#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2piy s HIS 7 N 0.00 3.76 -0.00 1.61 5.04 -1.26 -5.06 115.29 119.38 2piy s HIS 7 Ca 0.00 1.78 0.01 0.00 -1.54 0.00 0.00 55.06 55.31 2piy s HIS 7 Cb 0.00 -3.15 -0.00 0.00 0.04 0.00 0.00 32.58 29.47 2piy s HIS 7 CO 0.00 -0.11 -0.03 0.45 -2.34 0.00 0.00 174.74 172.71 2piy s SER 8 N -0.89 0.42 0.17 9.88 0.15 -1.26 -5.03 113.70 117.14 2piy s SER 8 Ca 0.44 -0.06 0.26 0.00 0.70 0.00 0.00 55.95 57.28 2piy s SER 8 Cb -0.29 -0.06 0.91 0.00 -1.71 0.00 0.00 66.02 64.87 2piy s SER 8 CO 0.36 0.03 1.78 -1.22 1.20 0.00 0.00 173.24 175.40 2piy n TYR 9 N 3.07 0.71 -1.09 3.44 4.01 -1.26 -3.18 117.16 122.86 2piy n TYR 9 Ca -0.14 0.22 0.04 0.00 -0.16 0.00 0.00 57.90 57.87 2piy n TYR 9 Cb 0.58 -0.86 0.26 0.00 -0.31 0.00 0.00 39.34 39.02 2piy n TYR 9 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2piy n GLU 10 N -2.09 2.87 -4.17 -0.72 1.02 -1.26 -4.83 120.64 111.46 2piy n GLU 10 Ca 0.05 -2.95 -0.11 0.00 -0.02 0.00 0.00 57.16 54.13 2piy n GLU 10 Cb 0.37 -1.90 -0.10 0.00 -0.02 0.00 0.00 31.44 29.79 2piy n GLU 10 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2piy s LYS 11 N -2.93 0.85 0.04 3.49 1.02 -1.19 -4.77 119.74 116.24 2piy s LYS 11 Ca 0.45 -1.34 -0.29 0.00 0.02 0.00 0.00 55.97 54.80 2piy s LYS 11 Cb 0.37 -0.24 -0.04 0.00 -0.52 0.00 0.00 37.83 37.40 2piy s LYS 11 CO 0.08 -0.01 0.95 0.71 -0.92 0.00 0.00 175.35 176.16 2piy s TYR 12 N -3.59 3.71 -0.06 3.18 2.02 -1.26 -4.75 117.35 116.59 2piy s TYR 12 Ca 0.12 1.70 0.01 0.00 -0.37 0.00 0.00 57.07 58.53 2piy s TYR 12 Cb 0.05 -3.07 -0.03 0.00 -0.40 0.00 0.00 41.96 38.51 2piy s TYR 12 CO -0.04 0.08 -0.06 -0.80 -1.57 0.00 0.00 175.55 173.15 2piy s ASN 13 N 0.62 4.68 0.90 2.29 0.01 -1.26 -5.01 114.94 117.17 2piy s ASN 13 Ca 0.49 -0.02 -0.12 0.00 -0.71 0.00 0.00 52.86 52.50 2piy s ASN 13 Cb -0.22 -1.18 0.13 0.00 0.41 0.00 0.00 41.25 40.40 2piy s ASN 13 CO 0.28 0.36 1.13 0.54 -1.51 0.00 0.00 177.10 177.89 2piy s ASN 14 N -0.86 3.58 0.22 -1.22 2.20 -1.26 -4.72 114.94 112.87 2piy s ASN 14 Ca 0.13 1.05 -0.08 0.00 -0.94 0.00 0.00 52.86 53.02 2piy s ASN 14 Cb -0.11 -1.66 0.18 0.00 -2.00 0.00 0.00 41.25 37.66 2piy s ASN 14 CO 0.02 -2.52 1.86 -0.25 -2.94 0.00 0.00 177.10 173.27 2piy h TRP 15 N -1.47 1.12 -1.00 1.54 2.91 -1.96 -0.43 115.95 116.66 2piy h TRP 15 Ca -0.50 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 59.58 2piy h TRP 15 Cb 1.32 -0.36 -0.07 0.00 -0.51 0.00 0.00 29.16 29.54 2piy h TRP 15 CO 0.32 0.76 0.64 0.93 -1.03 0.00 0.00 178.44 180.07 2piy h GLU 16 N 1.15 1.10 -0.18 2.65 3.07 -1.99 0.28 114.58 120.66 2piy h GLU 16 Ca 0.30 -0.07 -0.19 0.00 -0.50 0.00 0.00 59.36 58.90 2piy h GLU 16 Cb -0.01 -0.25 0.01 0.00 -0.84 0.00 0.00 28.75 27.65 2piy h GLU 16 CO -0.05 0.73 -0.62 1.15 -1.40 0.00 0.00 179.01 178.81 2piy h THR 17 N 1.13 1.30 -0.56 1.13 2.02 -1.71 -2.31 112.91 113.91 2piy h THR 17 Ca 0.44 -1.84 -0.04 0.00 0.77 0.00 0.00 66.41 65.74 2piy h THR 17 Cb 0.24 1.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.55 2piy h THR 17 CO -0.19 0.58 0.17 0.40 0.37 0.00 0.00 175.52 176.85 2piy h ILE 18 N 0.46 1.24 -0.44 3.11 2.04 -0.32 -0.36 117.51 123.23 2piy h ILE 18 Ca -0.03 -0.81 0.02 0.00 1.00 0.00 0.00 64.86 65.05 2piy h ILE 18 Cb 1.25 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 2piy h ILE 18 CO 0.13 0.30 0.26 -0.08 0.00 0.00 0.00 178.15 178.77 2piy h GLU 19 N 0.77 0.51 -0.48 2.37 4.81 -0.49 -0.26 114.58 121.82 2piy h GLU 19 Ca 0.18 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.31 2piy h GLU 19 Cb 0.29 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2piy h GLU 19 CO -0.01 0.34 0.03 0.00 -0.73 0.00 0.00 179.01 178.65 2piy h ALA 20 N 1.20 1.15 -0.85 2.92 0.00 -1.22 -2.36 119.26 120.11 2piy h ALA 20 Ca 0.18 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2piy h ALA 20 Cb 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2piy h ALA 20 CO -0.08 0.55 0.42 2.35 0.00 0.00 0.00 179.25 182.49 2piy h TRP 21 N 0.74 1.22 -0.56 0.00 7.01 -0.45 -1.00 115.95 122.90 2piy h TRP 21 Ca 0.15 -0.06 -0.03 0.00 2.11 0.00 0.00 58.89 61.07 2piy h TRP 21 Cb 0.40 -0.38 -0.03 0.00 -2.10 0.00 0.00 29.16 27.05 2piy h TRP 21 CO 0.02 0.87 0.23 1.79 -2.79 0.00 0.00 178.44 178.56 2piy h THR 22 N 1.21 1.20 -0.19 2.65 1.35 -0.53 0.69 112.91 119.29 2piy h THR 22 Ca 0.29 -0.62 -0.11 0.00 -0.55 0.00 0.00 66.41 65.43 2piy h THR 22 Cb 0.11 0.53 -0.00 0.00 -1.73 0.00 0.00 68.15 67.05 2piy h THR 22 CO -0.04 0.25 -0.29 0.50 -0.25 0.00 0.00 175.52 175.69 2piy h LYS 23 N 0.80 0.54 -0.20 4.72 1.63 -1.26 -3.08 116.57 119.72 2piy h LYS 23 Ca 0.19 -0.32 -0.07 0.00 -0.85 0.00 0.00 60.65 59.60 2piy h LYS 23 Cb 0.15 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 31.80 2piy h LYS 23 CO -0.02 0.92 -0.15 0.37 -3.45 0.00 0.00 179.45 177.13 2piy h GLN 24 N 0.20 0.45 -0.01 1.90 4.15 -0.69 -1.70 115.11 119.42 2piy h GLN 24 Ca 0.02 -0.22 -0.09 0.00 0.77 0.00 0.00 58.65 59.13 2piy h GLN 24 Cb 0.87 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 2piy h GLN 24 CO 0.07 0.77 -0.44 -0.24 -1.93 0.00 0.00 178.83 177.06 2piy h VAL 25 N 0.13 1.32 -0.06 2.39 3.04 -0.99 -0.91 116.25 121.17 2piy h VAL 25 Ca 0.04 -1.51 -0.04 0.00 -1.01 0.00 0.00 66.70 64.18 2piy h VAL 25 Cb 0.66 1.81 0.00 0.00 -2.01 0.00 0.00 31.29 31.75 2piy h VAL 25 CO 0.04 0.43 -0.11 0.74 -1.01 0.00 0.00 177.57 177.66 2piy h THR 26 N 0.01 1.42 0.00 3.17 2.02 -1.48 -2.61 112.91 115.44 2piy h THR 26 Ca -0.00 -1.43 -0.05 0.00 0.77 0.00 0.00 66.41 65.70 2piy h THR 26 Cb 0.78 2.23 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 2piy h THR 26 CO 0.06 0.39 -0.23 0.77 0.37 0.00 0.00 175.52 176.88 2piy h SER 27 N -0.33 0.00 1.60 4.18 4.64 -1.03 -1.68 113.55 120.93 2piy h SER 27 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2piy h SER 27 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2piy h SER 27 CO 0.03 0.23 0.00 -0.33 -0.87 0.00 0.00 176.83 175.88 2piy h GLU 28 N 0.00 0.00 -1.37 4.77 5.08 -1.19 -3.37 114.58 118.50 2piy h GLU 28 Ca -0.00 0.00 -0.40 0.00 -1.00 0.00 0.00 59.36 57.95 2piy h GLU 28 Cb 0.43 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.28 2piy h GLU 28 CO 0.03 0.00 -1.20 0.09 -1.00 0.00 0.00 179.01 176.93 2piy n ASN 29 N -2.48 1.20 0.26 1.42 3.02 -0.68 -4.95 115.26 113.05 2piy n ASN 29 Ca 0.05 -2.82 0.18 0.00 -0.03 0.00 0.00 54.58 51.95 2piy n ASN 29 Cb 0.45 -0.56 0.86 0.00 -0.61 0.00 0.00 39.78 39.92 2piy n ASN 29 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2piy h PRO 30 N 3.00 0.00 -0.11 3.52 0.13 -1.60 0.30 132.00 137.24 2piy h PRO 30 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2piy h PRO 30 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2piy h PRO 30 CO 0.50 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.87 2piy n ASP 31 N -2.82 1.43 0.00 1.44 5.75 -1.26 -4.09 116.55 116.99 2piy n ASP 31 Ca -0.01 -1.61 0.00 0.00 -0.01 0.00 0.00 54.79 53.16 2piy n ASP 31 Cb 0.16 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2piy n ASP 31 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2piy n LEU 32 N 0.15 0.00 -3.82 -2.12 4.77 -0.36 -4.42 117.00 111.20 2piy n LEU 32 Ca 0.17 -0.05 -0.16 0.00 -0.03 0.00 0.00 56.01 55.94 2piy n LEU 32 Cb 0.31 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.24 2piy n LEU 32 CO 0.14 0.00 -0.37 -0.63 -1.33 0.00 0.00 177.39 175.20 2piy s ILE 33 N -0.20 0.13 0.02 -0.08 1.01 -0.05 -0.70 121.20 121.34 2piy s ILE 33 Ca 0.00 0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.81 2piy s ILE 33 Cb 0.00 -0.22 -0.02 0.00 0.01 0.00 0.00 42.46 42.23 2piy s ILE 33 CO 0.00 0.12 -0.22 -0.94 0.00 0.00 0.00 174.94 173.89 2piy s SER 34 N 0.86 2.67 -0.10 3.58 1.04 -0.88 -4.39 113.70 116.47 2piy s SER 34 Ca -0.08 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.86 2piy s SER 34 Cb -0.12 -0.25 -0.02 0.00 0.10 0.00 0.00 66.02 65.73 2piy s SER 34 CO -0.02 0.22 -0.11 -0.60 0.98 0.00 0.00 173.24 173.71 2piy s ARG 35 N -0.96 3.10 0.24 4.02 3.52 -1.26 -0.99 118.95 126.63 2piy s ARG 35 Ca 0.09 -0.64 0.02 0.00 -0.13 0.00 0.00 55.73 55.06 2piy s ARG 35 Cb -0.09 -2.60 -0.05 0.00 -1.56 0.00 0.00 34.95 30.65 2piy s ARG 35 CO 0.01 0.39 0.05 0.95 -0.81 0.00 0.00 175.30 175.89 2piy s THR 36 N -0.10 0.72 -0.12 4.11 -4.23 -0.66 -4.99 115.64 110.37 2piy s THR 36 Ca -0.01 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 2piy s THR 36 Cb -0.14 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.20 2piy s THR 36 CO 0.03 -0.17 -0.08 0.00 -0.54 0.00 0.00 174.62 173.87 2piy s ALA 37 N -3.64 2.88 -1.72 3.99 0.00 -1.26 -0.26 121.76 121.75 2piy s ALA 37 Ca 0.33 -0.87 0.18 0.00 0.00 0.00 0.00 51.96 51.60 2piy s ALA 37 Cb 0.07 -1.34 0.43 0.00 0.00 0.00 0.00 23.12 22.28 2piy s ALA 37 CO 0.11 0.35 1.35 0.44 0.00 0.00 0.00 175.76 178.01 2piy n ILE 38 N 3.07 0.78 -0.64 0.00 -5.35 -0.33 -4.96 119.36 111.92 2piy n ILE 38 Ca -0.18 -0.89 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 2piy n ILE 38 Cb 0.53 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 39.13 2piy n ILE 38 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2piy n GLY 39 N 1.16 -2.09 3.39 3.28 0.00 -1.26 -4.80 105.19 104.87 2piy n GLY 39 Ca 0.17 -1.41 -0.29 0.00 0.00 0.00 0.00 46.02 44.49 2piy n GLY 39 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2piy s THR 40 N -2.03 2.27 0.93 2.61 -4.23 -1.26 -1.28 115.64 112.64 2piy s THR 40 Ca 0.00 -1.70 -0.14 0.00 -1.18 0.00 0.00 61.69 58.67 2piy s THR 40 Cb 0.00 -1.99 0.16 0.00 1.34 0.00 0.00 72.50 72.01 2piy s THR 40 CO 0.00 0.13 1.20 0.42 -0.54 0.00 0.00 174.62 175.82 2piy s THR 41 N -1.03 1.96 0.32 3.99 -4.23 -0.30 -4.52 115.64 111.83 2piy s THR 41 Ca 0.14 0.00 0.07 0.00 -1.18 0.00 0.00 61.69 60.72 2piy s THR 41 Cb -0.10 -2.85 0.31 0.00 1.34 0.00 0.00 72.50 71.20 2piy s THR 41 CO 0.06 0.00 1.81 0.15 -0.54 0.00 0.00 174.62 176.10 2piy h PHE 42 N -1.54 0.98 -0.58 3.99 3.57 -1.96 -0.75 116.94 120.65 2piy h PHE 42 Ca -0.47 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.06 2piy h PHE 42 Cb 1.30 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2piy h PHE 42 CO -0.37 0.27 0.00 1.28 -2.23 0.00 0.00 178.31 177.27 2piy n LEU 43 N -4.68 3.77 0.00 0.59 4.77 -1.26 -4.93 117.00 115.27 2piy n LEU 43 Ca 0.21 -1.90 0.00 0.00 -0.03 0.00 0.00 56.01 54.30 2piy n LEU 43 Cb 0.54 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2piy n LEU 43 CO 0.25 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 2piy n GLY 44 N 1.21 0.57 3.87 -0.72 0.00 -0.29 -5.05 105.19 104.78 2piy n GLY 44 Ca 0.21 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 2piy n GLY 44 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2piy s ASN 45 N -2.74 6.58 -0.20 1.61 0.01 -1.26 -4.79 114.94 114.15 2piy s ASN 45 Ca 0.00 1.11 -0.22 0.00 -0.71 0.00 0.00 52.86 53.04 2piy s ASN 45 Cb 0.00 -2.31 -0.02 0.00 0.41 0.00 0.00 41.25 39.33 2piy s ASN 45 CO 0.00 -0.30 0.67 0.20 -1.51 0.00 0.00 177.10 176.16 2piy s ASN 46 N -2.88 6.73 -0.87 -1.22 0.02 -1.26 -1.15 114.94 114.31 2piy s ASN 46 Ca 0.51 0.89 -0.21 0.00 -1.02 0.00 0.00 52.86 53.02 2piy s ASN 46 Cb -0.10 -2.37 0.09 0.00 0.02 0.00 0.00 41.25 38.89 2piy s ASN 46 CO 0.27 -0.31 1.18 -0.63 0.02 0.00 0.00 177.10 177.63 2piy s ILE 47 N 2.04 4.34 0.40 0.60 1.01 -0.41 -4.98 121.20 124.21 2piy s ILE 47 Ca 0.30 -0.91 -0.23 0.00 0.00 0.00 0.00 60.65 59.82 2piy s ILE 47 Cb -0.16 -4.84 -0.10 0.00 0.01 0.00 0.00 42.46 37.38 2piy s ILE 47 CO 0.10 -1.63 0.99 -0.31 0.00 0.00 0.00 174.94 174.09 2piy s TYR 48 N 3.85 3.35 -0.06 3.97 2.02 -1.26 -1.18 117.35 128.04 2piy s TYR 48 Ca 0.34 1.66 0.02 0.00 -0.37 0.00 0.00 57.07 58.72 2piy s TYR 48 Cb -0.07 -2.99 0.01 0.00 -0.40 0.00 0.00 41.96 38.52 2piy s TYR 48 CO -0.03 -0.30 -0.10 -1.17 -1.57 0.00 0.00 175.55 172.39 2piy s LEU 49 N -2.77 1.58 -0.24 -1.29 2.96 0.64 -4.22 118.68 115.35 2piy s LEU 49 Ca 0.58 -0.25 -0.08 0.00 -0.22 0.00 0.00 54.13 54.17 2piy s LEU 49 Cb -0.17 -0.72 -0.03 0.00 0.50 0.00 0.00 46.19 45.77 2piy s LEU 49 CO 0.21 0.02 0.08 -0.76 -1.32 0.00 0.00 176.35 174.58 2piy s LEU 50 N 0.69 3.56 -0.47 -0.68 1.43 0.16 -1.65 118.68 121.73 2piy s LEU 50 Ca -0.13 -0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 2piy s LEU 50 Cb -0.15 -1.95 0.04 0.00 0.03 0.00 0.00 46.19 44.16 2piy s LEU 50 CO 0.03 0.01 0.60 -0.75 0.23 0.00 0.00 176.35 176.46 2piy s LYS 51 N 1.36 3.17 -0.23 1.70 2.20 -0.16 -0.37 119.74 127.41 2piy s LYS 51 Ca 0.05 -0.68 -0.07 0.00 -0.36 0.00 0.00 55.97 54.92 2piy s LYS 51 Cb -0.15 -4.02 -0.03 0.00 -1.51 0.00 0.00 37.83 32.13 2piy s LYS 51 CO 0.04 -1.08 0.05 0.08 -0.36 0.00 0.00 175.35 174.08 2piy s VAL 52 N 2.61 4.25 0.00 4.02 1.01 0.71 -2.08 120.40 130.93 2piy s VAL 52 Ca 0.17 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.96 2piy s VAL 52 Cb -0.17 -2.97 0.00 0.00 0.00 0.00 0.00 36.38 33.24 2piy s VAL 52 CO 0.15 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.23 2piy n GLY 53 N 4.65 2.91 3.61 4.51 0.00 0.12 -0.49 105.19 120.51 2piy n GLY 53 Ca -0.16 -0.99 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 2piy n GLY 53 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2piy s LYS 54 N -2.05 3.87 0.42 1.61 2.47 0.21 -4.26 119.74 122.01 2piy s LYS 54 Ca 0.00 0.70 -0.26 0.00 -1.56 0.00 0.00 55.97 54.85 2piy s LYS 54 Cb 0.00 -3.81 -0.10 0.00 -1.46 0.00 0.00 37.83 32.46 2piy s LYS 54 CO 0.00 -1.04 1.29 -2.30 0.16 0.00 0.00 175.35 173.46 2piy n PRO 55 N 7.04 1.98 -3.75 4.03 -0.02 -1.26 -4.78 135.00 138.24 2piy n PRO 55 Ca 0.09 0.70 -0.01 0.00 -2.02 0.00 0.00 63.50 62.26 2piy n PRO 55 Cb 0.48 -2.40 -0.00 0.00 -0.02 0.00 0.00 33.50 31.55 2piy n PRO 55 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2piy s GLY 56 N -0.51 -0.22 0.21 -1.23 0.00 -1.26 -5.14 107.32 99.16 2piy s GLY 56 Ca 0.60 0.22 -0.30 0.00 0.00 0.00 0.00 44.72 45.24 2piy s GLY 56 CO 0.58 0.75 1.18 2.56 0.00 0.00 0.00 173.10 178.18 2piy s PRO 57 N -2.75 4.51 -0.56 2.90 0.04 -1.26 -4.44 135.00 133.44 2piy s PRO 57 Ca 0.15 1.88 -0.04 0.00 0.04 0.00 0.00 61.00 63.03 2piy s PRO 57 Cb 0.00 -3.22 0.01 0.00 0.04 0.00 0.00 34.50 31.33 2piy s PRO 57 CO 0.01 -0.03 0.38 0.27 0.04 0.00 0.00 177.00 177.67 2piy n ASN 58 N 2.16 -2.89 -4.87 6.66 6.94 -1.26 -4.95 115.26 117.05 2piy n ASN 58 Ca 0.03 -0.66 -0.33 0.00 -0.02 0.00 0.00 54.58 53.60 2piy n ASN 58 Cb 0.45 -0.99 -0.05 0.00 -2.36 0.00 0.00 39.78 36.82 2piy n ASN 58 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2piy s LYS 59 N -4.39 3.79 1.05 -3.83 1.02 -1.26 -5.10 119.74 111.02 2piy s LYS 59 Ca 0.06 0.23 -0.13 0.00 0.02 0.00 0.00 55.97 56.15 2piy s LYS 59 Cb -0.03 -2.79 0.21 0.00 -0.52 0.00 0.00 37.83 34.70 2piy s LYS 59 CO 0.57 0.42 1.09 -1.25 -0.92 0.00 0.00 175.35 175.25 2piy s PRO 60 N -2.48 0.04 0.05 -1.68 0.04 -1.26 -4.82 135.00 124.89 2piy s PRO 60 Ca 0.42 0.48 -0.11 0.00 0.04 0.00 0.00 61.00 61.83 2piy s PRO 60 Cb -0.12 -1.69 0.01 0.00 0.04 0.00 0.00 34.50 32.73 2piy s PRO 60 CO 0.21 -2.99 0.23 0.00 0.04 0.00 0.00 177.00 174.49 2piy s ALA 61 N -2.91 -0.44 -0.09 8.56 0.00 0.28 -1.47 121.76 125.69 2piy s ALA 61 Ca 0.66 -0.24 0.05 0.00 0.00 0.00 0.00 51.96 52.43 2piy s ALA 61 Cb -0.19 0.32 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 2piy s ALA 61 CO 0.58 -0.40 -0.24 0.42 0.00 0.00 0.00 175.76 176.13 2piy s ILE 62 N -2.73 2.02 -0.19 0.00 1.01 -0.13 -0.45 121.20 120.72 2piy s ILE 62 Ca -0.04 -1.01 -0.09 0.00 0.00 0.00 0.00 60.65 59.51 2piy s ILE 62 Cb -0.00 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 2piy s ILE 62 CO -0.05 0.55 0.09 0.12 0.00 0.00 0.00 174.94 175.66 2piy s PHE 63 N 0.19 3.32 -0.05 3.97 5.36 -0.52 -0.91 117.98 129.34 2piy s PHE 63 Ca -0.14 0.18 0.01 0.00 -0.96 0.00 0.00 56.93 56.03 2piy s PHE 63 Cb -0.17 -2.12 0.02 0.00 -0.34 0.00 0.00 43.02 40.41 2piy s PHE 63 CO 0.07 0.20 -0.07 1.41 -1.46 0.00 0.00 175.22 175.38 2piy s MET 64 N 0.40 1.08 0.21 10.12 -2.45 0.35 -0.51 119.30 128.51 2piy s MET 64 Ca 0.05 -0.20 0.11 0.00 -1.25 0.00 0.00 55.69 54.41 2piy s MET 64 Cb -0.12 -1.00 -0.05 0.00 1.25 0.00 0.00 34.83 34.92 2piy s MET 64 CO -0.01 -0.05 -0.22 0.16 1.05 0.00 0.00 175.02 175.96 2piy s ASP 65 N 0.82 3.52 0.21 1.11 1.47 -0.61 -0.77 116.67 122.42 2piy s ASP 65 Ca -0.12 -0.88 0.05 0.00 1.18 0.00 0.00 52.55 52.77 2piy s ASP 65 Cb -0.15 -0.29 -0.05 0.00 -0.34 0.00 0.00 42.92 42.09 2piy s ASP 65 CO 0.01 0.10 -0.07 0.00 0.68 0.00 0.00 175.17 175.90 2piy n GLY 67 N -0.39 0.18 0.12 0.00 0.00 -1.26 -1.84 105.19 102.01 2piy n GLY 67 Ca -0.07 -0.63 -0.08 0.00 0.00 0.00 0.00 46.02 45.24 2piy n GLY 67 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2piy h PHE 68 N 0.00 -0.14 -3.51 1.61 -1.00 -1.91 -1.79 116.94 110.20 2piy h PHE 68 Ca -0.15 0.02 -0.64 0.00 2.81 0.00 0.00 57.97 60.01 2piy h PHE 68 Cb 1.04 0.10 -0.21 0.00 3.61 0.00 0.00 35.95 40.49 2piy h PHE 68 CO 0.18 -0.11 -0.61 -1.01 -1.61 0.00 0.00 178.31 175.15 2piy s HIS 69 N -6.20 3.12 0.26 -0.55 3.76 -1.26 -4.44 115.29 109.97 2piy s HIS 69 Ca -0.14 -0.28 -0.02 0.00 -0.15 0.00 0.00 55.06 54.47 2piy s HIS 69 Cb 0.11 -2.16 0.43 0.00 1.11 0.00 0.00 32.58 32.06 2piy s HIS 69 CO 0.69 -0.18 1.85 0.00 -0.85 0.00 0.00 174.74 176.24 2piy h ALA 70 N 7.62 1.34 -0.00 -1.40 0.00 -1.59 -2.25 119.26 122.97 2piy h ALA 70 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2piy h ALA 70 Cb 1.18 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2piy h ALA 70 CO 0.62 0.29 -0.05 2.89 0.00 0.00 0.00 179.25 182.99 2piy n ARG 71 N -4.60 0.63 -2.15 0.00 1.85 -0.75 -4.41 116.66 107.22 2piy n ARG 71 Ca 0.15 -0.12 -0.41 0.00 -1.00 0.00 0.00 57.85 56.47 2piy n ARG 71 Cb 0.24 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 30.15 2piy n ARG 71 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2piy n GLU 72 N -1.08 4.27 0.28 2.89 1.02 -0.85 -4.77 120.64 122.40 2piy n GLU 72 Ca 0.15 -3.53 0.11 0.00 -0.02 0.00 0.00 57.16 53.88 2piy n GLU 72 Cb 0.25 -2.73 0.77 0.00 -0.02 0.00 0.00 31.44 29.71 2piy n GLU 72 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 2piy h TRP 73 N 5.01 0.00 0.00 -0.32 4.06 -1.77 -0.54 115.95 122.40 2piy h TRP 73 Ca 0.58 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.49 2piy h TRP 73 Cb 0.42 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.58 2piy h TRP 73 CO 1.46 0.00 -0.19 0.97 -3.56 0.00 0.00 178.44 177.12 2piy h ILE 74 N 0.00 0.62 0.45 1.49 6.09 -1.87 -2.46 117.51 121.83 2piy h ILE 74 Ca -0.00 -0.88 -0.02 0.00 -1.37 0.00 0.00 64.86 62.59 2piy h ILE 74 Cb 0.01 1.57 0.00 0.00 0.47 0.00 0.00 36.82 38.87 2piy h ILE 74 CO 0.00 0.19 -0.22 -1.28 -3.07 0.00 0.00 178.15 173.78 2piy h SER 75 N 0.00 -0.51 -0.77 2.19 0.87 -1.39 -1.32 113.55 112.62 2piy h SER 75 Ca -0.00 -0.02 0.08 0.00 -1.23 0.00 0.00 61.79 60.61 2piy h SER 75 Cb 0.55 0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 62.58 2piy h SER 75 CO 0.03 -0.30 0.43 0.45 -0.53 0.00 0.00 176.83 176.90 2piy h HIS 76 N -0.68 0.79 -0.81 2.24 3.86 -1.60 -1.57 115.15 117.38 2piy h HIS 76 Ca -0.06 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2piy h HIS 76 Cb 0.50 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.69 2piy h HIS 76 CO -0.03 0.34 0.51 0.00 0.86 0.00 0.00 177.93 179.61 2piy h ALA 77 N 1.41 1.38 -0.45 2.45 0.00 -1.30 -2.90 119.26 119.86 2piy h ALA 77 Ca 0.36 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 2piy h ALA 77 Cb 0.29 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2piy h ALA 77 CO -0.22 0.55 0.09 0.35 0.00 0.00 0.00 179.25 180.02 2piy h PHE 78 N 1.10 0.77 -0.83 0.00 3.57 -0.21 -1.21 116.94 120.13 2piy h PHE 78 Ca 0.29 -0.10 0.03 0.00 3.53 0.00 0.00 57.97 61.73 2piy h PHE 78 Cb -0.09 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 38.39 2piy h PHE 78 CO 0.00 0.72 0.55 0.00 -2.23 0.00 0.00 178.31 177.35 2piy h GLN 80 N 1.04 0.60 -0.78 0.00 4.20 -1.39 -2.73 115.11 116.04 2piy h GLN 80 Ca 0.33 -0.23 0.05 0.00 0.06 0.00 0.00 58.65 58.86 2piy h GLN 80 Cb 0.03 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.72 2piy h GLN 80 CO -0.10 0.79 0.48 2.35 -0.67 0.00 0.00 178.83 181.68 2piy h TRP 81 N 0.37 0.90 -0.32 2.96 2.91 -0.48 -2.71 115.95 119.57 2piy h TRP 81 Ca 0.08 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.13 2piy h TRP 81 Cb 0.56 -0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 28.91 2piy h TRP 81 CO 0.05 0.47 0.21 0.35 -1.03 0.00 0.00 178.44 178.50 2piy h PHE 82 N 0.91 0.41 -0.73 2.65 3.04 -0.78 -1.96 116.94 120.47 2piy h PHE 82 Ca 0.33 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.29 2piy h PHE 82 Cb 0.11 -0.14 -0.04 0.00 2.56 0.00 0.00 35.95 38.45 2piy h PHE 82 CO -0.04 0.26 0.46 0.28 -2.02 0.00 0.00 178.31 177.25 2piy h VAL 83 N 0.44 1.20 -0.44 1.41 2.07 -1.18 -0.91 116.25 118.83 2piy h VAL 83 Ca 0.12 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 2piy h VAL 83 Cb -0.05 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 2piy h VAL 83 CO -0.03 0.20 0.11 -0.09 0.02 0.00 0.00 177.57 177.78 2piy h ARG 84 N 0.99 0.71 -0.48 1.57 2.43 -1.28 -2.03 114.38 116.29 2piy h ARG 84 Ca 0.27 -0.17 0.09 0.00 -0.81 0.00 0.00 59.98 59.35 2piy h ARG 84 Cb -0.08 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 29.31 2piy h ARG 84 CO -0.05 0.71 0.06 0.93 -1.51 0.00 0.00 179.97 180.11 2piy h GLU 85 N 0.59 0.18 -0.02 0.20 4.39 -0.94 0.81 114.58 119.79 2piy h GLU 85 Ca 0.14 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.84 2piy h GLU 85 Cb 0.32 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2piy h GLU 85 CO 0.00 0.12 -0.03 0.00 -1.16 0.00 0.00 179.01 177.94 2piy h ALA 86 N 1.39 -0.01 -0.09 3.43 0.00 -0.90 -1.73 119.26 121.36 2piy h ALA 86 Ca 0.24 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.98 2piy h ALA 86 Cb 0.34 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2piy h ALA 86 CO -0.34 -0.52 -0.72 -0.39 0.00 0.00 0.00 179.25 177.28 2piy h VAL 87 N -0.05 1.37 -0.24 0.00 -1.51 -0.97 -2.38 116.25 112.47 2piy h VAL 87 Ca 0.02 -2.11 -0.17 0.00 -1.23 0.00 0.00 66.70 63.22 2piy h VAL 87 Cb 0.08 2.08 -0.00 0.00 -2.13 0.00 0.00 31.29 31.31 2piy h VAL 87 CO -0.05 0.64 -0.53 -0.07 -1.23 0.00 0.00 177.57 176.32 2piy h LEU 88 N 0.30 0.77 0.00 4.19 3.38 -0.78 -3.31 115.31 119.85 2piy h LEU 88 Ca -0.03 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2piy h LEU 88 Cb 1.29 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2piy h LEU 88 CO 0.12 1.15 -0.80 0.35 0.09 0.00 0.00 178.44 179.35 2piy n THR 89 N -3.98 0.00 -1.70 0.22 -2.24 -0.66 -4.87 114.28 101.04 2piy n THR 89 Ca -0.03 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.31 2piy n THR 89 Cb 0.61 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.50 2piy n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2piy n TYR 90 N -1.50 2.58 0.00 4.78 9.36 -0.90 -1.16 117.16 130.32 2piy n TYR 90 Ca 0.05 0.09 0.00 0.00 3.32 0.00 0.00 57.90 61.36 2piy n TYR 90 Cb 0.33 -2.64 0.00 0.00 -0.63 0.00 0.00 39.34 36.40 2piy n TYR 90 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2piy n GLY 91 N 3.83 1.92 0.76 2.98 0.00 -1.26 -4.84 105.19 108.58 2piy n GLY 91 Ca 0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 2piy n GLY 91 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2piy n TYR 92 N -2.00 0.00 -3.13 1.61 4.02 -0.31 -4.98 117.16 112.37 2piy n TYR 92 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.49 2piy n TYR 92 Cb 0.00 -0.09 -0.06 0.00 -0.02 0.00 0.00 39.34 39.18 2piy n TYR 92 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 2piy s GLU 93 N -2.04 4.26 0.21 -0.72 -6.30 -0.58 -4.98 118.70 108.55 2piy s GLU 93 Ca -0.03 0.64 -0.09 0.00 -2.50 0.00 0.00 54.97 52.98 2piy s GLU 93 Cb 0.01 -3.54 0.16 0.00 0.00 0.00 0.00 34.13 30.76 2piy s GLU 93 CO 0.04 -0.15 1.84 0.66 0.02 0.00 0.00 175.26 177.68 2piy h SER 94 N 7.28 0.97 0.08 -1.70 4.64 -1.93 -1.71 113.55 121.18 2piy h SER 94 Ca -0.34 -0.09 -0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2piy h SER 94 Cb 1.16 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2piy h SER 94 CO 0.77 0.77 -0.04 0.45 -0.87 0.00 0.00 176.83 177.91 2piy h HIS 95 N 1.09 -0.10 -0.43 4.77 3.86 -1.97 -1.69 115.15 120.68 2piy h HIS 95 Ca 0.28 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.44 2piy h HIS 95 Cb 0.01 0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2piy h HIS 95 CO -0.00 0.27 0.07 1.98 0.86 0.00 0.00 177.93 181.11 2piy h MET 96 N -0.49 0.65 -0.31 2.45 -1.53 -1.90 0.12 114.93 113.91 2piy h MET 96 Ca -0.01 -0.13 -0.00 0.00 -3.44 0.00 0.00 59.70 56.12 2piy h MET 96 Cb 0.42 -0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.35 2piy h MET 96 CO 0.02 0.62 0.18 1.15 0.14 0.00 0.00 176.91 179.02 2piy h THR 97 N 0.63 1.12 -0.48 -0.77 2.02 -1.25 -1.13 112.91 113.05 2piy h THR 97 Ca 0.14 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 2piy h THR 97 Cb 0.29 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2piy h THR 97 CO 0.00 0.12 0.24 -0.08 0.37 0.00 0.00 175.52 176.17 2piy h GLU 98 N 0.39 0.69 -0.22 6.66 4.81 -0.72 -1.82 114.58 124.38 2piy h GLU 98 Ca 0.11 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2piy h GLU 98 Cb 0.03 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 2piy h GLU 98 CO -0.02 0.57 0.01 0.74 -0.73 0.00 0.00 179.01 179.58 2piy h PHE 99 N 0.64 -0.00 0.00 0.92 0.05 -0.45 -1.09 116.94 117.01 2piy h PHE 99 Ca 0.17 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 61.91 2piy h PHE 99 Cb 0.11 0.03 -0.01 0.00 2.00 0.00 0.00 35.95 38.08 2piy h PHE 99 CO -0.01 -0.03 -0.28 -0.07 -0.18 0.00 0.00 178.31 177.74 2piy h LEU 100 N 0.08 0.00 -0.27 1.54 3.38 -1.12 0.54 115.31 119.45 2piy h LEU 100 Ca 0.10 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 2piy h LEU 100 Cb 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2piy h LEU 100 CO -0.17 0.28 -0.47 0.78 0.09 0.00 0.00 178.44 178.95 2piy h ASN 101 N 0.00 0.88 0.23 -0.43 2.35 -0.99 0.63 115.58 118.25 2piy h ASN 101 Ca -0.00 -0.53 -0.35 0.00 -0.55 0.00 0.00 56.30 54.87 2piy h ASN 101 Cb 1.00 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 39.11 2piy h ASN 101 CO 0.04 1.24 -1.78 0.11 -1.65 0.00 0.00 177.43 175.39 2piy h LYS 102 N 0.55 0.33 -4.92 0.81 1.57 -0.95 -3.45 116.57 110.50 2piy h LYS 102 Ca 0.02 -0.57 -0.36 0.00 -1.87 0.00 0.00 60.65 57.87 2piy h LYS 102 Cb 1.07 0.21 -0.14 0.00 0.08 0.00 0.00 32.23 33.45 2piy h LYS 102 CO 0.11 1.24 -0.61 -0.48 -0.57 0.00 0.00 179.45 179.13 2piy s LEU 103 N -7.15 1.70 -0.05 2.94 0.05 0.16 -4.13 118.68 112.20 2piy s LEU 103 Ca -0.16 -1.38 0.01 0.00 0.05 0.00 0.00 54.13 52.65 2piy s LEU 103 Cb 0.06 -0.02 -0.03 0.00 -2.05 0.00 0.00 46.19 44.14 2piy s LEU 103 CO 0.83 -0.71 -0.04 -1.81 -0.55 0.00 0.00 176.35 174.07 2piy s ASP 104 N -3.33 4.83 -0.27 1.48 1.01 -0.54 -4.33 116.67 115.51 2piy s ASP 104 Ca 0.38 -0.01 -0.13 0.00 0.71 0.00 0.00 52.55 53.49 2piy s ASP 104 Cb 0.08 -1.23 -0.04 0.00 1.01 0.00 0.00 42.92 42.73 2piy s ASP 104 CO 0.14 0.34 0.28 -0.36 0.21 0.00 0.00 175.17 175.78 2piy s PHE 105 N -0.90 3.24 -0.42 4.23 0.40 0.35 -0.95 117.98 123.92 2piy s PHE 105 Ca 0.15 0.28 -0.23 0.00 -0.60 0.00 0.00 56.93 56.53 2piy s PHE 105 Cb -0.11 -2.47 0.02 0.00 0.51 0.00 0.00 43.02 40.97 2piy s PHE 105 CO 0.04 -0.18 0.75 0.71 0.70 0.00 0.00 175.22 177.24 2piy s TYR 106 N 1.87 3.04 -0.24 0.36 1.51 -0.09 -0.21 117.35 123.58 2piy s TYR 106 Ca 0.11 0.23 -0.06 0.00 -1.01 0.00 0.00 57.07 56.34 2piy s TYR 106 Cb -0.16 -3.52 -0.01 0.00 -0.11 0.00 0.00 41.96 38.16 2piy s TYR 106 CO 0.10 -0.89 0.02 0.08 -1.11 0.00 0.00 175.55 173.76 2piy s VAL 107 N 3.14 3.84 -0.47 0.71 1.01 0.51 -0.49 120.40 128.64 2piy s VAL 107 Ca 0.29 -0.40 -0.09 0.00 0.00 0.00 0.00 61.98 61.77 2piy s VAL 107 Cb -0.13 -2.81 0.12 0.00 0.00 0.00 0.00 36.38 33.56 2piy s VAL 107 CO 0.20 0.33 0.35 -0.22 0.00 0.00 0.00 175.10 175.76 2piy s LEU 108 N 1.54 5.70 0.25 3.92 0.20 0.05 -0.67 118.68 129.67 2piy s LEU 108 Ca 0.05 -1.89 -0.01 0.00 0.69 0.00 0.00 54.13 52.97 2piy s LEU 108 Cb -0.15 -2.02 0.32 0.00 -0.43 0.00 0.00 46.19 43.91 2piy s LEU 108 CO 0.00 -0.70 1.71 1.55 -0.29 0.00 0.00 176.35 178.63 2piy h PRO 109 N 8.47 0.68 -2.81 0.98 0.13 -1.85 -0.97 132.00 136.62 2piy h PRO 109 Ca -0.22 -0.23 -0.28 0.00 -0.87 0.00 0.00 66.00 64.40 2piy h PRO 109 Cb 1.07 -0.05 -0.35 0.00 0.13 0.00 0.00 31.00 31.80 2piy h PRO 109 CO 0.86 0.80 -0.60 0.08 -0.23 0.00 0.00 178.00 178.91 2piy s VAL 110 N -4.70 -0.33 -0.13 1.56 1.01 -1.25 -4.23 120.40 112.34 2piy s VAL 110 Ca -0.08 0.15 -0.16 0.00 0.00 0.00 0.00 61.98 61.89 2piy s VAL 110 Cb 0.14 -0.49 -0.14 0.00 0.00 0.00 0.00 36.38 35.90 2piy s VAL 110 CO 0.81 0.00 0.35 0.25 0.00 0.00 0.00 175.10 176.51 2piy h LEU 111 N 8.32 0.00 -6.73 3.92 5.85 -1.43 -3.41 115.31 121.83 2piy h LEU 111 Ca -0.15 -0.50 -0.77 0.00 0.84 0.00 0.00 57.88 57.31 2piy h LEU 111 Cb 1.13 0.00 -0.19 0.00 0.37 0.00 0.00 40.66 41.97 2piy h LEU 111 CO 0.19 0.84 1.64 -3.20 -0.34 0.00 0.00 178.44 177.57 2piy n ASN 112 N -4.66 5.39 -0.19 1.25 5.15 -0.67 -4.79 115.26 116.73 2piy n ASN 112 Ca -0.08 -3.15 -0.09 0.00 -0.60 0.00 0.00 54.58 50.66 2piy n ASN 112 Cb 0.30 -1.44 0.02 0.00 -0.53 0.00 0.00 39.78 38.12 2piy n ASN 112 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 2piy h ILE 113 N 3.78 1.25 -0.56 -1.44 2.04 -1.84 -1.97 117.51 118.77 2piy h ILE 113 Ca 0.34 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 65.22 2piy h ILE 113 Cb 0.66 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 2piy h ILE 113 CO 1.50 0.35 0.30 0.44 0.00 0.00 0.00 178.15 180.74 2piy h ASP 114 N 0.79 0.70 -0.63 1.72 3.32 -1.96 -0.07 116.42 120.30 2piy h ASP 114 Ca 0.17 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 2piy h ASP 114 Cb 0.41 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 2piy h ASP 114 CO 0.01 0.60 0.17 1.23 -1.72 0.00 0.00 179.24 179.53 2piy h GLY 115 N 0.75 1.08 0.96 2.75 0.00 -1.74 -2.26 103.07 104.61 2piy h GLY 115 Ca 0.20 -0.66 0.01 0.00 0.00 0.00 0.00 47.33 46.87 2piy h GLY 115 CO -0.03 0.62 0.21 -1.82 0.00 0.00 0.00 176.54 175.52 2piy h TYR 116 N 0.93 0.40 -0.98 5.60 3.20 -0.61 -1.54 116.97 123.96 2piy h TYR 116 Ca 0.20 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.15 2piy h TYR 116 Cb 0.33 -0.13 -0.07 0.00 1.54 0.00 0.00 36.73 38.41 2piy h TYR 116 CO 0.02 0.24 0.63 0.82 -1.64 0.00 0.00 178.16 178.24 2piy h ILE 117 N 0.43 1.07 -0.15 1.81 2.04 -0.93 -1.78 117.51 120.00 2piy h ILE 117 Ca 0.13 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 2piy h ILE 117 Cb -0.02 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 35.88 2piy h ILE 117 CO -0.05 0.21 -0.09 0.22 0.00 0.00 0.00 178.15 178.45 2piy h TYR 118 N 1.14 0.24 0.00 1.37 3.20 -0.70 -0.85 116.97 121.37 2piy h TYR 118 Ca 0.43 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.28 2piy h TYR 118 Cb 0.19 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.39 2piy h TYR 118 CO -0.01 0.33 0.00 1.79 -1.64 0.00 0.00 178.16 178.63 2piy h THR 119 N 0.23 0.00 0.04 1.81 1.35 -0.46 0.12 112.91 116.00 2piy h THR 119 Ca 0.05 -0.58 -0.30 0.00 -0.55 0.00 0.00 66.41 65.03 2piy h THR 119 Cb 0.30 1.55 -0.03 0.00 -1.73 0.00 0.00 68.15 68.24 2piy h THR 119 CO 0.02 0.00 -1.66 -0.50 -0.25 0.00 0.00 175.52 173.13 2piy h TRP 120 N 0.00 0.17 0.00 4.73 4.06 -0.98 -3.29 115.95 120.63 2piy h TRP 120 Ca 0.00 -0.12 -0.35 0.00 2.06 0.00 0.00 58.89 60.48 2piy h TRP 120 Cb 0.61 -0.01 -0.07 0.00 -1.00 0.00 0.00 29.16 28.69 2piy h TRP 120 CO 0.00 1.21 -2.23 0.25 -3.56 0.00 0.00 178.44 174.11 2piy n THR 121 N -3.23 1.45 0.00 1.49 -2.24 -0.47 -4.90 114.28 106.38 2piy n THR 121 Ca -0.18 -0.84 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 2piy n THR 121 Cb 1.04 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2piy n THR 121 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2piy n LYS 122 N -2.83 0.00 -3.44 -0.78 4.76 -0.14 -5.08 118.16 110.65 2piy n LYS 122 Ca -0.29 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 54.95 2piy n LYS 122 Cb 1.13 -0.14 -0.11 0.00 -1.84 0.00 0.00 35.03 34.08 2piy n LYS 122 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2piy s ASN 123 N -4.73 1.94 0.63 4.39 3.84 -0.24 -5.01 114.94 115.77 2piy s ASN 123 Ca 0.00 -0.76 0.38 0.00 0.21 0.00 0.00 52.86 52.69 2piy s ASN 123 Cb 0.00 0.35 2.11 0.00 -0.55 0.00 0.00 41.25 43.16 2piy s ASN 123 CO 0.00 -0.39 2.30 -0.09 -2.79 0.00 0.00 177.10 176.13 2piy h ARG 124 N 8.29 0.00 -0.67 0.43 9.65 -1.80 -1.90 114.38 128.38 2piy h ARG 124 Ca -0.15 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.73 2piy h ARG 124 Cb 1.08 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.66 2piy h ARG 124 CO 0.35 0.01 0.00 -1.33 2.80 0.00 0.00 179.97 181.79 2piy n MET 125 N -3.38 3.39 -1.93 0.20 2.81 -1.26 -4.58 117.12 112.37 2piy n MET 125 Ca -0.03 -2.80 -0.38 0.00 -1.81 0.00 0.00 57.70 52.68 2piy n MET 125 Cb 0.10 -1.77 0.02 0.00 -0.71 0.00 0.00 33.22 30.86 2piy n MET 125 CO 0.00 0.00 0.00 -0.46 1.51 0.00 0.00 175.97 177.02 2piy s TRP 126 N -1.56 2.48 0.00 2.03 -0.11 -0.72 -4.86 118.94 116.21 2piy s TRP 126 Ca 0.50 1.42 0.00 0.00 1.22 0.00 0.00 56.10 59.24 2piy s TRP 126 Cb 0.30 -3.68 0.00 0.00 -1.50 0.00 0.00 33.47 28.59 2piy s TRP 126 CO 0.27 -2.47 0.00 -2.13 -4.62 0.00 0.00 176.95 168.00 2piy n ARG 127 N -0.79 0.00 -1.05 5.86 0.63 -1.26 -1.81 116.66 118.24 2piy n ARG 127 Ca 0.09 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.86 2piy n ARG 127 Cb 0.46 -0.53 0.11 0.00 0.45 0.00 0.00 32.46 32.95 2piy n ARG 127 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2piy n LYS 128 N -2.87 -0.73 -0.47 -0.14 5.02 -1.26 -2.27 118.16 115.44 2piy n LYS 128 Ca 0.00 -1.13 -0.11 0.00 -2.02 0.00 0.00 58.31 55.05 2piy n LYS 128 Cb 0.45 -0.76 0.09 0.00 -0.02 0.00 0.00 35.03 34.79 2piy n LYS 128 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2piy n THR 129 N -3.02 0.00 -1.39 -0.18 -2.24 -0.22 -4.41 114.28 102.82 2piy n THR 129 Ca 0.09 -0.23 0.08 0.00 -2.27 0.00 0.00 64.05 61.72 2piy n THR 129 Cb 0.32 -1.29 0.16 0.00 -2.10 0.00 0.00 70.33 67.42 2piy n THR 129 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2piy n ARG 130 N -2.51 1.34 -2.43 -0.78 5.12 -1.26 -4.08 116.66 112.06 2piy n ARG 130 Ca 0.06 -2.85 -0.34 0.00 -1.93 0.00 0.00 57.85 52.79 2piy n ARG 130 Cb 0.21 -1.48 -0.03 0.00 -1.16 0.00 0.00 32.46 30.01 2piy n ARG 130 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2piy s SER 131 N -2.96 6.25 0.64 0.55 1.04 -1.26 -4.69 113.70 113.27 2piy s SER 131 Ca 0.34 1.88 -0.11 0.00 0.48 0.00 0.00 55.95 58.54 2piy s SER 131 Cb 0.32 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.86 2piy s SER 131 CO -0.02 -0.85 1.04 0.42 0.98 0.00 0.00 173.24 174.81 2piy s THR 132 N -2.13 4.33 -0.05 2.02 -4.23 -1.26 -0.55 115.64 113.77 2piy s THR 132 Ca 0.66 0.73 0.03 0.00 -1.18 0.00 0.00 61.69 61.93 2piy s THR 132 Cb -0.16 -3.75 0.01 0.00 1.34 0.00 0.00 72.50 69.95 2piy s THR 132 CO 0.24 -0.98 -0.12 0.20 -0.54 0.00 0.00 174.62 173.42 2piy s ASN 133 N -4.23 1.72 0.32 3.99 0.01 -1.25 -4.82 114.94 110.67 2piy s ASN 133 Ca 0.56 -0.28 -0.29 0.00 -0.71 0.00 0.00 52.86 52.13 2piy s ASN 133 Cb -0.11 -0.66 -0.11 0.00 0.41 0.00 0.00 41.25 40.78 2piy s ASN 133 CO 0.53 0.06 1.52 0.00 -1.51 0.00 0.00 177.10 177.70 2piy s ALA 134 N 0.43 3.65 0.00 0.60 0.00 -1.26 -2.93 121.76 122.25 2piy s ALA 134 Ca -0.10 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.40 2piy s ALA 134 Cb -0.13 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.37 2piy s ALA 134 CO 0.03 -0.97 0.00 0.41 0.00 0.00 0.00 175.76 175.23 2piy n GLY 135 N 1.41 0.81 3.34 0.00 0.00 -1.26 -4.99 105.19 104.49 2piy n GLY 135 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 2piy n GLY 135 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2piy s THR 136 N -3.12 0.07 -0.88 2.61 -1.32 -1.15 -5.02 115.64 106.83 2piy s THR 136 Ca 0.00 -0.69 0.25 0.00 -1.21 0.00 0.00 61.69 60.05 2piy s THR 136 Cb 0.00 -1.27 0.07 0.00 -1.51 0.00 0.00 72.50 69.79 2piy s THR 136 CO 0.00 -0.31 1.49 0.35 -2.21 0.00 0.00 174.62 173.94 2piy n THR 137 N -0.23 0.14 -2.10 5.08 -2.24 -1.26 -4.53 114.28 109.14 2piy n THR 137 Ca -0.15 -0.10 -0.41 0.00 -2.27 0.00 0.00 64.05 61.13 2piy n THR 137 Cb 0.63 -0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.81 2piy n THR 137 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2piy s ILE 139 N -1.15 3.47 0.00 0.00 -1.09 -1.26 -3.87 121.20 117.30 2piy s ILE 139 Ca 0.50 -0.55 0.00 0.00 -2.23 0.00 0.00 60.65 58.36 2piy s ILE 139 Cb -0.40 -2.42 0.00 0.00 -1.58 0.00 0.00 42.46 38.06 2piy s ILE 139 CO 0.53 0.57 0.00 0.61 -1.23 0.00 0.00 174.94 175.42 2piy n GLY 140 N 2.60 1.57 3.37 6.18 0.00 0.28 -4.91 105.19 114.28 2piy n GLY 140 Ca -0.18 -1.69 -0.29 0.00 0.00 0.00 0.00 46.02 43.86 2piy n GLY 140 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2piy s THR 141 N -2.25 2.23 -0.44 2.61 2.01 -1.26 -4.82 115.64 113.72 2piy s THR 141 Ca 0.00 -1.60 -0.29 0.00 0.31 0.00 0.00 61.69 60.11 2piy s THR 141 Cb 0.00 -1.94 0.02 0.00 0.01 0.00 0.00 72.50 70.59 2piy s THR 141 CO 0.00 0.20 1.19 -0.62 -0.69 0.00 0.00 174.62 174.71 2piy s ASP 142 N -1.73 6.61 0.54 3.53 -1.08 -0.13 -1.05 116.67 123.36 2piy s ASP 142 Ca 0.13 0.65 0.22 0.00 -0.52 0.00 0.00 52.55 53.03 2piy s ASP 142 Cb -0.10 -2.55 1.47 0.00 -1.46 0.00 0.00 42.92 40.29 2piy s ASP 142 CO 0.04 -1.24 2.17 1.55 0.52 0.00 0.00 175.17 178.22 2piy h PRO 143 N 9.39 0.00 -0.57 4.34 0.13 -1.86 -1.09 132.00 142.34 2piy h PRO 143 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2piy h PRO 143 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2piy h PRO 143 CO 1.10 0.03 0.00 -1.71 -0.23 0.00 0.00 178.00 177.20 2piy n ASN 144 N -4.17 2.58 0.00 1.44 5.15 -1.26 -2.39 115.26 116.60 2piy n ASN 144 Ca -0.03 -2.21 0.00 0.00 -0.60 0.00 0.00 54.58 51.74 2piy n ASN 144 Cb 0.12 -0.41 0.00 0.00 -0.53 0.00 0.00 39.78 38.96 2piy n ASN 144 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2piy n ARG 145 N 0.44 1.69 -0.11 1.20 5.12 -0.42 -3.31 116.66 121.27 2piy n ARG 145 Ca 0.13 -1.14 0.09 0.00 -1.93 0.00 0.00 57.85 55.00 2piy n ARG 145 Cb 0.50 -0.95 0.14 0.00 -1.16 0.00 0.00 32.46 30.98 2piy n ARG 145 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2piy n ASN 146 N -0.33 2.83 -4.92 0.55 4.05 -1.00 -4.50 115.26 111.95 2piy n ASN 146 Ca 0.00 -1.83 -0.27 0.00 0.45 0.00 0.00 54.58 52.93 2piy n ASN 146 Cb 0.20 -0.14 -0.03 0.00 1.23 0.00 0.00 39.78 41.04 2piy n ASN 146 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2piy s PHE 147 N -1.26 3.48 -1.55 1.20 0.40 0.06 0.09 117.98 120.40 2piy s PHE 147 Ca 0.26 0.46 -0.12 0.00 -0.60 0.00 0.00 56.93 56.93 2piy s PHE 147 Cb 0.16 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.70 2piy s PHE 147 CO 0.23 0.25 2.65 -3.47 0.70 0.00 0.00 175.22 175.57 2piy n ASP 148 N -0.98 6.65 -3.65 1.36 -0.08 -1.26 -4.20 116.55 114.39 2piy n ASP 148 Ca -0.04 -2.68 -0.29 0.00 -1.51 0.00 0.00 54.79 50.27 2piy n ASP 148 Cb 0.54 -1.60 -0.15 0.00 2.34 0.00 0.00 41.12 42.25 2piy n ASP 148 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2piy s ALA 149 N 2.63 1.06 -1.46 -1.67 0.00 -1.26 -4.78 121.76 116.27 2piy s ALA 149 Ca 0.60 -1.27 -0.12 0.00 0.00 0.00 0.00 51.96 51.16 2piy s ALA 149 Cb 0.16 -1.46 0.09 0.00 0.00 0.00 0.00 23.12 21.92 2piy s ALA 149 CO -0.07 -1.59 0.72 0.41 0.00 0.00 0.00 175.76 175.23 2piy n GLY 150 N 5.05 -0.49 3.62 0.00 0.00 -1.26 -0.89 105.19 111.23 2piy n GLY 150 Ca -0.05 0.14 -0.53 0.00 0.00 0.00 0.00 46.02 45.58 2piy n GLY 150 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2piy n TRP 151 N -4.31 1.69 -2.23 1.61 -0.00 -1.26 -1.75 117.44 111.19 2piy n TRP 151 Ca 0.02 0.58 -0.11 0.00 -0.00 0.00 0.00 57.50 57.98 2piy n TRP 151 Cb 0.53 -2.38 -0.01 0.00 -0.00 0.00 0.00 31.31 29.45 2piy n TRP 151 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2piy n THR 153 N -2.98 0.51 -3.58 0.00 -2.24 -0.71 -4.87 114.28 100.39 2piy n THR 153 Ca -0.12 -0.56 -0.14 0.00 -2.27 0.00 0.00 64.05 60.95 2piy n THR 153 Cb 0.55 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.44 2piy n THR 153 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2piy s THR 154 N -3.34 0.00 -0.49 4.28 -1.32 -1.26 -4.94 115.64 108.56 2piy s THR 154 Ca -0.03 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.45 2piy s THR 154 Cb 0.11 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.10 2piy s THR 154 CO 0.83 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.85 2piy n GLY 155 N 1.61 0.62 3.18 6.08 0.00 -1.26 -0.91 105.19 114.50 2piy n GLY 155 Ca -0.15 -0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.53 2piy n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2piy s ALA 156 N -1.78 1.23 0.02 4.61 0.00 -1.26 -4.60 121.76 119.98 2piy s ALA 156 Ca 0.00 -0.99 -0.00 0.00 0.00 0.00 0.00 51.96 50.97 2piy s ALA 156 Cb 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2piy s ALA 156 CO 0.00 0.19 0.13 0.45 0.00 0.00 0.00 175.76 176.53 2piy s SER 157 N -1.64 5.93 0.00 0.00 0.15 -0.81 -4.94 113.70 112.40 2piy s SER 157 Ca -0.01 0.18 0.21 0.00 0.70 0.00 0.00 55.95 57.04 2piy s SER 157 Cb -0.10 -1.75 0.53 0.00 -1.71 0.00 0.00 66.02 62.99 2piy s SER 157 CO 0.02 0.23 1.45 0.35 1.20 0.00 0.00 173.24 176.49 2piy n THR 158 N 0.82 0.53 -3.65 6.45 -2.24 -1.26 -1.31 114.28 113.61 2piy n THR 158 Ca -0.10 -0.67 -0.37 0.00 -2.27 0.00 0.00 64.05 60.63 2piy n THR 158 Cb 0.52 0.67 -0.11 0.00 -2.10 0.00 0.00 70.33 69.31 2piy n THR 158 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2piy s ASP 159 N -1.36 5.82 0.41 3.42 3.68 -1.26 -4.94 116.67 122.44 2piy s ASP 159 Ca 0.38 -0.04 0.28 0.00 2.13 0.00 0.00 52.55 55.30 2piy s ASP 159 Cb 0.21 -2.07 1.49 0.00 -1.45 0.00 0.00 42.92 41.11 2piy s ASP 159 CO 0.29 -0.02 1.86 1.55 0.13 0.00 0.00 175.17 178.98 2piy h PRO 160 N 8.17 0.00 -0.01 4.34 0.13 -1.91 -1.21 132.00 141.52 2piy h PRO 160 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2piy h PRO 160 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2piy h PRO 160 CO 0.58 0.00 -0.10 0.00 -0.23 0.00 0.00 178.00 178.24 2piy s ASP 162 N -2.38 6.36 0.56 0.00 1.01 -0.46 -5.01 116.67 116.76 2piy s ASP 162 Ca 0.31 0.25 0.34 0.00 0.71 0.00 0.00 52.55 54.16 2piy s ASP 162 Cb 0.20 -1.94 1.48 0.00 1.01 0.00 0.00 42.92 43.66 2piy s ASP 162 CO 0.45 0.06 2.03 -0.33 0.21 0.00 0.00 175.17 177.59 2piy h GLU 163 N 2.32 0.00 -0.37 8.23 4.39 -1.90 -2.80 114.58 124.45 2piy h GLU 163 Ca -0.48 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.11 2piy h GLU 163 Cb 1.19 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.77 2piy h GLU 163 CO 0.70 0.02 0.02 0.25 -1.16 0.00 0.00 179.01 178.85 2piy n THR 164 N -3.14 2.48 -1.66 1.13 -2.24 -1.26 -4.50 114.28 105.09 2piy n THR 164 Ca -0.00 -2.20 -0.47 0.00 -2.27 0.00 0.00 64.05 59.11 2piy n THR 164 Cb 0.28 -0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 68.17 2piy n THR 164 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2piy n TYR 165 N -0.76 2.21 1.35 4.78 9.36 -1.06 -1.92 117.16 131.12 2piy n TYR 165 Ca 0.29 0.30 0.13 0.00 3.32 0.00 0.00 57.90 61.94 2piy n TYR 165 Cb 1.02 -2.53 0.45 0.00 -0.63 0.00 0.00 39.34 37.66 2piy n TYR 165 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2piy n GLY 167 N 1.27 0.52 0.22 0.00 0.00 -1.26 -4.30 105.19 101.64 2piy n GLY 167 Ca 0.15 -1.91 0.15 0.00 0.00 0.00 0.00 46.02 44.40 2piy n GLY 167 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2piy h SER 168 N 0.00 0.00 -4.19 1.61 4.64 -1.96 -3.46 113.55 110.19 2piy h SER 168 Ca 0.00 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 61.57 2piy h SER 168 Cb 0.00 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 61.90 2piy h SER 168 CO 0.00 0.00 0.82 0.00 -0.87 0.00 0.00 176.83 176.78 2piy s ALA 169 N -3.46 -2.08 0.27 5.18 0.00 -1.26 -5.05 121.76 115.37 2piy s ALA 169 Ca 0.04 1.63 -0.30 0.00 0.00 0.00 0.00 51.96 53.32 2piy s ALA 169 Cb 0.09 -0.19 -0.12 0.00 0.00 0.00 0.00 23.12 22.89 2piy s ALA 169 CO 0.53 -0.57 1.49 0.00 0.00 0.00 0.00 175.76 177.21 2piy n ALA 170 N -0.05 1.82 -2.02 0.00 0.00 -1.26 -1.51 120.51 117.48 2piy n ALA 170 Ca 0.01 0.39 -0.19 0.00 0.00 0.00 0.00 53.44 53.64 2piy n ALA 170 Cb 0.58 -2.36 -0.04 0.00 0.00 0.00 0.00 19.45 17.63 2piy n ALA 170 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2piy n GLU 171 N 1.98 -1.45 0.23 0.00 1.02 0.11 -4.87 120.64 117.66 2piy n GLU 171 Ca 0.10 1.03 0.06 0.00 -0.02 0.00 0.00 57.16 58.33 2piy n GLU 171 Cb 0.34 -5.49 0.52 0.00 -0.02 0.00 0.00 31.44 26.79 2piy n GLU 171 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2piy h SER 172 N 0.00 0.00 -3.54 1.62 4.64 -1.52 -3.39 113.55 111.36 2piy h SER 172 Ca -0.43 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.37 2piy h SER 172 Cb 1.30 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.36 2piy h SER 172 CO 0.55 0.19 0.27 -1.61 -0.87 0.00 0.00 176.83 175.36 2piy s GLU 173 N -4.57 4.64 0.42 4.77 0.41 -1.26 -4.95 118.70 118.15 2piy s GLU 173 Ca -0.04 1.29 0.12 0.00 -0.41 0.00 0.00 54.97 55.93 2piy s GLU 173 Cb 0.15 -3.34 0.96 0.00 -1.78 0.00 0.00 34.13 30.12 2piy s GLU 173 CO 0.69 0.33 1.98 0.87 -0.49 0.00 0.00 175.26 178.64 2piy h LYS 174 N 5.24 0.48 -0.18 1.61 1.57 -1.88 -0.99 116.57 122.42 2piy h LYS 174 Ca -0.44 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.23 2piy h LYS 174 Cb 1.21 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 2piy h LYS 174 CO 0.70 0.31 -0.19 0.93 -0.57 0.00 0.00 179.45 180.63 2piy h GLU 175 N 0.49 0.45 -0.06 3.15 3.07 -1.93 -1.24 114.58 118.51 2piy h GLU 175 Ca 0.27 -0.24 -0.18 0.00 -0.50 0.00 0.00 59.36 58.71 2piy h GLU 175 Cb 0.43 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 2piy h GLU 175 CO -0.08 0.81 -0.72 1.79 -1.40 0.00 0.00 179.01 179.41 2piy h THR 176 N 0.10 1.40 -0.72 1.13 1.35 -1.85 -2.22 112.91 112.10 2piy h THR 176 Ca 0.03 -2.18 0.02 0.00 -0.55 0.00 0.00 66.41 63.72 2piy h THR 176 Cb 0.74 2.14 -0.04 0.00 -1.73 0.00 0.00 68.15 69.26 2piy h THR 176 CO 0.05 0.65 0.47 0.50 -0.25 0.00 0.00 175.52 176.93 2piy h LYS 177 N 0.22 0.91 -0.52 4.72 1.63 -1.17 -0.86 116.57 121.51 2piy h LYS 177 Ca -0.03 -0.05 -0.08 0.00 -0.85 0.00 0.00 60.65 59.64 2piy h LYS 177 Cb 1.29 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 32.69 2piy h LYS 177 CO 0.12 0.60 0.02 0.00 -3.45 0.00 0.00 179.45 176.74 2piy h ALA 178 N 1.28 0.70 -0.33 5.00 0.00 -0.96 0.96 119.26 125.89 2piy h ALA 178 Ca 0.27 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2piy h ALA 178 Cb -0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2piy h ALA 178 CO -0.08 0.50 -0.07 1.25 0.00 0.00 0.00 179.25 180.85 2piy h LEU 179 N 0.78 0.64 -0.60 0.00 6.46 -1.25 -1.65 115.31 119.69 2piy h LEU 179 Ca 0.15 -0.36 -0.09 0.00 -0.12 0.00 0.00 57.88 57.46 2piy h LEU 179 Cb 0.50 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.23 2piy h LEU 179 CO 0.02 0.85 0.03 0.00 -0.62 0.00 0.00 178.44 178.73 2piy h ALA 180 N 0.81 0.81 -0.73 1.25 0.00 -1.01 -1.93 119.26 118.46 2piy h ALA 180 Ca 0.09 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2piy h ALA 180 Cb 0.57 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2piy h ALA 180 CO 0.03 0.62 0.44 -0.44 0.00 0.00 0.00 179.25 179.91 2piy h ASP 181 N 0.94 0.87 -0.31 0.00 3.32 -0.71 -0.99 116.42 119.54 2piy h ASP 181 Ca 0.18 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 2piy h ASP 181 Cb 0.51 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 2piy h ASP 181 CO 0.02 0.67 0.05 0.15 -1.72 0.00 0.00 179.24 178.41 2piy h PHE 182 N 0.99 0.56 -0.52 4.55 3.57 -1.02 -2.13 116.94 122.94 2piy h PHE 182 Ca 0.26 -0.08 -0.11 0.00 3.53 0.00 0.00 57.97 61.58 2piy h PHE 182 Cb -0.05 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 2piy h PHE 182 CO -0.01 0.61 -0.10 0.82 -2.23 0.00 0.00 178.31 177.40 2piy h ILE 183 N 0.35 1.26 0.00 1.41 2.04 -1.14 -2.14 117.51 119.29 2piy h ILE 183 Ca 0.09 -1.23 -0.04 0.00 1.00 0.00 0.00 64.86 64.68 2piy h ILE 183 Cb 0.35 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2piy h ILE 183 CO 0.01 0.43 -0.20 0.03 0.00 0.00 0.00 178.15 178.42 2piy h ARG 184 N 0.86 0.00 0.00 2.37 3.08 -1.12 -1.91 114.38 117.65 2piy h ARG 184 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2piy h ARG 184 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2piy h ARG 184 CO 0.04 0.20 0.00 0.09 -1.07 0.00 0.00 179.97 179.23 2piy n ASN 185 N -4.02 0.69 -1.09 7.04 3.02 -0.81 -3.91 115.26 116.19 2piy n ASN 185 Ca -0.02 0.58 0.05 0.00 -0.03 0.00 0.00 54.58 55.16 2piy n ASN 185 Cb 0.28 -0.76 0.09 0.00 -0.61 0.00 0.00 39.78 38.78 2piy n ASN 185 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2piy n ASN 186 N -2.17 1.24 0.24 6.41 3.02 -0.77 -4.85 115.26 118.39 2piy n ASN 186 Ca 0.05 -2.71 0.08 0.00 -0.03 0.00 0.00 54.58 51.96 2piy n ASN 186 Cb 0.39 -0.38 0.60 0.00 -0.61 0.00 0.00 39.78 39.77 2piy n ASN 186 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2piy h LEU 187 N 0.92 0.00 -1.24 3.41 3.38 -1.54 -1.86 115.31 118.38 2piy h LEU 187 Ca -0.13 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 2piy h LEU 187 Cb 1.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 2piy h LEU 187 CO 0.06 0.11 -0.17 0.77 0.09 0.00 0.00 178.44 179.29 2piy h SER 187 N 0.00 0.00 0.00 -0.43 4.64 -1.89 -3.29 113.55 112.58 2piy h SER 187 Ca -0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2piy h SER 187 Cb 0.20 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.24 2piy h SER 187 CO 0.01 0.17 -2.00 -1.54 -0.87 0.00 0.00 176.83 172.61 2piy n SER 188 N -3.36 1.52 -4.66 4.97 3.41 -0.88 -4.95 113.62 109.67 2piy n SER 188 Ca 0.00 -0.01 -0.43 0.00 -0.26 0.00 0.00 58.87 58.17 2piy n SER 188 Cb 0.39 0.76 -0.02 0.00 -0.26 0.00 0.00 64.21 65.08 2piy n SER 188 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2piy s ILE 189 N -2.35 4.35 -0.02 -1.33 1.01 -0.75 -0.56 121.20 121.54 2piy s ILE 189 Ca -0.09 1.62 0.13 0.00 0.00 0.00 0.00 60.65 62.31 2piy s ILE 189 Cb 0.04 -4.09 -0.21 0.00 0.01 0.00 0.00 42.46 38.22 2piy s ILE 189 CO 0.58 -0.19 0.30 0.29 0.00 0.00 0.00 174.94 175.91 2piy n LYS 190 N 6.65 0.43 -3.87 2.79 4.76 0.40 -4.84 118.16 124.49 2piy n LYS 190 Ca 0.14 -0.12 -0.11 0.00 -2.87 0.00 0.00 58.31 55.34 2piy n LYS 190 Cb 0.45 -1.32 -0.10 0.00 -1.84 0.00 0.00 35.03 32.23 2piy n LYS 190 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2piy s ALA 191 N -2.92 -0.34 -0.11 7.82 0.00 -1.25 -3.88 121.76 121.08 2piy s ALA 191 Ca -0.05 -0.10 0.02 0.00 0.00 0.00 0.00 51.96 51.83 2piy s ALA 191 Cb 0.09 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.31 2piy s ALA 191 CO 0.56 -0.20 -0.16 -0.47 0.00 0.00 0.00 175.76 175.48 2piy s TYR 192 N -1.32 2.06 -0.10 0.00 5.04 0.43 -1.44 117.35 122.03 2piy s TYR 192 Ca -0.14 -0.98 0.02 0.00 -2.44 0.00 0.00 57.07 53.53 2piy s TYR 192 Cb -0.07 -1.47 0.01 0.00 0.35 0.00 0.00 41.96 40.78 2piy s TYR 192 CO 0.02 -0.49 -0.15 -0.51 -1.34 0.00 0.00 175.55 173.07 2piy s LEU 193 N 0.96 1.74 -0.11 6.97 1.43 0.33 -1.30 118.68 128.70 2piy s LEU 193 Ca -0.07 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.64 2piy s LEU 193 Cb -0.15 -1.06 0.02 0.00 0.03 0.00 0.00 46.19 45.03 2piy s LEU 193 CO -0.01 0.04 -0.14 0.28 0.23 0.00 0.00 176.35 176.74 2piy s THR 194 N 0.84 1.47 -0.24 5.49 -1.32 -0.67 -1.58 115.64 119.63 2piy s THR 194 Ca -0.10 -0.61 -0.10 0.00 -1.21 0.00 0.00 61.69 59.67 2piy s THR 194 Cb -0.15 -1.35 -0.05 0.00 -1.51 0.00 0.00 72.50 69.44 2piy s THR 194 CO 0.01 0.44 0.14 -0.63 -2.21 0.00 0.00 174.62 172.37 2piy s ILE 195 N 1.09 5.18 0.37 5.08 -1.09 -0.40 -1.67 121.20 129.76 2piy s ILE 195 Ca -0.04 0.12 0.04 0.00 -2.23 0.00 0.00 60.65 58.53 2piy s ILE 195 Cb -0.14 -3.41 -0.04 0.00 -1.58 0.00 0.00 42.46 37.29 2piy s ILE 195 CO -0.03 0.35 0.12 -1.00 -1.23 0.00 0.00 174.94 173.14 2piy s HIS 196 N 1.11 1.79 0.19 3.97 3.76 0.70 -4.02 115.29 122.79 2piy s HIS 196 Ca 0.07 -1.22 -0.10 0.00 -0.15 0.00 0.00 55.06 53.66 2piy s HIS 196 Cb -0.14 -1.13 -0.00 0.00 1.11 0.00 0.00 32.58 32.41 2piy s HIS 196 CO 0.05 -0.26 0.35 -1.54 -0.85 0.00 0.00 174.74 172.48 2piy s SER 197 N -3.53 -0.02 0.45 1.40 1.04 -1.26 -1.30 113.70 110.47 2piy s SER 197 Ca 0.29 -0.86 0.03 0.00 0.48 0.00 0.00 55.95 55.89 2piy s SER 197 Cb 0.05 0.48 0.03 0.00 0.10 0.00 0.00 66.02 66.68 2piy s SER 197 CO 0.15 -0.96 0.28 0.00 0.98 0.00 0.00 173.24 173.69 2piy n TYR 198 N -0.27 -0.47 0.00 5.02 4.11 -1.26 -4.89 117.16 119.40 2piy n TYR 198 Ca -0.06 -1.94 0.00 0.00 -0.00 0.00 0.00 57.90 55.90 2piy n TYR 198 Cb 0.63 -0.36 0.00 0.00 -0.00 0.00 0.00 39.34 39.61 2piy n TYR 198 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 2piy n SER 199 N -1.76 0.00 -3.13 9.48 7.64 -0.17 -4.78 113.62 120.89 2piy n SER 199 Ca -0.04 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.78 2piy n SER 199 Cb 0.52 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.74 2piy n SER 199 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2piy n GLN 200 N 0.00 -1.64 -4.09 1.43 6.02 -0.36 -4.80 117.38 113.95 2piy n GLN 200 Ca 0.00 1.27 -0.11 0.00 -0.01 0.00 0.00 57.00 58.16 2piy n GLN 200 Cb 0.00 -5.76 -0.11 0.00 1.02 0.00 0.00 30.24 25.39 2piy n GLN 200 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 2piy s MET 201 N -3.51 0.61 -0.21 -1.09 -1.94 -0.33 -2.04 119.30 110.78 2piy s MET 201 Ca 0.16 -1.00 -0.01 0.00 -1.71 0.00 0.00 55.69 53.13 2piy s MET 201 Cb -0.02 -0.11 0.02 0.00 2.01 0.00 0.00 34.83 36.72 2piy s MET 201 CO 0.75 -0.02 -0.12 0.42 -0.01 0.00 0.00 175.02 176.04 2piy s ILE 202 N -2.56 2.60 -0.01 2.53 1.01 -0.61 -0.68 121.20 123.47 2piy s ILE 202 Ca -0.01 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.77 2piy s ILE 202 Cb -0.02 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 2piy s ILE 202 CO -0.03 0.39 -0.05 -0.76 0.00 0.00 0.00 174.94 174.49 2piy s LEU 203 N 1.33 3.28 0.31 2.97 1.43 0.80 -2.37 118.68 126.44 2piy s LEU 203 Ca 0.03 -0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.08 2piy s LEU 203 Cb -0.15 -1.85 -0.06 0.00 0.03 0.00 0.00 46.19 44.17 2piy s LEU 203 CO -0.08 0.30 0.07 -0.72 0.23 0.00 0.00 176.35 176.15 2piy s TYR 204 N -0.99 1.84 0.80 0.29 -0.85 -0.98 -0.24 117.35 117.23 2piy s TYR 204 Ca 0.17 -1.04 -0.14 0.00 -0.52 0.00 0.00 57.07 55.54 2piy s TYR 204 Cb -0.11 -1.17 0.07 0.00 0.38 0.00 0.00 41.96 41.12 2piy s TYR 204 CO 0.07 -0.11 1.09 -2.30 -1.52 0.00 0.00 175.55 172.79 2piy n PRO 205 N -0.65 0.19 -4.06 -3.49 -0.02 -1.26 -0.50 135.00 125.21 2piy n PRO 205 Ca -0.02 0.14 -0.22 0.00 -2.02 0.00 0.00 63.50 61.38 2piy n PRO 205 Cb 0.66 -2.35 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 2piy n PRO 205 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2piy s TYR 206 N -2.10 2.95 0.00 6.00 2.02 -1.25 -4.36 117.35 120.61 2piy s TYR 206 Ca 0.72 -0.20 0.00 0.00 -0.37 0.00 0.00 57.07 57.21 2piy s TYR 206 Cb -0.30 -1.50 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 2piy s TYR 206 CO 0.52 0.43 0.00 0.43 -1.57 0.00 0.00 175.55 175.36 2piy n SER 207 N -1.18 4.93 -0.18 2.29 7.64 -1.26 -1.40 113.62 124.46 2piy n SER 207 Ca -0.06 0.00 0.14 0.00 1.01 0.00 0.00 58.87 59.96 2piy n SER 207 Cb 0.59 0.78 0.49 0.00 -1.01 0.00 0.00 64.21 65.05 2piy n SER 207 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2piy n TYR 208 N -1.69 0.00 -3.52 1.43 0.18 -1.25 -0.57 117.16 111.74 2piy n TYR 208 Ca 0.00 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.64 2piy n TYR 208 Cb 0.21 -0.16 -0.04 0.00 -0.38 0.00 0.00 39.34 38.97 2piy n TYR 208 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2piy s ASP 209 N -2.50 -0.53 0.00 9.48 3.68 -1.26 -4.80 116.67 120.75 2piy s ASP 209 Ca 0.26 0.24 0.29 0.00 2.13 0.00 0.00 52.55 55.47 2piy s ASP 209 Cb 0.20 0.54 1.29 0.00 -1.45 0.00 0.00 42.92 43.49 2piy s ASP 209 CO 0.50 -0.77 1.92 -1.22 0.13 0.00 0.00 175.17 175.73 2piy n TYR 210 N 0.26 0.00 -1.81 -5.34 4.02 -1.26 -4.49 117.16 108.54 2piy n TYR 210 Ca -0.18 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.33 2piy n TYR 210 Cb 0.61 -0.33 0.05 0.00 -0.02 0.00 0.00 39.34 39.64 2piy n TYR 210 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 176.86 174.26 2piy s LYS 211 N -2.73 3.00 0.16 -0.72 -2.85 -1.26 -4.93 119.74 110.41 2piy s LYS 211 Ca 0.22 2.14 -0.02 0.00 -1.00 0.00 0.00 55.97 57.31 2piy s LYS 211 Cb 0.20 -2.13 -0.05 0.00 -2.06 0.00 0.00 37.83 33.79 2piy s LYS 211 CO 0.51 -1.27 0.36 -0.51 0.10 0.00 0.00 175.35 174.54 2piy s LEU 212 N -3.76 4.26 0.47 2.77 1.43 -1.26 -3.95 118.68 118.64 2piy s LEU 212 Ca 0.75 0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 54.08 2piy s LEU 212 Cb -0.38 -3.20 -0.07 0.00 0.03 0.00 0.00 46.19 42.56 2piy s LEU 212 CO 0.44 0.03 1.14 -2.16 0.23 0.00 0.00 176.35 176.02 2piy s PRO 213 N -2.93 3.72 0.30 1.29 0.04 -1.26 -4.94 135.00 131.23 2piy s PRO 213 Ca 0.39 1.68 0.06 0.00 0.04 0.00 0.00 61.00 63.17 2piy s PRO 213 Cb -0.12 -2.32 0.77 0.00 0.04 0.00 0.00 34.50 32.88 2piy s PRO 213 CO 0.27 -0.56 1.72 1.49 0.04 0.00 0.00 177.00 179.96 2piy h GLU 214 N 1.89 0.49 -1.00 4.56 4.22 -1.98 0.39 114.58 123.15 2piy h GLU 214 Ca -0.49 -0.03 -0.53 0.00 0.08 0.00 0.00 59.36 58.39 2piy h GLU 214 Cb 1.25 -0.11 -0.30 0.00 0.50 0.00 0.00 28.75 30.09 2piy h GLU 214 CO 0.60 0.32 0.67 0.27 -2.18 0.00 0.00 179.01 178.69 2piy n ASN 215 N -4.96 4.31 -0.33 1.04 2.04 -1.26 -4.66 115.26 111.43 2piy n ASN 215 Ca 0.24 -3.59 0.15 0.00 -0.44 0.00 0.00 54.58 50.94 2piy n ASN 215 Cb 0.67 -0.85 0.37 0.00 -2.53 0.00 0.00 39.78 37.44 2piy n ASN 215 CO 0.00 0.00 0.00 -1.13 -0.44 0.00 0.00 177.26 175.69 2piy h ASN 216 N 1.12 0.69 -0.47 0.53 -1.24 -1.28 -0.38 115.58 114.56 2piy h ASN 216 Ca 0.62 0.09 -0.07 0.00 0.71 0.00 0.00 56.30 57.65 2piy h ASN 216 Cb 2.52 -0.03 -0.02 0.00 0.73 0.00 0.00 38.32 41.53 2piy h ASN 216 CO 1.15 0.23 0.02 0.00 -1.29 0.00 0.00 177.43 177.54 2piy h ALA 217 N 1.64 0.63 -0.29 1.57 0.00 -1.84 -1.11 119.26 119.86 2piy h ALA 217 Ca 0.57 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 2piy h ALA 217 Cb 1.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2piy h ALA 217 CO -0.35 0.41 -0.01 1.49 0.00 0.00 0.00 179.25 180.78 2piy h GLU 218 N 0.66 0.52 -0.63 0.00 4.81 -1.53 -2.24 114.58 116.18 2piy h GLU 218 Ca 0.13 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 2piy h GLU 218 Cb 0.47 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 2piy h GLU 218 CO 0.02 0.68 0.22 -0.07 -0.73 0.00 0.00 179.01 179.13 2piy h LEU 219 N 0.30 0.88 -0.53 1.64 3.38 -1.01 0.10 115.31 120.07 2piy h LEU 219 Ca 0.08 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 2piy h LEU 219 Cb 0.46 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2piy h LEU 219 CO 0.02 0.81 -0.05 -1.13 0.09 0.00 0.00 178.44 178.18 2piy h ASN 220 N 0.93 0.96 -0.64 -0.43 -0.73 -1.14 -0.24 115.58 114.28 2piy h ASN 220 Ca 0.21 -0.33 -0.08 0.00 1.87 0.00 0.00 56.30 57.97 2piy h ASN 220 Cb 0.24 -0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.54 2piy h ASN 220 CO -0.01 1.06 0.10 0.78 -0.37 0.00 0.00 177.43 178.99 2piy h ASN 221 N 0.83 1.03 -0.18 1.15 2.35 -0.90 -0.62 115.58 119.25 2piy h ASN 221 Ca 0.14 -0.24 -0.04 0.00 -0.55 0.00 0.00 56.30 55.61 2piy h ASN 221 Cb 0.60 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 2piy h ASN 221 CO 0.04 1.03 -0.04 0.25 -1.65 0.00 0.00 177.43 177.05 2piy h LEU 222 N 1.01 0.35 -0.80 1.61 5.85 -0.80 -2.23 115.31 120.29 2piy h LEU 222 Ca 0.20 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 2piy h LEU 222 Cb 0.43 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2piy h LEU 222 CO 0.01 0.64 0.22 0.00 -0.34 0.00 0.00 178.44 178.96 2piy h ALA 223 N 0.72 1.03 -0.60 1.25 0.00 -0.95 -1.09 119.26 119.62 2piy h ALA 223 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2piy h ALA 223 Cb 0.48 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2piy h ALA 223 CO 0.02 0.65 0.38 -0.22 0.00 0.00 0.00 179.25 180.08 2piy h LYS 224 N 1.07 0.80 -0.20 0.00 3.64 -1.06 -1.17 116.57 119.65 2piy h LYS 224 Ca 0.23 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.40 2piy h LYS 224 Cb 0.31 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 2piy h LYS 224 CO -0.01 0.56 -0.48 0.00 -2.27 0.00 0.00 179.45 177.24 2piy h ALA 225 N 1.20 0.79 -0.47 5.00 0.00 -1.08 -2.19 119.26 122.50 2piy h ALA 225 Ca 0.22 -0.48 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 2piy h ALA 225 Cb -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2piy h ALA 225 CO -0.04 0.67 -0.13 0.00 0.00 0.00 0.00 179.25 179.74 2piy h ALA 226 N 1.05 0.65 -0.05 0.00 0.00 -0.89 -0.72 119.26 119.31 2piy h ALA 226 Ca 0.02 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 2piy h ALA 226 Cb 1.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2piy h ALA 226 CO 0.09 0.57 -0.51 -0.39 0.00 0.00 0.00 179.25 179.02 2piy h VAL 227 N 0.77 1.36 -0.42 0.00 -1.51 -1.17 -0.42 116.25 114.85 2piy h VAL 227 Ca 0.12 -1.75 -0.06 0.00 -1.23 0.00 0.00 66.70 63.78 2piy h VAL 227 Cb 0.69 1.89 -0.02 0.00 -2.13 0.00 0.00 31.29 31.72 2piy h VAL 227 CO 0.05 0.51 0.05 0.50 -1.23 0.00 0.00 177.57 177.45 2piy h LYS 228 N 0.10 0.72 -0.57 5.19 3.64 -1.14 -2.44 116.57 122.07 2piy h LYS 228 Ca 0.00 -0.20 -0.06 0.00 -1.27 0.00 0.00 60.65 59.12 2piy h LYS 228 Cb 0.93 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.65 2piy h LYS 228 CO 0.07 0.76 0.12 1.49 -2.27 0.00 0.00 179.45 179.62 2piy h GLU 229 N 0.57 0.92 -0.97 1.90 4.57 -0.83 -2.84 114.58 117.89 2piy h GLU 229 Ca 0.13 -0.23 0.03 0.00 -1.18 0.00 0.00 59.36 58.10 2piy h GLU 229 Cb 0.41 -0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 28.83 2piy h GLU 229 CO 0.01 0.87 0.64 1.25 -1.18 0.00 0.00 179.01 180.60 2piy h LEU 230 N 0.82 1.07 -1.05 1.64 6.46 -0.98 -2.65 115.31 120.63 2piy h LEU 230 Ca 0.18 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 2piy h LEU 230 Cb 0.38 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.06 2piy h LEU 230 CO 0.01 0.74 0.00 0.00 -0.62 0.00 0.00 178.44 178.57 2piy h ALA 231 N 1.42 1.00 0.00 1.25 0.00 -1.19 -3.17 119.26 118.57 2piy h ALA 231 Ca 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 2piy h ALA 231 Cb -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2piy h ALA 231 CO -0.11 0.00 -0.06 1.79 0.00 0.00 0.00 179.25 180.87 2piy h THR 232 N 0.00 0.44 0.00 0.00 1.35 -1.40 -0.11 112.91 113.19 2piy h THR 232 Ca 0.00 -0.29 -0.04 0.00 -0.55 0.00 0.00 66.41 65.53 2piy h THR 232 Cb 0.58 1.20 -0.01 0.00 -1.73 0.00 0.00 68.15 68.19 2piy h THR 232 CO 0.00 0.06 -0.25 0.25 -0.25 0.00 0.00 175.52 175.33 2piy h LEU 233 N 0.00 0.00 -0.64 3.87 5.85 -1.74 -3.42 115.31 119.24 2piy h LEU 233 Ca -0.00 -0.67 0.00 0.00 0.84 0.00 0.00 57.88 58.05 2piy h LEU 233 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2piy h LEU 233 CO 0.01 0.98 0.00 -1.22 -0.34 0.00 0.00 178.44 177.87 2piy n TYR 234 N -4.61 0.00 -0.77 1.25 4.01 -1.24 -5.01 117.16 110.79 2piy n TYR 234 Ca -0.12 -0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 2piy n TYR 234 Cb 0.41 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 2piy n TYR 234 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2piy n GLY 235 N -0.03 0.59 3.70 2.72 0.00 -0.05 -5.01 105.19 107.11 2piy n GLY 235 Ca 0.00 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2piy n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2piy s THR 236 N -2.00 3.47 -0.26 2.61 2.01 -1.26 -4.97 115.64 115.24 2piy s THR 236 Ca 0.00 0.97 -0.11 0.00 0.31 0.00 0.00 61.69 62.86 2piy s THR 236 Cb 0.00 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.84 2piy s THR 236 CO 0.00 0.03 0.19 -0.54 -0.69 0.00 0.00 174.62 173.62 2piy s LYS 237 N 1.82 4.01 0.09 4.92 1.02 -1.26 -4.05 119.74 126.30 2piy s LYS 237 Ca 0.65 -0.26 0.04 0.00 0.02 0.00 0.00 55.97 56.42 2piy s LYS 237 Cb -0.35 -3.60 -0.04 0.00 -0.52 0.00 0.00 37.83 33.32 2piy s LYS 237 CO 0.29 -0.08 0.05 0.71 -0.92 0.00 0.00 175.35 175.40 2piy s TYR 238 N 1.46 3.09 0.39 3.18 1.51 -1.26 -4.90 117.35 120.81 2piy s TYR 238 Ca 0.08 0.02 0.08 0.00 -1.01 0.00 0.00 57.07 56.23 2piy s TYR 238 Cb -0.15 -1.57 -0.02 0.00 -0.11 0.00 0.00 41.96 40.11 2piy s TYR 238 CO 0.08 0.50 0.33 0.95 -1.11 0.00 0.00 175.55 176.31 2piy s THR 239 N -1.40 2.94 0.16 -0.71 -4.23 -0.87 -4.99 115.64 106.55 2piy s THR 239 Ca 0.28 -1.38 -0.21 0.00 -1.18 0.00 0.00 61.69 59.19 2piy s THR 239 Cb -0.12 -3.06 0.06 0.00 1.34 0.00 0.00 72.50 70.73 2piy s THR 239 CO 0.20 -0.06 0.57 -0.72 -0.54 0.00 0.00 174.62 174.07 2piy s TYR 240 N -2.42 -0.44 -5.00 3.99 1.13 -1.26 -1.58 117.35 111.77 2piy s TYR 240 Ca 0.45 0.19 0.00 0.00 -1.41 0.00 0.00 57.07 56.30 2piy s TYR 240 Cb -0.04 0.51 0.00 0.00 -1.10 0.00 0.00 41.96 41.33 2piy s TYR 240 CO 0.27 -0.85 0.00 0.41 -2.51 0.00 0.00 175.55 172.87 2piy n GLY 241 N -0.36 -0.43 3.76 5.49 0.00 -1.00 -4.99 105.19 107.67 2piy n GLY 241 Ca -0.16 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 43.83 2piy n GLY 241 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2piy s PRO 242 N -1.70 3.39 0.15 1.61 0.02 -1.26 -2.32 135.00 134.90 2piy s PRO 242 Ca 0.00 2.29 -0.16 0.00 0.02 0.00 0.00 61.00 63.15 2piy s PRO 242 Cb 0.00 -2.43 0.01 0.00 0.02 0.00 0.00 34.50 32.10 2piy s PRO 242 CO 0.00 -1.01 1.80 0.78 -0.33 0.00 0.00 177.00 178.25 2piy h GLY 243 N 1.84 0.57 0.82 0.52 0.00 -0.70 -0.64 103.07 105.49 2piy h GLY 243 Ca -0.51 -0.22 0.05 0.00 0.00 0.00 0.00 47.33 46.65 2piy h GLY 243 CO 0.59 0.22 0.59 0.00 0.00 0.00 0.00 176.54 177.94 2piy h ALA 244 N 1.14 1.24 0.00 3.60 0.00 -1.40 -2.52 119.26 121.32 2piy h ALA 244 Ca 0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2piy h ALA 244 Cb -0.04 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 2piy h ALA 244 CO -0.03 0.42 -1.72 0.25 0.00 0.00 0.00 179.25 178.17 2piy n THR 245 N -4.53 0.35 0.05 0.00 -2.24 -1.17 -3.29 114.28 103.45 2piy n THR 245 Ca 0.13 -0.55 -0.05 0.00 -2.27 0.00 0.00 64.05 61.30 2piy n THR 245 Cb 0.13 -0.17 -0.10 0.00 -2.10 0.00 0.00 70.33 68.09 2piy n THR 245 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2piy h THR 246 N 0.00 1.30 0.00 4.28 2.02 -0.95 -3.44 112.91 116.11 2piy h THR 246 Ca -0.05 -2.96 0.00 0.00 0.77 0.00 0.00 66.41 64.17 2piy h THR 246 Cb 1.13 2.63 0.00 0.00 -1.74 0.00 0.00 68.15 70.16 2piy h THR 246 CO 0.01 0.74 0.00 0.00 0.37 0.00 0.00 175.52 176.64 2piy n ILE 247 N -3.23 0.14 -3.61 3.11 3.06 -0.96 -5.04 119.36 112.82 2piy n ILE 247 Ca -0.04 0.05 -0.03 0.00 -2.50 0.00 0.00 62.75 60.23 2piy n ILE 247 Cb 0.92 -0.48 -0.02 0.00 0.54 0.00 0.00 39.64 40.60 2piy n ILE 247 CO 0.00 0.00 0.00 -0.72 -2.50 0.00 0.00 176.55 173.33 2piy s TYR 248 N -1.45 -0.09 0.28 9.51 -0.85 -1.12 -5.04 117.35 118.59 2piy s TYR 248 Ca 0.00 0.05 -0.29 0.00 -0.52 0.00 0.00 57.07 56.30 2piy s TYR 248 Cb 0.00 0.51 -0.10 0.00 0.38 0.00 0.00 41.96 42.75 2piy s TYR 248 CO 0.00 -0.15 1.40 -1.25 -1.52 0.00 0.00 175.55 174.02 2piy s PRO 249 N -2.31 4.29 -0.29 -3.49 0.04 -1.21 -4.19 135.00 127.84 2piy s PRO 249 Ca 0.10 2.28 0.04 0.00 0.04 0.00 0.00 61.00 63.46 2piy s PRO 249 Cb -0.00 -3.09 0.18 0.00 0.04 0.00 0.00 34.50 31.62 2piy s PRO 249 CO -0.04 -0.35 0.48 0.00 0.04 0.00 0.00 177.00 177.14 2piy s ALA 250 N -0.40 -1.70 0.57 8.56 0.00 0.27 -4.26 121.76 124.79 2piy s ALA 250 Ca 0.56 0.55 -0.15 0.00 0.00 0.00 0.00 51.96 52.91 2piy s ALA 250 Cb -0.41 -2.28 -0.05 0.00 0.00 0.00 0.00 23.12 20.38 2piy s ALA 250 CO 0.47 -1.80 1.03 0.00 0.00 0.00 0.00 175.76 175.46 2piy s ALA 251 N 2.64 2.89 0.00 0.00 0.00 -0.09 -3.87 121.76 123.33 2piy s ALA 251 Ca 0.10 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.32 2piy s ALA 251 Cb -0.11 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.83 2piy s ALA 251 CO -0.28 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.29 2piy n GLY 252 N -1.38 0.51 3.82 0.00 0.00 -0.07 -4.36 105.19 103.72 2piy n GLY 252 Ca 0.08 -0.81 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 2piy n GLY 252 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2piy s GLY 253 N -2.74 2.41 0.28 -0.02 0.00 -1.21 -0.76 107.32 105.28 2piy s GLY 253 Ca 0.00 0.36 0.10 0.00 0.00 0.00 0.00 44.72 45.19 2piy s GLY 253 CO 0.00 0.65 1.63 1.48 0.00 0.00 0.00 173.10 176.85 2piy h SER 254 N 2.03 0.01 -0.34 1.64 4.64 -1.87 -2.41 113.55 117.25 2piy h SER 254 Ca -0.49 -0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 60.65 2piy h SER 254 Cb 1.18 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2piy h SER 254 CO 0.62 0.61 -0.46 -2.24 -0.87 0.00 0.00 176.83 174.49 2piy h ASP 255 N 0.01 1.00 -0.60 4.97 2.03 -1.93 0.27 116.42 122.17 2piy h ASP 255 Ca -0.01 -0.50 -0.07 0.00 -0.73 0.00 0.00 57.03 55.73 2piy h ASP 255 Cb 1.06 -0.28 -0.02 0.00 -0.83 0.00 0.00 39.33 39.25 2piy h ASP 255 CO 0.08 1.30 0.09 0.44 -1.03 0.00 0.00 179.24 180.12 2piy h ASP 256 N 0.72 0.96 0.01 4.15 3.32 -1.94 -2.02 116.42 121.62 2piy h ASP 256 Ca 0.04 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 2piy h ASP 256 Cb 1.06 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.36 2piy h ASP 256 CO 0.11 0.98 -0.00 -0.25 -1.72 0.00 0.00 179.24 178.35 2piy h TRP 257 N 0.90 -0.01 -0.74 4.55 7.01 -1.32 -1.79 115.95 124.56 2piy h TRP 257 Ca 0.18 -0.00 0.12 0.00 2.11 0.00 0.00 58.89 61.30 2piy h TRP 257 Cb 0.43 0.00 -0.08 0.00 -2.10 0.00 0.00 29.16 27.41 2piy h TRP 257 CO 0.03 0.19 0.33 0.00 -2.79 0.00 0.00 178.44 176.19 2piy h ALA 258 N 0.79 1.03 -0.64 2.65 0.00 -0.90 -1.50 119.26 120.69 2piy h ALA 258 Ca -0.00 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2piy h ALA 258 Cb 0.20 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2piy h ALA 258 CO 0.00 -0.14 0.18 -0.92 0.00 0.00 0.00 179.25 178.37 2piy h TYR 259 N 0.51 1.05 0.00 0.00 3.20 -1.11 -1.72 116.97 118.91 2piy h TYR 259 Ca 0.39 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 62.14 2piy h TYR 259 Cb 0.52 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.49 2piy h TYR 259 CO -0.14 0.86 0.00 -0.25 -1.64 0.00 0.00 178.16 177.00 2piy n ASP 260 N -4.34 0.00 0.09 -2.11 10.43 -0.69 -1.50 116.55 118.42 2piy n ASP 260 Ca 0.04 0.06 0.13 0.00 2.57 0.00 0.00 54.79 57.59 2piy n ASP 260 Cb 0.23 -0.33 0.37 0.00 1.84 0.00 0.00 41.12 43.23 2piy n ASP 260 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2piy n GLN 261 N -1.33 0.24 0.00 -1.24 1.13 -0.63 -4.92 117.38 110.63 2piy n GLN 261 Ca 0.10 0.17 0.00 0.00 -1.94 0.00 0.00 57.00 55.33 2piy n GLN 261 Cb 0.21 -1.75 0.00 0.00 0.11 0.00 0.00 30.24 28.81 2piy n GLN 261 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2piy n GLY 262 N 1.33 1.00 3.51 1.08 0.00 -0.56 -5.07 105.19 106.48 2piy n GLY 262 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2piy n GLY 262 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2piy s ILE 263 N -2.00 4.05 -0.33 -0.61 1.01 -1.07 -4.88 121.20 117.37 2piy s ILE 263 Ca 0.00 0.13 0.26 0.00 0.00 0.00 0.00 60.65 61.04 2piy s ILE 263 Cb 0.00 -4.77 0.34 0.00 0.01 0.00 0.00 42.46 38.04 2piy s ILE 263 CO 0.00 -1.58 1.74 0.11 0.00 0.00 0.00 174.94 175.20 2piy h LYS 264 N 9.74 0.00 -4.13 2.79 1.79 -1.83 -3.35 116.57 121.58 2piy h LYS 264 Ca -0.28 0.00 -0.71 0.00 -2.18 0.00 0.00 60.65 57.48 2piy h LYS 264 Cb 1.06 0.00 -0.33 0.00 -1.58 0.00 0.00 32.23 31.38 2piy h LYS 264 CO 1.21 0.00 -0.43 0.71 -1.08 0.00 0.00 179.45 179.87 2piy s TYR 265 N -3.33 3.50 -0.09 -1.35 2.02 -1.25 -5.00 117.35 111.85 2piy s TYR 265 Ca 0.06 -2.38 0.00 0.00 -0.37 0.00 0.00 57.07 54.38 2piy s TYR 265 Cb 0.07 -3.31 0.02 0.00 -0.40 0.00 0.00 41.96 38.35 2piy s TYR 265 CO 0.61 -0.94 -0.08 0.45 -1.57 0.00 0.00 175.55 174.03 2piy s SER 266 N 1.66 1.86 0.00 2.29 0.15 -1.26 -0.43 113.70 117.97 2piy s SER 266 Ca 0.11 -0.26 0.01 0.00 0.70 0.00 0.00 55.95 56.51 2piy s SER 266 Cb -0.22 -0.75 -0.00 0.00 -1.71 0.00 0.00 66.02 63.34 2piy s SER 266 CO -0.03 -0.08 -0.03 -0.36 1.20 0.00 0.00 173.24 173.94 2piy s PHE 267 N 1.35 0.25 -0.20 3.44 0.08 -0.42 -4.37 117.98 118.12 2piy s PHE 267 Ca -0.02 -0.10 -0.06 0.00 0.12 0.00 0.00 56.93 56.86 2piy s PHE 267 Cb -0.14 -0.16 -0.03 0.00 -0.57 0.00 0.00 43.02 42.12 2piy s PHE 267 CO -0.04 -0.02 0.04 0.99 -0.10 0.00 0.00 175.22 176.09 2piy s THR 268 N -0.24 4.36 -0.12 0.64 2.01 0.67 -1.66 115.64 121.29 2piy s THR 268 Ca -0.01 -0.18 -0.12 0.00 0.31 0.00 0.00 61.69 61.70 2piy s THR 268 Cb -0.02 -2.98 -0.05 0.00 0.01 0.00 0.00 72.50 69.46 2piy s THR 268 CO -0.00 0.42 0.26 -0.36 -0.69 0.00 0.00 174.62 174.25 2piy s PHE 269 N 0.86 3.54 -0.30 4.92 0.40 -0.67 -0.14 117.98 126.60 2piy s PHE 269 Ca 0.02 0.62 -0.02 0.00 -0.60 0.00 0.00 56.93 56.95 2piy s PHE 269 Cb -0.14 -2.21 0.04 0.00 0.51 0.00 0.00 43.02 41.23 2piy s PHE 269 CO 0.02 0.45 0.00 -1.21 0.70 0.00 0.00 175.22 175.18 2piy s GLU 270 N -0.22 2.54 0.00 0.44 0.41 0.14 -0.22 118.70 121.80 2piy s GLU 270 Ca 0.16 -1.20 0.00 0.00 -0.41 0.00 0.00 54.97 53.53 2piy s GLU 270 Cb -0.13 -3.18 0.00 0.00 -1.78 0.00 0.00 34.13 29.04 2piy s GLU 270 CO 0.05 -0.58 0.00 1.28 -0.49 0.00 0.00 175.26 175.52 2piy n LEU 271 N 4.66 0.00 -4.69 1.80 4.77 -0.42 -1.19 117.00 121.93 2piy n LEU 271 Ca -0.14 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.53 2piy n LEU 271 Cb 0.44 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.68 2piy n LEU 271 CO 0.27 -0.42 0.71 -0.13 -1.33 0.00 0.00 177.39 176.49 2piy s ARG 272 N -2.47 1.27 0.00 3.23 0.52 -1.26 -1.68 118.95 118.56 2piy s ARG 272 Ca 0.00 1.59 0.00 0.00 -0.52 0.00 0.00 55.73 56.80 2piy s ARG 272 Cb 0.00 -1.75 0.00 0.00 0.52 0.00 0.00 34.95 33.72 2piy s ARG 272 CO 0.00 -2.45 0.00 -0.40 0.02 0.00 0.00 175.30 172.47 2piy n ASP 273 N -3.92 0.00 -0.55 0.23 3.85 -1.26 -4.58 116.55 110.33 2piy n ASP 273 Ca 0.12 0.00 0.05 0.00 -0.71 0.00 0.00 54.79 54.25 2piy n ASP 273 Cb 0.52 0.00 0.11 0.00 -1.35 0.00 0.00 41.12 40.40 2piy n ASP 273 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2piy n LYS 274 N 0.00 2.15 0.00 0.11 4.76 -1.26 -1.00 118.16 122.92 2piy n LYS 274 Ca 0.00 -1.75 0.00 0.00 -2.87 0.00 0.00 58.31 53.69 2piy n LYS 274 Cb 0.00 -1.24 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 2piy n LYS 274 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2piy n GLY 275 N 0.50 1.14 0.08 0.72 0.00 -1.26 -4.95 105.19 101.42 2piy n GLY 275 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2piy n GLY 275 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2piy h ARG 276 N 0.00 0.03 0.00 1.61 2.43 -2.02 -3.28 114.38 113.14 2piy h ARG 276 Ca 0.00 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2piy h ARG 276 Cb 0.00 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 2piy h ARG 276 CO 0.00 0.02 -1.59 0.66 -1.51 0.00 0.00 179.97 177.55 2piy n TYR 277 N -5.12 0.00 0.00 2.20 4.02 -1.26 -5.08 117.16 111.92 2piy n TYR 277 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 2piy n TYR 277 Cb 0.07 -0.33 0.00 0.00 -0.02 0.00 0.00 39.34 39.06 2piy n TYR 277 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2piy n GLY 278 N 1.91 3.43 0.22 2.72 0.00 -1.24 -1.89 105.19 110.34 2piy n GLY 278 Ca -0.05 -0.11 0.10 0.00 0.00 0.00 0.00 46.02 45.95 2piy n GLY 278 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2piy h PHE 279 N 0.00 0.00 -1.36 1.61 0.04 -1.93 -3.28 116.94 112.03 2piy h PHE 279 Ca 0.00 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 60.12 2piy h PHE 279 Cb 0.00 0.00 -0.18 0.00 2.20 0.00 0.00 35.95 37.97 2piy h PHE 279 CO 0.00 0.22 1.17 -0.89 -0.60 0.00 0.00 178.31 178.22 2piy n ILE 280 N -3.43 4.27 -2.00 -0.55 2.08 -0.79 -4.43 119.36 114.50 2piy n ILE 280 Ca -0.00 -3.93 -0.42 0.00 0.56 0.00 0.00 62.75 58.96 2piy n ILE 280 Cb 0.41 -1.68 -0.03 0.00 -0.75 0.00 0.00 39.64 37.59 2piy n ILE 280 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 2piy s LEU 281 N -2.68 4.37 0.50 1.39 2.96 -1.23 -4.85 118.68 119.13 2piy s LEU 281 Ca 0.54 2.53 -0.23 0.00 -0.22 0.00 0.00 54.13 56.75 2piy s LEU 281 Cb 0.31 -3.59 -0.07 0.00 0.50 0.00 0.00 46.19 43.34 2piy s LEU 281 CO -0.20 -0.78 1.36 -2.65 -1.32 0.00 0.00 176.35 172.75 2piy n PRO 282 N 4.07 1.88 0.29 0.98 -0.02 -1.26 -4.86 135.00 136.08 2piy n PRO 282 Ca 0.13 0.68 0.17 0.00 -2.02 0.00 0.00 63.50 62.47 2piy n PRO 282 Cb 0.40 -2.55 0.97 0.00 -0.02 0.00 0.00 33.50 32.29 2piy n PRO 282 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2piy h GLU 283 N 1.77 0.00 0.00 -0.52 5.08 -1.92 -1.10 114.58 117.88 2piy h GLU 283 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2piy h GLU 283 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2piy h GLU 283 CO 0.58 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.46 2piy n SER 284 N -3.63 0.04 -0.70 1.42 3.41 -1.26 -1.96 113.62 110.94 2piy n SER 284 Ca -0.02 0.51 0.09 0.00 -0.26 0.00 0.00 58.87 59.19 2piy n SER 284 Cb 0.14 -0.52 0.08 0.00 -0.26 0.00 0.00 64.21 63.64 2piy n SER 284 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2piy n GLN 285 N -1.54 1.42 0.07 4.33 6.02 -0.42 -4.63 117.38 122.63 2piy n GLN 285 Ca 0.03 -1.55 -0.12 0.00 -0.01 0.00 0.00 57.00 55.35 2piy n GLN 285 Cb 0.14 -1.33 -0.07 0.00 1.02 0.00 0.00 30.24 30.00 2piy n GLN 285 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2piy h ILE 286 N 3.38 0.95 0.13 5.09 2.04 -1.49 -1.47 117.51 126.14 2piy h ILE 286 Ca 0.00 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2piy h ILE 286 Cb 0.72 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.76 2piy h ILE 286 CO 0.00 0.00 -0.06 -0.61 0.00 0.00 0.00 178.15 177.48 2piy h GLN 287 N -0.07 -0.16 -0.55 2.37 -0.00 -1.82 -0.38 115.11 114.49 2piy h GLN 287 Ca -0.01 0.01 -0.03 0.00 -0.00 0.00 0.00 58.65 58.63 2piy h GLN 287 Cb 0.06 0.04 -0.02 0.00 0.00 0.00 0.00 27.48 27.55 2piy h GLN 287 CO 0.01 -0.09 0.23 0.00 0.00 0.00 0.00 178.83 178.98 2piy h ALA 288 N 0.68 0.71 -0.35 3.38 0.00 -1.85 0.13 119.26 121.96 2piy h ALA 288 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2piy h ALA 288 Cb 0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2piy h ALA 288 CO 0.03 0.31 0.23 1.15 0.00 0.00 0.00 179.25 180.97 2piy h THR 289 N 0.74 1.09 -0.36 0.00 2.02 -1.12 -2.13 112.91 113.16 2piy h THR 289 Ca 0.18 -0.18 -0.15 0.00 0.77 0.00 0.00 66.41 67.04 2piy h THR 289 Cb 0.17 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 2piy h THR 289 CO -0.02 0.09 -0.37 0.00 0.37 0.00 0.00 175.52 175.59 2piy h GLU 291 N 0.70 0.27 -0.22 0.00 4.57 -0.82 -0.05 114.58 119.04 2piy h GLU 291 Ca 0.06 -0.04 -0.14 0.00 -1.18 0.00 0.00 59.36 58.07 2piy h GLU 291 Cb 0.94 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.47 2piy h GLU 291 CO 0.09 0.28 -0.43 1.05 -1.18 0.00 0.00 179.01 178.81 2piy h GLU 292 N 0.20 0.53 -0.54 1.92 4.11 -1.37 -2.87 114.58 116.56 2piy h GLU 292 Ca 0.07 -0.28 -0.07 0.00 0.07 0.00 0.00 59.36 59.15 2piy h GLU 292 Cb 0.09 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2piy h GLU 292 CO -0.01 0.86 0.04 1.15 0.07 0.00 0.00 179.01 181.13 2piy h THR 293 N 0.43 1.25 -0.99 -1.06 2.02 -1.13 -2.49 112.91 110.93 2piy h THR 293 Ca 0.03 -0.99 0.14 0.00 0.77 0.00 0.00 66.41 66.36 2piy h THR 293 Cb 0.93 0.78 -0.09 0.00 -1.74 0.00 0.00 68.15 68.03 2piy h THR 293 CO 0.08 0.36 0.62 0.24 0.37 0.00 0.00 175.52 177.19 2piy h MET 294 N 0.83 0.87 -0.61 6.66 2.86 -0.78 -0.72 114.93 124.04 2piy h MET 294 Ca 0.16 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.68 2piy h MET 294 Cb 0.43 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2piy h MET 294 CO 0.02 0.57 0.08 -0.07 1.06 0.00 0.00 176.91 178.56 2piy h LEU 295 N 0.89 0.96 -0.33 1.22 3.38 -1.36 0.72 115.31 120.79 2piy h LEU 295 Ca 0.52 -0.23 -0.16 0.00 0.09 0.00 0.00 57.88 58.10 2piy h LEU 295 Cb 0.65 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2piy h LEU 295 CO -0.29 0.97 -0.41 0.00 0.09 0.00 0.00 178.44 178.80 2piy h ALA 296 N 1.14 0.49 -0.56 1.53 0.00 -1.27 -0.93 119.26 119.65 2piy h ALA 296 Ca 0.18 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 2piy h ALA 296 Cb 0.44 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2piy h ALA 296 CO 0.01 0.61 -0.07 0.82 0.00 0.00 0.00 179.25 180.62 2piy h ILE 297 N 0.64 1.27 -0.21 0.00 1.08 -0.86 -1.63 117.51 117.78 2piy h ILE 297 Ca 0.04 -1.23 -0.15 0.00 -0.39 0.00 0.00 64.86 63.13 2piy h ILE 297 Cb 1.01 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 35.66 2piy h ILE 297 CO 0.10 0.44 -0.49 0.11 -0.69 0.00 0.00 178.15 177.61 2piy h LYS 298 N 0.93 0.58 -0.32 2.37 1.57 -0.83 -0.84 116.57 120.02 2piy h LYS 298 Ca 0.15 -0.34 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2piy h LYS 298 Cb 0.64 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 2piy h LYS 298 CO 0.04 0.94 0.19 -0.92 -0.57 0.00 0.00 179.45 179.14 2piy h TYR 299 N 0.46 0.43 -0.70 -1.35 3.20 -0.97 0.16 116.97 118.21 2piy h TYR 299 Ca 0.02 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2piy h TYR 299 Cb 1.03 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 39.12 2piy h TYR 299 CO 0.04 0.33 0.39 0.28 -1.64 0.00 0.00 178.16 177.56 2piy h VAL 300 N 0.41 1.21 -0.55 1.81 2.07 -1.19 -1.60 116.25 118.42 2piy h VAL 300 Ca 0.12 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 2piy h VAL 300 Cb 0.03 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 2piy h VAL 300 CO -0.02 0.23 0.33 0.74 0.02 0.00 0.00 177.57 178.87 2piy h THR 301 N 0.96 1.17 -0.82 2.57 2.02 -0.85 -0.33 112.91 117.63 2piy h THR 301 Ca 0.25 -0.38 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 2piy h THR 301 Cb 0.02 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 66.81 2piy h THR 301 CO -0.04 0.17 0.45 -1.13 0.37 0.00 0.00 175.52 175.34 2piy h ASN 302 N 0.74 1.02 -0.15 4.18 -1.24 -0.67 -1.51 115.58 117.95 2piy h ASN 302 Ca 0.20 -0.10 -0.02 0.00 0.71 0.00 0.00 56.30 57.09 2piy h ASN 302 Cb -0.01 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 38.77 2piy h ASN 302 CO -0.04 0.82 0.02 0.22 -1.29 0.00 0.00 177.43 177.16 2piy h TYR 303 N 1.14 0.27 -0.82 0.67 3.20 -0.93 -3.10 116.97 117.39 2piy h TYR 303 Ca 0.29 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.13 2piy h TYR 303 Cb 0.03 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.18 2piy h TYR 303 CO 0.00 0.44 0.54 0.28 -1.64 0.00 0.00 178.16 177.78 2piy h VAL 304 N 0.02 1.19 0.00 1.81 2.07 -0.79 -1.28 116.25 119.26 2piy h VAL 304 Ca 0.04 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2piy h VAL 304 Cb 0.32 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.09 2piy h VAL 304 CO 0.00 0.20 -0.04 -0.07 0.02 0.00 0.00 177.57 177.68 2piy h LEU 305 N 1.09 0.00 -1.10 2.57 3.38 -1.27 1.00 115.31 120.98 2piy h LEU 305 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2piy h LEU 305 Cb -0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2piy h LEU 305 CO -0.08 0.04 0.00 0.61 0.09 0.00 0.00 178.44 179.10 2piy n GLY 306 N -1.05 0.37 2.59 0.83 0.00 -0.49 -4.25 105.19 103.18 2piy n GLY 306 Ca -0.03 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 2piy n GLY 306 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2piy n HIS 307 N 0.35 0.94 1.45 1.61 8.25 0.34 -5.10 115.22 123.08 2piy n HIS 307 Ca 0.12 -2.94 0.14 0.00 -0.26 0.00 0.00 57.72 54.78 2piy n HIS 307 Cb 0.28 -0.36 0.49 0.00 1.12 0.00 0.00 29.99 31.52 2piy n HIS 307 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26