -2.23 1.28 0.00 0.00 0.00 179.25 178.18 1ayp n LEU 19 N -4.71 2.19 0.08 0.00 4.32 -1.13 -2.47 117.00 115.28 1ayp n LEU 19 Ca 0.05 0.05 -0.00 0.00 -0.02 0.00 0.00 56.01 56.09 1ayp n LEU 19 Cb 0.06 -0.64 0.29 0.00 -1.62 0.00 0.00 43.42 41.51 1ayp n LEU 19 CO 0.34 0.79 0.79 0.28 -1.22 0.00 0.00 177.39 178.37 1ayp h SER 20 N 0.02 0.32 0.00 -1.43 0.02 -1.52 -3.35 113.55 107.60 1ayp h SER 20 Ca -0.49 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 1ayp h SER 20 Cb 2.01 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 64.46 1ayp h SER 20 CO 0.00 0.55 -0.02 -1.22 -1.14 0.00 0.00 176.83 175.00 1ayp n TYR 21 N -4.17 0.00 -0.10 3.45 4.01 -0.57 -4.34 117.16 115.43 1ayp n TYR 21 Ca -0.01 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.80 1ayp n TYR 21 Cb 0.35 0.00 0.41 0.00 -0.31 0.00 0.00 39.34 39.79 1ayp n TYR 21 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1ayp h GLY 22 N 0.00 0.74 0.00 2.72 0.00 -1.16 -3.24 103.07 102.12 1ayp h GLY 22 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.09 1ayp h GLY 22 CO 0.00 0.19 0.00 0.69 0.00 0.00 0.00 176.54 177.42 1ayp n PHE 23 N -4.47 0.00 -1.56 5.60 3.01 -1.25 -3.63 117.46 115.15 1ayp n PHE 23 Ca 0.08 0.00 -0.58 0.00 1.01 0.00 0.00 57.45 57.96 1ayp n PHE 23 Cb 0.21 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.59 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 -0.01 1.73 -4.59 1.38 4.19 -0.47 -4.08 117.16 115.30 1ayp n TYR 24 Ca 0.00 0.61 0.00 0.00 3.31 0.00 0.00 57.90 61.82 1ayp n TYR 24 Cb 0.09 -2.41 0.00 0.00 0.49 0.00 0.00 39.34 37.51 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 5.41 0.79 0.14 2.98 0.00 0.31 -3.12 105.19 111.70 1ayp n GLY 25 Ca 0.37 -0.76 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 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 -3.65 0.38 -2.97 0.00 8.25 -1.26 -3.86 115.22 112.10 1ayp n HIS 27 Ca -0.25 0.11 -0.42 0.00 -0.26 0.00 0.00 57.72 56.90 1ayp n HIS 27 Cb 1.04 -0.55 -0.05 0.00 1.12 0.00 0.00 29.99 31.55 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 4.45 0.86 3.64 0.00 0.00 -1.24 -3.62 105.19 109.29 1ayp n GLY 29 Ca 0.03 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 1ayp n GLY 29 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ayp s VAL 30 N -1.92 3.56 0.00 1.61 1.01 -1.26 -4.77 120.40 118.63 1ayp s VAL 30 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.63 1ayp s VAL 30 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.87 1ayp s VAL 30 CO 0.00 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.56 1ayp n GLY 31 N 4.50 -1.36 0.00 4.51 0.00 -1.26 -5.07 105.19 106.50 1ayp n GLY 31 Ca 0.19 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.93 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 3.45 3.37 -0.02 0.00 -1.26 -4.57 105.19 106.16 1ayp n GLY 32 Ca 0.00 -0.11 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.69 1.24 0.16 1.61 1.70 -1.25 -4.99 118.95 116.72 1ayp s ARG 33 Ca 0.00 -1.25 0.00 0.00 -0.47 0.00 0.00 55.73 54.01 1ayp s ARG 33 Cb 0.00 0.38 0.00 0.00 -0.57 0.00 0.00 34.95 34.76 1ayp s ARG 33 CO 0.00 -0.46 0.00 0.41 -1.08 0.00 0.00 175.30 174.17 1ayp n GLY 34 N -0.25 -1.86 3.88 3.88 0.00 -1.26 -4.49 105.19 105.10 1ayp n GLY 34 Ca -0.05 -1.37 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 1ayp n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ayp s SER 35 N -4.89 6.50 -0.45 1.61 0.01 -0.08 -3.68 113.70 112.72 1ayp s SER 35 Ca 0.00 1.00 -0.27 0.00 1.31 0.00 0.00 55.95 57.99 1ayp s SER 35 Cb 0.00 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 63.93 1ayp s SER 35 CO 0.00 -0.33 1.99 -2.84 0.41 0.00 0.00 173.24 172.47 1ayp s PRO 36 N -3.74 2.81 0.00 12.44 0.02 -1.26 -4.82 135.00 140.44 1ayp s PRO 36 Ca 0.49 1.21 0.00 0.00 0.02 0.00 0.00 61.00 62.72 1ayp s PRO 36 Cb -0.10 -4.36 0.00 0.00 0.02 0.00 0.00 34.50 30.05 1ayp s PRO 36 CO 0.31 -2.49 0.00 1.17 -0.33 0.00 0.00 177.00 175.66 1ayp n LYS 37 N 8.85 0.00 -2.09 5.54 3.00 -1.26 -4.71 118.16 127.49 1ayp n LYS 37 Ca 0.26 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.53 1ayp n LYS 37 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.54 1ayp n LYS 37 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1ayp n ASP 38 N -2.01 -0.79 -0.34 3.14 5.75 -1.26 -5.04 116.55 115.99 1ayp n ASP 38 Ca 0.00 -1.60 0.07 0.00 -0.01 0.00 0.00 54.79 53.25 1ayp n ASP 38 Cb 0.00 1.33 0.24 0.00 -1.03 0.00 0.00 41.12 41.66 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 1.94 1.45 -0.62 2.12 0.00 -1.96 -0.36 119.26 121.84 1ayp h ALA 39 Ca -0.12 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1ayp h ALA 39 Cb 0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ayp h ALA 39 CO 0.15 0.11 0.02 1.15 0.00 0.00 0.00 179.25 180.69 1ayp h THR 40 N 0.87 1.26 -0.49 0.00 2.02 -1.93 -2.12 112.91 112.53 1ayp h THR 40 Ca 0.49 -1.13 -0.10 0.00 0.77 0.00 0.00 66.41 66.44 1ayp h THR 40 Cb 0.56 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1ayp h THR 40 CO -0.30 0.41 -0.10 -0.78 0.37 0.00 0.00 175.52 175.13 1ayp h ASP 41 N 0.98 0.89 0.15 4.18 3.58 -1.70 0.40 116.42 124.90 1ayp h ASP 41 Ca 0.18 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.35 1ayp h ASP 41 Cb 0.53 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.34 1ayp h ASP 41 CO 0.03 1.00 0.00 0.03 -2.88 0.00 0.00 179.24 177.42 1ayp h ARG 42 N 0.80 0.00 0.17 0.28 3.08 -0.82 -0.90 114.38 117.00 1ayp h ARG 42 Ca 0.13 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.95 1ayp h ARG 42 Cb 0.62 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.69 1ayp h ARG 42 CO 0.04 0.00 -1.03 0.00 -1.07 0.00 0.00 179.97 177.91 1ayp h VAL 45 N 1.18 1.09 -0.09 0.00 3.04 -1.28 0.66 116.25 120.85 1ayp h VAL 45 Ca 0.35 -0.30 -0.23 0.00 -1.01 0.00 0.00 66.70 65.51 1ayp h VAL 45 Cb -0.06 0.14 0.01 0.00 -2.01 0.00 0.00 31.29 29.37 1ayp h VAL 45 CO -0.09 0.16 -0.84 0.74 -1.01 0.00 0.00 177.57 176.52 1ayp h THR 46 N 0.87 1.31 -0.49 3.17 2.02 -1.55 -1.52 112.91 116.70 1ayp h THR 46 Ca 0.30 -2.10 -0.08 0.00 0.77 0.00 0.00 66.41 65.30 1ayp h THR 46 Cb 0.12 2.13 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 1ayp h THR 46 CO -0.09 0.65 -0.02 -0.74 0.37 0.00 0.00 175.52 175.69 1ayp h HIS 47 N 0.44 0.97 -0.35 3.16 6.17 -0.80 -0.47 115.15 124.27 1ayp h HIS 47 Ca -0.07 -0.18 -0.04 0.00 0.71 0.00 0.00 60.37 60.79 1ayp h HIS 47 Cb 1.47 -0.25 -0.02 0.00 2.52 0.00 0.00 27.41 31.13 1ayp h HIS 47 CO 0.08 0.92 0.03 -0.44 0.71 0.00 0.00 177.93 179.22 1ayp h ASP 48 N 0.74 0.49 -0.48 3.26 5.19 -0.85 0.40 116.42 125.18 1ayp h ASP 48 Ca 0.14 -0.09 -0.01 0.00 -0.62 0.00 0.00 57.03 56.46 1ayp h ASP 48 Cb 0.54 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.90 1ayp h ASP 48 CO 0.03 0.55 0.27 0.00 -3.12 0.00 0.00 179.24 176.97 1ayp h TYR 51 N 0.33 0.00 0.04 0.00 -1.99 -0.75 -1.63 116.97 112.97 1ayp h TYR 51 Ca 0.10 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.83 1ayp h TYR 51 Cb 0.09 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.82 1ayp h TYR 51 CO -0.03 0.19 -0.02 -0.22 -0.00 0.00 0.00 178.16 178.08 1ayp h LYS 52 N 0.00 -0.05 -0.94 4.88 3.64 -0.64 -2.23 116.57 121.22 1ayp h LYS 52 Ca -0.00 0.00 0.29 0.00 -1.27 0.00 0.00 60.65 59.67 1ayp h LYS 52 Cb 0.62 0.01 -0.16 0.00 -0.41 0.00 0.00 32.23 32.29 1ayp h LYS 52 CO 0.02 -0.00 0.24 -0.09 -2.27 0.00 0.00 179.45 177.35 1ayp h ARG 53 N -1.01 0.11 -0.24 1.90 2.43 -1.14 -1.05 114.38 115.38 1ayp h ARG 53 Ca -0.00 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1ayp h ARG 53 Cb 0.07 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1ayp h ARG 53 CO 0.01 0.07 -0.02 -0.07 -1.51 0.00 0.00 179.97 178.45 1ayp h LEU 54 N 0.11 0.43 -1.37 3.80 4.07 -1.26 -2.70 115.31 118.40 1ayp h LEU 54 Ca 0.63 -0.33 -0.05 0.00 0.08 0.00 0.00 57.88 58.21 1ayp h LEU 54 Cb 1.39 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 43.01 1ayp h LEU 54 CO -0.76 0.66 -0.23 1.05 -1.08 0.00 0.00 178.44 178.08 1ayp h GLU 55 N 0.19 0.00 0.00 1.13 4.11 -0.75 -0.87 114.58 118.40 1ayp h GLU 55 Ca 0.06 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.39 1ayp h GLU 55 Cb 0.46 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1ayp h GLU 55 CO 0.02 0.23 -0.52 -0.22 0.07 0.00 0.00 179.01 178.59 1ayp h LYS 56 N 0.00 0.00 0.00 1.06 1.63 -1.21 -0.09 116.57 117.96 1ayp h LYS 56 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1ayp h LYS 56 Cb 0.63 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 1ayp h LYS 56 CO 0.03 0.52 0.00 0.00 -3.45 0.00 0.00 179.45 176.55 1ayp h ARG 57 N 0.00 0.00 0.00 1.90 3.08 -0.98 -3.47 114.38 114.91 1ayp h ARG 57 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1ayp h ARG 57 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.00 1ayp h ARG 57 CO 0.07 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.38 1ayp n GLY 58 N 1.15 0.64 3.79 0.04 0.00 -0.05 -5.07 105.19 105.69 1ayp n GLY 58 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.70 2.12 0.15 0.00 0.00 -1.26 -3.94 107.32 102.69 1ayp s GLY 60 Ca 0.58 0.76 0.00 0.00 0.00 0.00 0.00 44.72 46.06 1ayp s GLY 60 CO 0.24 1.16 0.00 -1.30 0.00 0.00 0.00 173.10 173.21 1ayp n THR 61 N -3.18 0.19 0.18 0.90 -2.24 -1.26 -4.77 114.28 104.10 1ayp n THR 61 Ca 0.13 0.06 0.07 0.00 -2.27 0.00 0.00 64.05 62.04 1ayp n THR 61 Cb 0.51 -0.57 0.19 0.00 -2.10 0.00 0.00 70.33 68.36 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 -1.95 -3.13 116.57 112.28 1ayp h LYS 62 Ca 0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.59 1ayp h LYS 62 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1ayp h LYS 62 CO 0.00 0.30 -1.72 1.19 -0.57 0.00 0.00 179.45 178.65 1ayp n PHE 63 N -3.24 0.00 -1.67 -1.35 3.72 -1.26 -1.14 117.46 112.52 1ayp n PHE 63 Ca 0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.99 1ayp n PHE 63 Cb 0.60 -0.52 -0.03 0.00 -0.94 0.00 0.00 39.48 38.59 1ayp n PHE 63 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 1ayp n LEU 64 N -2.48 4.06 -4.76 4.37 7.94 -1.24 -4.42 117.00 120.48 1ayp n LEU 64 Ca -0.18 0.94 -0.39 0.00 -1.11 0.00 0.00 56.01 55.27 1ayp n LEU 64 Cb 0.82 -1.52 -0.05 0.00 0.53 0.00 0.00 43.42 43.20 1ayp n LEU 64 CO 0.21 0.17 0.34 -0.44 -1.11 0.00 0.00 177.39 176.56 1ayp s SER 65 N 3.77 7.03 0.34 1.96 0.01 -1.26 -0.50 113.70 125.05 1ayp s SER 65 Ca 0.87 1.23 0.04 0.00 1.31 0.00 0.00 55.95 59.40 1ayp s SER 65 Cb -0.47 -2.39 -0.03 0.00 0.21 0.00 0.00 66.02 63.33 1ayp s SER 65 CO 0.41 0.07 0.17 -0.72 0.41 0.00 0.00 173.24 173.58 1ayp s TYR 66 N -0.09 1.69 -0.01 2.43 -0.85 -1.26 -4.93 117.35 114.32 1ayp s TYR 66 Ca 0.33 -1.39 0.02 0.00 -0.52 0.00 0.00 57.07 55.52 1ayp s TYR 66 Cb -0.19 -0.93 -0.00 0.00 0.38 0.00 0.00 41.96 41.22 1ayp s TYR 66 CO 0.19 -0.51 -0.08 -1.59 -1.52 0.00 0.00 175.55 172.04 1ayp s LYS 67 N -3.72 0.65 0.14 -3.49 -2.85 -1.26 -5.00 119.74 104.21 1ayp s LYS 67 Ca 0.33 -0.27 0.03 0.00 -1.00 0.00 0.00 55.97 55.07 1ayp s LYS 67 Cb 0.04 -0.63 -0.01 0.00 -2.06 0.00 0.00 37.83 35.16 1ayp s LYS 67 CO 0.18 0.15 0.12 1.97 0.10 0.00 0.00 175.35 177.88 1ayp n PHE 68 N 2.98 -0.36 -3.78 1.78 -1.74 -1.26 -1.53 117.46 113.55 1ayp n PHE 68 Ca -0.14 -1.21 -0.11 0.00 -0.56 0.00 0.00 57.45 55.43 1ayp n PHE 68 Cb 0.57 0.13 -0.07 0.00 1.52 0.00 0.00 39.48 41.62 1ayp n PHE 68 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1ayp s SER 69 N -2.00 -0.05 0.32 5.98 1.04 -0.24 -4.86 113.70 113.88 1ayp s SER 69 Ca 0.17 -0.32 0.09 0.00 0.48 0.00 0.00 55.95 56.37 1ayp s SER 69 Cb 0.01 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.43 1ayp s SER 69 CO 0.12 -0.64 0.08 0.54 0.98 0.00 0.00 173.24 174.33 1ayp s ASN 70 N -2.26 4.58 -0.41 7.02 4.22 -1.26 -0.01 114.94 126.81 1ayp s ASN 70 Ca -0.03 -0.77 0.04 0.00 -2.14 0.00 0.00 52.86 49.96 1ayp s ASN 70 Cb 0.00 -0.74 0.17 0.00 1.28 0.00 0.00 41.25 41.96 1ayp s ASN 70 CO -0.05 -0.21 0.39 -0.44 -2.04 0.00 0.00 177.10 174.74 1ayp s SER 71 N -3.78 1.13 1.50 3.54 0.01 0.23 -4.97 113.70 111.36 1ayp s SER 71 Ca 0.36 -2.51 0.00 0.00 1.31 0.00 0.00 55.95 55.11 1ayp s SER 71 Cb -0.03 0.09 0.00 0.00 0.21 0.00 0.00 66.02 66.29 1ayp s SER 71 CO 0.21 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.29 1ayp n GLY 72 N 3.24 2.00 1.36 3.44 0.00 -1.26 -1.91 105.19 112.06 1ayp n GLY 72 Ca 0.23 -0.39 0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 6.07 3.99 -4.62 1.61 7.64 -1.26 -4.83 113.62 122.22 1ayp n SER 73 Ca 0.00 -2.37 -0.40 0.00 1.01 0.00 0.00 58.87 57.11 1ayp n SER 73 Cb 0.00 -0.52 -0.08 0.00 -1.01 0.00 0.00 64.21 62.60 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 -1.81 4.08 0.02 1.43 3.52 -0.80 -4.73 118.95 120.67 1ayp s ARG 74 Ca 0.42 0.31 -0.07 0.00 -0.13 0.00 0.00 55.73 56.26 1ayp s ARG 74 Cb 0.27 -3.64 -0.05 0.00 -1.56 0.00 0.00 34.95 29.97 1ayp s ARG 74 CO 0.20 -0.32 0.29 0.42 -0.81 0.00 0.00 175.30 175.08 1ayp s ILE 75 N 2.20 5.27 -0.04 4.11 -1.09 -1.26 0.76 121.20 131.14 1ayp s ILE 75 Ca 0.21 0.19 -0.02 0.00 -2.23 0.00 0.00 60.65 58.80 1ayp s ILE 75 Cb -0.16 -3.58 0.03 0.00 -1.58 0.00 0.00 42.46 37.17 1ayp s ILE 75 CO 0.09 0.34 0.06 -0.89 -1.23 0.00 0.00 174.94 173.31 1ayp s THR 76 N -1.33 -0.11 -0.01 2.92 2.01 0.98 -4.97 115.64 115.13 1ayp s THR 76 Ca 0.29 0.39 -0.27 0.00 0.31 0.00 0.00 61.69 62.40 1ayp s THR 76 Cb -0.13 -0.15 -0.04 0.00 0.01 0.00 0.00 72.50 72.19 1ayp s THR 76 CO 0.17 0.16 0.87 0.00 -0.69 0.00 0.00 174.62 175.13 1ayp s ALA 78 N 0.77 1.59 0.21 0.00 0.00 -0.58 -4.96 121.76 118.78 1ayp s ALA 78 Ca 0.46 0.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.13 1ayp s ALA 78 Cb -0.20 -3.22 -0.09 0.00 0.00 0.00 0.00 23.12 19.62 1ayp s ALA 78 CO 0.24 -2.33 1.23 0.15 0.00 0.00 0.00 175.76 175.06 1ayp s LYS 79 N -4.90 4.46 0.21 0.00 1.02 -1.26 -4.82 119.74 114.45 1ayp s LYS 79 Ca 0.63 1.95 -0.06 0.00 0.02 0.00 0.00 55.97 58.51 1ayp s LYS 79 Cb -0.18 -3.21 0.03 0.00 -0.52 0.00 0.00 37.83 33.94 1ayp s LYS 79 CO 0.57 -0.13 0.40 0.00 -0.92 0.00 0.00 175.35 175.27 1ayp n GLN 80 N 2.33 0.57 -0.93 1.68 10.64 -1.26 -5.04 117.38 125.37 1ayp n GLN 80 Ca 0.04 -1.33 -0.32 0.00 -1.83 0.00 0.00 57.00 53.57 1ayp n GLN 80 Cb 0.44 1.54 0.14 0.00 -0.86 0.00 0.00 30.24 31.50 1ayp n GLN 80 CO 0.00 0.00 0.00 0.16 -1.83 0.00 0.00 177.06 175.39 1ayp s ASP 81 N -2.17 3.42 0.36 2.61 -4.77 -1.26 -4.39 116.67 110.46 1ayp s ASP 81 Ca 0.11 2.17 0.08 0.00 -3.30 0.00 0.00 52.55 51.60 1ayp s ASP 81 Cb -0.02 -2.56 0.79 0.00 -1.09 0.00 0.00 42.92 40.03 1ayp s ASP 81 CO 0.08 -2.77 1.90 0.28 0.70 0.00 0.00 175.17 175.36 1ayp h SER 82 N -1.44 0.66 0.25 2.11 0.02 -2.01 0.14 113.55 113.28 1ayp h SER 82 Ca -0.44 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.54 1ayp h SER 82 Cb 1.27 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 63.67 1ayp h SER 82 CO 0.45 0.37 -0.34 0.00 -1.14 0.00 0.00 176.83 176.17 1ayp h ARG 84 N -0.65 0.83 0.29 0.00 3.08 -1.54 -0.41 114.38 115.99 1ayp h ARG 84 Ca -0.00 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.77 1ayp h ARG 84 Cb 0.62 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1ayp h ARG 84 CO -0.12 0.89 -0.17 0.77 -1.07 0.00 0.00 179.97 180.28 1ayp h SER 85 N 0.68 -0.41 0.23 7.04 0.02 -0.71 -1.53 113.55 118.87 1ayp h SER 85 Ca 0.13 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 1ayp h SER 85 Cb 0.53 0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 1ayp h SER 85 CO 0.03 -0.27 -0.14 1.56 -1.14 0.00 0.00 176.83 176.86 1ayp h GLN 86 N -0.43 0.00 -0.15 3.45 1.08 -0.08 -1.35 115.11 117.62 1ayp h GLN 86 Ca -0.03 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.13 1ayp h GLN 86 Cb 0.35 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1ayp h GLN 86 CO 0.04 0.14 -0.06 1.25 -0.95 0.00 0.00 178.83 179.25 1ayp h LEU 87 N 0.00 0.31 -0.13 1.46 6.46 -1.00 -1.01 115.31 121.40 1ayp h LEU 87 Ca -0.00 -0.40 -0.02 0.00 -0.12 0.00 0.00 57.88 57.33 1ayp h LEU 87 Cb 0.29 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.13 1ayp h LEU 87 CO 0.02 0.65 0.00 0.00 -0.62 0.00 0.00 178.44 178.49 1ayp h GLU 89 N -0.03 0.82 0.25 0.00 4.39 -1.30 -0.92 114.58 117.80 1ayp h GLU 89 Ca 0.04 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 1ayp h GLU 89 Cb 0.35 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.79 1ayp h GLU 89 CO 0.01 0.55 -0.43 0.00 -1.16 0.00 0.00 179.01 177.98 1ayp h ASP 91 N -0.72 0.17 -0.36 0.00 5.19 -0.98 -2.92 116.42 116.79 1ayp h ASP 91 Ca -0.03 0.01 0.08 0.00 -0.62 0.00 0.00 57.03 56.47 1ayp h ASP 91 Cb 0.67 -0.02 -0.08 0.00 0.18 0.00 0.00 39.33 40.07 1ayp h ASP 91 CO -0.15 0.13 -0.21 0.50 -3.12 0.00 0.00 179.24 176.39 1ayp h LYS 92 N 0.23 -0.15 -0.99 3.56 3.64 -1.18 -1.05 116.57 120.63 1ayp h LYS 92 Ca 0.09 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.59 1ayp h LYS 92 Cb 0.02 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 31.79 1ayp h LYS 92 CO -0.06 -0.10 0.63 0.00 -2.27 0.00 0.00 179.45 177.64 1ayp h ALA 93 N 1.04 1.47 0.46 5.00 0.00 -1.20 0.23 119.26 126.26 1ayp h ALA 93 Ca 0.18 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1ayp h ALA 93 Cb 0.44 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ayp h ALA 93 CO -0.45 0.27 -0.22 0.00 0.00 0.00 0.00 179.25 178.84 1ayp h ALA 94 N 1.51 -0.62 -0.67 0.00 0.00 -1.29 -1.19 119.26 117.00 1ayp h ALA 94 Ca 0.48 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 55.33 1ayp h ALA 94 Cb 0.41 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 1ayp h ALA 94 CO -0.24 -0.69 0.46 0.00 0.00 0.00 0.00 179.25 178.77 1ayp h ALA 95 N -0.59 2.14 0.68 0.00 0.00 -0.13 0.78 119.26 122.13 1ayp h ALA 95 Ca -0.06 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1ayp h ALA 95 Cb 0.58 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ayp h ALA 95 CO 0.10 -0.31 -0.33 1.15 0.00 0.00 0.00 179.25 179.86 1ayp h THR 96 N 0.35 0.16 0.00 0.00 2.02 -0.95 -2.17 112.91 112.32 1ayp h THR 96 Ca 0.32 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.23 1ayp h THR 96 Cb 0.78 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 1ayp h THR 96 CO -0.09 0.02 0.00 0.00 0.37 0.00 0.00 175.52 175.82 1ayp h PHE 98 N 0.00 0.89 -0.14 0.00 0.04 -0.46 -3.12 116.94 114.15 1ayp h PHE 98 Ca 0.00 -0.65 0.01 0.00 2.80 0.00 0.00 57.97 60.12 1ayp h PHE 98 Cb 0.05 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 1ayp h PHE 98 CO 0.00 1.54 0.07 0.00 -0.60 0.00 0.00 178.31 179.32 1ayp h ALA 99 N 0.21 0.17 -0.70 2.45 0.00 -0.11 -2.91 119.26 118.37 1ayp h ALA 99 Ca -0.25 0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.79 1ayp h ALA 99 Cb 2.14 -0.03 -0.13 0.00 0.00 0.00 0.00 17.79 19.77 1ayp h ALA 99 CO 0.26 -0.36 -0.30 0.00 0.00 0.00 0.00 179.25 178.85 1ayp h ARG 100 N 0.16 -0.09 -0.96 0.00 3.08 -1.37 -0.87 114.38 114.33 1ayp h ARG 100 Ca 0.06 0.01 -0.20 0.00 0.07 0.00 0.00 59.98 59.92 1ayp h ARG 100 Cb 0.01 0.02 -0.12 0.00 0.08 0.00 0.00 29.97 29.96 1ayp h ARG 100 CO -0.04 -0.06 0.25 0.09 -1.07 0.00 0.00 179.97 179.15 1ayp n ASN 101 N -5.46 3.32 -0.04 7.04 3.02 -1.13 -4.28 115.26 117.72 1ayp n ASN 101 Ca 0.07 -2.69 -0.05 0.00 -0.03 0.00 0.00 54.58 51.88 1ayp n ASN 101 Cb 0.37 -0.64 0.16 0.00 -0.61 0.00 0.00 39.78 39.05 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 0.72 0.64 0.26 3.52 3.64 -0.97 -2.62 116.57 121.76 1ayp h LYS 102 Ca 0.24 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1ayp h LYS 102 Cb 1.75 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.52 1ayp h LYS 102 CO 0.46 0.79 -0.12 1.79 -2.27 0.00 0.00 179.45 180.10 1ayp h THR 103 N 0.57 0.78 -1.38 1.00 1.35 -1.82 -2.05 112.91 111.37 1ayp h THR 103 Ca 0.09 -0.26 0.40 0.00 -0.55 0.00 0.00 66.41 66.09 1ayp h THR 103 Cb 0.65 0.93 -0.07 0.00 -1.73 0.00 0.00 68.15 67.93 1ayp h THR 103 CO 0.05 0.06 0.97 0.74 -0.25 0.00 0.00 175.52 177.08 1ayp h THR 104 N -0.48 0.29 -1.87 6.82 2.02 -1.78 -3.46 112.91 114.44 1ayp h THR 104 Ca -0.04 -0.02 -0.65 0.00 0.77 0.00 0.00 66.41 66.47 1ayp h THR 104 Cb 0.36 0.22 0.04 0.00 -1.74 0.00 0.00 68.15 67.04 1ayp h THR 104 CO 0.06 0.01 0.77 0.00 0.37 0.00 0.00 175.52 176.73 1ayp n TYR 105 N -4.24 2.00 -3.94 3.16 4.19 -0.77 -4.94 117.16 112.61 1ayp n TYR 105 Ca 0.32 0.39 -0.34 0.00 3.31 0.00 0.00 57.90 61.57 1ayp n TYR 105 Cb 1.41 -2.48 -0.14 0.00 0.49 0.00 0.00 39.34 38.62 1ayp n TYR 105 CO 0.00 0.00 0.00 1.21 0.91 0.00 0.00 176.86 178.98 1ayp s ASN 106 N 2.00 4.82 0.00 2.98 3.84 -1.26 -4.95 114.94 122.37 1ayp s ASN 106 Ca 0.88 -1.48 0.00 0.00 0.21 0.00 0.00 52.86 52.46 1ayp s ASN 106 Cb -0.86 -1.68 0.00 0.00 -0.55 0.00 0.00 41.25 38.16 1ayp s ASN 106 CO 0.50 -0.29 0.29 0.29 -2.79 0.00 0.00 177.10 175.10 1ayp n LYS 107 N 4.54 0.42 -0.00 0.43 5.02 -1.26 -0.17 118.16 127.13 1ayp n LYS 107 Ca -0.10 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.19 1ayp n LYS 107 Cb 0.43 -1.24 -0.00 0.00 -0.02 0.00 0.00 35.03 34.19 1ayp n LYS 107 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1ayp h LYS 108 N 0.81 0.00 0.00 1.97 3.64 -2.00 -3.41 116.57 117.58 1ayp h LYS 108 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1ayp h LYS 108 Cb 0.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1ayp h LYS 108 CO 0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 1ayp n TYR 109 N -2.28 0.00 -0.03 1.91 4.01 0.76 -4.08 117.16 117.46 1ayp n TYR 109 Ca -0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.72 1ayp n TYR 109 Cb 0.01 0.00 0.25 0.00 -0.31 0.00 0.00 39.34 39.29 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 0.00 0.59 0.00 -0.72 4.15 -1.80 0.92 115.11 118.25 1ayp h GLN 110 Ca 0.00 -0.14 -0.05 0.00 0.77 0.00 0.00 58.65 59.23 1ayp h GLN 110 Cb 0.00 -0.08 -0.11 0.00 0.21 0.00 0.00 27.48 27.50 1ayp h GLN 110 CO 0.00 0.63 -0.64 0.66 -1.93 0.00 0.00 178.83 177.54 1ayp n TYR 111 N -4.25 0.00 -1.97 3.99 4.01 -1.26 -1.37 117.16 116.31 1ayp n TYR 111 Ca 0.02 -1.20 -0.42 0.00 -0.16 0.00 0.00 57.90 56.14 1ayp n TYR 111 Cb 0.27 -0.22 -0.02 0.00 -0.31 0.00 0.00 39.34 39.06 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 -2.30 3.01 -0.48 -0.72 5.04 -1.14 -4.91 117.35 115.85 1ayp s TYR 112 Ca 0.37 0.88 -0.24 0.00 -2.44 0.00 0.00 57.07 55.63 1ayp s TYR 112 Cb 0.37 -3.87 0.03 0.00 0.35 0.00 0.00 41.96 38.84 1ayp s TYR 112 CO -0.10 -2.98 0.87 -1.12 -1.34 0.00 0.00 175.55 170.89 1ayp s SER 113 N 0.64 6.42 0.67 4.32 0.01 -1.26 -4.40 113.70 120.09 1ayp s SER 113 Ca 0.63 -0.12 0.32 0.00 1.31 0.00 0.00 55.95 58.09 1ayp s SER 113 Cb -0.43 -2.42 1.75 0.00 0.21 0.00 0.00 66.02 65.13 1ayp s SER 113 CO 0.40 -1.05 1.99 0.78 0.41 0.00 0.00 173.24 175.76 1ayp h ASN 114 N 9.11 0.00 -0.95 2.44 4.21 -1.91 -2.89 115.58 125.59 1ayp h ASN 114 Ca -0.25 0.00 0.35 0.00 1.21 0.00 0.00 56.30 57.61 1ayp h ASN 114 Cb 1.08 0.00 -0.12 0.00 -1.12 0.00 0.00 38.32 38.16 1ayp h ASN 114 CO 1.02 0.00 0.58 1.17 -1.29 0.00 0.00 177.43 178.90 1ayp n LYS 115 N -2.92 -0.04 -0.63 0.81 4.81 -1.26 0.52 118.16 119.45 1ayp n LYS 115 Ca -0.02 1.01 0.08 0.00 -0.87 0.00 0.00 58.31 58.51 1ayp n LYS 115 Cb 0.34 -1.91 0.34 0.00 0.02 0.00 0.00 35.03 33.82 1ayp n LYS 115 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1ayp n HIS 116 N -4.44 1.51 -3.02 5.64 8.25 -1.09 -4.89 115.22 117.17 1ayp n HIS 116 Ca 0.30 -0.57 -0.43 0.00 -0.26 0.00 0.00 57.72 56.76 1ayp n HIS 116 Cb 1.12 -0.29 -0.06 0.00 1.12 0.00 0.00 29.99 31.89 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 3.17 2.88 0.00 0.00 0.52 -1.26 -4.08 118.95 120.17 1ayp s ARG 118 Ca 0.23 -1.01 0.00 0.00 -0.52 0.00 0.00 55.73 54.43 1ayp s ARG 118 Cb -0.15 -2.57 0.00 0.00 0.52 0.00 0.00 34.95 32.75 1ayp s ARG 118 CO 0.16 0.43 0.00 0.41 0.02 0.00 0.00 175.30 176.32 1ayp n GLY 119 N -0.85 0.67 0.13 -3.53 0.00 -1.26 -0.90 105.19 99.45 1ayp n GLY 119 Ca -0.08 -2.17 -0.20 0.00 0.00 0.00 0.00 46.02 43.57 1ayp n GLY 119 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ayp h SER 120 N 0.00 0.45 -4.09 1.61 4.64 -1.95 -3.43 113.55 110.78 1ayp h SER 120 Ca 0.00 -0.82 0.00 0.00 -0.47 0.00 0.00 61.79 60.50 1ayp h SER 120 Cb 0.00 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 1ayp h SER 120 CO 0.00 1.72 -0.53 0.41 -0.87 0.00 0.00 176.83 177.56 1ayp n THR 121 N -3.48 -4.52 0.00 2.95 -1.04 -1.24 -4.86 114.28 102.09 1ayp n THR 121 Ca -0.26 1.55 0.00 0.00 -2.04 0.00 0.00 64.05 63.30 1ayp n THR 121 Cb 1.06 -2.66 0.00 0.00 -1.82 0.00 0.00 70.33 66.91 1ayp n THR 121 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1ayp n PRO 122 N 0.24 0.00 0.00 -2.82 -0.02 -1.26 -4.96 135.00 126.18 1ayp n PRO 122 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1ayp n PRO 122 Cb 0.00 -0.31 0.00 0.00 -0.02 0.00 0.00 33.50 33.17 1ayp n PRO 122 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1ayp n ARG 123 N 0.00 0.00 0.00 -0.52 0.63 -1.26 -5.17 116.66 110.34 1ayp n ARG 123 Ca 0.00 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.08 1ayp n ARG 123 Cb 0.00 0.00 0.69 0.00 0.45 0.00 0.00 32.46 33.60 1ayp n ARG 123 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12