#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a3z s LYS 2 N 0.00 4.02 0.00 1.96 1.02 -1.26 -1.04 119.74 124.45 2a3z s LYS 2 Ca 0.00 -0.29 0.08 0.00 0.02 0.00 0.00 55.97 55.78 2a3z s LYS 2 Cb 0.00 -3.59 -0.02 0.00 -0.52 0.00 0.00 37.83 33.69 2a3z s LYS 2 CO 0.00 -0.04 -0.24 0.42 -0.92 0.00 0.00 175.35 174.57 2a3z s ILE 3 N 1.36 2.28 0.09 2.17 1.01 -0.06 -1.02 121.20 127.02 2a3z s ILE 3 Ca 0.07 -1.17 -0.03 0.00 0.00 0.00 0.00 60.65 59.52 2a3z s ILE 3 Cb -0.15 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 2a3z s ILE 3 CO 0.07 0.48 0.07 0.00 0.00 0.00 0.00 174.94 175.57 2a3z s ALA 4 N -0.72 0.41 -0.06 9.38 0.00 -0.54 -0.92 121.76 129.31 2a3z s ALA 4 Ca 0.11 -1.13 0.03 0.00 0.00 0.00 0.00 51.96 50.96 2a3z s ALA 4 Cb -0.10 0.55 0.01 0.00 0.00 0.00 0.00 23.12 23.58 2a3z s ALA 4 CO 0.01 -0.46 -0.13 0.00 0.00 0.00 0.00 175.76 175.17 2a3z s ALA 5 N -3.95 1.33 -0.08 0.00 0.00 -0.33 -0.54 121.76 118.18 2a3z s ALA 5 Ca 0.13 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.58 2a3z s ALA 5 Cb 0.07 -0.57 0.04 0.00 0.00 0.00 0.00 23.12 22.66 2a3z s ALA 5 CO -0.06 0.14 0.09 0.12 0.00 0.00 0.00 175.76 176.06 2a3z s PHE 6 N 0.57 0.02 -0.35 0.00 5.36 0.14 -0.87 117.98 122.85 2a3z s PHE 6 Ca -0.13 0.21 -0.22 0.00 -0.96 0.00 0.00 56.93 55.82 2a3z s PHE 6 Cb -0.15 -0.47 0.00 0.00 -0.34 0.00 0.00 43.02 42.06 2a3z s PHE 6 CO 0.04 -0.29 0.74 1.21 -1.46 0.00 0.00 175.22 175.45 2a3z s ASN 7 N 2.20 6.54 -0.31 6.13 3.84 -1.26 -1.78 114.94 130.29 2a3z s ASN 7 Ca 0.04 0.37 -0.07 0.00 0.21 0.00 0.00 52.86 53.41 2a3z s ASN 7 Cb -0.13 -2.38 0.02 0.00 -0.55 0.00 0.00 41.25 38.21 2a3z s ASN 7 CO -0.05 -0.65 0.10 -0.63 -2.79 0.00 0.00 177.10 173.08 2a3z s ILE 8 N 2.94 4.05 0.06 -5.21 1.01 -1.01 -4.26 121.20 118.78 2a3z s ILE 8 Ca 0.29 -0.78 -0.35 0.00 0.00 0.00 0.00 60.65 59.82 2a3z s ILE 8 Cb -0.14 -3.15 -0.14 0.00 0.01 0.00 0.00 42.46 39.05 2a3z s ILE 8 CO 0.15 -0.01 1.63 -1.14 0.00 0.00 0.00 174.94 175.57 2a3z n ARG 9 N 4.88 1.96 -3.90 2.79 0.63 -1.26 -1.72 116.66 120.04 2a3z n ARG 9 Ca -0.14 0.71 -0.27 0.00 -0.92 0.00 0.00 57.85 57.23 2a3z n ARG 9 Cb 0.47 -2.48 -0.05 0.00 0.45 0.00 0.00 32.46 30.86 2a3z n ARG 9 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2a3z n THR 10 N 3.81 -1.13 -1.68 5.15 -2.24 -1.25 -4.79 114.28 112.14 2a3z n THR 10 Ca 0.19 -0.39 -0.48 0.00 -2.27 0.00 0.00 64.05 61.10 2a3z n THR 10 Cb 0.27 -1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 67.41 2a3z n THR 10 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2a3z n PHE 11 N -3.79 2.31 -3.45 4.78 -0.00 -0.70 -4.77 117.46 111.84 2a3z n PHE 11 Ca -0.19 0.06 -0.00 0.00 -0.00 0.00 0.00 57.45 57.32 2a3z n PHE 11 Cb 0.49 -2.63 0.00 0.00 -0.00 0.00 0.00 39.48 37.33 2a3z n PHE 11 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2a3z n GLY 12 N 4.16 1.28 0.28 7.13 0.00 -1.26 -0.14 105.19 116.64 2a3z n GLY 12 Ca 0.21 -0.93 -0.00 0.00 0.00 0.00 0.00 46.02 45.30 2a3z n GLY 12 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2a3z h GLU 13 N 0.00 0.73 -0.38 1.61 5.08 -1.90 -0.99 114.58 118.73 2a3z h GLU 13 Ca -0.01 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 2a3z h GLU 13 Cb 0.04 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 2a3z h GLU 13 CO 0.01 0.49 -0.01 1.15 -1.00 0.00 0.00 179.01 179.65 2a3z h THR 14 N 0.76 1.26 -0.20 1.13 2.02 -1.96 -0.38 112.91 115.54 2a3z h THR 14 Ca 0.33 -1.02 -0.02 0.00 0.77 0.00 0.00 66.41 66.48 2a3z h THR 14 Cb 0.22 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2a3z h THR 14 CO -0.20 0.34 0.05 0.50 0.37 0.00 0.00 175.52 176.59 2a3z h LYS 15 N 0.51 0.31 0.00 6.66 3.64 -1.70 -3.04 116.57 122.94 2a3z h LYS 15 Ca 0.11 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2a3z h LYS 15 Cb 0.48 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2a3z h LYS 15 CO 0.02 0.43 -0.00 0.52 -2.27 0.00 0.00 179.45 178.15 2a3z h MET 16 N 0.14 0.00 0.00 1.90 2.86 -1.10 -2.38 114.93 116.35 2a3z h MET 16 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2a3z h MET 16 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2a3z h MET 16 CO -0.00 0.00 0.00 0.43 1.06 0.00 0.00 176.91 178.40 2a3z n SER 17 N -3.09 0.33 -4.55 1.22 7.64 -0.16 -4.68 113.62 110.32 2a3z n SER 17 Ca 0.01 0.53 -0.43 0.00 1.01 0.00 0.00 58.87 59.99 2a3z n SER 17 Cb 0.30 -0.62 -0.06 0.00 -1.01 0.00 0.00 64.21 62.83 2a3z n SER 17 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2a3z s ASN 18 N -3.61 6.42 0.35 6.43 3.84 -0.90 -4.94 114.94 122.53 2a3z s ASN 18 Ca 0.12 -0.04 0.04 0.00 0.21 0.00 0.00 52.86 53.19 2a3z s ASN 18 Cb 0.16 -2.36 0.65 0.00 -0.55 0.00 0.00 41.25 39.15 2a3z s ASN 18 CO 0.54 -0.80 1.93 0.00 -2.79 0.00 0.00 177.10 175.98 2a3z h ALA 19 N 8.79 1.46 0.02 1.71 0.00 -1.85 0.10 119.26 129.49 2a3z h ALA 19 Ca -0.25 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 2a3z h ALA 19 Cb 1.09 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2a3z h ALA 19 CO 0.92 0.40 -0.01 1.15 0.00 0.00 0.00 179.25 181.71 2a3z h THR 20 N 0.59 1.31 -0.41 0.00 2.02 -1.93 -1.77 112.91 112.72 2a3z h THR 20 Ca 0.14 -1.05 -0.02 0.00 0.77 0.00 0.00 66.41 66.25 2a3z h THR 20 Cb 0.17 2.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2a3z h THR 20 CO -0.01 0.27 0.17 -0.07 0.37 0.00 0.00 175.52 176.25 2a3z h LEU 21 N -0.49 0.56 -0.53 2.58 3.38 -1.71 -2.32 115.31 116.78 2a3z h LEU 21 Ca -0.00 -0.16 0.10 0.00 0.09 0.00 0.00 57.88 57.90 2a3z h LEU 21 Cb 0.46 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.99 2a3z h LEU 21 CO 0.00 0.57 0.08 0.00 0.09 0.00 0.00 178.44 179.18 2a3z h ALA 22 N 1.02 0.59 -0.80 1.53 0.00 -0.88 -1.16 119.26 119.55 2a3z h ALA 22 Ca 0.14 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2a3z h ALA 22 Cb 0.18 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2a3z h ALA 22 CO -0.01 -0.33 0.48 1.03 0.00 0.00 0.00 179.25 180.42 2a3z h SER 23 N 0.21 0.96 -0.36 0.00 0.87 -0.94 0.18 113.55 114.48 2a3z h SER 23 Ca 0.27 -0.07 -0.15 0.00 -1.23 0.00 0.00 61.79 60.61 2a3z h SER 23 Cb 0.39 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2a3z h SER 23 CO -0.38 0.75 -0.37 1.88 -0.53 0.00 0.00 176.83 178.18 2a3z h TYR 24 N 1.10 1.08 -0.63 2.24 0.05 -1.06 -1.77 116.97 117.98 2a3z h TYR 24 Ca 0.29 -0.32 -0.03 0.00 0.05 0.00 0.00 58.73 58.72 2a3z h TYR 24 Cb -0.04 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.44 2a3z h TYR 24 CO -0.01 1.13 0.26 0.82 -1.05 0.00 0.00 178.16 179.32 2a3z h ILE 25 N 0.75 1.22 -0.46 -2.88 2.04 -0.71 -0.61 117.51 116.86 2a3z h ILE 25 Ca 0.07 -0.67 -0.13 0.00 1.00 0.00 0.00 64.86 65.13 2a3z h ILE 25 Cb 0.95 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2a3z h ILE 25 CO 0.09 0.27 -0.21 0.58 0.00 0.00 0.00 178.15 178.88 2a3z h VAL 26 N 0.90 1.27 -0.46 1.67 2.07 -0.54 -1.97 116.25 119.19 2a3z h VAL 26 Ca 0.21 -1.37 -0.05 0.00 0.82 0.00 0.00 66.70 66.31 2a3z h VAL 26 Cb 0.16 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 2a3z h VAL 26 CO -0.02 0.47 0.09 -0.09 0.02 0.00 0.00 177.57 178.04 2a3z h ARG 27 N 0.80 0.76 -0.03 1.57 2.43 -0.80 -1.03 114.38 118.09 2a3z h ARG 27 Ca 0.10 -0.20 0.02 0.00 -0.81 0.00 0.00 59.98 59.10 2a3z h ARG 27 Cb 0.79 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 2a3z h ARG 27 CO 0.07 0.76 -0.08 0.82 -1.51 0.00 0.00 179.97 180.03 2a3z h ILE 28 N 0.63 0.78 -0.71 1.20 2.04 -1.01 -2.99 117.51 117.45 2a3z h ILE 28 Ca 0.14 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.97 2a3z h ILE 28 Cb 0.36 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2a3z h ILE 28 CO 0.01 0.00 0.33 0.58 0.00 0.00 0.00 178.15 179.06 2a3z h VAL 29 N -0.13 1.24 0.00 1.67 2.07 -0.99 -2.70 116.25 117.40 2a3z h VAL 29 Ca 0.04 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2a3z h VAL 29 Cb 0.19 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2a3z h VAL 29 CO -0.11 0.28 0.01 0.03 0.02 0.00 0.00 177.57 177.80 2a3z h ARG 30 N 0.99 0.00 0.00 1.57 3.08 -1.04 -1.89 114.38 117.08 2a3z h ARG 30 Ca 0.24 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.29 2a3z h ARG 30 Cb 0.14 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 2a3z h ARG 30 CO -0.03 0.00 -0.02 0.00 -1.07 0.00 0.00 179.97 178.85 2a3z h ARG 31 N 0.00 0.00 -6.61 0.04 3.08 -1.52 -3.45 114.38 105.92 2a3z h ARG 31 Ca 0.00 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 59.36 2a3z h ARG 31 Cb 0.01 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 29.81 2a3z h ARG 31 CO 0.00 0.02 -0.84 0.71 -1.07 0.00 0.00 179.97 178.79 2a3z s TYR 32 N -3.91 2.45 0.08 3.04 2.02 -0.71 -4.86 117.35 115.46 2a3z s TYR 32 Ca -0.02 -0.33 0.05 0.00 -0.37 0.00 0.00 57.07 56.40 2a3z s TYR 32 Cb 0.11 -1.47 -0.23 0.00 -0.40 0.00 0.00 41.96 39.97 2a3z s TYR 32 CO 0.51 0.14 1.12 -0.44 -1.57 0.00 0.00 175.55 175.32 2a3z h ASP 33 N 4.91 0.10 -3.44 2.29 3.32 -1.38 -3.44 116.42 118.77 2a3z h ASP 33 Ca -0.46 -0.12 -0.34 0.00 0.02 0.00 0.00 57.03 56.13 2a3z h ASP 33 Cb 1.14 -0.03 -0.36 0.00 0.22 0.00 0.00 39.33 40.31 2a3z h ASP 33 CO 0.46 1.09 -0.74 -0.63 -1.72 0.00 0.00 179.24 177.71 2a3z s ILE 34 N -2.68 0.03 -0.01 0.35 1.01 -1.13 -0.87 121.20 117.90 2a3z s ILE 34 Ca -0.02 0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.88 2a3z s ILE 34 Cb 0.09 -0.19 -0.00 0.00 0.01 0.00 0.00 42.46 42.37 2a3z s ILE 34 CO 0.83 0.14 -0.08 0.54 0.00 0.00 0.00 174.94 176.37 2a3z s VAL 35 N 1.40 0.65 -0.20 2.92 0.11 -0.37 -1.47 120.40 123.46 2a3z s VAL 35 Ca -0.05 -0.33 -0.10 0.00 -2.93 0.00 0.00 61.98 58.57 2a3z s VAL 35 Cb -0.13 -0.56 -0.05 0.00 -1.53 0.00 0.00 36.38 34.11 2a3z s VAL 35 CO -0.03 0.19 0.12 -0.22 -3.33 0.00 0.00 175.10 171.84 2a3z s LEU 36 N -0.06 4.17 -0.12 2.54 0.20 0.30 -1.33 118.68 124.37 2a3z s LEU 36 Ca 0.01 0.22 0.01 0.00 0.69 0.00 0.00 54.13 55.06 2a3z s LEU 36 Cb -0.05 -2.07 -0.01 0.00 -0.43 0.00 0.00 46.19 43.63 2a3z s LEU 36 CO -0.00 0.18 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.45 2a3z s ILE 37 N 0.34 2.72 0.43 6.68 1.01 0.27 -0.68 121.20 131.98 2a3z s ILE 37 Ca 0.08 -0.78 0.07 0.00 0.00 0.00 0.00 60.65 60.02 2a3z s ILE 37 Cb -0.11 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 2a3z s ILE 37 CO -0.02 0.53 0.18 -1.10 0.00 0.00 0.00 174.94 174.54 2a3z s GLN 38 N 0.41 2.21 -1.53 2.79 -0.21 -0.74 -1.61 119.66 120.98 2a3z s GLN 38 Ca -0.12 -1.92 -0.01 0.00 0.02 0.00 0.00 55.36 53.33 2a3z s GLN 38 Cb -0.16 -1.94 0.00 0.00 1.00 0.00 0.00 33.01 31.90 2a3z s GLN 38 CO 0.06 -0.18 0.14 0.39 -2.12 0.00 0.00 175.29 173.57 2a3z n GLU 39 N -1.28 -2.19 -2.04 2.91 1.02 -1.26 -2.41 120.64 115.39 2a3z n GLU 39 Ca -0.03 0.87 -0.43 0.00 -0.02 0.00 0.00 57.16 57.56 2a3z n GLU 39 Cb 0.65 -5.43 -0.03 0.00 -0.02 0.00 0.00 31.44 26.62 2a3z n GLU 39 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2a3z s VAL 40 N -2.97 3.59 -0.67 2.62 1.01 -1.21 -1.91 120.40 120.86 2a3z s VAL 40 Ca 0.07 0.67 0.05 0.00 0.00 0.00 0.00 61.98 62.77 2a3z s VAL 40 Cb -0.03 -3.58 0.17 0.00 0.00 0.00 0.00 36.38 32.94 2a3z s VAL 40 CO 0.08 -0.22 0.49 0.54 0.00 0.00 0.00 175.10 175.99 2a3z n ARG 41 N 7.65 1.65 -3.45 2.72 5.12 0.81 -1.38 116.66 129.78 2a3z n ARG 41 Ca 0.19 -4.33 -0.29 0.00 -1.93 0.00 0.00 57.85 51.50 2a3z n ARG 41 Cb 0.45 -2.20 -0.12 0.00 -1.16 0.00 0.00 32.46 29.42 2a3z n ARG 41 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2a3z s ASP 42 N -1.31 2.74 0.46 0.55 2.15 -1.26 -4.32 116.67 115.67 2a3z s ASP 42 Ca 0.26 -2.31 0.13 0.00 0.43 0.00 0.00 52.55 51.07 2a3z s ASP 42 Cb -0.02 -0.40 1.07 0.00 -0.30 0.00 0.00 42.92 43.27 2a3z s ASP 42 CO -0.17 -0.29 2.06 0.77 -0.17 0.00 0.00 175.17 177.37 2a3z h SER 43 N 6.82 0.27 0.00 -0.34 4.64 -1.97 -2.92 113.55 120.05 2a3z h SER 43 Ca 0.09 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2a3z h SER 43 Cb 0.96 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2a3z h SER 43 CO 0.28 0.18 -0.05 1.41 -0.87 0.00 0.00 176.83 177.78 2a3z n HIS 44 N -4.48 0.00 -1.56 4.77 8.25 -1.26 -4.98 115.22 115.95 2a3z n HIS 44 Ca 0.04 -0.57 -0.12 0.00 -0.26 0.00 0.00 57.72 56.80 2a3z n HIS 44 Cb 0.19 -0.08 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 2a3z n HIS 44 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2a3z n LEU 45 N -0.73 -1.05 -0.12 2.41 4.77 -1.11 -4.92 117.00 116.25 2a3z n LEU 45 Ca 0.06 0.23 -0.13 0.00 -0.03 0.00 0.00 56.01 56.14 2a3z n LEU 45 Cb 0.46 -1.91 -0.02 0.00 -2.33 0.00 0.00 43.42 39.62 2a3z n LEU 45 CO 0.00 -0.53 0.58 0.58 -1.33 0.00 0.00 177.39 176.70 2a3z h VAL 46 N 0.00 1.28 -0.35 4.08 2.07 -1.94 -1.83 116.25 119.56 2a3z h VAL 46 Ca -0.26 -1.48 -0.15 0.00 0.82 0.00 0.00 66.70 65.62 2a3z h VAL 46 Cb 0.90 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.05 2a3z h VAL 46 CO 0.37 0.49 -0.37 0.00 0.02 0.00 0.00 177.57 178.08 2a3z h ALA 47 N 0.77 0.67 -0.57 1.67 0.00 -1.91 -1.47 119.26 118.42 2a3z h ALA 47 Ca 0.07 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.45 2a3z h ALA 47 Cb 0.90 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2a3z h ALA 47 CO 0.08 0.67 0.01 0.28 0.00 0.00 0.00 179.25 180.29 2a3z h VAL 48 N 0.68 1.26 -0.32 0.00 2.07 -1.94 -0.95 116.25 117.05 2a3z h VAL 48 Ca 0.06 -1.09 -0.12 0.00 0.82 0.00 0.00 66.70 66.37 2a3z h VAL 48 Cb 0.94 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 2a3z h VAL 48 CO 0.09 0.39 -0.30 1.23 0.02 0.00 0.00 177.57 179.01 2a3z h GLY 49 N 1.00 0.74 0.67 2.17 0.00 -1.15 -1.55 103.07 104.94 2a3z h GLY 49 Ca 0.17 -0.67 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2a3z h GLY 49 CO 0.02 0.60 -0.00 1.70 0.00 0.00 0.00 176.54 178.87 2a3z h LYS 50 N 0.58 -0.01 -0.10 4.80 3.64 -1.03 0.24 116.57 124.70 2a3z h LYS 50 Ca 0.07 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2a3z h LYS 50 Cb 0.80 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.57 2a3z h LYS 50 CO 0.07 0.32 -0.22 1.25 -2.27 0.00 0.00 179.45 178.60 2a3z h LEU 51 N -0.34 -0.66 -1.64 5.20 5.85 -1.15 -2.11 115.31 120.46 2a3z h LEU 51 Ca -0.00 0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.90 2a3z h LEU 51 Cb 0.34 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2a3z h LEU 51 CO 0.00 -0.27 0.36 -0.07 -0.34 0.00 0.00 178.44 178.12 2a3z h LEU 52 N -0.29 0.38 -0.15 2.25 3.38 -1.22 -0.84 115.31 118.82 2a3z h LEU 52 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2a3z h LEU 52 Cb 0.42 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2a3z h LEU 52 CO -0.27 0.24 0.05 0.44 0.09 0.00 0.00 178.44 178.99 2a3z h ASP 53 N 0.43 0.21 -0.08 -0.43 3.32 -0.31 0.04 116.42 119.60 2a3z h ASP 53 Ca 0.24 -0.20 0.04 0.00 0.02 0.00 0.00 57.03 57.13 2a3z h ASP 53 Cb 0.40 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.85 2a3z h ASP 53 CO -0.06 0.35 -0.19 1.88 -1.72 0.00 0.00 179.24 179.50 2a3z h TYR 54 N 0.06 -0.50 0.00 4.55 0.05 -0.98 -2.34 116.97 117.81 2a3z h TYR 54 Ca 0.05 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.82 2a3z h TYR 54 Cb 0.22 0.23 -0.00 0.00 1.01 0.00 0.00 36.73 38.18 2a3z h TYR 54 CO -0.00 -0.27 -0.15 -0.07 -1.05 0.00 0.00 178.16 176.62 2a3z h LEU 55 N -0.27 0.00 -3.16 3.88 3.38 -0.83 -3.13 115.31 115.19 2a3z h LEU 55 Ca 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2a3z h LEU 55 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 2a3z h LEU 55 CO -0.23 0.15 -0.01 0.59 0.09 0.00 0.00 178.44 179.03 2a3z n ASN 56 N -4.32 3.21 0.25 -0.43 3.02 -0.03 -4.67 115.26 112.29 2a3z n ASN 56 Ca -0.03 -3.08 0.15 0.00 -0.03 0.00 0.00 54.58 51.59 2a3z n ASN 56 Cb 0.22 -0.50 0.47 0.00 -0.61 0.00 0.00 39.78 39.36 2a3z n ASN 56 CO 0.00 0.00 0.00 0.06 -2.62 0.00 0.00 177.26 174.70 2a3z h GLN 57 N 1.06 0.00 0.00 3.52 3.07 -1.36 -3.24 115.11 118.15 2a3z h GLN 57 Ca 0.01 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.62 2a3z h GLN 57 Cb 1.27 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.81 2a3z h GLN 57 CO 0.14 0.03 -1.59 -0.25 0.09 0.00 0.00 178.83 177.25 2a3z n ASP 58 N -3.12 2.69 -3.65 0.06 8.00 -1.26 -4.93 116.55 114.33 2a3z n ASP 58 Ca 0.02 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.28 2a3z n ASP 58 Cb 0.40 0.94 -0.17 0.00 -0.02 0.00 0.00 41.12 42.27 2a3z n ASP 58 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2a3z s ASP 59 N -3.87 1.93 0.57 -2.24 -1.08 -1.23 -5.04 116.67 105.72 2a3z s ASP 59 Ca -0.04 -0.36 0.39 0.00 -0.52 0.00 0.00 52.55 52.01 2a3z s ASP 59 Cb 0.04 -0.25 2.09 0.00 -1.46 0.00 0.00 42.92 43.34 2a3z s ASP 59 CO 0.39 -0.30 2.18 1.55 0.52 0.00 0.00 175.17 179.51 2a3z h PRO 60 N 8.41 0.00 -0.25 4.34 0.13 -1.91 -1.72 132.00 140.99 2a3z h PRO 60 Ca -0.14 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.91 2a3z h PRO 60 Cb 1.14 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.22 2a3z h PRO 60 CO 0.24 0.00 -0.06 0.09 -0.23 0.00 0.00 178.00 178.04 2a3z n ASN 61 N -2.86 2.95 -0.23 1.44 3.02 -1.26 -4.70 115.26 113.61 2a3z n ASN 61 Ca -0.03 -3.40 0.01 0.00 -0.03 0.00 0.00 54.58 51.14 2a3z n ASN 61 Cb 0.06 -0.57 0.13 0.00 -0.61 0.00 0.00 39.78 38.80 2a3z n ASN 61 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2a3z h THR 62 N 1.15 0.81 -3.79 3.41 2.02 -1.59 -3.40 112.91 111.52 2a3z h THR 62 Ca 0.09 -0.18 -0.23 0.00 0.77 0.00 0.00 66.41 66.86 2a3z h THR 62 Cb 1.45 0.23 -0.27 0.00 -1.74 0.00 0.00 68.15 67.82 2a3z h THR 62 CO 0.25 0.10 -0.72 -0.31 0.37 0.00 0.00 175.52 175.20 2a3z s TYR 63 N -6.07 0.10 0.34 3.16 1.51 -1.26 -4.31 117.35 110.83 2a3z s TYR 63 Ca -0.13 -0.09 0.08 0.00 -1.01 0.00 0.00 57.07 55.93 2a3z s TYR 63 Cb 0.18 -0.07 -0.05 0.00 -0.11 0.00 0.00 41.96 41.92 2a3z s TYR 63 CO 0.76 -0.03 0.10 -1.01 -1.11 0.00 0.00 175.55 174.26 2a3z s HIS 64 N -0.23 2.66 0.15 2.71 3.76 0.44 -4.91 115.29 119.86 2a3z s HIS 64 Ca -0.02 -0.39 0.05 0.00 -0.15 0.00 0.00 55.06 54.54 2a3z s HIS 64 Cb -0.02 -1.58 -0.04 0.00 1.11 0.00 0.00 32.58 32.05 2a3z s HIS 64 CO -0.00 0.39 -0.10 1.52 -0.85 0.00 0.00 174.74 175.70 2a3z s TYR 65 N -2.45 1.28 -0.08 1.40 1.13 -1.26 -1.71 117.35 115.66 2a3z s TYR 65 Ca 0.37 -0.76 0.00 0.00 -1.41 0.00 0.00 57.07 55.27 2a3z s TYR 65 Cb -0.02 -0.65 0.02 0.00 -1.10 0.00 0.00 41.96 40.21 2a3z s TYR 65 CO 0.22 0.09 -0.06 0.08 -2.51 0.00 0.00 175.55 173.36 2a3z s VAL 66 N -3.32 0.80 0.02 -3.49 1.01 -0.03 -4.98 120.40 110.40 2a3z s VAL 66 Ca 0.17 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.98 2a3z s VAL 66 Cb 0.03 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.56 2a3z s VAL 66 CO 0.01 0.31 -0.07 0.54 0.00 0.00 0.00 175.10 175.89 2a3z s VAL 67 N 1.44 0.55 0.64 2.92 0.11 -1.26 -0.03 120.40 124.77 2a3z s VAL 67 Ca -0.01 -0.66 -0.03 0.00 -2.93 0.00 0.00 61.98 58.35 2a3z s VAL 67 Cb -0.13 -0.54 0.06 0.00 -1.53 0.00 0.00 36.38 34.24 2a3z s VAL 67 CO -0.04 -0.09 0.91 -0.94 -3.33 0.00 0.00 175.10 171.61 2a3z s SER 68 N -0.82 4.95 0.98 3.54 1.04 -0.14 -5.00 113.70 118.24 2a3z s SER 68 Ca -0.03 0.16 -0.12 0.00 0.48 0.00 0.00 55.95 56.44 2a3z s SER 68 Cb -0.06 -0.88 0.18 0.00 0.10 0.00 0.00 66.02 65.36 2a3z s SER 68 CO 0.00 -1.44 1.08 -1.61 0.98 0.00 0.00 173.24 172.26 2a3z s GLU 69 N -5.03 0.53 0.12 4.02 0.41 -1.26 -4.77 118.70 112.73 2a3z s GLU 69 Ca 0.60 0.86 -0.31 0.00 -0.41 0.00 0.00 54.97 55.70 2a3z s GLU 69 Cb -0.10 -1.72 -0.08 0.00 -1.78 0.00 0.00 34.13 30.45 2a3z s GLU 69 CO 0.42 -2.75 1.38 -2.14 -0.49 0.00 0.00 175.26 171.68 2a3z s PRO 70 N -4.79 4.33 0.09 0.39 0.02 -1.26 -4.49 135.00 129.28 2a3z s PRO 70 Ca 0.65 2.07 0.08 0.00 0.02 0.00 0.00 61.00 63.82 2a3z s PRO 70 Cb -0.20 -3.24 -0.04 0.00 0.02 0.00 0.00 34.50 31.04 2a3z s PRO 70 CO 0.59 -0.42 -0.16 -0.51 -0.33 0.00 0.00 177.00 176.17 2a3z s LEU 71 N 0.98 2.75 0.00 -5.54 1.43 0.25 -4.81 118.68 113.74 2a3z s LEU 71 Ca 0.64 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 2a3z s LEU 71 Cb -0.37 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.25 2a3z s LEU 71 CO 0.31 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.71 2a3z n GLY 72 N 1.06 2.05 0.26 -3.19 0.00 -1.19 -0.95 105.19 103.23 2a3z n GLY 72 Ca -0.15 -0.56 -0.07 0.00 0.00 0.00 0.00 46.02 45.24 2a3z n GLY 72 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2a3z h ARG 73 N 0.00 0.87 0.00 1.61 2.43 -1.78 -3.46 114.38 114.05 2a3z h ARG 73 Ca 0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2a3z h ARG 73 Cb 0.00 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 2a3z h ARG 73 CO 0.00 0.68 0.00 0.27 -1.51 0.00 0.00 179.97 179.41 2a3z n ASN 74 N -4.54 0.35 0.16 -3.80 0.23 -1.26 -5.04 115.26 101.36 2a3z n ASN 74 Ca 0.04 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.21 2a3z n ASN 74 Cb 0.11 0.00 0.26 0.00 -2.08 0.00 0.00 39.78 38.07 2a3z n ASN 74 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2a3z h SER 75 N 0.00 0.00 -3.04 0.53 4.64 -2.00 -3.42 113.55 110.26 2a3z h SER 75 Ca 0.00 -0.01 -0.57 0.00 -0.47 0.00 0.00 61.79 60.74 2a3z h SER 75 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 2a3z h SER 75 CO 0.00 0.00 1.00 -0.47 -0.87 0.00 0.00 176.83 176.49 2a3z s TYR 76 N -3.17 2.57 0.09 4.77 5.04 -1.26 -5.01 117.35 120.38 2a3z s TYR 76 Ca 0.08 0.80 0.07 0.00 -2.44 0.00 0.00 57.07 55.59 2a3z s TYR 76 Cb 0.09 -3.89 -0.03 0.00 0.35 0.00 0.00 41.96 38.47 2a3z s TYR 76 CO 0.65 -1.99 -0.19 0.15 -1.34 0.00 0.00 175.55 172.82 2a3z s LYS 77 N 4.22 1.06 0.03 4.97 1.02 -1.26 -4.47 119.74 125.32 2a3z s LYS 77 Ca 0.59 -1.11 -0.02 0.00 0.02 0.00 0.00 55.97 55.46 2a3z s LYS 77 Cb -0.19 -1.27 -0.02 0.00 -0.52 0.00 0.00 37.83 35.83 2a3z s LYS 77 CO 0.24 0.29 0.01 -1.21 -0.92 0.00 0.00 175.35 173.76 2a3z s GLU 78 N -1.84 0.44 0.21 1.68 2.02 -0.13 -4.76 118.70 116.31 2a3z s GLU 78 Ca 0.05 -0.75 0.07 0.00 0.02 0.00 0.00 54.97 54.35 2a3z s GLU 78 Cb -0.10 0.16 -0.04 0.00 0.10 0.00 0.00 34.13 34.25 2a3z s GLU 78 CO 0.04 -0.09 0.11 1.03 0.02 0.00 0.00 175.26 176.38 2a3z s ARG 79 N -2.20 2.75 -0.10 1.61 0.52 -0.48 0.87 118.95 121.92 2a3z s ARG 79 Ca -0.09 -1.04 -0.09 0.00 -0.52 0.00 0.00 55.73 53.99 2a3z s ARG 79 Cb -0.04 -2.51 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 2a3z s ARG 79 CO -0.03 0.44 0.21 0.71 0.02 0.00 0.00 175.30 176.64 2a3z s TYR 80 N -1.93 3.62 -0.10 -0.53 2.02 -1.26 -3.31 117.35 115.85 2a3z s TYR 80 Ca 0.31 0.63 0.01 0.00 -0.37 0.00 0.00 57.07 57.65 2a3z s TYR 80 Cb -0.09 -2.05 0.02 0.00 -0.40 0.00 0.00 41.96 39.45 2a3z s TYR 80 CO 0.23 0.68 -0.10 -1.17 -1.57 0.00 0.00 175.55 173.62 2a3z s LEU 81 N -0.93 1.39 -0.10 -1.29 2.96 -0.64 -0.97 118.68 119.10 2a3z s LEU 81 Ca 0.17 -0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 53.74 2a3z s LEU 81 Cb -0.13 -0.88 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 2a3z s LEU 81 CO 0.06 -0.06 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.63 2a3z s PHE 82 N 1.34 3.04 -0.07 5.38 0.40 0.96 0.98 117.98 130.00 2a3z s PHE 82 Ca -0.01 -0.03 0.04 0.00 -0.60 0.00 0.00 56.93 56.32 2a3z s PHE 82 Cb -0.14 -1.82 0.00 0.00 0.51 0.00 0.00 43.02 41.58 2a3z s PHE 82 CO -0.05 0.25 -0.18 -0.51 0.70 0.00 0.00 175.22 175.43 2a3z s LEU 83 N -0.43 1.90 -0.01 -0.37 1.43 -0.44 -0.85 118.68 119.90 2a3z s LEU 83 Ca 0.07 -0.42 -0.08 0.00 -1.03 0.00 0.00 54.13 52.68 2a3z s LEU 83 Cb -0.12 -1.10 0.01 0.00 0.03 0.00 0.00 46.19 45.00 2a3z s LEU 83 CO 0.02 0.12 0.16 0.72 0.23 0.00 0.00 176.35 177.60 2a3z s PHE 84 N 0.33 -0.02 -0.42 0.29 -0.71 -0.69 -1.23 117.98 115.52 2a3z s PHE 84 Ca -0.12 0.01 -0.23 0.00 -1.04 0.00 0.00 56.93 55.54 2a3z s PHE 84 Cb -0.15 -0.02 0.02 0.00 -1.21 0.00 0.00 43.02 41.66 2a3z s PHE 84 CO 0.05 -0.26 0.80 1.03 -1.34 0.00 0.00 175.22 175.50 2a3z s ARG 85 N -1.10 3.54 0.00 1.99 0.52 -0.05 -0.42 118.95 123.43 2a3z s ARG 85 Ca -0.12 0.07 0.14 0.00 -0.52 0.00 0.00 55.73 55.30 2a3z s ARG 85 Cb -0.06 -3.89 0.59 0.00 0.52 0.00 0.00 34.95 32.11 2a3z s ARG 85 CO 0.01 -1.03 1.44 -0.35 0.02 0.00 0.00 175.30 175.39 2a3z n PRO 86 N 6.66 0.01 0.04 3.54 -0.04 -1.26 -0.62 135.00 143.33 2a3z n PRO 86 Ca 0.03 0.26 0.13 0.00 -0.04 0.00 0.00 63.50 63.88 2a3z n PRO 86 Cb 0.48 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.81 2a3z n PRO 86 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2a3z n ASN 87 N -1.49 0.49 -0.12 3.54 6.94 -1.26 -4.17 115.26 119.20 2a3z n ASN 87 Ca 0.03 0.25 -0.26 0.00 -0.02 0.00 0.00 54.58 54.59 2a3z n ASN 87 Cb 0.16 -0.23 -0.11 0.00 -2.36 0.00 0.00 39.78 37.24 2a3z n ASN 87 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2a3z n LYS 88 N -1.84 0.60 -4.18 -3.83 4.76 0.21 -5.05 118.16 108.82 2a3z n LYS 88 Ca 0.05 0.34 -0.11 0.00 -2.87 0.00 0.00 58.31 55.73 2a3z n LYS 88 Cb 0.39 -1.59 -0.10 0.00 -1.84 0.00 0.00 35.03 31.89 2a3z n LYS 88 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2a3z s VAL 89 N -2.47 0.57 0.02 -0.18 -7.23 -0.75 -4.47 120.40 105.88 2a3z s VAL 89 Ca -0.34 -1.93 0.07 0.00 -1.81 0.00 0.00 61.98 57.97 2a3z s VAL 89 Cb 0.11 -1.85 -0.02 0.00 0.56 0.00 0.00 36.38 35.18 2a3z s VAL 89 CO 0.55 -0.71 -0.22 -0.44 -0.31 0.00 0.00 175.10 173.97 2a3z s SER 90 N -3.07 2.64 -0.21 4.85 0.01 -0.76 -4.19 113.70 112.96 2a3z s SER 90 Ca 0.17 -0.48 -0.29 0.00 1.31 0.00 0.00 55.95 56.65 2a3z s SER 90 Cb 0.06 -0.25 0.01 0.00 0.21 0.00 0.00 66.02 66.04 2a3z s SER 90 CO -0.02 0.22 1.04 -0.69 0.41 0.00 0.00 173.24 174.21 2a3z s VAL 91 N -0.68 4.69 -0.11 3.43 1.01 -1.26 -0.21 120.40 127.27 2a3z s VAL 91 Ca 0.09 2.02 0.04 0.00 0.00 0.00 0.00 61.98 64.13 2a3z s VAL 91 Cb -0.09 -4.30 -0.24 0.00 0.00 0.00 0.00 36.38 31.75 2a3z s VAL 91 CO 0.01 -0.15 0.41 0.18 0.00 0.00 0.00 175.10 175.54 2a3z n LEU 92 N 6.13 1.72 -3.50 3.92 4.77 0.45 -4.94 117.00 125.53 2a3z n LEU 92 Ca 0.12 0.24 -0.10 0.00 -0.03 0.00 0.00 56.01 56.24 2a3z n LEU 92 Cb 0.46 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 2a3z n LEU 92 CO 0.52 0.64 0.65 -0.62 -1.33 0.00 0.00 177.39 177.25 2a3z s ASP 93 N -6.47 -0.41 0.07 -1.43 2.15 -1.21 -5.01 116.67 104.35 2a3z s ASP 93 Ca -0.15 0.09 -0.09 0.00 0.43 0.00 0.00 52.55 52.82 2a3z s ASP 93 Cb 0.07 0.41 0.00 0.00 -0.30 0.00 0.00 42.92 43.11 2a3z s ASP 93 CO 0.78 -0.63 0.20 0.42 -0.17 0.00 0.00 175.17 175.77 2a3z s THR 94 N -2.87 0.12 0.06 1.71 -4.23 -1.26 -1.09 115.64 108.09 2a3z s THR 94 Ca 0.03 -1.02 -0.26 0.00 -1.18 0.00 0.00 61.69 59.25 2a3z s THR 94 Cb -0.01 -1.14 0.09 0.00 1.34 0.00 0.00 72.50 72.78 2a3z s THR 94 CO -0.07 -0.56 0.76 -0.72 -0.54 0.00 0.00 174.62 173.49 2a3z s TYR 95 N -3.25 -0.43 -0.14 3.99 -0.85 -0.76 -5.01 117.35 110.90 2a3z s TYR 95 Ca 0.00 0.27 -0.06 0.00 -0.52 0.00 0.00 57.07 56.77 2a3z s TYR 95 Cb 0.02 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.87 2a3z s TYR 95 CO -0.08 -0.67 0.06 -1.14 -1.52 0.00 0.00 175.55 172.20 2a3z s GLN 96 N -3.36 3.59 0.28 -3.49 2.00 -1.26 -0.73 119.66 116.68 2a3z s GLN 96 Ca 0.03 -0.32 -0.30 0.00 -2.00 0.00 0.00 55.36 52.77 2a3z s GLN 96 Cb -0.01 -3.08 -0.11 0.00 0.80 0.00 0.00 33.01 30.61 2a3z s GLN 96 CO -0.11 0.49 1.57 -0.47 -0.50 0.00 0.00 175.29 176.28 2a3z s TYR 97 N -0.26 2.82 -0.08 1.67 5.04 -0.28 -4.94 117.35 121.32 2a3z s TYR 97 Ca 0.08 0.80 0.01 0.00 -2.44 0.00 0.00 57.07 55.51 2a3z s TYR 97 Cb -0.12 -4.03 -0.05 0.00 0.35 0.00 0.00 41.96 38.11 2a3z s TYR 97 CO 0.02 -3.47 -0.06 -3.47 -1.34 0.00 0.00 175.55 167.23 2a3z n ASP 98 N 2.35 3.40 -2.08 4.32 2.03 -1.26 -4.41 116.55 120.91 2a3z n ASP 98 Ca 0.08 -0.04 -0.19 0.00 0.52 0.00 0.00 54.79 55.16 2a3z n ASP 98 Cb 0.38 -0.07 -0.04 0.00 -0.72 0.00 0.00 41.12 40.67 2a3z n ASP 98 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2a3z n ASP 99 N -2.70 -5.31 -0.18 1.67 -0.08 -1.26 -1.69 116.55 107.01 2a3z n ASP 99 Ca -0.14 0.20 -0.02 0.00 -1.51 0.00 0.00 54.79 53.32 2a3z n ASP 99 Cb 0.65 -4.54 -0.01 0.00 2.34 0.00 0.00 41.12 39.56 2a3z n ASP 99 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2a3z n GLY 100 N -0.73 0.57 3.66 0.27 0.00 -1.26 -4.87 105.19 102.82 2a3z n GLY 100 Ca -0.21 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.90 2a3z n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a3z h GLU 102 N 2.11 0.90 0.00 0.00 5.08 -1.96 -2.99 114.58 117.71 2a3z h GLU 102 Ca -0.25 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2a3z h GLU 102 Cb 1.26 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2a3z h GLU 102 CO 0.31 0.59 -0.04 -1.13 -1.00 0.00 0.00 179.01 177.74 2a3z n SER 103 N -4.66 1.27 0.27 1.42 3.41 -1.26 -4.73 113.62 109.34 2a3z n SER 103 Ca 0.16 -1.85 0.14 0.00 -0.26 0.00 0.00 58.87 57.06 2a3z n SER 103 Cb 0.30 -0.08 0.78 0.00 -0.26 0.00 0.00 64.21 64.95 2a3z n SER 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a3z h GLY 105 N 0.68 1.18 2.00 0.00 0.00 -1.53 -0.50 103.07 104.91 2a3z h GLY 105 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2a3z h GLY 105 CO 0.01 0.15 0.00 3.43 0.00 0.00 0.00 176.54 180.13 2a3z h ASN 106 N 0.77 0.00 -0.45 0.19 -0.26 -1.63 -1.77 115.58 112.43 2a3z h ASN 106 Ca 0.36 0.00 0.04 0.00 -0.56 0.00 0.00 56.30 56.15 2a3z h ASN 106 Cb 0.29 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.53 2a3z h ASN 106 CO -0.22 0.00 0.30 0.44 -1.06 0.00 0.00 177.43 176.89 2a3z h ASP 107 N 0.00 0.38 -0.00 5.81 5.19 -1.21 -3.31 116.42 123.27 2a3z h ASP 107 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2a3z h ASP 107 Cb 0.15 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.58 2a3z h ASP 107 CO 0.00 0.25 -0.08 -1.54 -3.12 0.00 0.00 179.24 174.76 2a3z n SER 108 N -4.48 0.33 -3.75 6.45 3.41 -0.72 -5.04 113.62 109.82 2a3z n SER 108 Ca 0.05 -0.67 -0.13 0.00 -0.26 0.00 0.00 58.87 57.87 2a3z n SER 108 Cb 0.20 0.79 -0.13 0.00 -0.26 0.00 0.00 64.21 64.81 2a3z n SER 108 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2a3z s PHE 109 N -0.98 -0.28 0.05 7.33 0.40 -0.89 -4.53 117.98 119.09 2a3z s PHE 109 Ca 0.01 0.67 -0.24 0.00 -0.60 0.00 0.00 56.93 56.78 2a3z s PHE 109 Cb 0.02 0.04 -0.16 0.00 0.51 0.00 0.00 43.02 43.43 2a3z s PHE 109 CO 0.07 -0.18 1.56 1.03 0.70 0.00 0.00 175.22 178.40 2a3z h SER 110 N 6.73 0.04 -4.15 1.36 0.87 -1.86 -3.33 113.55 113.20 2a3z h SER 110 Ca -0.36 -0.20 -0.69 0.00 -1.23 0.00 0.00 61.79 59.31 2a3z h SER 110 Cb 1.17 -0.01 -0.36 0.00 -0.44 0.00 0.00 62.40 62.76 2a3z h SER 110 CO 0.38 0.22 -0.36 -0.13 -0.53 0.00 0.00 176.83 176.41 2a3z s ARG 111 N -5.41 2.59 -0.37 2.24 0.52 -1.26 -2.97 118.95 114.29 2a3z s ARG 111 Ca -0.14 -2.59 -0.44 0.00 -0.52 0.00 0.00 55.73 52.04 2a3z s ARG 111 Cb 0.05 -3.73 -0.18 0.00 0.52 0.00 0.00 34.95 31.61 2a3z s ARG 111 CO 0.67 -1.18 1.61 0.39 0.02 0.00 0.00 175.30 176.81 2a3z n GLU 112 N 3.38 0.46 -1.65 3.54 4.71 -1.26 -4.68 120.64 125.14 2a3z n GLU 112 Ca 0.09 0.17 -0.45 0.00 -0.01 0.00 0.00 57.16 56.96 2a3z n GLU 112 Cb 0.37 -1.74 -0.02 0.00 -1.01 0.00 0.00 31.44 29.05 2a3z n GLU 112 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 2a3z n PRO 113 N 4.28 1.80 -3.27 3.49 -0.02 -1.26 -4.65 135.00 135.38 2a3z n PRO 113 Ca 0.28 0.64 -0.39 0.00 -2.02 0.00 0.00 63.50 62.01 2a3z n PRO 113 Cb 0.03 -2.19 -0.06 0.00 -0.02 0.00 0.00 33.50 31.26 2a3z n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a3z s ALA 114 N -0.59 3.57 -0.07 3.55 0.00 -1.25 -1.12 121.76 125.85 2a3z s ALA 114 Ca 0.63 0.03 0.01 0.00 0.00 0.00 0.00 51.96 52.62 2a3z s ALA 114 Cb -0.66 -2.65 0.02 0.00 0.00 0.00 0.00 23.12 19.83 2a3z s ALA 114 CO 0.56 0.35 -0.07 0.08 0.00 0.00 0.00 175.76 176.68 2a3z s VAL 115 N -0.90 0.81 -0.08 0.00 1.01 0.09 -1.76 120.40 119.56 2a3z s VAL 115 Ca 0.29 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.06 2a3z s VAL 115 Cb -0.19 -0.82 0.01 0.00 0.00 0.00 0.00 36.38 35.38 2a3z s VAL 115 CO 0.18 0.31 -0.12 -0.69 0.00 0.00 0.00 175.10 174.78 2a3z s VAL 116 N 1.24 1.20 -0.19 2.92 1.01 -0.28 -1.83 120.40 124.47 2a3z s VAL 116 Ca -0.05 -0.49 -0.17 0.00 0.00 0.00 0.00 61.98 61.28 2a3z s VAL 116 Cb -0.14 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 2a3z s VAL 116 CO -0.02 0.38 0.43 -0.75 0.00 0.00 0.00 175.10 175.13 2a3z s LYS 117 N 0.88 4.19 0.11 2.72 2.20 -0.25 -0.97 119.74 128.63 2a3z s LYS 117 Ca -0.10 0.27 0.06 0.00 -0.36 0.00 0.00 55.97 55.84 2a3z s LYS 117 Cb -0.15 -3.53 -0.04 0.00 -1.51 0.00 0.00 37.83 32.60 2a3z s LYS 117 CO 0.01 -0.04 -0.04 -0.06 -0.36 0.00 0.00 175.35 174.86 2a3z s PHE 118 N 1.29 2.87 -0.13 4.03 0.08 0.62 -0.41 117.98 126.33 2a3z s PHE 118 Ca 0.21 -0.10 -0.04 0.00 0.12 0.00 0.00 56.93 57.12 2a3z s PHE 118 Cb -0.15 -1.47 -0.03 0.00 -0.57 0.00 0.00 43.02 40.80 2a3z s PHE 118 CO 0.08 0.46 0.02 0.45 -0.10 0.00 0.00 175.22 176.14 2a3z s SER 119 N -2.36 5.34 -0.30 1.36 0.15 0.71 -2.18 113.70 116.42 2a3z s SER 119 Ca 0.24 0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.98 2a3z s SER 119 Cb -0.11 -1.70 0.13 0.00 -1.71 0.00 0.00 66.02 62.63 2a3z s SER 119 CO 0.16 0.29 0.26 -0.55 1.20 0.00 0.00 173.24 174.61 2a3z s SER 120 N -0.33 2.07 0.06 5.45 0.15 0.13 -1.83 113.70 119.40 2a3z s SER 120 Ca 0.07 -0.99 0.27 0.00 0.70 0.00 0.00 55.95 56.00 2a3z s SER 120 Cb -0.12 0.30 0.93 0.00 -1.71 0.00 0.00 66.02 65.42 2a3z s SER 120 CO 0.02 -0.39 1.75 0.00 1.20 0.00 0.00 173.24 175.82 2a3z n HIS 121 N 5.16 0.26 1.08 3.44 1.44 -1.26 -3.71 115.22 121.63 2a3z n HIS 121 Ca -0.01 0.08 0.12 0.00 -2.01 0.00 0.00 57.72 55.89 2a3z n HIS 121 Cb 0.45 -0.57 0.20 0.00 0.12 0.00 0.00 29.99 30.19 2a3z n HIS 121 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2a3z n SER 122 N -1.73 0.96 -4.73 4.39 3.41 -1.26 -4.93 113.62 109.74 2a3z n SER 122 Ca 0.06 -0.76 -0.24 0.00 -0.26 0.00 0.00 58.87 57.67 2a3z n SER 122 Cb 0.37 0.36 -0.07 0.00 -0.26 0.00 0.00 64.21 64.61 2a3z n SER 122 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2a3z s THR 123 N -2.76 2.47 0.21 6.66 -4.23 -1.24 -4.86 115.64 111.89 2a3z s THR 123 Ca 0.16 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 58.90 2a3z s THR 123 Cb 0.18 -2.97 0.04 0.00 1.34 0.00 0.00 72.50 71.09 2a3z s THR 123 CO 0.65 -0.06 1.63 0.11 -0.54 0.00 0.00 174.62 176.42 2a3z h LYS 124 N 1.49 0.81 -6.44 3.99 1.57 -1.87 -3.40 116.57 112.71 2a3z h LYS 124 Ca -0.43 -0.32 -0.54 0.00 -1.87 0.00 0.00 60.65 57.50 2a3z h LYS 124 Cb 1.25 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 33.52 2a3z h LYS 124 CO 0.68 0.94 0.75 0.08 -0.57 0.00 0.00 179.45 181.33 2a3z s VAL 125 N -4.66 3.67 -0.17 0.50 1.01 -1.26 -4.94 120.40 114.54 2a3z s VAL 125 Ca -0.10 1.13 -0.01 0.00 0.00 0.00 0.00 61.98 63.00 2a3z s VAL 125 Cb 0.13 -3.73 -0.22 0.00 0.00 0.00 0.00 36.38 32.56 2a3z s VAL 125 CO 0.84 0.04 0.14 0.29 0.00 0.00 0.00 175.10 176.40 2a3z n LYS 126 N 4.69 0.71 -4.61 2.72 4.76 -1.26 -4.55 118.16 120.62 2a3z n LYS 126 Ca 0.12 0.21 -0.24 0.00 -2.87 0.00 0.00 58.31 55.53 2a3z n LYS 126 Cb 0.44 -1.63 -0.16 0.00 -1.84 0.00 0.00 35.03 31.84 2a3z n LYS 126 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2a3z s GLU 127 N -2.54 1.47 0.19 1.97 2.02 -1.26 0.22 118.70 120.78 2a3z s GLU 127 Ca -0.26 -0.45 -0.10 0.00 0.02 0.00 0.00 54.97 54.19 2a3z s GLU 127 Cb 0.08 -1.29 -0.01 0.00 0.10 0.00 0.00 34.13 33.01 2a3z s GLU 127 CO 0.71 0.14 0.33 -0.59 0.02 0.00 0.00 175.26 175.87 2a3z s PHE 128 N 0.27 0.43 0.17 1.61 -0.71 -0.93 -4.80 117.98 114.02 2a3z s PHE 128 Ca -0.07 -0.78 0.11 0.00 -1.04 0.00 0.00 56.93 55.16 2a3z s PHE 128 Cb -0.12 -0.01 -0.04 0.00 -1.21 0.00 0.00 43.02 41.64 2a3z s PHE 128 CO 0.02 -0.80 -0.24 0.00 -1.34 0.00 0.00 175.22 172.86 2a3z s ALA 129 N -3.99 2.50 -0.05 1.99 0.00 -0.72 -0.27 121.76 121.21 2a3z s ALA 129 Ca 0.20 -1.56 0.05 0.00 0.00 0.00 0.00 51.96 50.65 2a3z s ALA 129 Cb 0.02 -0.38 -0.00 0.00 0.00 0.00 0.00 23.12 22.76 2a3z s ALA 129 CO 0.03 0.48 -0.21 0.42 0.00 0.00 0.00 175.76 176.49 2a3z s ILE 130 N -1.43 1.72 -0.18 0.00 1.01 -0.14 -0.51 121.20 121.68 2a3z s ILE 130 Ca 0.18 -0.87 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 2a3z s ILE 130 Cb -0.09 -1.47 -0.02 0.00 0.01 0.00 0.00 42.46 40.90 2a3z s ILE 130 CO 0.09 0.48 -0.05 -0.69 0.00 0.00 0.00 174.94 174.77 2a3z s VAL 131 N 0.02 3.58 -0.12 2.92 1.01 0.30 -1.13 120.40 126.97 2a3z s VAL 131 Ca -0.06 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 2a3z s VAL 131 Cb -0.13 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 2a3z s VAL 131 CO 0.03 0.47 0.26 0.00 0.00 0.00 0.00 175.10 175.86 2a3z s ALA 132 N 0.82 3.70 -0.04 5.51 0.00 -0.72 -1.12 121.76 129.91 2a3z s ALA 132 Ca -0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 2a3z s ALA 132 Cb -0.15 -2.26 0.03 0.00 0.00 0.00 0.00 23.12 20.75 2a3z s ALA 132 CO 0.02 0.32 0.07 -1.17 0.00 0.00 0.00 175.76 174.99 2a3z s LEU 133 N -0.25 0.77 -0.40 0.00 2.96 -0.54 -3.79 118.68 117.43 2a3z s LEU 133 Ca 0.17 0.12 -0.07 0.00 -0.22 0.00 0.00 54.13 54.12 2a3z s LEU 133 Cb -0.13 0.02 0.08 0.00 0.50 0.00 0.00 46.19 46.66 2a3z s LEU 133 CO 0.05 -0.16 0.22 -2.28 -1.32 0.00 0.00 176.35 172.86 2a3z s HIS 134 N 1.36 3.37 0.66 5.38 5.65 -1.26 -2.69 115.29 127.75 2a3z s HIS 134 Ca -0.06 -1.69 -0.11 0.00 0.25 0.00 0.00 55.06 53.45 2a3z s HIS 134 Cb -0.12 -2.88 -0.02 0.00 -1.18 0.00 0.00 32.58 28.37 2a3z s HIS 134 CO -0.04 -0.86 1.05 -1.54 -0.65 0.00 0.00 174.74 172.70 2a3z s SER 135 N 1.95 5.86 -0.18 9.88 1.04 -0.40 -4.58 113.70 127.27 2a3z s SER 135 Ca 0.03 1.45 -0.29 0.00 0.48 0.00 0.00 55.95 57.61 2a3z s SER 135 Cb -0.22 -2.41 -0.01 0.00 0.10 0.00 0.00 66.02 63.47 2a3z s SER 135 CO 0.01 -1.11 1.24 0.00 0.98 0.00 0.00 173.24 174.35 2a3z s ALA 136 N -3.16 3.65 0.29 5.32 0.00 -1.26 -4.79 121.76 121.81 2a3z s ALA 136 Ca 0.56 0.40 0.04 0.00 0.00 0.00 0.00 51.96 52.96 2a3z s ALA 136 Cb -0.12 -3.62 0.76 0.00 0.00 0.00 0.00 23.12 20.14 2a3z s ALA 136 CO 0.54 -1.20 1.65 -1.35 0.00 0.00 0.00 175.76 175.41 2a3z h PRO 137 N 8.18 0.23 0.00 0.00 0.11 -1.95 0.21 132.00 138.78 2a3z h PRO 137 Ca -0.25 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2a3z h PRO 137 Cb 1.10 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2a3z h PRO 137 CO 0.98 0.15 0.00 -1.13 -0.21 0.00 0.00 178.00 177.79 2a3z n SER 138 N -5.19 0.15 -0.54 -2.05 3.41 -1.26 -2.78 113.62 105.35 2a3z n SER 138 Ca 0.23 0.51 0.06 0.00 -0.26 0.00 0.00 58.87 59.41 2a3z n SER 138 Cb 0.72 -0.55 0.19 0.00 -0.26 0.00 0.00 64.21 64.31 2a3z n SER 138 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2a3z n ASP 139 N -1.64 2.05 -0.07 4.04 8.00 0.65 -4.88 116.55 124.69 2a3z n ASP 139 Ca 0.07 -3.65 -0.08 0.00 0.71 0.00 0.00 54.79 51.84 2a3z n ASP 139 Cb 0.35 -0.52 -0.01 0.00 -0.02 0.00 0.00 41.12 40.93 2a3z n ASP 139 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a3z h ALA 140 N 0.77 0.31 0.13 2.24 0.00 -1.12 -1.43 119.26 120.17 2a3z h ALA 140 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2a3z h ALA 140 Cb 1.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2a3z h ALA 140 CO 0.06 -0.30 -0.10 0.28 0.00 0.00 0.00 179.25 179.18 2a3z h VAL 141 N 0.23 0.77 -0.31 0.00 2.07 -1.88 -0.70 116.25 116.43 2a3z h VAL 141 Ca 0.12 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.65 2a3z h VAL 141 Cb 0.08 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2a3z h VAL 141 CO -0.11 0.00 0.19 0.00 0.02 0.00 0.00 177.57 177.67 2a3z h ALA 142 N 0.62 0.39 -0.42 1.67 0.00 -1.91 0.31 119.26 119.92 2a3z h ALA 142 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2a3z h ALA 142 Cb 0.22 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2a3z h ALA 142 CO -0.01 -0.17 0.10 0.93 0.00 0.00 0.00 179.25 180.10 2a3z h GLU 143 N 0.39 0.67 -0.50 0.00 5.08 -1.05 0.30 114.58 119.47 2a3z h GLU 143 Ca 0.12 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2a3z h GLU 143 Cb -0.02 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2a3z h GLU 143 CO -0.05 0.68 0.20 0.82 -1.00 0.00 0.00 179.01 179.66 2a3z h ILE 144 N 0.54 1.21 -0.79 3.13 2.04 -1.05 -1.56 117.51 121.03 2a3z h ILE 144 Ca 0.13 -0.66 0.08 0.00 1.00 0.00 0.00 64.86 65.42 2a3z h ILE 144 Cb 0.31 0.72 -0.07 0.00 -0.74 0.00 0.00 36.82 37.04 2a3z h ILE 144 CO 0.00 0.25 0.45 -1.13 0.00 0.00 0.00 178.15 177.72 2a3z h ASN 145 N 0.66 0.66 0.51 1.72 -1.24 -0.69 -2.32 115.58 114.89 2a3z h ASN 145 Ca 0.17 0.04 -0.03 0.00 0.71 0.00 0.00 56.30 57.19 2a3z h ASN 145 Cb 0.20 -0.09 -0.00 0.00 0.73 0.00 0.00 38.32 39.15 2a3z h ASN 145 CO -0.01 0.40 -0.13 0.28 -1.29 0.00 0.00 177.43 176.67 2a3z h SER 146 N 0.79 0.00 -0.48 1.15 0.02 0.21 -1.59 113.55 113.65 2a3z h SER 146 Ca 0.37 0.00 0.14 0.00 -0.84 0.00 0.00 61.79 61.46 2a3z h SER 146 Cb 0.30 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 2a3z h SER 146 CO -0.22 0.13 0.38 -0.07 -1.14 0.00 0.00 176.83 175.91 2a3z h LEU 147 N 0.00 0.00 -0.55 5.07 3.38 -0.71 0.72 115.31 123.22 2a3z h LEU 147 Ca -0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2a3z h LEU 147 Cb 0.42 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2a3z h LEU 147 CO 0.02 0.00 0.26 0.22 0.09 0.00 0.00 178.44 179.02 2a3z h TYR 148 N 0.00 0.46 -0.28 1.13 3.20 -1.38 -0.19 116.97 119.91 2a3z h TYR 148 Ca 0.23 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.99 2a3z h TYR 148 Cb 0.99 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.13 2a3z h TYR 148 CO 0.00 0.20 -0.35 -0.44 -1.64 0.00 0.00 178.16 175.93 2a3z h ASP 149 N 0.49 0.65 -0.55 -2.11 3.32 -1.05 -1.37 116.42 115.80 2a3z h ASP 149 Ca 0.25 -0.27 0.07 0.00 0.02 0.00 0.00 57.03 57.10 2a3z h ASP 149 Cb 0.21 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.52 2a3z h ASP 149 CO -0.20 0.95 0.23 0.58 -1.72 0.00 0.00 179.24 179.08 2a3z h VAL 150 N 0.53 0.86 -0.49 -1.35 2.07 -0.82 0.22 116.25 117.27 2a3z h VAL 150 Ca 0.05 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2a3z h VAL 150 Cb 0.85 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2a3z h VAL 150 CO 0.07 0.08 0.31 0.22 0.02 0.00 0.00 177.57 178.27 2a3z h TYR 151 N 0.44 0.64 -1.00 1.57 3.20 -0.46 0.28 116.97 121.64 2a3z h TYR 151 Ca 0.26 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.19 2a3z h TYR 151 Cb 0.25 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.24 2a3z h TYR 151 CO -0.14 0.43 0.65 -0.07 -1.64 0.00 0.00 178.16 177.39 2a3z h LEU 152 N 0.66 1.06 -0.62 2.82 4.07 -1.07 -1.23 115.31 121.00 2a3z h LEU 152 Ca 0.18 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 58.04 2a3z h LEU 152 Cb -0.04 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.45 2a3z h LEU 152 CO -0.04 0.70 -0.02 -0.78 -1.08 0.00 0.00 178.44 177.22 2a3z h ASP 153 N 1.22 1.05 -0.40 -0.43 3.58 0.45 -1.63 116.42 120.26 2a3z h ASP 153 Ca 0.42 -0.31 0.01 0.00 0.42 0.00 0.00 57.03 57.57 2a3z h ASP 153 Cb 0.09 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.84 2a3z h ASP 153 CO -0.15 1.11 0.25 0.58 -2.88 0.00 0.00 179.24 178.15 2a3z h VAL 154 N 0.96 1.08 -0.19 2.25 2.07 -0.69 -1.14 116.25 120.59 2a3z h VAL 154 Ca 0.17 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.56 2a3z h VAL 154 Cb 0.59 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 2a3z h VAL 154 CO 0.03 0.09 -0.11 1.56 0.02 0.00 0.00 177.57 179.17 2a3z h GLN 155 N 0.51 -0.10 -0.32 1.57 4.20 -0.99 0.60 115.11 120.59 2a3z h GLN 155 Ca 0.15 0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.83 2a3z h GLN 155 Cb -0.04 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2a3z h GLN 155 CO -0.05 -0.06 0.06 0.37 -0.67 0.00 0.00 178.83 178.48 2a3z h GLN 156 N -0.10 0.53 0.16 1.46 4.15 -1.19 -0.69 115.11 119.43 2a3z h GLN 156 Ca 0.11 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 2a3z h GLN 156 Cb 0.26 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.89 2a3z h GLN 156 CO -0.26 0.61 -0.08 0.87 -1.93 0.00 0.00 178.83 178.04 2a3z h LYS 157 N 0.36 -0.21 -0.10 1.69 1.57 -1.08 -3.36 116.57 115.44 2a3z h LYS 157 Ca 0.10 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2a3z h LYS 157 Cb 0.33 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2a3z h LYS 157 CO 0.00 0.04 0.00 0.91 -0.57 0.00 0.00 179.45 179.84 2a3z n TRP 158 N -5.08 0.12 -3.88 -1.35 8.01 0.19 -4.98 117.44 110.46 2a3z n TRP 158 Ca -0.09 -0.14 -0.26 0.00 -1.31 0.00 0.00 57.50 55.70 2a3z n TRP 158 Cb 0.19 -0.01 0.01 0.00 -2.01 0.00 0.00 31.31 29.49 2a3z n TRP 158 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 2a3z n HIS 159 N 0.52 -1.90 -4.74 -5.99 8.25 -0.27 -4.95 115.22 106.16 2a3z n HIS 159 Ca 0.07 0.82 -0.26 0.00 -0.26 0.00 0.00 57.72 58.09 2a3z n HIS 159 Cb 0.30 -3.95 -0.16 0.00 1.12 0.00 0.00 29.99 27.29 2a3z n HIS 159 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2a3z s LEU 160 N -6.96 1.79 -0.00 2.41 2.96 -1.24 -5.01 118.68 112.62 2a3z s LEU 160 Ca 0.22 -0.35 0.21 0.00 -0.22 0.00 0.00 54.13 54.00 2a3z s LEU 160 Cb -0.12 -0.94 -0.26 0.00 0.50 0.00 0.00 46.19 45.38 2a3z s LEU 160 CO 0.85 0.09 0.55 0.59 -1.32 0.00 0.00 176.35 177.11 2a3z n ASN 161 N 3.55 0.21 -4.48 3.68 5.03 -1.26 -3.98 115.26 118.01 2a3z n ASN 161 Ca -0.21 0.08 -0.42 0.00 0.87 0.00 0.00 54.58 54.90 2a3z n ASN 161 Cb 0.52 1.47 -0.03 0.00 -1.02 0.00 0.00 39.78 40.72 2a3z n ASN 161 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2a3z s ASP 162 N -4.88 6.21 -0.05 6.41 1.01 -1.26 -2.63 116.67 121.48 2a3z s ASP 162 Ca -0.07 -0.93 -0.02 0.00 0.71 0.00 0.00 52.55 52.25 2a3z s ASP 162 Cb 0.12 -2.46 0.04 0.00 1.01 0.00 0.00 42.92 41.62 2a3z s ASP 162 CO 0.87 -1.53 0.10 -0.69 0.21 0.00 0.00 175.17 174.13 2a3z s VAL 163 N 4.49 -0.08 -0.14 -1.27 1.01 -0.63 -1.76 120.40 122.02 2a3z s VAL 163 Ca 0.27 0.23 -0.06 0.00 0.00 0.00 0.00 61.98 62.43 2a3z s VAL 163 Cb -0.13 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 2a3z s VAL 163 CO 0.09 0.10 0.06 -0.32 0.00 0.00 0.00 175.10 175.03 2a3z s MET 164 N 1.33 3.58 -0.11 2.72 1.75 0.34 -1.25 119.30 127.65 2a3z s MET 164 Ca -0.07 -0.32 0.02 0.00 -1.25 0.00 0.00 55.69 54.07 2a3z s MET 164 Cb -0.12 -3.08 0.01 0.00 2.84 0.00 0.00 34.83 34.48 2a3z s MET 164 CO -0.05 0.50 -0.16 -0.51 -0.65 0.00 0.00 175.02 174.15 2a3z s LEU 165 N -0.28 1.79 0.08 4.11 1.02 0.63 -0.54 118.68 125.49 2a3z s LEU 165 Ca 0.08 -0.46 -0.15 0.00 0.02 0.00 0.00 54.13 53.63 2a3z s LEU 165 Cb -0.12 -1.15 0.03 0.00 0.02 0.00 0.00 46.19 44.96 2a3z s LEU 165 CO 0.02 0.03 0.34 0.00 0.02 0.00 0.00 176.35 176.76 2a3z s MET 166 N 0.94 0.93 0.00 1.70 0.23 -0.28 -0.28 119.30 122.54 2a3z s MET 166 Ca -0.07 -0.61 0.00 0.00 -1.03 0.00 0.00 55.69 53.98 2a3z s MET 166 Cb -0.15 0.40 0.00 0.00 -1.53 0.00 0.00 34.83 33.55 2a3z s MET 166 CO -0.01 -0.33 0.00 0.41 -2.03 0.00 0.00 175.02 173.06 2a3z n GLY 167 N 0.19 0.59 3.51 3.16 0.00 -0.87 -1.46 105.19 110.31 2a3z n GLY 167 Ca -0.17 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 2a3z n GLY 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2a3z s ASP 168 N -4.00 6.51 0.00 1.61 2.15 -1.09 -1.52 116.67 120.33 2a3z s ASP 168 Ca 0.00 -1.62 0.26 0.00 0.43 0.00 0.00 52.55 51.62 2a3z s ASP 168 Cb 0.00 -2.49 1.41 0.00 -0.30 0.00 0.00 42.92 41.55 2a3z s ASP 168 CO 0.00 -1.33 1.93 0.49 -0.17 0.00 0.00 175.17 176.08 2a3z n PHE 169 N 7.84 0.02 -3.68 -5.34 3.01 -0.73 -1.27 117.46 117.31 2a3z n PHE 169 Ca 0.25 -0.01 -0.27 0.00 1.01 0.00 0.00 57.45 58.43 2a3z n PHE 169 Cb 0.50 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.94 2a3z n PHE 169 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2a3z n ASN 170 N -0.65 -2.70 -2.59 4.37 3.02 -0.97 -4.69 115.26 111.05 2a3z n ASN 170 Ca 0.19 -0.58 -0.25 0.00 -0.03 0.00 0.00 54.58 53.91 2a3z n ASN 170 Cb 0.15 -2.28 -0.09 0.00 -0.61 0.00 0.00 39.78 36.95 2a3z n ASN 170 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2a3z n ALA 171 N -3.64 6.68 -3.98 5.41 0.00 -1.03 -4.02 120.51 119.93 2a3z n ALA 171 Ca 0.04 -2.82 0.01 0.00 0.00 0.00 0.00 53.44 50.67 2a3z n ALA 171 Cb 0.50 -2.52 0.02 0.00 0.00 0.00 0.00 19.45 17.45 2a3z n ALA 171 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2a3z s ASP 172 N 1.30 0.01 1.46 0.00 -1.08 -1.25 -4.65 116.67 112.46 2a3z s ASP 172 Ca 0.63 -0.35 0.00 0.00 -0.52 0.00 0.00 52.55 52.31 2a3z s ASP 172 Cb 0.30 0.25 0.00 0.00 -1.46 0.00 0.00 42.92 42.01 2a3z s ASP 172 CO -0.09 -0.50 0.00 0.00 0.52 0.00 0.00 175.17 175.10 2a3z n SER 174 N 2.94 0.12 -0.06 0.00 3.41 -1.26 -3.67 113.62 115.10 2a3z n SER 174 Ca 0.00 0.52 -0.15 0.00 -0.26 0.00 0.00 58.87 58.98 2a3z n SER 174 Cb 0.00 -0.55 -0.14 0.00 -0.26 0.00 0.00 64.21 63.26 2a3z n SER 174 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2a3z n TYR 175 N -1.62 0.54 -3.75 7.33 4.01 -0.85 -4.72 117.16 118.09 2a3z n TYR 175 Ca 0.05 0.15 -0.28 0.00 -0.16 0.00 0.00 57.90 57.66 2a3z n TYR 175 Cb 0.27 -1.08 -0.16 0.00 -0.31 0.00 0.00 39.34 38.06 2a3z n TYR 175 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2a3z s VAL 176 N -2.54 0.67 0.73 -0.72 1.01 -0.95 -4.33 120.40 114.26 2a3z s VAL 176 Ca -0.19 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 60.99 2a3z s VAL 176 Cb 0.07 -1.21 0.10 0.00 0.00 0.00 0.00 36.38 35.35 2a3z s VAL 176 CO 0.75 -0.28 1.02 0.42 0.00 0.00 0.00 175.10 177.02 2a3z s THR 177 N 1.78 2.23 0.16 3.92 -4.23 -1.25 -3.60 115.64 114.65 2a3z s THR 177 Ca 0.00 -0.40 -0.15 0.00 -1.18 0.00 0.00 61.69 59.96 2a3z s THR 177 Cb -0.17 -2.83 0.05 0.00 1.34 0.00 0.00 72.50 70.88 2a3z s THR 177 CO -0.11 0.00 1.81 0.28 -0.54 0.00 0.00 174.62 176.06 2a3z h SER 178 N -0.65 0.58 0.15 3.99 0.02 -2.00 -1.98 113.55 113.65 2a3z h SER 178 Ca -0.41 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2a3z h SER 178 Cb 1.28 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 63.68 2a3z h SER 178 CO 0.48 0.44 -0.02 0.77 -1.14 0.00 0.00 176.83 177.36 2a3z h SER 179 N 0.66 0.00 1.23 3.07 4.64 -2.03 -2.98 113.55 118.14 2a3z h SER 179 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2a3z h SER 179 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2a3z h SER 179 CO -0.04 0.02 -0.42 1.56 -0.87 0.00 0.00 176.83 177.08 2a3z h GLN 180 N 0.00 0.00 -0.06 4.77 4.20 -1.73 -3.30 115.11 118.99 2a3z h GLN 180 Ca -0.00 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.73 2a3z h GLN 180 Cb 0.10 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 2a3z h GLN 180 CO 0.00 0.00 0.05 -1.49 -0.67 0.00 0.00 178.83 176.73 2a3z h TRP 181 N 0.00 0.00 0.00 2.96 4.06 -1.58 -1.11 115.95 120.28 2a3z h TRP 181 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2a3z h TRP 181 Cb 0.83 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.99 2a3z h TRP 181 CO 0.00 0.00 0.00 -1.13 -3.56 0.00 0.00 178.44 173.75 2a3z n SER 182 N -4.23 0.38 -0.80 -3.49 3.41 -1.24 -2.30 113.62 105.35 2a3z n SER 182 Ca -0.01 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.28 2a3z n SER 182 Cb 0.16 -0.66 0.12 0.00 -0.26 0.00 0.00 64.21 63.57 2a3z n SER 182 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2a3z n SER 183 N -1.89 2.62 -4.34 4.04 3.41 -0.42 -4.81 113.62 112.22 2a3z n SER 183 Ca 0.04 -1.83 -0.43 0.00 -0.26 0.00 0.00 58.87 56.39 2a3z n SER 183 Cb 0.28 0.10 -0.08 0.00 -0.26 0.00 0.00 64.21 64.25 2a3z n SER 183 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2a3z s ILE 184 N -2.11 4.90 0.51 -1.33 1.01 -0.97 -4.89 121.20 118.31 2a3z s ILE 184 Ca 0.27 -1.22 0.17 0.00 0.00 0.00 0.00 60.65 59.87 2a3z s ILE 184 Cb 0.20 -3.97 0.29 0.00 0.01 0.00 0.00 42.46 38.99 2a3z s ILE 184 CO 0.36 -0.58 2.12 0.03 0.00 0.00 0.00 174.94 176.87 2a3z h ARG 185 N 8.65 0.04 0.00 2.79 3.08 -1.86 0.41 114.38 127.49 2a3z h ARG 185 Ca -0.27 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.78 2a3z h ARG 185 Cb 1.10 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.14 2a3z h ARG 185 CO 0.85 0.03 -0.02 1.25 -1.07 0.00 0.00 179.97 181.01 2a3z h LEU 186 N 0.04 0.00 0.01 3.04 5.85 -1.81 -0.29 115.31 122.15 2a3z h LEU 186 Ca 0.05 0.00 -0.41 0.00 0.84 0.00 0.00 57.88 58.37 2a3z h LEU 186 Cb 0.16 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.13 2a3z h LEU 186 CO -0.00 0.02 -2.34 -1.14 -0.34 0.00 0.00 178.44 174.64 2a3z n ARG 187 N -3.35 0.62 0.15 1.25 3.00 0.01 -4.57 116.66 113.76 2a3z n ARG 187 Ca -0.02 0.26 0.02 0.00 -0.00 0.00 0.00 57.85 58.11 2a3z n ARG 187 Cb 0.14 -1.55 0.17 0.00 0.00 0.00 0.00 32.46 31.21 2a3z n ARG 187 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 2a3z h THR 188 N -0.57 1.04 -3.10 5.15 1.35 -1.10 -3.44 112.91 112.24 2a3z h THR 188 Ca -0.60 -2.04 -0.53 0.00 -0.55 0.00 0.00 66.41 62.68 2a3z h THR 188 Cb 1.71 2.22 0.01 0.00 -1.73 0.00 0.00 68.15 70.37 2a3z h THR 188 CO -0.25 0.51 0.64 -0.55 -0.25 0.00 0.00 175.52 175.62 2a3z s SER 189 N -6.52 6.96 0.00 5.36 0.15 -0.13 -4.90 113.70 114.61 2a3z s SER 189 Ca 0.01 2.16 0.28 0.00 0.70 0.00 0.00 55.95 59.10 2a3z s SER 189 Cb 0.10 -2.58 1.56 0.00 -1.71 0.00 0.00 66.02 63.39 2a3z s SER 189 CO 0.73 -0.56 1.98 -1.54 1.20 0.00 0.00 173.24 175.05 2a3z n SER 190 N 3.96 0.00 0.27 5.45 3.41 -1.26 -2.64 113.62 122.81 2a3z n SER 190 Ca 0.10 -0.59 0.18 0.00 -0.26 0.00 0.00 58.87 58.30 2a3z n SER 190 Cb 0.44 -0.11 0.94 0.00 -0.26 0.00 0.00 64.21 65.23 2a3z n SER 190 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2a3z h THR 191 N 0.00 0.29 -3.92 6.66 2.02 -1.95 -3.45 112.91 112.56 2a3z h THR 191 Ca 0.00 0.00 -0.69 0.00 0.77 0.00 0.00 66.41 66.49 2a3z h THR 191 Cb 0.09 0.87 -0.24 0.00 -1.74 0.00 0.00 68.15 67.13 2a3z h THR 191 CO 0.00 0.00 -0.78 -0.36 0.37 0.00 0.00 175.52 174.75 2a3z s PHE 192 N -4.43 2.70 -0.17 3.16 0.40 -1.08 -4.33 117.98 114.22 2a3z s PHE 192 Ca -0.05 -0.28 -0.04 0.00 -0.60 0.00 0.00 56.93 55.97 2a3z s PHE 192 Cb 0.14 -1.66 -0.02 0.00 0.51 0.00 0.00 43.02 41.98 2a3z s PHE 192 CO 0.47 0.09 -0.04 -0.65 0.70 0.00 0.00 175.22 175.79 2a3z s GLN 193 N -0.51 3.58 -0.35 0.44 -0.21 0.35 -4.95 119.66 118.02 2a3z s GLN 193 Ca 0.07 -0.55 -0.18 0.00 0.02 0.00 0.00 55.36 54.71 2a3z s GLN 193 Cb -0.12 -2.94 -0.00 0.00 1.00 0.00 0.00 33.01 30.95 2a3z s GLN 193 CO 0.02 0.12 0.52 -1.58 -2.12 0.00 0.00 175.29 172.25 2a3z s TRP 194 N 0.68 3.18 -0.03 0.91 0.52 -1.26 -1.25 118.94 121.68 2a3z s TRP 194 Ca -0.02 0.20 0.12 0.00 0.02 0.00 0.00 56.10 56.43 2a3z s TRP 194 Cb -0.14 -2.94 -0.20 0.00 -1.15 0.00 0.00 33.47 29.04 2a3z s TRP 194 CO 0.02 -0.54 0.83 -0.07 0.02 0.00 0.00 176.95 177.21 2a3z h LEU 195 N 9.11 0.00 -8.85 2.99 3.38 -1.47 -3.43 115.31 117.04 2a3z h LEU 195 Ca -0.28 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.05 2a3z h LEU 195 Cb 1.12 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.70 2a3z h LEU 195 CO 0.78 0.91 -0.42 -0.63 0.09 0.00 0.00 178.44 179.17 2a3z s ILE 196 N -2.69 5.26 0.73 1.22 -1.09 -1.25 -4.79 121.20 118.59 2a3z s ILE 196 Ca -0.03 0.16 -0.12 0.00 -2.23 0.00 0.00 60.65 58.44 2a3z s ILE 196 Cb 0.08 -3.64 0.03 0.00 -1.58 0.00 0.00 42.46 37.35 2a3z s ILE 196 CO 0.82 0.13 1.11 -2.16 -1.23 0.00 0.00 174.94 173.61 2a3z s PRO 197 N 1.85 2.68 0.65 2.79 0.04 -1.26 -4.82 135.00 136.94 2a3z s PRO 197 Ca 0.09 0.42 0.39 0.00 0.04 0.00 0.00 61.00 61.94 2a3z s PRO 197 Cb -0.16 -2.00 2.14 0.00 0.04 0.00 0.00 34.50 34.51 2a3z s PRO 197 CO 0.11 -1.15 2.25 -0.44 0.04 0.00 0.00 177.00 177.81 2a3z h ASP 198 N -0.74 0.00 1.29 6.66 3.32 -1.95 -2.47 116.42 122.52 2a3z h ASP 198 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2a3z h ASP 198 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2a3z h ASP 198 CO 0.64 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.62 2a3z n SER 199 N -3.23 0.74 -4.79 6.45 3.41 -1.26 -4.50 113.62 110.44 2a3z n SER 199 Ca -0.02 0.59 -0.35 0.00 -0.26 0.00 0.00 58.87 58.83 2a3z n SER 199 Cb 0.15 -0.78 -0.05 0.00 -0.26 0.00 0.00 64.21 63.27 2a3z n SER 199 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a3z s ALA 200 N -3.14 3.05 -0.29 7.33 0.00 -0.93 -4.94 121.76 122.83 2a3z s ALA 200 Ca 0.09 0.58 -0.07 0.00 0.00 0.00 0.00 51.96 52.56 2a3z s ALA 200 Cb 0.12 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 20.01 2a3z s ALA 200 CO 0.55 -0.09 0.09 0.34 0.00 0.00 0.00 175.76 176.65 2a3z s ASP 201 N -1.81 5.21 -0.09 0.00 2.15 -1.26 -2.22 116.67 118.65 2a3z s ASP 201 Ca 0.60 -0.59 0.13 0.00 0.43 0.00 0.00 52.55 53.11 2a3z s ASP 201 Cb -0.17 -1.91 0.33 0.00 -0.30 0.00 0.00 42.92 40.87 2a3z s ASP 201 CO 0.22 -0.17 1.25 0.35 -0.17 0.00 0.00 175.17 176.65 2a3z n THR 202 N 4.90 1.63 -4.29 1.71 -2.24 0.63 -4.79 114.28 111.84 2a3z n THR 202 Ca -0.15 -1.57 -0.33 0.00 -2.27 0.00 0.00 64.05 59.74 2a3z n THR 202 Cb 0.49 0.08 -0.09 0.00 -2.10 0.00 0.00 70.33 68.71 2a3z n THR 202 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2a3z s THR 203 N -2.03 4.20 -0.83 4.28 -4.23 -1.25 -1.12 115.64 114.66 2a3z s THR 203 Ca 0.28 -0.56 0.26 0.00 -1.18 0.00 0.00 61.69 60.49 2a3z s THR 203 Cb 0.21 -2.86 0.18 0.00 1.34 0.00 0.00 72.50 71.37 2a3z s THR 203 CO 0.08 0.40 1.67 0.00 -0.54 0.00 0.00 174.62 176.23 2a3z n ALA 204 N 1.46 2.60 -1.72 3.99 0.00 0.12 -4.71 120.51 122.25 2a3z n ALA 204 Ca -0.15 -0.14 -0.29 0.00 0.00 0.00 0.00 53.44 52.86 2a3z n ALA 204 Cb 0.53 -1.36 0.12 0.00 0.00 0.00 0.00 19.45 18.74 2a3z n ALA 204 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2a3z s THR 205 N -3.07 1.99 -2.00 0.00 -4.23 -1.23 -4.87 115.64 102.24 2a3z s THR 205 Ca 0.11 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.71 2a3z s THR 205 Cb 0.15 -2.88 0.25 0.00 1.34 0.00 0.00 72.50 71.37 2a3z s THR 205 CO 0.62 0.00 1.03 -1.54 -0.54 0.00 0.00 174.62 174.19 2a3z n SER 206 N -3.56 0.00 -4.83 3.99 3.41 -1.26 -4.75 113.62 106.62 2a3z n SER 206 Ca 0.08 -0.90 -0.32 0.00 -0.26 0.00 0.00 58.87 57.47 2a3z n SER 206 Cb 0.60 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.56 2a3z n SER 206 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2a3z s THR 207 N -2.00 4.20 -0.47 6.66 -4.23 -1.26 -5.03 115.64 113.52 2a3z s THR 207 Ca 0.13 0.91 -0.01 0.00 -1.18 0.00 0.00 61.69 61.55 2a3z s THR 207 Cb 0.06 -3.56 0.12 0.00 1.34 0.00 0.00 72.50 70.47 2a3z s THR 207 CO 0.10 -0.75 0.25 0.21 -0.54 0.00 0.00 174.62 173.90 2a3z s ASN 208 N -3.33 5.04 -0.06 3.99 2.47 -1.26 -4.69 114.94 117.09 2a3z s ASN 208 Ca 0.60 -2.41 -0.04 0.00 0.42 0.00 0.00 52.86 51.42 2a3z s ASN 208 Cb -0.13 -1.78 0.03 0.00 -1.45 0.00 0.00 41.25 37.92 2a3z s ASN 208 CO 0.43 -0.43 0.16 0.00 -3.72 0.00 0.00 177.10 173.54 2a3z n ALA 210 N 3.53 6.55 -0.15 0.00 0.00 -0.94 -0.27 120.51 129.23 2a3z n ALA 210 Ca -0.18 -4.07 -0.09 0.00 0.00 0.00 0.00 53.44 49.09 2a3z n ALA 210 Cb 0.56 -2.90 -0.00 0.00 0.00 0.00 0.00 19.45 17.10 2a3z n ALA 210 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2a3z h TYR 211 N 4.93 0.72 -2.99 0.00 0.05 -1.86 -3.36 116.97 114.46 2a3z h TYR 211 Ca 0.65 -0.08 -0.62 0.00 0.05 0.00 0.00 58.73 58.74 2a3z h TYR 211 Cb 0.38 -0.21 -0.06 0.00 1.01 0.00 0.00 36.73 37.85 2a3z h TYR 211 CO 1.56 0.65 -0.25 -0.51 -1.05 0.00 0.00 178.16 178.56 2a3z s ASP 212 N -6.01 6.72 0.11 3.88 1.01 -1.26 -1.77 116.67 119.34 2a3z s ASP 212 Ca -0.13 0.85 -0.07 0.00 0.71 0.00 0.00 52.55 53.91 2a3z s ASP 212 Cb 0.11 -2.22 -0.01 0.00 1.01 0.00 0.00 42.92 41.80 2a3z s ASP 212 CO 0.77 0.30 0.16 -0.13 0.21 0.00 0.00 175.17 176.49 2a3z s ARG 213 N -0.87 0.89 -0.07 8.23 1.81 -0.57 -4.93 118.95 123.44 2a3z s ARG 213 Ca 0.22 -1.11 -0.03 0.00 -1.72 0.00 0.00 55.73 53.10 2a3z s ARG 213 Cb -0.16 0.32 0.04 0.00 -0.45 0.00 0.00 34.95 34.70 2a3z s ARG 213 CO 0.11 -0.28 0.08 0.42 -0.68 0.00 0.00 175.30 174.95 2a3z s ILE 214 N -3.92 -0.13 -0.02 1.52 1.01 -1.26 -2.05 121.20 116.35 2a3z s ILE 214 Ca 0.10 0.33 0.08 0.00 0.00 0.00 0.00 60.65 61.16 2a3z s ILE 214 Cb 0.05 -0.24 -0.02 0.00 0.01 0.00 0.00 42.46 42.27 2a3z s ILE 214 CO -0.07 0.11 -0.25 -0.69 0.00 0.00 0.00 174.94 174.03 2a3z s VAL 215 N 2.19 2.10 -0.02 2.92 1.01 0.61 -1.03 120.40 128.18 2a3z s VAL 215 Ca 0.04 -1.09 0.05 0.00 0.00 0.00 0.00 61.98 60.98 2a3z s VAL 215 Cb -0.13 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 2a3z s VAL 215 CO -0.04 0.58 -0.16 0.68 0.00 0.00 0.00 175.10 176.16 2a3z s VAL 216 N -0.58 1.25 0.22 2.92 -7.23 -0.38 -0.27 120.40 116.33 2a3z s VAL 216 Ca 0.09 -0.66 0.10 0.00 -1.81 0.00 0.00 61.98 59.70 2a3z s VAL 216 Cb -0.10 -1.05 -0.05 0.00 0.56 0.00 0.00 36.38 35.74 2a3z s VAL 216 CO -0.01 0.36 -0.19 0.00 -0.31 0.00 0.00 175.10 174.96 2a3z s ALA 217 N -0.24 2.33 0.00 1.32 0.00 -0.38 -0.49 121.76 124.29 2a3z s ALA 217 Ca 0.03 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 50.31 2a3z s ALA 217 Cb -0.07 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.84 2a3z s ALA 217 CO 0.00 0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.40 2a3z n GLY 218 N -0.19 1.84 0.27 0.00 0.00 -1.08 -1.61 105.19 104.43 2a3z n GLY 218 Ca -0.09 -1.24 -0.03 0.00 0.00 0.00 0.00 46.02 44.66 2a3z n GLY 218 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2a3z h SER 219 N 0.00 0.63 0.02 1.61 4.64 -1.95 -1.16 113.55 117.34 2a3z h SER 219 Ca 0.00 -0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2a3z h SER 219 Cb 0.00 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 2a3z h SER 219 CO 0.00 0.74 -0.01 0.25 -0.87 0.00 0.00 176.83 176.94 2a3z h LEU 220 N 0.60 -0.03 -0.46 5.97 5.85 -1.97 -1.39 115.31 123.88 2a3z h LEU 220 Ca 0.12 -0.29 0.06 0.00 0.84 0.00 0.00 57.88 58.61 2a3z h LEU 220 Cb 0.47 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 2a3z h LEU 220 CO 0.02 0.27 0.16 0.25 -0.34 0.00 0.00 178.44 178.81 2a3z h LEU 221 N -0.33 0.16 -0.73 2.25 6.46 -1.81 -1.28 115.31 120.04 2a3z h LEU 221 Ca -0.00 0.05 0.06 0.00 -0.12 0.00 0.00 57.88 57.88 2a3z h LEU 221 Cb 0.31 0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 40.22 2a3z h LEU 221 CO 0.01 0.13 0.42 1.56 -0.62 0.00 0.00 178.44 179.93 2a3z h GLN 222 N 0.33 0.73 0.00 1.25 4.20 -1.16 -1.25 115.11 119.21 2a3z h GLN 222 Ca 0.22 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 2a3z h GLN 222 Cb 0.22 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 2a3z h GLN 222 CO -0.22 0.49 -0.10 0.66 -0.67 0.00 0.00 178.83 178.99 2a3z h SER 223 N 0.76 0.00 1.51 1.46 4.64 -0.56 -2.91 113.55 118.45 2a3z h SER 223 Ca 0.33 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.56 2a3z h SER 223 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2a3z h SER 223 CO -0.19 0.10 -0.41 0.28 -0.87 0.00 0.00 176.83 175.73 2a3z h SER 224 N 0.00 0.00 -2.54 4.97 0.02 -0.09 -3.46 113.55 112.45 2a3z h SER 224 Ca -0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 2a3z h SER 224 Cb 0.33 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.90 2a3z h SER 224 CO 0.01 0.41 1.11 -0.69 -1.14 0.00 0.00 176.83 176.54 2a3z s VAL 225 N -3.06 2.67 -0.21 2.27 1.01 -1.10 -0.64 120.40 121.34 2a3z s VAL 225 Ca 0.04 0.11 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 2a3z s VAL 225 Cb 0.07 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 2a3z s VAL 225 CO 0.73 -0.00 1.65 -0.69 0.00 0.00 0.00 175.10 176.79 2a3z s VAL 226 N 2.95 3.64 0.35 2.92 1.01 -0.30 -4.91 120.40 126.06 2a3z s VAL 226 Ca 0.81 0.72 -0.28 0.00 0.00 0.00 0.00 61.98 63.23 2a3z s VAL 226 Cb -0.45 -3.65 -0.12 0.00 0.00 0.00 0.00 36.38 32.16 2a3z s VAL 226 CO 0.36 -0.27 1.36 -0.81 0.00 0.00 0.00 175.10 175.74 2a3z n PRO 227 N 7.70 2.29 -0.85 2.72 -0.04 -1.26 -1.70 135.00 143.86 2a3z n PRO 227 Ca 0.19 0.80 0.00 0.00 -0.04 0.00 0.00 63.50 64.46 2a3z n PRO 227 Cb 0.45 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 2a3z n PRO 227 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2a3z n GLY 228 N 0.79 0.92 0.16 0.55 0.00 -1.26 -4.91 105.19 101.44 2a3z n GLY 228 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.13 2a3z n GLY 228 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2a3z h SER 229 N 0.00 0.00 -3.31 1.61 4.64 -1.70 -3.45 113.55 111.35 2a3z h SER 229 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 2a3z h SER 229 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 2a3z h SER 229 CO 0.00 0.25 0.41 0.00 -0.87 0.00 0.00 176.83 176.62 2a3z s ALA 230 N -3.10 3.41 0.07 5.18 0.00 -1.26 -4.26 121.76 121.80 2a3z s ALA 230 Ca 0.04 0.23 -0.26 0.00 0.00 0.00 0.00 51.96 51.96 2a3z s ALA 230 Cb 0.07 -3.28 0.09 0.00 0.00 0.00 0.00 23.12 19.99 2a3z s ALA 230 CO 0.73 -0.52 0.80 0.00 0.00 0.00 0.00 175.76 176.76 2a3z s ALA 231 N 1.80 -1.72 0.66 0.00 0.00 -0.85 -4.84 121.76 116.81 2a3z s ALA 231 Ca 0.43 0.75 -0.15 0.00 0.00 0.00 0.00 51.96 52.99 2a3z s ALA 231 Cb -0.18 0.60 -0.00 0.00 0.00 0.00 0.00 23.12 23.54 2a3z s ALA 231 CO 0.17 -0.75 1.10 -2.14 0.00 0.00 0.00 175.76 174.14 2a3z s PRO 232 N -3.36 2.86 -0.38 0.00 0.02 -1.26 -1.36 135.00 131.52 2a3z s PRO 232 Ca 0.04 1.34 -0.10 0.00 0.02 0.00 0.00 61.00 62.31 2a3z s PRO 232 Cb -0.01 -1.96 0.04 0.00 0.02 0.00 0.00 34.50 32.59 2a3z s PRO 232 CO -0.09 -1.20 0.20 0.12 -0.33 0.00 0.00 177.00 175.70 2a3z s PHE 233 N -2.40 3.27 -0.89 6.54 5.36 0.84 -4.86 117.98 125.83 2a3z s PHE 233 Ca 0.66 -1.20 -0.21 0.00 -0.96 0.00 0.00 56.93 55.23 2a3z s PHE 233 Cb -0.19 -2.55 0.10 0.00 -0.34 0.00 0.00 43.02 40.04 2a3z s PHE 233 CO 0.42 -0.72 1.16 0.34 -1.46 0.00 0.00 175.22 174.96 2a3z s ASP 234 N 1.68 6.50 0.55 6.13 -1.08 -1.26 -4.06 116.67 125.13 2a3z s ASP 234 Ca 0.01 -1.68 0.33 0.00 -0.52 0.00 0.00 52.55 50.69 2a3z s ASP 234 Cb -0.20 -2.44 1.33 0.00 -1.46 0.00 0.00 42.92 40.15 2a3z s ASP 234 CO 0.05 -1.24 1.97 2.19 0.52 0.00 0.00 175.17 178.66 2a3z h PHE 235 N 9.20 0.00 -0.20 -5.34 -5.15 -1.96 -0.47 116.94 113.02 2a3z h PHE 235 Ca 0.07 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.81 2a3z h PHE 235 Cb 1.03 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.19 2a3z h PHE 235 CO 1.15 0.00 0.01 0.37 -2.00 0.00 0.00 178.31 177.84 2a3z h GLN 236 N 0.00 0.34 -0.24 6.09 4.15 -1.92 -0.38 115.11 123.15 2a3z h GLN 236 Ca -0.00 -0.10 -0.06 0.00 0.77 0.00 0.00 58.65 59.26 2a3z h GLN 236 Cb 0.53 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.18 2a3z h GLN 236 CO 0.00 0.53 -0.08 0.00 -1.93 0.00 0.00 178.83 177.35 2a3z h ALA 237 N 0.80 0.34 -0.61 3.38 0.00 -1.75 -0.14 119.26 121.28 2a3z h ALA 237 Ca 0.06 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.74 2a3z h ALA 237 Cb 0.37 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 2a3z h ALA 237 CO 0.01 0.16 0.32 0.00 0.00 0.00 0.00 179.25 179.74 2a3z h ALA 238 N 0.75 0.80 -0.65 0.00 0.00 -1.08 -2.66 119.26 116.42 2a3z h ALA 238 Ca 0.06 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2a3z h ALA 238 Cb 0.56 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2a3z h ALA 238 CO 0.03 -0.02 0.00 0.66 0.00 0.00 0.00 179.25 179.92 2a3z n TYR 239 N -4.84 1.59 -4.10 0.00 4.01 -0.16 -4.96 117.16 108.71 2a3z n TYR 239 Ca 0.07 -0.63 -0.38 0.00 -0.16 0.00 0.00 57.90 56.81 2a3z n TYR 239 Cb 0.17 -0.28 -0.02 0.00 -0.31 0.00 0.00 39.34 38.90 2a3z n TYR 239 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2a3z n GLY 240 N 1.08 -0.55 3.94 2.72 0.00 -0.96 -4.96 105.19 106.46 2a3z n GLY 240 Ca 0.26 0.28 -0.24 0.00 0.00 0.00 0.00 46.02 46.32 2a3z n GLY 240 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a3z s LEU 241 N -7.28 3.94 0.73 0.99 1.43 -0.11 -5.04 118.68 113.35 2a3z s LEU 241 Ca 0.28 0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 53.81 2a3z s LEU 241 Cb -0.14 -3.42 0.03 0.00 0.03 0.00 0.00 46.19 42.69 2a3z s LEU 241 CO 0.96 -0.35 1.07 -0.94 0.23 0.00 0.00 176.35 177.33 2a3z s SER 242 N -4.04 5.00 0.45 2.29 1.04 -1.26 -4.84 113.70 112.34 2a3z s SER 242 Ca 0.41 1.63 0.13 0.00 0.48 0.00 0.00 55.95 58.60 2a3z s SER 242 Cb -0.10 -2.44 1.03 0.00 0.10 0.00 0.00 66.02 64.61 2a3z s SER 242 CO 0.38 -1.69 2.05 -1.13 0.98 0.00 0.00 173.24 173.82 2a3z h ASN 243 N -0.89 0.14 -0.30 7.02 -0.73 -1.98 -1.95 115.58 116.89 2a3z h ASN 243 Ca -0.44 -0.01 -0.11 0.00 1.87 0.00 0.00 56.30 57.60 2a3z h ASN 243 Cb 1.22 -0.04 -0.01 0.00 0.27 0.00 0.00 38.32 39.77 2a3z h ASN 243 CO 0.56 0.19 -0.25 -0.33 -0.37 0.00 0.00 177.43 177.22 2a3z h GLU 244 N 0.15 0.70 -0.26 6.67 3.07 -1.99 -0.93 114.58 121.99 2a3z h GLU 244 Ca 0.04 -0.35 -0.01 0.00 -0.50 0.00 0.00 59.36 58.54 2a3z h GLU 244 Cb 0.14 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 2a3z h GLU 244 CO 0.00 0.96 0.13 1.98 -1.40 0.00 0.00 179.01 180.69 2a3z h MET 245 N 0.45 0.36 -0.59 2.33 4.05 -1.92 -2.01 114.93 117.60 2a3z h MET 245 Ca 0.05 -0.05 0.11 0.00 -0.28 0.00 0.00 59.70 59.54 2a3z h MET 245 Cb 0.81 -0.07 -0.09 0.00 -0.80 0.00 0.00 31.60 31.46 2a3z h MET 245 CO 0.06 0.34 0.10 0.00 0.23 0.00 0.00 176.91 177.65 2a3z h ALA 246 N 1.00 0.68 0.00 0.39 0.00 -1.13 -1.40 119.26 118.81 2a3z h ALA 246 Ca 0.09 0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 2a3z h ALA 246 Cb 0.09 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2a3z h ALA 246 CO -0.01 -0.33 -0.37 -0.07 0.00 0.00 0.00 179.25 178.47 2a3z h LEU 247 N 0.23 0.00 -1.71 0.00 4.07 -1.06 -0.99 115.31 115.84 2a3z h LEU 247 Ca 0.31 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.24 2a3z h LEU 247 Cb 0.47 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 2a3z h LEU 247 CO -0.42 0.37 -0.17 0.00 -1.08 0.00 0.00 178.44 177.14 2a3z h ALA 248 N 1.63 1.61 0.12 1.53 0.00 -0.49 -3.16 119.26 120.50 2a3z h ALA 248 Ca -0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2a3z h ALA 248 Cb 0.76 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2a3z h ALA 248 CO 0.05 0.21 -0.06 0.82 0.00 0.00 0.00 179.25 180.27 2a3z h ILE 249 N 0.00 0.85 -2.03 0.00 2.04 -0.81 -3.49 117.51 114.06 2a3z h ILE 249 Ca -0.00 -1.29 0.18 0.00 1.00 0.00 0.00 64.86 64.75 2a3z h ILE 249 Cb 0.32 1.49 -0.14 0.00 -0.74 0.00 0.00 36.82 37.75 2a3z h ILE 249 CO 0.02 0.24 0.59 -0.55 0.00 0.00 0.00 178.15 178.46 2a3z s SER 250 N -5.59 -0.25 0.00 1.72 0.15 -0.91 -4.16 113.70 104.66 2a3z s SER 250 Ca -0.12 -0.10 0.20 0.00 0.70 0.00 0.00 55.95 56.63 2a3z s SER 250 Cb -0.00 0.33 0.54 0.00 -1.71 0.00 0.00 66.02 65.18 2a3z s SER 250 CO 0.43 -0.56 1.44 -0.90 1.20 0.00 0.00 173.24 174.85 2a3z n ASP 251 N -0.28 2.62 -4.39 5.45 5.75 -1.26 -4.16 116.55 120.28 2a3z n ASP 251 Ca -0.06 -1.91 -0.28 0.00 -0.01 0.00 0.00 54.79 52.53 2a3z n ASP 251 Cb 0.61 -0.24 -0.13 0.00 -1.03 0.00 0.00 41.12 40.33 2a3z n ASP 251 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2a3z s HIS 252 N -1.52 2.25 0.32 2.11 3.76 -1.26 0.11 115.29 121.06 2a3z s HIS 252 Ca 0.35 -0.38 -0.09 0.00 -0.15 0.00 0.00 55.06 54.79 2a3z s HIS 252 Cb 0.19 -1.19 -0.07 0.00 1.11 0.00 0.00 32.58 32.62 2a3z s HIS 252 CO 0.27 0.36 0.65 0.71 -0.85 0.00 0.00 174.74 175.88 2a3z s TYR 253 N -1.22 3.45 0.62 1.40 2.02 -0.27 -4.55 117.35 118.80 2a3z s TYR 253 Ca 0.15 0.91 -0.19 0.00 -0.37 0.00 0.00 57.07 57.57 2a3z s TYR 253 Cb -0.09 -2.31 -0.02 0.00 -0.40 0.00 0.00 41.96 39.14 2a3z s TYR 253 CO 0.07 0.09 1.29 -2.14 -1.57 0.00 0.00 175.55 173.28 2a3z s PRO 254 N -3.42 2.70 -0.08 -1.71 0.02 -1.26 -4.69 135.00 126.56 2a3z s PRO 254 Ca 0.49 2.06 -0.01 0.00 0.02 0.00 0.00 61.00 63.56 2a3z s PRO 254 Cb -0.11 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.47 2a3z s PRO 254 CO 0.27 -1.48 -0.03 0.14 -0.33 0.00 0.00 177.00 175.56 2a3z s VAL 255 N -1.41 4.01 0.19 3.83 -7.23 -0.05 -0.11 120.40 119.63 2a3z s VAL 255 Ca 0.80 -0.36 0.04 0.00 -1.81 0.00 0.00 61.98 60.65 2a3z s VAL 255 Cb -0.37 -2.67 -0.05 0.00 0.56 0.00 0.00 36.38 33.85 2a3z s VAL 255 CO 0.40 0.60 -0.05 -1.83 -0.31 0.00 0.00 175.10 173.90 2a3z s GLU 256 N -0.80 1.19 0.07 4.82 -1.05 -0.46 -1.19 118.70 121.28 2a3z s GLU 256 Ca 0.12 -1.56 -0.24 0.00 -0.15 0.00 0.00 54.97 53.14 2a3z s GLU 256 Cb -0.11 -0.61 0.06 0.00 -0.44 0.00 0.00 34.13 33.03 2a3z s GLU 256 CO 0.02 -0.01 0.57 0.54 0.95 0.00 0.00 175.26 177.33 2a3z s VAL 257 N -3.38 0.02 0.01 1.83 0.11 -0.10 -2.00 120.40 116.89 2a3z s VAL 257 Ca 0.22 -0.14 0.08 0.00 -2.93 0.00 0.00 61.98 59.22 2a3z s VAL 257 Cb 0.04 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.87 2a3z s VAL 257 CO 0.04 -0.07 -0.25 -0.89 -3.33 0.00 0.00 175.10 170.60 2a3z s THR 258 N -2.72 1.96 0.13 5.04 2.01 -1.26 -0.89 115.64 119.91 2a3z s THR 258 Ca -0.04 -1.17 0.10 0.00 0.31 0.00 0.00 61.69 60.89 2a3z s THR 258 Cb -0.00 -1.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.82 2a3z s THR 258 CO -0.04 0.44 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.33 2a3z s LEU 259 N -0.86 2.33 0.00 4.42 1.43 -0.20 -1.15 118.68 124.65 2a3z s LEU 259 Ca 0.10 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 2a3z s LEU 259 Cb -0.09 -1.08 0.00 0.00 0.03 0.00 0.00 46.19 45.05 2a3z s LEU 259 CO 0.00 0.12 0.00 1.07 0.23 0.00 0.00 176.35 177.77