#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p88 h ASN 26 N 0.00 -0.17 0.60 4.04 -0.26 -1.93 -2.93 115.58 114.93 1p88 h ASN 26 Ca 0.00 0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.72 1p88 h ASN 26 Cb 0.00 0.04 0.01 0.00 -1.06 0.00 0.00 38.32 37.31 1p88 h ASN 26 CO 0.00 0.02 -0.29 0.03 -1.06 0.00 0.00 177.43 176.14 1p88 h ARG 27 N -0.49 -0.77 -0.98 0.81 2.47 -1.97 -2.31 114.38 111.13 1p88 h ARG 27 Ca -0.02 0.05 0.31 0.00 -1.26 0.00 0.00 59.98 59.06 1p88 h ARG 27 Cb 0.16 0.18 -0.18 0.00 -1.65 0.00 0.00 29.97 28.47 1p88 h ARG 27 CO 0.03 -0.46 0.20 0.00 0.56 0.00 0.00 179.97 180.30 1p88 h ALA 28 N -0.87 1.48 -0.20 0.04 0.00 -1.95 0.82 119.26 118.58 1p88 h ALA 28 Ca -0.08 0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.96 1p88 h ALA 28 Cb 0.67 0.49 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1p88 h ALA 28 CO 0.13 -0.67 -0.59 -0.07 0.00 0.00 0.00 179.25 178.05 1p88 h LEU 29 N 0.03 0.74 -0.00 0.00 3.38 -1.48 0.15 115.31 118.12 1p88 h LEU 29 Ca 0.67 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 1p88 h LEU 29 Cb 1.52 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 1p88 h LEU 29 CO -0.85 1.16 0.00 0.25 0.09 0.00 0.00 178.44 179.09 1p88 h LEU 30 N 0.49 0.00 -1.27 1.67 5.85 0.11 -1.27 115.31 120.89 1p88 h LEU 30 Ca 0.00 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.39 1p88 h LEU 30 Cb 1.16 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 1p88 h LEU 30 CO 0.12 0.27 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.13 1p88 h LEU 31 N -0.26 0.00 -0.63 2.25 3.38 -0.70 0.54 115.31 119.90 1p88 h LEU 31 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1p88 h LEU 31 Cb 0.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1p88 h LEU 31 CO 0.00 0.29 0.21 0.00 0.09 0.00 0.00 178.44 179.03 1p88 h ALA 32 N 1.71 0.82 0.25 1.53 0.00 -0.56 -0.99 119.26 122.02 1p88 h ALA 32 Ca -0.00 -0.20 -0.34 0.00 0.00 0.00 0.00 54.91 54.37 1p88 h ALA 32 Cb 0.69 -0.24 0.04 0.00 0.00 0.00 0.00 17.79 18.27 1p88 h ALA 32 CO 0.04 0.48 -1.49 0.00 0.00 0.00 0.00 179.25 178.28 1p88 h ALA 33 N 1.08 -0.14 0.00 0.00 0.00 -0.89 -3.16 119.26 116.15 1p88 h ALA 33 Ca 0.21 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1p88 h ALA 33 Cb 0.27 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1p88 h ALA 33 CO -0.01 0.71 0.00 1.28 0.00 0.00 0.00 179.25 181.23 1p88 n LEU 34 N -3.72 0.00 -5.03 0.00 4.77 0.15 0.89 117.00 114.05 1p88 n LEU 34 Ca -0.18 0.17 -0.19 0.00 -0.03 0.00 0.00 56.01 55.78 1p88 n LEU 34 Cb 1.10 -0.17 0.05 0.00 -2.33 0.00 0.00 43.42 42.07 1p88 n LEU 34 CO 0.60 -0.11 0.32 0.00 -1.33 0.00 0.00 177.39 176.87 1p88 s ALA 35 N -2.34 4.67 -0.28 -1.18 0.00 -0.39 -1.60 121.76 120.64 1p88 s ALA 35 Ca 0.14 -2.07 -0.05 0.00 0.00 0.00 0.00 51.96 49.98 1p88 s ALA 35 Cb 0.08 -1.50 0.02 0.00 0.00 0.00 0.00 23.12 21.72 1p88 s ALA 35 CO 0.16 -0.79 0.03 -1.01 0.00 0.00 0.00 175.76 174.15 1p88 s HIS 36 N -2.63 3.13 0.00 0.00 3.76 0.35 0.12 115.29 120.02 1p88 s HIS 36 Ca 0.61 -1.27 0.00 0.00 -0.15 0.00 0.00 55.06 54.25 1p88 s HIS 36 Cb -0.06 -2.18 0.00 0.00 1.11 0.00 0.00 32.58 31.45 1p88 s HIS 36 CO 0.38 -0.65 0.00 0.41 -0.85 0.00 0.00 174.74 174.03 1p88 n GLY 37 N 4.78 2.40 3.58 -2.22 0.00 -1.26 -1.56 105.19 110.91 1p88 n GLY 37 Ca -0.15 -2.07 -0.40 0.00 0.00 0.00 0.00 46.02 43.40 1p88 n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1p88 s LYS 38 N -2.25 3.81 0.08 1.61 2.20 -1.25 0.27 119.74 124.20 1p88 s LYS 38 Ca 0.00 -0.11 0.09 0.00 -0.36 0.00 0.00 55.97 55.60 1p88 s LYS 38 Cb 0.00 -3.73 -0.03 0.00 -1.51 0.00 0.00 37.83 32.55 1p88 s LYS 38 CO 0.00 -0.44 -0.24 0.99 -0.36 0.00 0.00 175.35 175.30 1p88 s THR 39 N 2.15 2.39 -0.07 3.43 2.01 -1.03 -4.50 115.64 120.03 1p88 s THR 39 Ca 0.15 -1.49 -0.02 0.00 0.31 0.00 0.00 61.69 60.65 1p88 s THR 39 Cb -0.16 -2.01 -0.03 0.00 0.01 0.00 0.00 72.50 70.31 1p88 s THR 39 CO 0.11 0.24 0.03 -0.69 -0.69 0.00 0.00 174.62 173.62 1p88 s VAL 40 N -0.95 4.48 -0.23 3.82 1.01 0.50 -0.51 120.40 128.52 1p88 s VAL 40 Ca 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.85 1p88 s VAL 40 Cb -0.10 -2.93 0.02 0.00 0.00 0.00 0.00 36.38 33.37 1p88 s VAL 40 CO 0.05 0.55 -0.09 -0.76 0.00 0.00 0.00 175.10 174.85 1p88 s LEU 41 N -1.09 2.98 0.12 3.92 2.01 0.18 0.25 118.68 127.05 1p88 s LEU 41 Ca 0.15 -0.81 0.03 0.00 0.01 0.00 0.00 54.13 53.52 1p88 s LEU 41 Cb -0.11 -1.63 -0.04 0.00 0.01 0.00 0.00 46.19 44.42 1p88 s LEU 41 CO 0.05 -0.10 0.17 0.28 1.01 0.00 0.00 176.35 177.77 1p88 s THR 42 N 1.32 4.87 -1.14 5.49 -1.32 0.29 -0.68 115.64 124.47 1p88 s THR 42 Ca 0.01 -0.78 0.00 0.00 -1.21 0.00 0.00 61.69 59.71 1p88 s THR 42 Cb -0.16 -3.44 0.00 0.00 -1.51 0.00 0.00 72.50 67.39 1p88 s THR 42 CO -0.06 -0.01 0.00 -3.20 -2.21 0.00 0.00 174.62 169.14 1p88 n ASN 43 N -0.10 -4.12 -3.21 8.08 5.15 -0.27 0.17 115.26 120.96 1p88 n ASN 43 Ca -0.07 0.15 -0.12 0.00 -0.60 0.00 0.00 54.58 53.93 1p88 n ASN 43 Cb 0.53 -2.97 0.12 0.00 -0.53 0.00 0.00 39.78 36.92 1p88 n ASN 43 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1p88 n LEU 44 N -1.50 0.00 -4.46 1.20 4.77 0.60 -4.74 117.00 112.87 1p88 n LEU 44 Ca -0.13 -0.34 -0.33 0.00 -0.03 0.00 0.00 56.01 55.18 1p88 n LEU 44 Cb 0.49 -0.47 -0.13 0.00 -2.33 0.00 0.00 43.42 40.98 1p88 n LEU 44 CO 0.17 -2.05 -0.40 -0.22 -1.33 0.00 0.00 177.39 173.56 1p88 s LEU 45 N 0.00 2.97 -0.96 2.23 2.96 -1.26 -4.75 118.68 119.87 1p88 s LEU 45 Ca 0.26 -0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 53.78 1p88 s LEU 45 Cb -0.05 -1.68 0.13 0.00 0.50 0.00 0.00 46.19 45.09 1p88 s LEU 45 CO 0.22 0.21 1.18 -0.62 -1.32 0.00 0.00 176.35 176.02 1p88 s ASP 46 N 0.09 6.65 -0.24 3.68 -1.08 -1.26 -4.53 116.67 119.98 1p88 s ASP 46 Ca -0.03 -2.05 -0.26 0.00 -0.52 0.00 0.00 52.55 49.68 1p88 s ASP 46 Cb -0.14 -2.42 0.09 0.00 -1.46 0.00 0.00 42.92 39.00 1p88 s ASP 46 CO 0.04 -1.09 0.86 -0.44 0.52 0.00 0.00 175.17 175.06 1p88 s SER 47 N 3.72 -0.59 0.48 -0.34 0.01 -1.26 -5.01 113.70 110.70 1p88 s SER 47 Ca 0.35 1.05 0.42 0.00 1.31 0.00 0.00 55.95 59.08 1p88 s SER 47 Cb -0.04 1.03 1.52 0.00 0.21 0.00 0.00 66.02 68.74 1p88 s SER 47 CO -0.09 -0.27 1.41 -0.90 0.41 0.00 0.00 173.24 173.80 1p88 n ASP 48 N 2.11 0.04 -0.27 2.44 5.68 -1.26 0.19 116.55 125.48 1p88 n ASP 48 Ca -0.14 0.97 -0.01 0.00 -0.50 0.00 0.00 54.79 55.11 1p88 n ASP 48 Cb 0.56 -0.48 0.12 0.00 -1.14 0.00 0.00 41.12 40.17 1p88 n ASP 48 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1p88 h ASP 49 N 0.00 0.73 0.12 -1.12 3.04 -1.94 0.91 116.42 118.16 1p88 h ASP 49 Ca 0.84 0.02 -0.19 0.00 -3.24 0.00 0.00 57.03 54.46 1p88 h ASP 49 Cb 3.24 -0.13 0.01 0.00 -1.04 0.00 0.00 39.33 41.41 1p88 h ASP 49 CO -0.09 0.47 -0.88 0.58 -2.04 0.00 0.00 179.24 177.28 1p88 h VAL 50 N 0.86 1.42 -1.01 4.15 2.07 0.19 -1.43 116.25 122.50 1p88 h VAL 50 Ca 0.33 -2.48 0.23 0.00 0.82 0.00 0.00 66.70 65.61 1p88 h VAL 50 Cb 0.15 3.08 -0.11 0.00 -1.52 0.00 0.00 31.29 32.89 1p88 h VAL 50 CO -0.16 0.69 0.62 -0.09 0.02 0.00 0.00 177.57 178.64 1p88 h ARG 51 N -0.44 0.58 0.06 1.57 2.43 -0.79 0.65 114.38 118.44 1p88 h ARG 51 Ca -0.17 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 58.73 1p88 h ARG 51 Cb 1.59 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 31.01 1p88 h ARG 51 CO 0.10 0.39 -1.07 0.45 -1.51 0.00 0.00 179.97 178.34 1p88 h HIS 52 N 0.60 0.33 -0.76 2.20 3.86 0.81 1.60 115.15 123.80 1p88 h HIS 52 Ca 0.61 -0.22 0.11 0.00 -1.16 0.00 0.00 60.37 59.71 1p88 h HIS 52 Cb 1.17 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 29.56 1p88 h HIS 52 CO -0.00 1.12 0.50 1.98 0.86 0.00 0.00 177.93 182.39 1p88 h MET 53 N 0.08 0.58 0.13 2.45 1.85 0.13 3.94 114.93 124.08 1p88 h MET 53 Ca -0.08 -0.03 -0.21 0.00 -0.61 0.00 0.00 59.70 58.77 1p88 h MET 53 Cb 1.77 -0.13 0.01 0.00 0.43 0.00 0.00 31.60 33.68 1p88 h MET 53 CO 0.16 0.38 -0.99 -0.07 -0.40 0.00 0.00 176.91 176.00 1p88 h LEU 54 N 0.59 0.43 -1.15 3.39 3.38 -0.16 -3.13 115.31 118.67 1p88 h LEU 54 Ca 0.36 -0.92 0.07 0.00 0.09 0.00 0.00 57.88 57.48 1p88 h LEU 54 Cb 0.59 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 1p88 h LEU 54 CO -0.13 1.46 0.59 -1.13 0.09 0.00 0.00 178.44 179.31 1p88 h ASN 55 N -0.37 0.90 -0.51 -0.43 -1.24 0.49 1.58 115.58 116.01 1p88 h ASN 55 Ca -0.19 0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.83 1p88 h ASN 55 Cb 1.67 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 40.51 1p88 h ASN 55 CO 0.12 0.57 0.32 0.00 -1.29 0.00 0.00 177.43 177.15 1p88 h ALA 56 N 1.51 0.65 -0.58 1.57 0.00 0.73 1.25 119.26 124.39 1p88 h ALA 56 Ca 0.39 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 1p88 h ALA 56 Cb 0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1p88 h ALA 56 CO -0.15 0.12 0.03 -0.07 0.00 0.00 0.00 179.25 179.17 1p88 h LEU 57 N 0.68 0.95 -1.37 0.00 4.07 -1.02 -2.25 115.31 116.37 1p88 h LEU 57 Ca 0.18 -0.25 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 1p88 h LEU 57 Cb -0.04 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.43 1p88 h LEU 57 CO -0.04 0.99 0.03 0.74 -1.08 0.00 0.00 178.44 179.09 1p88 h THR 58 N 0.91 1.17 -0.08 0.22 2.02 0.40 0.92 112.91 118.47 1p88 h THR 58 Ca 0.17 -0.63 -0.21 0.00 0.77 0.00 0.00 66.41 66.51 1p88 h THR 58 Cb 0.49 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1p88 h THR 58 CO 0.02 0.22 -0.82 0.00 0.37 0.00 0.00 175.52 175.31 1p88 h ALA 59 N 1.60 0.41 0.00 6.16 0.00 0.20 -3.16 119.26 124.47 1p88 h ALA 59 Ca 0.10 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1p88 h ALA 59 Cb 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1p88 h ALA 59 CO 0.00 0.74 -0.25 1.28 0.00 0.00 0.00 179.25 181.03 1p88 n LEU 60 N -3.85 0.66 0.00 0.00 4.77 -0.91 -4.69 117.00 112.98 1p88 n LEU 60 Ca -0.06 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1p88 n LEU 60 Cb 0.76 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1p88 n LEU 60 CO 0.51 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1p88 n GLY 61 N 1.35 1.50 3.64 -0.72 0.00 -0.47 -4.32 105.19 106.18 1p88 n GLY 61 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1p88 n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p88 s VAL 62 N -2.00 5.05 0.00 1.61 1.01 0.31 -4.99 120.40 121.38 1p88 s VAL 62 Ca 0.00 1.04 -0.25 0.00 0.00 0.00 0.00 61.98 62.77 1p88 s VAL 62 Cb 0.00 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 1p88 s VAL 62 CO 0.00 0.11 0.77 -0.44 0.00 0.00 0.00 175.10 175.53 1p88 s SER 63 N 1.32 7.15 0.25 3.32 0.01 -1.26 -4.27 113.70 120.23 1p88 s SER 63 Ca 0.25 1.38 -0.19 0.00 1.31 0.00 0.00 55.95 58.70 1p88 s SER 63 Cb -0.16 -2.46 0.02 0.00 0.21 0.00 0.00 66.02 63.64 1p88 s SER 63 CO 0.09 -0.06 0.64 -0.72 0.41 0.00 0.00 173.24 173.60 1p88 s TYR 64 N 0.35 -0.14 0.05 2.43 1.13 -1.26 0.26 117.35 120.18 1p88 s TYR 64 Ca 0.40 -0.26 0.05 0.00 -1.41 0.00 0.00 57.07 55.85 1p88 s TYR 64 Cb -0.20 0.56 -0.02 0.00 -1.10 0.00 0.00 41.96 41.20 1p88 s TYR 64 CO 0.22 -1.10 -0.15 0.99 -2.51 0.00 0.00 175.55 173.00 1p88 s THR 65 N -3.91 1.16 -0.10 -3.49 2.01 0.57 -4.93 115.64 106.95 1p88 s THR 65 Ca 0.11 -1.13 0.02 0.00 0.31 0.00 0.00 61.69 61.00 1p88 s THR 65 Cb -0.04 -1.07 -0.01 0.00 0.01 0.00 0.00 72.50 71.39 1p88 s THR 65 CO 0.03 -0.07 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.52 1p88 s LEU 66 N -1.37 2.56 0.00 4.42 2.96 -1.26 -0.27 118.68 125.72 1p88 s LEU 66 Ca 0.01 -0.36 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1p88 s LEU 66 Cb -0.09 -1.55 0.00 0.00 0.50 0.00 0.00 46.19 45.06 1p88 s LEU 66 CO 0.02 0.21 0.00 -0.24 -1.32 0.00 0.00 176.35 175.01 1p88 n SER 67 N 3.24 -0.23 -0.07 3.68 2.88 0.20 -4.94 113.62 118.38 1p88 n SER 67 Ca -0.18 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.25 1p88 n SER 67 Cb 0.53 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.84 1p88 n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1p88 n ALA 68 N -2.99 1.43 1.98 -1.46 0.00 -1.26 -4.10 120.51 114.12 1p88 n ALA 68 Ca 0.00 -1.04 0.14 0.00 0.00 0.00 0.00 53.44 52.54 1p88 n ALA 68 Cb 0.00 -0.46 0.82 0.00 0.00 0.00 0.00 19.45 19.81 1p88 n ALA 68 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1p88 n ASP 69 N -2.98 0.00 -3.10 0.00 8.00 -1.26 -4.88 116.55 112.33 1p88 n ASP 69 Ca -0.28 -1.12 -0.23 0.00 0.71 0.00 0.00 54.79 53.87 1p88 n ASP 69 Cb 1.09 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 42.22 1p88 n ASP 69 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1p88 n ARG 70 N -0.94 -4.70 0.00 -1.24 1.74 -1.26 -4.82 116.66 105.44 1p88 n ARG 70 Ca 0.21 0.83 0.00 0.00 -0.77 0.00 0.00 57.85 58.12 1p88 n ARG 70 Cb 0.10 -5.67 0.00 0.00 -1.02 0.00 0.00 32.46 25.86 1p88 n ARG 70 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1p88 n THR 71 N -4.42 0.00 -4.30 0.55 -2.24 -1.26 -4.16 114.28 98.45 1p88 n THR 71 Ca -0.09 -0.14 -0.32 0.00 -2.27 0.00 0.00 64.05 61.23 1p88 n THR 71 Cb 0.61 1.39 -0.16 0.00 -2.10 0.00 0.00 70.33 70.06 1p88 n THR 71 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1p88 s ARG 72 N -0.13 2.75 -0.07 -0.78 0.52 -1.25 0.22 118.95 120.21 1p88 s ARG 72 Ca 0.00 -0.74 0.01 0.00 -0.52 0.00 0.00 55.73 54.48 1p88 s ARG 72 Cb 0.00 -2.35 0.02 0.00 0.52 0.00 0.00 34.95 33.14 1p88 s ARG 72 CO 0.00 -0.14 -0.08 0.00 0.02 0.00 0.00 175.30 175.10 1p88 s GLU 74 N 1.07 3.44 -0.12 0.00 2.12 0.63 0.49 118.70 126.33 1p88 s GLU 74 Ca -0.08 -0.57 0.01 0.00 0.36 0.00 0.00 54.97 54.69 1p88 s GLU 74 Cb -0.14 -2.78 0.02 0.00 0.26 0.00 0.00 34.13 31.48 1p88 s GLU 74 CO -0.01 0.31 -0.12 0.42 -0.54 0.00 0.00 175.26 175.32 1p88 s ILE 75 N 0.16 1.37 -0.63 -3.70 1.01 0.34 0.21 121.20 119.96 1p88 s ILE 75 Ca -0.03 -0.52 -0.26 0.00 0.00 0.00 0.00 60.65 59.83 1p88 s ILE 75 Cb -0.14 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 1p88 s ILE 75 CO 0.03 0.42 2.02 0.27 0.00 0.00 0.00 174.94 177.68 1p88 s ILE 76 N 1.39 3.27 0.27 2.92 -0.00 0.73 -2.45 121.20 127.33 1p88 s ILE 76 Ca 0.01 0.08 -0.17 0.00 -0.00 0.00 0.00 60.65 60.57 1p88 s ILE 76 Cb -0.13 -3.70 -0.12 0.00 -0.00 0.00 0.00 42.46 38.50 1p88 s ILE 76 CO -0.07 -0.68 0.15 0.61 -0.00 0.00 0.00 174.94 174.95 1p88 n GLY 77 N 5.95 -1.88 0.03 6.27 0.00 0.77 -4.02 105.19 112.31 1p88 n GLY 77 Ca 0.27 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.47 1p88 n GLY 77 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1p88 n ASN 78 N 1.71 0.62 0.00 1.61 2.85 0.26 -4.19 115.26 118.11 1p88 n ASN 78 Ca 0.10 -0.12 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 1p88 n ASN 78 Cb 0.27 0.38 0.00 0.00 1.24 0.00 0.00 39.78 41.68 1p88 n ASN 78 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1p88 n GLY 79 N 1.40 0.72 0.00 8.20 0.00 0.32 -4.91 105.19 110.92 1p88 n GLY 79 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1p88 n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 80 N -2.07 0.09 3.68 -0.02 0.00 -0.63 -4.77 105.19 101.47 1p88 n GLY 80 Ca 0.00 -1.11 -0.55 0.00 0.00 0.00 0.00 46.02 44.36 1p88 n GLY 80 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1p88 n PRO 81 N 0.00 1.30 -2.27 1.61 -0.04 -1.26 -4.17 135.00 130.16 1p88 n PRO 81 Ca 0.00 0.47 -0.43 0.00 -0.04 0.00 0.00 63.50 63.50 1p88 n PRO 81 Cb 0.00 -2.17 -0.02 0.00 -0.04 0.00 0.00 33.50 31.27 1p88 n PRO 81 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1p88 s LEU 82 N 2.84 3.61 -0.02 1.53 2.01 -1.26 -4.86 118.68 122.53 1p88 s LEU 82 Ca 0.94 1.00 -0.28 0.00 0.01 0.00 0.00 54.13 55.81 1p88 s LEU 82 Cb -0.99 -3.54 -0.03 0.00 0.01 0.00 0.00 46.19 41.64 1p88 s LEU 82 CO 0.59 -1.45 0.88 -1.38 1.01 0.00 0.00 176.35 176.01 1p88 s HIS 83 N 5.62 3.64 -0.23 0.29 -3.43 -1.26 -4.90 115.29 115.01 1p88 s HIS 83 Ca 0.65 1.55 -0.16 0.00 -0.80 0.00 0.00 55.06 56.31 1p88 s HIS 83 Cb -0.16 -3.01 -0.04 0.00 -1.43 0.00 0.00 32.58 27.94 1p88 s HIS 83 CO 0.32 0.04 0.41 0.00 -2.00 0.00 0.00 174.74 173.51 1p88 s ALA 84 N 0.87 3.57 -0.03 -1.38 0.00 -1.26 -4.53 121.76 118.99 1p88 s ALA 84 Ca 0.47 -0.63 -0.30 0.00 0.00 0.00 0.00 51.96 51.50 1p88 s ALA 84 Cb -0.20 -2.70 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 1p88 s ALA 84 CO 0.25 -0.48 1.40 -1.21 0.00 0.00 0.00 175.76 175.72 1p88 s GLU 85 N 1.71 4.27 0.41 0.00 2.02 -1.26 -4.64 118.70 121.20 1p88 s GLU 85 Ca 0.18 1.93 0.00 0.00 0.02 0.00 0.00 54.97 57.10 1p88 s GLU 85 Cb -0.15 -3.65 0.00 0.00 0.10 0.00 0.00 34.13 30.42 1p88 s GLU 85 CO 0.09 -0.62 0.00 0.41 0.02 0.00 0.00 175.26 175.16 1p88 n GLY 86 N 3.68 -2.30 3.77 -1.39 0.00 -1.26 -4.71 105.19 102.99 1p88 n GLY 86 Ca 0.14 -1.13 -0.38 0.00 0.00 0.00 0.00 46.02 44.65 1p88 n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p88 s ALA 87 N -2.76 3.13 0.28 4.61 0.00 -1.26 -4.65 121.76 121.10 1p88 s ALA 87 Ca 0.00 0.83 0.09 0.00 0.00 0.00 0.00 51.96 52.89 1p88 s ALA 87 Cb 0.00 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 1p88 s ALA 87 CO 0.00 -0.36 0.04 -1.17 0.00 0.00 0.00 175.76 174.26 1p88 s LEU 88 N -2.51 3.25 -0.27 0.00 2.96 0.49 -4.96 118.68 117.63 1p88 s LEU 88 Ca 0.57 -0.64 -0.04 0.00 -0.22 0.00 0.00 54.13 53.80 1p88 s LEU 88 Cb -0.27 -1.76 0.10 0.00 0.50 0.00 0.00 46.19 44.76 1p88 s LEU 88 CO 0.33 -0.06 0.13 -1.61 -1.32 0.00 0.00 176.35 173.83 1p88 s GLU 89 N -3.72 0.18 -0.28 1.98 2.02 -1.26 0.22 118.70 117.85 1p88 s GLU 89 Ca 0.33 -0.46 -0.11 0.00 0.02 0.00 0.00 54.97 54.75 1p88 s GLU 89 Cb -0.06 -1.23 -0.05 0.00 0.10 0.00 0.00 34.13 32.89 1p88 s GLU 89 CO 0.21 -0.97 0.17 -0.51 0.02 0.00 0.00 175.26 174.18 1p88 s LEU 90 N 2.11 3.95 -0.69 1.80 1.02 0.51 -4.89 118.68 122.49 1p88 s LEU 90 Ca 0.08 -0.03 -0.18 0.00 0.02 0.00 0.00 54.13 54.02 1p88 s LEU 90 Cb -0.16 -2.09 0.13 0.00 0.02 0.00 0.00 46.19 44.09 1p88 s LEU 90 CO -0.33 -0.05 0.77 -0.36 0.02 0.00 0.00 176.35 176.40 1p88 s PHE 91 N 1.73 3.18 -0.83 0.29 0.08 -1.26 0.14 117.98 121.32 1p88 s PHE 91 Ca 0.07 -1.26 -0.01 0.00 0.12 0.00 0.00 56.93 55.86 1p88 s PHE 91 Cb -0.16 -4.01 0.35 0.00 -0.57 0.00 0.00 43.02 38.64 1p88 s PHE 91 CO 0.10 -1.25 1.81 1.28 -0.10 0.00 0.00 175.22 177.06 1p88 n LEU 92 N 5.84 6.99 0.00 -0.37 7.99 0.36 -4.83 117.00 132.97 1p88 n LEU 92 Ca 0.00 -5.06 0.00 0.00 -0.01 0.00 0.00 56.01 50.94 1p88 n LEU 92 Cb 0.44 -0.99 0.00 0.00 -0.11 0.00 0.00 43.42 42.76 1p88 n LEU 92 CO 0.52 1.92 0.37 0.61 -1.51 0.00 0.00 177.39 179.30 1p88 n GLY 93 N -0.40 -3.07 0.00 -0.72 0.00 -1.23 -2.25 105.19 97.51 1p88 n GLY 93 Ca 0.49 0.35 0.14 0.00 0.00 0.00 0.00 46.02 47.00 1p88 n GLY 93 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p88 n ASN 94 N -1.61 0.00 -2.37 1.61 3.02 -1.26 -3.85 115.26 110.80 1p88 n ASN 94 Ca 0.00 -0.78 -0.26 0.00 -0.03 0.00 0.00 54.58 53.50 1p88 n ASN 94 Cb 0.00 -0.03 -0.01 0.00 -0.61 0.00 0.00 39.78 39.13 1p88 n ASN 94 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1p88 n ALA 95 N -1.03 6.11 0.15 5.41 0.00 -0.96 -4.54 120.51 125.64 1p88 n ALA 95 Ca 0.20 -2.84 0.19 0.00 0.00 0.00 0.00 53.44 50.99 1p88 n ALA 95 Cb 0.11 -1.90 0.75 0.00 0.00 0.00 0.00 19.45 18.41 1p88 n ALA 95 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1p88 h GLY 96 N 3.30 0.00 1.23 0.00 0.00 -1.68 0.86 103.07 106.78 1p88 h GLY 96 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1p88 h GLY 96 CO 0.97 0.00 -0.76 -0.91 0.00 0.00 0.00 176.54 175.84 1p88 h THR 97 N 0.00 0.00 0.01 4.70 1.35 -1.92 -3.31 112.91 113.74 1p88 h THR 97 Ca 0.15 -0.97 -0.33 0.00 -0.55 0.00 0.00 66.41 64.71 1p88 h THR 97 Cb 1.01 1.58 -0.05 0.00 -1.73 0.00 0.00 68.15 68.96 1p88 h THR 97 CO -0.00 0.00 -2.02 0.00 -0.25 0.00 0.00 175.52 173.25 1p88 n ALA 98 N -2.14 1.43 -0.06 6.62 0.00 0.26 -4.15 120.51 122.47 1p88 n ALA 98 Ca 0.01 -0.96 -0.11 0.00 0.00 0.00 0.00 53.44 52.38 1p88 n ALA 98 Cb 0.54 -0.56 -0.05 0.00 0.00 0.00 0.00 19.45 19.38 1p88 n ALA 98 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1p88 h MET 99 N 0.01 0.31 0.25 0.00 -1.53 -0.62 0.14 114.93 113.49 1p88 h MET 99 Ca -0.41 -0.07 0.01 0.00 -3.44 0.00 0.00 59.70 55.79 1p88 h MET 99 Cb 2.09 -0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 33.07 1p88 h MET 99 CO 0.05 0.44 -0.35 0.00 0.14 0.00 0.00 176.91 177.19 1p88 h ARG 100 N 0.12 -0.64 -0.04 0.39 -0.00 -1.77 0.39 114.38 112.85 1p88 h ARG 100 Ca 0.06 0.04 -0.05 0.00 -0.50 0.00 0.00 59.98 59.53 1p88 h ARG 100 Cb 0.27 0.14 -0.01 0.00 0.00 0.00 0.00 29.97 30.37 1p88 h ARG 100 CO 0.00 -0.42 -0.22 -1.35 0.00 0.00 0.00 179.97 177.98 1p88 h PRO 101 N -0.66 0.06 0.12 0.04 0.11 -1.70 -2.57 132.00 127.40 1p88 h PRO 101 Ca -0.00 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 1p88 h PRO 101 Cb 0.63 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1p88 h PRO 101 CO -0.12 0.27 -0.06 -0.07 -0.21 0.00 0.00 178.00 177.81 1p88 h LEU 102 N 0.05 -0.14 -1.98 2.35 3.38 -0.08 0.41 115.31 119.31 1p88 h LEU 102 Ca 0.01 -0.43 0.15 0.00 0.09 0.00 0.00 57.88 57.70 1p88 h LEU 102 Cb 0.42 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1p88 h LEU 102 CO 0.03 0.43 0.47 0.00 0.09 0.00 0.00 178.44 179.46 1p88 h ALA 103 N -0.10 2.29 0.00 1.53 0.00 -0.21 -0.20 119.26 122.57 1p88 h ALA 103 Ca -0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1p88 h ALA 103 Cb 0.55 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1p88 h ALA 103 CO 0.03 -0.73 -0.65 0.00 0.00 0.00 0.00 179.25 177.91 1p88 h ALA 104 N 1.54 0.11 -0.63 0.00 0.00 -1.34 -3.34 119.26 115.59 1p88 h ALA 104 Ca 0.24 -0.73 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1p88 h ALA 104 Cb 1.17 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 19.36 1p88 h ALA 104 CO -0.00 0.42 0.39 0.00 0.00 0.00 0.00 179.25 180.05 1p88 h ALA 105 N -0.59 1.49 0.00 0.00 0.00 0.34 -2.36 119.26 118.13 1p88 h ALA 105 Ca -0.14 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1p88 h ALA 105 Cb 0.86 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1p88 h ALA 105 CO -0.09 0.45 0.00 1.28 0.00 0.00 0.00 179.25 180.89 1p88 n LEU 106 N -4.41 0.46 -0.98 0.00 4.77 -0.13 -2.92 117.00 113.79 1p88 n LEU 106 Ca 0.06 0.57 0.02 0.00 -0.03 0.00 0.00 56.01 56.63 1p88 n LEU 106 Cb 0.07 -0.45 0.14 0.00 -2.33 0.00 0.00 43.42 40.85 1p88 n LEU 106 CO 0.37 -0.23 0.47 0.00 -1.33 0.00 0.00 177.39 176.66 1p88 n LEU 108 N 0.21 1.06 0.00 0.00 4.77 -1.15 0.73 117.00 122.62 1p88 n LEU 108 Ca 0.10 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1p88 n LEU 108 Cb 0.58 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1p88 n LEU 108 CO 0.11 -0.25 0.00 0.61 -1.33 0.00 0.00 177.39 176.53 1p88 n GLY 109 N 2.18 -1.01 2.99 -0.72 0.00 -1.26 -2.67 105.19 104.69 1p88 n GLY 109 Ca 0.00 -0.12 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 1p88 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p88 s SER 110 N -1.51 -0.21 -0.07 1.61 0.01 -1.26 -1.22 113.70 111.04 1p88 s SER 110 Ca 0.00 -0.57 -0.12 0.00 1.31 0.00 0.00 55.95 56.57 1p88 s SER 110 Cb 0.00 1.34 0.03 0.00 0.21 0.00 0.00 66.02 67.60 1p88 s SER 110 CO 0.00 -0.29 0.29 0.20 0.41 0.00 0.00 173.24 173.85 1p88 s ASN 111 N 2.27 -0.25 -0.58 2.44 -0.87 -1.25 -4.80 114.94 111.90 1p88 s ASN 111 Ca 0.12 0.38 -0.18 0.00 -1.57 0.00 0.00 52.86 51.61 1p88 s ASN 111 Cb -0.11 0.49 0.11 0.00 -0.02 0.00 0.00 41.25 41.72 1p88 s ASN 111 CO -0.20 -0.24 0.66 -1.81 -2.57 0.00 0.00 177.10 172.94 1p88 s ASP 112 N -0.44 6.18 0.06 -1.22 1.01 -1.15 -1.49 116.67 119.63 1p88 s ASP 112 Ca -0.06 -1.52 0.09 0.00 0.71 0.00 0.00 52.55 51.77 1p88 s ASP 112 Cb -0.04 -2.28 -0.03 0.00 1.01 0.00 0.00 42.92 41.58 1p88 s ASP 112 CO 0.02 -1.06 -0.22 -0.63 0.21 0.00 0.00 175.17 173.49 1p88 s ILE 113 N 2.43 2.48 -0.27 0.77 1.09 0.66 0.19 121.20 128.55 1p88 s ILE 113 Ca 0.09 -1.38 -0.01 0.00 -1.10 0.00 0.00 60.65 58.25 1p88 s ILE 113 Cb -0.26 -2.04 0.04 0.00 -1.06 0.00 0.00 42.46 39.15 1p88 s ILE 113 CO 0.05 0.29 -0.04 -0.69 -0.10 0.00 0.00 174.94 174.45 1p88 s VAL 114 N -0.92 2.85 -0.44 2.92 1.01 0.60 0.18 120.40 126.59 1p88 s VAL 114 Ca 0.14 -1.21 -0.13 0.00 0.00 0.00 0.00 61.98 60.77 1p88 s VAL 114 Cb -0.10 -2.53 0.06 0.00 0.00 0.00 0.00 36.38 33.80 1p88 s VAL 114 CO 0.05 0.07 0.33 -0.76 0.00 0.00 0.00 175.10 174.78 1p88 s LEU 115 N 1.28 5.33 0.00 3.92 1.43 0.60 0.19 118.68 131.42 1p88 s LEU 115 Ca -0.03 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.82 1p88 s LEU 115 Cb -0.18 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 43.92 1p88 s LEU 115 CO -0.03 -0.56 0.00 0.41 0.23 0.00 0.00 176.35 176.40 1p88 n THR 116 N 5.11 0.00 -3.91 5.49 -1.04 0.12 -1.64 114.28 118.41 1p88 n THR 116 Ca -0.12 -0.21 -0.02 0.00 -2.04 0.00 0.00 64.05 61.67 1p88 n THR 116 Cb 0.44 -0.01 0.02 0.00 -1.82 0.00 0.00 70.33 68.96 1p88 n THR 116 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1p88 s GLY 117 N -1.30 0.07 0.96 3.41 0.00 -1.26 0.13 107.32 109.33 1p88 s GLY 117 Ca 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 44.72 44.34 1p88 s GLY 117 CO 0.00 3.15 1.11 -0.54 0.00 0.00 0.00 173.10 176.82 1p88 s GLU 118 N -2.12 0.76 0.35 2.90 2.02 -1.26 -4.77 118.70 116.58 1p88 s GLU 118 Ca 0.24 0.41 0.17 0.00 0.02 0.00 0.00 54.97 55.80 1p88 s GLU 118 Cb -0.02 -1.79 1.17 0.00 0.10 0.00 0.00 34.13 33.59 1p88 s GLU 118 CO 0.04 -2.48 1.64 -1.00 0.02 0.00 0.00 175.26 173.48 1p88 h PRO 119 N -1.71 0.23 0.00 0.39 0.13 -2.02 1.10 132.00 130.12 1p88 h PRO 119 Ca -0.53 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.55 1p88 h PRO 119 Cb 1.33 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1p88 h PRO 119 CO 0.60 0.15 -0.17 0.00 -0.23 0.00 0.00 178.00 178.35 1p88 h ARG 120 N 0.24 0.00 -0.46 0.86 3.08 -1.92 -2.34 114.38 113.83 1p88 h ARG 120 Ca 0.76 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.80 1p88 h ARG 120 Cb 1.85 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.88 1p88 h ARG 120 CO -0.63 0.17 0.24 1.98 -1.07 0.00 0.00 179.97 180.66 1p88 h MET 121 N 0.00 0.64 0.00 0.04 4.05 0.11 0.67 114.93 120.44 1p88 h MET 121 Ca -0.00 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1p88 h MET 121 Cb 0.51 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 1p88 h MET 121 CO 0.02 0.48 0.00 0.87 0.23 0.00 0.00 176.91 178.51 1p88 h LYS 122 N 0.64 0.00 -0.13 0.39 6.56 -1.43 0.42 116.57 123.02 1p88 h LYS 122 Ca 0.17 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.76 1p88 h LYS 122 Cb 0.03 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.69 1p88 h LYS 122 CO -0.03 0.00 0.00 0.39 -2.06 0.00 0.00 179.45 177.75 1p88 n GLU 123 N -2.56 1.57 -3.74 3.15 1.02 0.23 -4.47 120.64 115.84 1p88 n GLU 123 Ca -0.01 -0.85 -0.28 0.00 -0.02 0.00 0.00 57.16 55.99 1p88 n GLU 123 Cb 0.09 -1.37 -0.12 0.00 -0.02 0.00 0.00 31.44 30.01 1p88 n GLU 123 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1p88 s ARG 124 N -1.84 1.75 0.60 3.49 0.52 0.15 -5.12 118.95 118.50 1p88 s ARG 124 Ca 0.31 -2.64 -0.19 0.00 -0.52 0.00 0.00 55.73 52.70 1p88 s ARG 124 Cb 0.16 -2.67 -0.04 0.00 0.52 0.00 0.00 34.95 32.93 1p88 s ARG 124 CO 0.25 -1.26 1.19 -0.35 0.02 0.00 0.00 175.30 175.16 1p88 n PRO 125 N 2.70 1.19 0.00 3.54 -0.04 -1.26 -4.24 135.00 136.89 1p88 n PRO 125 Ca 0.17 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 1p88 n PRO 125 Cb 0.37 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 1p88 n PRO 125 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1p88 n ILE 126 N -1.60 0.00 -0.19 0.52 0.13 0.17 -4.78 119.36 113.61 1p88 n ILE 126 Ca 0.14 -0.36 0.15 0.00 -1.10 0.00 0.00 62.75 61.58 1p88 n ILE 126 Cb 0.47 1.21 0.49 0.00 -0.84 0.00 0.00 39.64 40.96 1p88 n ILE 126 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1p88 h GLY 127 N 0.00 0.79 0.86 4.50 0.00 -1.77 -0.29 103.07 107.16 1p88 h GLY 127 Ca 0.00 -0.20 0.04 0.00 0.00 0.00 0.00 47.33 47.17 1p88 h GLY 127 CO 0.00 0.06 0.65 0.45 0.00 0.00 0.00 176.54 177.70 1p88 h HIS 128 N 0.45 1.22 0.01 5.60 3.86 -1.87 -0.67 115.15 123.76 1p88 h HIS 128 Ca 0.39 0.03 -0.26 0.00 -1.16 0.00 0.00 60.37 59.38 1p88 h HIS 128 Cb 0.87 -0.41 0.02 0.00 1.06 0.00 0.00 27.41 28.95 1p88 h HIS 128 CO -0.00 0.70 -1.01 1.25 0.86 0.00 0.00 177.93 179.73 1p88 h LEU 129 N 1.25 0.86 -0.41 2.43 5.85 -1.48 -2.61 115.31 121.20 1p88 h LEU 129 Ca 0.40 -0.75 0.05 0.00 0.84 0.00 0.00 57.88 58.42 1p88 h LEU 129 Cb 0.02 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.73 1p88 h LEU 129 CO -0.13 1.51 0.13 0.58 -0.34 0.00 0.00 178.44 180.18 1p88 h VAL 130 N 0.32 0.85 -0.17 1.05 2.07 -0.55 0.47 116.25 120.29 1p88 h VAL 130 Ca -0.13 -0.10 -0.16 0.00 0.82 0.00 0.00 66.70 67.13 1p88 h VAL 130 Cb 1.67 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1p88 h VAL 130 CO 0.20 0.05 -0.55 0.44 0.02 0.00 0.00 177.57 177.73 1p88 h ASP 131 N 0.28 0.59 -0.52 0.57 5.19 -1.23 1.04 116.42 122.34 1p88 h ASP 131 Ca 0.19 -0.32 -0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1p88 h ASP 131 Cb 0.19 -0.17 -0.03 0.00 0.18 0.00 0.00 39.33 39.51 1p88 h ASP 131 CO -0.21 1.02 0.32 0.00 -3.12 0.00 0.00 179.24 177.25 1p88 h ALA 132 N 0.99 0.66 0.00 3.45 0.00 -0.93 0.70 119.26 124.14 1p88 h ALA 132 Ca 0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1p88 h ALA 132 Cb 1.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1p88 h ALA 132 CO 0.10 0.15 -0.00 -0.07 0.00 0.00 0.00 179.25 179.43 1p88 h LEU 133 N 0.70 -0.01 -2.11 0.00 3.38 0.07 -3.12 115.31 114.22 1p88 h LEU 133 Ca 0.19 -0.83 0.07 0.00 0.09 0.00 0.00 57.88 57.41 1p88 h LEU 133 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1p88 h LEU 133 CO -0.04 0.84 0.22 0.03 0.09 0.00 0.00 178.44 179.58 1p88 h ARG 134 N -0.86 0.00 -0.07 1.13 2.47 0.12 0.27 114.38 117.44 1p88 h ARG 134 Ca -0.00 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.61 1p88 h ARG 134 Cb 0.83 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.14 1p88 h ARG 134 CO 0.00 0.00 -0.45 1.25 0.56 0.00 0.00 179.97 181.33 1p88 h LEU 135 N 0.00 0.18 -0.77 3.04 5.85 0.42 -2.43 115.31 121.60 1p88 h LEU 135 Ca 0.12 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1p88 h LEU 135 Cb 0.56 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1p88 h LEU 135 CO -0.00 0.61 0.00 0.61 -0.34 0.00 0.00 178.44 179.32 1p88 n GLY 136 N -0.13 0.31 0.30 3.75 0.00 0.87 -4.80 105.19 105.49 1p88 n GLY 136 Ca -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1p88 n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 137 N 0.48 0.68 3.78 -0.02 0.00 -0.92 -0.28 105.19 108.90 1p88 n GLY 137 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1p88 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p88 s ALA 138 N -2.15 2.68 -0.50 4.61 0.00 -0.75 -3.30 121.76 122.34 1p88 s ALA 138 Ca 0.00 0.64 -0.14 0.00 0.00 0.00 0.00 51.96 52.45 1p88 s ALA 138 Cb 0.00 -3.31 0.11 0.00 0.00 0.00 0.00 23.12 19.93 1p88 s ALA 138 CO 0.00 -0.82 0.43 0.15 0.00 0.00 0.00 175.76 175.52 1p88 s LYS 139 N -3.62 2.87 -0.06 0.00 1.02 -0.51 -4.20 119.74 115.23 1p88 s LYS 139 Ca 0.69 -1.63 0.01 0.00 0.02 0.00 0.00 55.97 55.05 1p88 s LYS 139 Cb -0.20 -4.16 0.02 0.00 -0.52 0.00 0.00 37.83 32.97 1p88 s LYS 139 CO 0.31 -1.22 -0.05 0.42 -0.92 0.00 0.00 175.35 173.90 1p88 s ILE 140 N 1.55 0.63 -0.02 2.17 1.01 -1.26 -1.54 121.20 123.74 1p88 s ILE 140 Ca 0.04 -0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.61 1p88 s ILE 140 Cb -0.28 -0.66 -0.01 0.00 0.01 0.00 0.00 42.46 41.51 1p88 s ILE 140 CO 0.03 0.26 -0.21 -0.89 0.00 0.00 0.00 174.94 174.14 1p88 s THR 141 N 1.16 1.63 0.06 2.92 2.01 -0.82 -4.96 115.64 117.65 1p88 s THR 141 Ca -0.07 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 60.76 1p88 s THR 141 Cb -0.14 -1.36 -0.05 0.00 0.01 0.00 0.00 72.50 70.96 1p88 s THR 141 CO -0.01 0.46 0.94 -0.31 -0.69 0.00 0.00 174.62 175.01 1p88 s TYR 142 N -0.44 3.74 0.00 4.92 2.02 -1.26 -0.90 117.35 125.43 1p88 s TYR 142 Ca 0.07 1.72 0.00 0.00 -0.37 0.00 0.00 57.07 58.49 1p88 s TYR 142 Cb -0.08 -3.05 0.00 0.00 -0.40 0.00 0.00 41.96 38.42 1p88 s TYR 142 CO -0.00 0.13 0.00 1.28 -1.57 0.00 0.00 175.55 175.39 1p88 n LEU 143 N 3.22 0.00 0.00 -1.29 4.32 -1.26 -4.91 117.00 117.08 1p88 n LEU 143 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.02 1p88 n LEU 143 Cb 0.50 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.30 1p88 n LEU 143 CO 0.51 0.00 0.20 -0.62 -1.22 0.00 0.00 177.39 176.26 1p88 n GLU 144 N 0.00 0.00 -4.25 3.23 1.02 -1.26 -4.83 120.64 114.55 1p88 n GLU 144 Ca 0.00 0.06 -0.29 0.00 -0.02 0.00 0.00 57.16 56.91 1p88 n GLU 144 Cb 0.00 -0.91 -0.10 0.00 -0.02 0.00 0.00 31.44 30.41 1p88 n GLU 144 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1p88 s GLN 145 N -0.81 2.07 0.15 3.49 -0.21 -1.26 -5.09 119.66 118.00 1p88 s GLN 145 Ca 0.00 -1.10 -0.31 0.00 0.02 0.00 0.00 55.36 53.97 1p88 s GLN 145 Cb 0.00 -2.25 -0.09 0.00 1.00 0.00 0.00 33.01 31.67 1p88 s GLN 145 CO 0.00 0.49 1.42 -1.21 -2.12 0.00 0.00 175.29 173.86 1p88 s GLU 146 N -2.36 4.30 -0.71 2.91 2.02 -1.26 -2.08 118.70 121.53 1p88 s GLU 146 Ca 0.22 2.15 0.00 0.00 0.02 0.00 0.00 54.97 57.36 1p88 s GLU 146 Cb -0.10 -3.21 0.00 0.00 0.10 0.00 0.00 34.13 30.91 1p88 s GLU 146 CO 0.14 -0.45 0.00 0.09 0.02 0.00 0.00 175.26 175.06 1p88 n ASN 147 N 3.65 -4.08 -4.78 -0.19 4.13 -1.26 -4.87 115.26 107.86 1p88 n ASN 147 Ca 0.11 0.16 -0.23 0.00 1.68 0.00 0.00 54.58 56.30 1p88 n ASN 147 Cb 0.41 -2.16 -0.06 0.00 -1.54 0.00 0.00 39.78 36.43 1p88 n ASN 147 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1p88 s TYR 148 N -2.16 2.68 0.05 3.10 1.51 -0.88 0.41 117.35 122.06 1p88 s TYR 148 Ca 0.00 -0.49 -0.10 0.00 -1.01 0.00 0.00 57.07 55.47 1p88 s TYR 148 Cb 0.00 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.92 1p88 s TYR 148 CO 0.00 0.16 0.66 -2.30 -1.11 0.00 0.00 175.55 172.96 1p88 n PRO 149 N -1.29 -0.15 -1.62 -1.71 -0.02 -1.26 -4.42 135.00 124.54 1p88 n PRO 149 Ca -0.01 0.65 -0.39 0.00 -2.02 0.00 0.00 63.50 61.73 1p88 n PRO 149 Cb 0.63 -0.96 0.04 0.00 -0.02 0.00 0.00 33.50 33.19 1p88 n PRO 149 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1p88 n PRO 150 N -3.94 1.13 -3.67 0.52 -0.02 -1.08 -4.32 135.00 123.62 1p88 n PRO 150 Ca 0.01 0.42 -0.12 0.00 -2.02 0.00 0.00 63.50 61.79 1p88 n PRO 150 Cb 0.09 -2.14 -0.08 0.00 -0.02 0.00 0.00 33.50 31.35 1p88 n PRO 150 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1p88 s LEU 151 N -1.44 -0.42 -0.44 2.45 1.43 -0.65 -4.04 118.68 115.56 1p88 s LEU 151 Ca 0.70 1.24 -0.09 0.00 -1.03 0.00 0.00 54.13 54.95 1p88 s LEU 151 Cb -0.47 2.05 0.10 0.00 0.03 0.00 0.00 46.19 47.90 1p88 s LEU 151 CO 0.51 -0.21 0.29 -0.13 0.23 0.00 0.00 176.35 177.04 1p88 s ARG 152 N 0.74 2.53 0.14 1.70 0.52 -0.08 -0.29 118.95 124.21 1p88 s ARG 152 Ca -0.03 -1.60 -0.13 0.00 -0.52 0.00 0.00 55.73 53.45 1p88 s ARG 152 Cb -0.05 -3.83 -0.07 0.00 0.52 0.00 0.00 34.95 31.52 1p88 s ARG 152 CO -0.05 -1.05 0.52 -0.51 0.02 0.00 0.00 175.30 174.22 1p88 s LEU 153 N 1.39 4.32 0.00 2.53 1.43 0.47 -1.94 118.68 126.89 1p88 s LEU 153 Ca 0.04 1.00 0.08 0.00 -1.03 0.00 0.00 54.13 54.23 1p88 s LEU 153 Cb -0.24 -3.25 0.13 0.00 0.03 0.00 0.00 46.19 42.86 1p88 s LEU 153 CO 0.01 0.10 0.96 0.00 0.23 0.00 0.00 176.35 177.65 1p88 n GLN 154 N 0.74 0.00 -0.33 1.70 6.02 -0.55 -0.25 117.38 124.70 1p88 n GLN 154 Ca -0.05 -1.12 0.05 0.00 -0.01 0.00 0.00 57.00 55.87 1p88 n GLN 154 Cb 0.52 -0.08 -0.01 0.00 1.02 0.00 0.00 30.24 31.69 1p88 n GLN 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1p88 n GLY 155 N 0.15 -0.84 0.00 1.08 0.00 -1.22 -3.83 105.19 100.53 1p88 n GLY 155 Ca -0.03 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1p88 n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 156 N -1.03 1.38 3.69 -0.02 0.00 -0.35 -1.42 105.19 107.43 1p88 n GLY 156 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1p88 n GLY 156 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1p88 s PHE 157 N -2.00 2.12 -0.02 1.61 5.36 0.22 -3.77 117.98 121.50 1p88 s PHE 157 Ca 0.00 0.01 0.02 0.00 -0.96 0.00 0.00 56.93 55.99 1p88 s PHE 157 Cb 0.00 -4.14 -0.02 0.00 -0.34 0.00 0.00 43.02 38.52 1p88 s PHE 157 CO 0.00 -4.72 0.01 0.25 -1.46 0.00 0.00 175.22 169.30 1p88 n THR 158 N 4.82 0.11 0.00 0.12 -2.24 0.06 -4.54 114.28 112.61 1p88 n THR 158 Ca 0.18 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1p88 n THR 158 Cb 0.39 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.73 1p88 n THR 158 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p88 n GLY 159 N 2.87 0.83 0.00 3.38 0.00 0.61 0.17 105.19 113.04 1p88 n GLY 159 Ca -0.03 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1p88 n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 160 N 0.00 2.52 3.52 -0.02 0.00 -0.81 -4.14 105.19 106.26 1p88 n GLY 160 Ca 0.00 -1.82 -0.57 0.00 0.00 0.00 0.00 46.02 43.63 1p88 n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p88 n ASN 161 N 0.00 1.87 -4.42 1.61 3.02 -1.26 -3.64 115.26 112.43 1p88 n ASN 161 Ca 0.00 0.77 -0.36 0.00 -0.03 0.00 0.00 54.58 54.97 1p88 n ASN 161 Cb 0.00 -1.11 -0.13 0.00 -0.61 0.00 0.00 39.78 37.93 1p88 n ASN 161 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1p88 s VAL 162 N 5.33 4.04 -0.26 2.41 1.01 0.48 -4.77 120.40 128.63 1p88 s VAL 162 Ca 1.07 -0.27 -0.19 0.00 0.00 0.00 0.00 61.98 62.60 1p88 s VAL 162 Cb -1.12 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1p88 s VAL 162 CO 0.61 0.39 0.55 -1.81 0.00 0.00 0.00 175.10 174.84 1p88 s ASP 163 N 1.37 6.47 -0.08 3.32 1.01 -1.26 -1.20 116.67 126.30 1p88 s ASP 163 Ca 0.05 0.55 -0.00 0.00 0.71 0.00 0.00 52.55 53.85 1p88 s ASP 163 Cb -0.15 -2.30 0.02 0.00 1.01 0.00 0.00 42.92 41.51 1p88 s ASP 163 CO 0.02 -0.33 -0.05 -0.69 0.21 0.00 0.00 175.17 174.33 1p88 s VAL 164 N 2.38 0.74 0.34 -1.27 1.01 -0.72 -4.49 120.40 118.39 1p88 s VAL 164 Ca 0.23 -0.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.79 1p88 s VAL 164 Cb -0.16 -0.79 -0.12 0.00 0.00 0.00 0.00 36.38 35.31 1p88 s VAL 164 CO 0.09 0.31 1.36 -0.67 0.00 0.00 0.00 175.10 176.19 1p88 n ASP 165 N 4.78 3.04 0.08 3.32 -0.08 -1.26 -2.66 116.55 123.78 1p88 n ASP 165 Ca -0.13 1.21 -0.13 0.00 -1.51 0.00 0.00 54.79 54.22 1p88 n ASP 165 Cb 0.50 -1.52 -0.08 0.00 2.34 0.00 0.00 41.12 42.37 1p88 n ASP 165 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1p88 h GLY 166 N 2.85 -0.14 -7.29 0.27 0.00 -1.30 -3.36 103.07 94.10 1p88 h GLY 166 Ca -0.47 0.05 -0.65 0.00 0.00 0.00 0.00 47.33 46.27 1p88 h GLY 166 CO 0.64 -0.05 1.13 -0.56 0.00 0.00 0.00 176.54 177.70 1p88 s SER 167 N -5.12 6.55 0.00 0.19 0.01 -1.21 0.48 113.70 114.60 1p88 s SER 167 Ca -0.14 -1.72 0.00 0.00 1.31 0.00 0.00 55.95 55.40 1p88 s SER 167 Cb 0.05 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1p88 s SER 167 CO 0.65 -1.29 0.00 0.52 0.41 0.00 0.00 173.24 173.53 1p88 n VAL 168 N 6.16 0.00 -3.66 3.43 0.31 -1.26 -4.99 118.33 118.32 1p88 n VAL 168 Ca 0.27 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.53 1p88 n VAL 168 Cb 0.50 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.35 1p88 n VAL 168 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1p88 s SER 169 N 1.47 -0.83 0.62 4.52 0.01 -1.26 -4.97 113.70 113.25 1p88 s SER 169 Ca 0.00 1.34 0.31 0.00 1.31 0.00 0.00 55.95 58.91 1p88 s SER 169 Cb 0.00 1.37 1.73 0.00 0.21 0.00 0.00 66.02 69.33 1p88 s SER 169 CO 0.00 -0.23 2.07 0.77 0.41 0.00 0.00 173.24 176.27 1p88 h SER 170 N 7.26 0.00 1.12 2.44 4.64 -1.90 0.28 113.55 127.38 1p88 h SER 170 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1p88 h SER 170 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1p88 h SER 170 CO 0.18 0.00 -0.10 0.00 -0.87 0.00 0.00 176.83 176.04 1p88 n GLN 171 N -3.51 0.12 0.04 4.77 0.00 -1.26 -2.01 117.38 115.53 1p88 n GLN 171 Ca 0.01 0.09 -0.08 0.00 0.00 0.00 0.00 57.00 57.02 1p88 n GLN 171 Cb 0.35 -1.63 -0.05 0.00 0.00 0.00 0.00 30.24 28.90 1p88 n GLN 171 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 1p88 h PHE 172 N 0.00 -0.20 -0.55 2.61 -1.00 -0.80 -0.59 116.94 116.41 1p88 h PHE 172 Ca 0.00 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1p88 h PHE 172 Cb 0.61 0.07 -0.03 0.00 3.61 0.00 0.00 35.95 40.21 1p88 h PHE 172 CO 0.00 0.13 0.27 -0.07 -1.61 0.00 0.00 178.31 177.03 1p88 h LEU 173 N -0.98 0.72 -0.92 1.54 3.38 -1.65 -1.57 115.31 115.83 1p88 h LEU 173 Ca -0.02 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 57.91 1p88 h LEU 173 Cb 0.42 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.91 1p88 h LEU 173 CO 0.04 0.64 0.57 0.74 0.09 0.00 0.00 178.44 180.52 1p88 h THR 174 N 0.75 0.99 -0.83 0.22 2.02 -1.50 0.12 112.91 114.67 1p88 h THR 174 Ca 0.19 -0.34 0.06 0.00 0.77 0.00 0.00 66.41 67.09 1p88 h THR 174 Cb 0.11 -0.07 -0.05 0.00 -1.74 0.00 0.00 68.15 66.39 1p88 h THR 174 CO -0.03 0.18 0.55 0.00 0.37 0.00 0.00 175.52 176.59 1p88 h ALA 175 N 1.46 1.56 0.03 6.16 0.00 -0.11 -0.83 119.26 127.54 1p88 h ALA 175 Ca 0.42 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 55.06 1p88 h ALA 175 Cb 0.30 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1p88 h ALA 175 CO -0.21 0.33 -1.04 -0.07 0.00 0.00 0.00 179.25 178.26 1p88 h LEU 176 N 0.95 0.64 -1.56 0.00 3.38 -0.63 -2.41 115.31 115.69 1p88 h LEU 176 Ca 0.35 -0.54 0.01 0.00 0.09 0.00 0.00 57.88 57.79 1p88 h LEU 176 Cb 0.17 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1p88 h LEU 176 CO -0.12 1.35 0.31 -0.07 0.09 0.00 0.00 178.44 180.01 1p88 h LEU 177 N 0.25 0.51 0.18 1.67 4.07 0.14 0.91 115.31 123.05 1p88 h LEU 177 Ca -0.11 -0.01 -0.27 0.00 0.08 0.00 0.00 57.88 57.57 1p88 h LEU 177 Cb 1.69 -0.13 0.02 0.00 1.08 0.00 0.00 40.66 43.33 1p88 h LEU 177 CO 0.19 0.37 -1.26 0.24 -1.08 0.00 0.00 178.44 176.89 1p88 h MET 178 N 0.60 0.38 -0.05 1.13 2.86 -1.18 -3.34 114.93 115.33 1p88 h MET 178 Ca 0.18 -0.65 -0.23 0.00 -2.06 0.00 0.00 59.70 56.94 1p88 h MET 178 Cb -0.01 0.24 0.02 0.00 0.06 0.00 0.00 31.60 31.91 1p88 h MET 178 CO -0.04 1.31 -0.88 1.15 1.06 0.00 0.00 176.91 179.51 1p88 h THR 179 N -0.13 1.30 -0.98 2.22 2.02 -1.17 -3.36 112.91 112.80 1p88 h THR 179 Ca -0.24 -2.12 0.01 0.00 0.77 0.00 0.00 66.41 64.84 1p88 h THR 179 Cb 1.89 2.28 -0.05 0.00 -1.74 0.00 0.00 68.15 70.54 1p88 h THR 179 CO 0.18 0.65 0.65 0.00 0.37 0.00 0.00 175.52 177.37 1p88 h ALA 180 N 0.44 1.30 0.00 6.16 0.00 0.69 -2.68 119.26 125.18 1p88 h ALA 180 Ca -0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1p88 h ALA 180 Cb 1.53 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1p88 h ALA 180 CO 0.18 0.64 -0.31 -1.00 0.00 0.00 0.00 179.25 178.76 1p88 h PRO 181 N 1.33 0.00 -0.01 0.00 0.13 -1.70 -0.16 132.00 131.58 1p88 h PRO 181 Ca 0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.49 1p88 h PRO 181 Cb -0.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 30.99 1p88 h PRO 181 CO -0.08 0.31 0.00 1.28 -0.23 0.00 0.00 178.00 179.28 1p88 n LEU 182 N -3.79 0.77 -4.75 1.56 4.77 -1.03 0.20 117.00 114.72 1p88 n LEU 182 Ca -0.01 -0.26 -0.40 0.00 -0.03 0.00 0.00 56.01 55.30 1p88 n LEU 182 Cb 0.40 -0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 1p88 n LEU 182 CO 0.36 0.13 0.58 0.00 -1.33 0.00 0.00 177.39 177.13 1p88 s ALA 183 N -1.99 3.34 0.52 -1.18 0.00 -0.07 -4.33 121.76 118.05 1p88 s ALA 183 Ca 0.42 0.49 0.28 0.00 0.00 0.00 0.00 51.96 53.14 1p88 s ALA 183 Cb 0.21 -3.13 1.40 0.00 0.00 0.00 0.00 23.12 21.60 1p88 s ALA 183 CO 0.34 0.13 1.92 -1.00 0.00 0.00 0.00 175.76 177.15 1p88 h PRO 184 N 4.88 0.06 -6.20 0.00 0.13 -1.69 2.38 132.00 131.56 1p88 h PRO 184 Ca -0.45 -0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.99 1p88 h PRO 184 Cb 1.21 -0.01 -0.25 0.00 0.13 0.00 0.00 31.00 32.08 1p88 h PRO 184 CO 0.69 0.04 -0.78 -2.00 -0.23 0.00 0.00 178.00 175.72 1p88 s GLU 185 N -5.05 2.59 0.40 0.86 2.56 0.44 -4.18 118.70 116.32 1p88 s GLU 185 Ca -0.05 -0.72 -0.26 0.00 0.00 0.00 0.00 54.97 53.94 1p88 s GLU 185 Cb 0.21 -2.38 -0.11 0.00 2.00 0.00 0.00 34.13 33.86 1p88 s GLU 185 CO 0.76 0.56 1.19 -3.47 -0.56 0.00 0.00 175.26 173.74 1p88 n ASP 186 N 2.50 2.17 -4.34 -1.70 -0.08 -1.26 -3.91 116.55 109.92 1p88 n ASP 186 Ca -0.17 1.11 -0.30 0.00 -1.51 0.00 0.00 54.79 53.92 1p88 n ASP 186 Cb 0.52 -1.45 -0.15 0.00 2.34 0.00 0.00 41.12 42.39 1p88 n ASP 186 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1p88 s THR 187 N -1.19 2.11 -0.16 5.18 2.01 0.16 -1.92 115.64 121.83 1p88 s THR 187 Ca 0.61 -1.38 0.00 0.00 0.31 0.00 0.00 61.69 61.23 1p88 s THR 187 Cb -0.54 -1.81 0.03 0.00 0.01 0.00 0.00 72.50 70.19 1p88 s THR 187 CO 0.58 0.35 -0.11 -0.69 -0.69 0.00 0.00 174.62 174.07 1p88 s VAL 188 N -0.81 1.45 -0.30 3.82 1.01 -1.24 -0.75 120.40 123.59 1p88 s VAL 188 Ca 0.11 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 1p88 s VAL 188 Cb -0.10 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1p88 s VAL 188 CO 0.02 0.33 0.19 -0.63 0.00 0.00 0.00 175.10 175.01 1p88 s ILE 189 N 1.51 5.11 -0.25 2.22 1.09 0.41 0.18 121.20 131.48 1p88 s ILE 189 Ca 0.03 -0.07 -0.11 0.00 -1.10 0.00 0.00 60.65 59.40 1p88 s ILE 189 Cb -0.14 -3.52 -0.05 0.00 -1.06 0.00 0.00 42.46 37.69 1p88 s ILE 189 CO -0.09 0.15 0.18 -0.60 -0.10 0.00 0.00 174.94 174.47 1p88 s ARG 190 N 1.71 4.04 -0.20 2.79 3.52 -0.34 0.16 118.95 130.64 1p88 s ARG 190 Ca 0.06 -0.27 -0.16 0.00 -0.13 0.00 0.00 55.73 55.23 1p88 s ARG 190 Cb -0.17 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.62 1p88 s ARG 190 CO 0.10 -0.01 0.43 0.42 -0.81 0.00 0.00 175.30 175.42 1p88 s ILE 191 N 1.26 5.18 -0.80 4.11 1.09 -1.25 -1.75 121.20 129.04 1p88 s ILE 191 Ca 0.08 0.77 -0.24 0.00 -1.10 0.00 0.00 60.65 60.15 1p88 s ILE 191 Cb -0.14 -3.76 0.05 0.00 -1.06 0.00 0.00 42.46 37.56 1p88 s ILE 191 CO 0.06 0.23 1.22 -0.54 -0.10 0.00 0.00 174.94 175.81 1p88 s LYS 192 N 1.39 3.29 0.00 2.79 1.02 -1.09 -4.68 119.74 122.47 1p88 s LYS 192 Ca 0.20 -0.73 0.00 0.00 0.02 0.00 0.00 55.97 55.46 1p88 s LYS 192 Cb -0.15 -4.51 0.00 0.00 -0.52 0.00 0.00 37.83 32.65 1p88 s LYS 192 CO 0.08 -2.04 0.00 0.41 -0.92 0.00 0.00 175.35 172.89 1p88 n GLY 193 N 5.69 0.95 3.30 -3.33 0.00 -1.26 -1.01 105.19 109.54 1p88 n GLY 193 Ca 0.10 -1.39 -0.33 0.00 0.00 0.00 0.00 46.02 44.40 1p88 n GLY 193 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p88 s ASP 194 N -4.00 3.66 0.35 1.61 1.11 -1.26 -4.84 116.67 113.30 1p88 s ASP 194 Ca 0.00 -0.43 -0.23 0.00 0.18 0.00 0.00 52.55 52.07 1p88 s ASP 194 Cb 0.00 -1.54 -0.15 0.00 1.07 0.00 0.00 42.92 42.29 1p88 s ASP 194 CO 0.00 0.15 0.31 0.18 1.18 0.00 0.00 175.17 176.98 1p88 n LEU 195 N 3.64 -1.81 -0.00 1.23 4.77 -1.24 -3.28 117.00 120.30 1p88 n LEU 195 Ca -0.19 0.92 -0.10 0.00 -0.03 0.00 0.00 56.01 56.61 1p88 n LEU 195 Cb 0.53 -0.95 0.04 0.00 -2.33 0.00 0.00 43.42 40.70 1p88 n LEU 195 CO 0.29 -3.58 0.45 1.62 -1.33 0.00 0.00 177.39 174.85 1p88 h VAL 196 N 0.62 1.32 0.00 4.08 3.04 -0.29 -3.41 116.25 121.61 1p88 h VAL 196 Ca -0.35 -1.83 -0.23 0.00 -1.01 0.00 0.00 66.70 63.27 1p88 h VAL 196 Cb 1.43 1.80 -0.15 0.00 -2.01 0.00 0.00 31.29 32.37 1p88 h VAL 196 CO 0.51 0.57 -0.43 -0.24 -1.01 0.00 0.00 177.57 176.97 1p88 n SER 197 N -3.95 -2.43 -0.33 3.17 2.88 -1.26 -4.89 113.62 106.81 1p88 n SER 197 Ca -0.04 -3.54 0.11 0.00 -1.33 0.00 0.00 58.87 54.08 1p88 n SER 197 Cb 0.62 1.88 0.23 0.00 -0.75 0.00 0.00 64.21 66.20 1p88 n SER 197 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1p88 n LYS 198 N 0.66 -0.08 -0.37 -1.46 0.00 -1.26 0.81 118.16 116.46 1p88 n LYS 198 Ca 0.06 1.44 0.32 0.00 0.00 0.00 0.00 58.31 60.13 1p88 n LYS 198 Cb 0.69 -2.24 0.64 0.00 0.00 0.00 0.00 35.03 34.12 1p88 n LYS 198 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 1p88 h PRO 199 N 0.00 0.16 -0.31 1.64 0.13 -1.98 1.04 132.00 132.68 1p88 h PRO 199 Ca 0.54 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 65.59 1p88 h PRO 199 Cb 1.03 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 1p88 h PRO 199 CO -0.92 0.11 -0.06 -0.92 -0.23 0.00 0.00 178.00 175.98 1p88 h TYR 200 N 0.17 0.66 -0.99 1.56 5.03 0.01 -2.71 116.97 120.69 1p88 h TYR 200 Ca 0.65 -0.14 0.08 0.00 2.58 0.00 0.00 58.73 61.90 1p88 h TYR 200 Cb 2.14 -0.16 -0.07 0.00 1.55 0.00 0.00 36.73 40.18 1p88 h TYR 200 CO -0.00 0.77 0.64 0.82 -1.32 0.00 0.00 178.16 179.06 1p88 h ILE 201 N 0.36 1.05 -0.54 1.81 1.08 0.11 -0.04 117.51 121.34 1p88 h ILE 201 Ca 0.08 -0.38 0.03 0.00 -0.39 0.00 0.00 64.86 64.20 1p88 h ILE 201 Cb 0.55 -0.17 -0.04 0.00 -3.07 0.00 0.00 36.82 34.09 1p88 h ILE 201 CO 0.03 0.20 0.31 0.44 -0.69 0.00 0.00 178.15 178.44 1p88 h ASP 202 N 1.12 0.48 0.04 1.72 5.19 -0.81 0.13 116.42 124.29 1p88 h ASP 202 Ca 0.44 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.87 1p88 h ASP 202 Cb 0.24 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.67 1p88 h ASP 202 CO -0.19 0.33 -0.02 0.40 -3.12 0.00 0.00 179.24 176.64 1p88 h ILE 203 N 0.60 1.01 -0.23 0.35 2.04 -1.02 -0.28 117.51 119.97 1p88 h ILE 203 Ca 0.23 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 66.00 1p88 h ILE 203 Cb 0.07 1.11 -0.06 0.00 -0.74 0.00 0.00 36.82 37.20 1p88 h ILE 203 CO -0.12 0.04 -0.16 0.74 0.00 0.00 0.00 178.15 178.65 1p88 h THR 204 N -0.12 0.55 0.00 -0.27 2.02 -0.40 2.16 112.91 116.86 1p88 h THR 204 Ca -0.01 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.10 1p88 h THR 204 Cb 0.10 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1p88 h THR 204 CO 0.01 0.00 -0.37 -0.07 0.37 0.00 0.00 175.52 175.46 1p88 h LEU 205 N -0.14 0.00 0.05 2.58 3.38 -0.66 1.27 115.31 121.78 1p88 h LEU 205 Ca 0.13 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1p88 h LEU 205 Cb 0.34 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.10 1p88 h LEU 205 CO -0.32 0.37 -0.44 -1.13 0.09 0.00 0.00 178.44 177.00 1p88 h ASN 206 N 0.00 0.31 0.50 -0.43 -0.73 0.15 -0.03 115.58 115.35 1p88 h ASN 206 Ca -0.00 -0.88 -0.10 0.00 1.87 0.00 0.00 56.30 57.19 1p88 h ASN 206 Cb 0.68 -0.10 -0.01 0.00 0.27 0.00 0.00 38.32 39.16 1p88 h ASN 206 CO 0.05 1.16 -0.47 0.25 -0.37 0.00 0.00 177.43 178.05 1p88 h LEU 207 N -0.50 0.00 -0.23 0.34 5.85 0.36 -2.02 115.31 119.12 1p88 h LEU 207 Ca -0.07 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.44 1p88 h LEU 207 Cb 1.27 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.29 1p88 h LEU 207 CO 0.08 0.47 -0.91 0.24 -0.34 0.00 0.00 178.44 177.98 1p88 h MET 208 N 0.00 0.30 -0.47 1.25 2.86 0.16 -3.12 114.93 115.91 1p88 h MET 208 Ca -0.00 -0.32 -0.05 0.00 -2.06 0.00 0.00 59.70 57.26 1p88 h MET 208 Cb 0.85 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.58 1p88 h MET 208 CO 0.06 1.03 0.10 0.87 1.06 0.00 0.00 176.91 180.03 1p88 h LYS 209 N 0.17 0.71 0.00 1.72 1.57 -0.49 -0.58 116.57 119.67 1p88 h LYS 209 Ca -0.06 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 1p88 h LYS 209 Cb 1.54 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.74 1p88 h LYS 209 CO 0.15 0.66 -0.09 0.00 -0.57 0.00 0.00 179.45 179.59 1p88 h THR 210 N 0.69 0.80 -0.00 -0.16 1.03 -1.31 -0.20 112.91 113.75 1p88 h THR 210 Ca 0.15 -0.36 0.00 0.00 -0.01 0.00 0.00 66.41 66.19 1p88 h THR 210 Cb 0.28 1.21 0.00 0.00 -1.07 0.00 0.00 68.15 68.57 1p88 h THR 210 CO -0.00 0.09 -0.12 0.49 -0.01 0.00 0.00 175.52 175.97 1p88 n PHE 211 N -4.03 0.00 0.00 0.00 3.72 -0.25 -4.13 117.46 112.77 1p88 n PHE 211 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1p88 n PHE 211 Cb 0.18 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.44 1p88 n PHE 211 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1p88 n GLY 212 N 1.36 1.13 3.31 1.37 0.00 -0.09 0.11 105.19 112.38 1p88 n GLY 212 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 1p88 n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p88 s VAL 213 N -2.00 1.88 -0.04 1.61 -7.23 -1.09 -4.72 120.40 108.82 1p88 s VAL 213 Ca 0.00 -1.53 0.03 0.00 -1.81 0.00 0.00 61.98 58.66 1p88 s VAL 213 Cb 0.00 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.27 1p88 s VAL 213 CO 0.00 0.05 -0.11 -1.61 -0.31 0.00 0.00 175.10 173.12 1p88 s GLU 214 N -1.78 1.30 0.10 4.82 2.02 -1.26 -2.51 118.70 121.39 1p88 s GLU 214 Ca 0.09 -0.39 0.09 0.00 0.02 0.00 0.00 54.97 54.78 1p88 s GLU 214 Cb -0.10 -1.16 -0.04 0.00 0.10 0.00 0.00 34.13 32.94 1p88 s GLU 214 CO 0.04 0.12 -0.21 0.42 0.02 0.00 0.00 175.26 175.65 1p88 s ILE 215 N 0.27 2.63 -0.30 -1.63 -1.09 -1.26 -4.42 121.20 115.40 1p88 s ILE 215 Ca -0.06 -1.50 -0.09 0.00 -2.23 0.00 0.00 60.65 56.77 1p88 s ILE 215 Cb -0.11 -2.16 -0.01 0.00 -1.58 0.00 0.00 42.46 38.59 1p88 s ILE 215 CO 0.01 0.16 0.13 -0.70 -1.23 0.00 0.00 174.94 173.32 1p88 s GLU 216 N -1.92 3.41 0.41 2.79 2.12 0.26 -4.93 118.70 120.84 1p88 s GLU 216 Ca 0.16 -0.66 -0.18 0.00 0.36 0.00 0.00 54.97 54.65 1p88 s GLU 216 Cb -0.10 -3.50 -0.10 0.00 0.26 0.00 0.00 34.13 30.69 1p88 s GLU 216 CO 0.08 -0.36 0.88 1.21 -0.54 0.00 0.00 175.26 176.52 1p88 s ASN 217 N 1.61 6.81 0.00 -1.70 2.47 -1.26 0.12 114.94 122.99 1p88 s ASN 217 Ca 0.05 1.51 0.00 0.00 0.42 0.00 0.00 52.86 54.84 1p88 s ASN 217 Cb -0.17 -2.47 0.00 0.00 -1.45 0.00 0.00 41.25 37.16 1p88 s ASN 217 CO 0.06 -0.35 0.00 1.67 -3.72 0.00 0.00 177.10 174.76 1p88 n GLN 218 N -0.75 3.83 -1.12 0.43 7.27 0.24 -4.89 117.38 122.38 1p88 n GLN 218 Ca 0.06 0.00 -0.37 0.00 0.07 0.00 0.00 57.00 56.75 1p88 n GLN 218 Cb 0.54 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.15 1p88 n GLN 218 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1p88 n HIS 219 N 0.00 1.98 -2.65 3.69 8.25 -1.26 -4.17 115.22 121.06 1p88 n HIS 219 Ca 0.00 -2.06 -0.19 0.00 -0.26 0.00 0.00 57.72 55.21 1p88 n HIS 219 Cb 0.00 -1.84 0.00 0.00 1.12 0.00 0.00 29.99 29.27 1p88 n HIS 219 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1p88 n TYR 220 N 6.25 -1.41 0.00 4.41 9.36 -1.26 -4.77 117.16 129.74 1p88 n TYR 220 Ca 0.50 0.17 0.00 0.00 3.32 0.00 0.00 57.90 61.88 1p88 n TYR 220 Cb 0.32 -3.69 0.00 0.00 -0.63 0.00 0.00 39.34 35.34 1p88 n TYR 220 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1p88 n GLN 221 N -3.27 0.00 0.00 2.98 10.64 -1.26 -3.73 117.38 122.74 1p88 n GLN 221 Ca -0.17 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.00 1p88 n GLN 221 Cb 0.64 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.02 1p88 n GLN 221 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 1p88 n GLN 222 N 0.00 0.00 -4.84 2.61 7.27 -1.16 -3.57 117.38 117.69 1p88 n GLN 222 Ca 0.00 0.00 -0.28 0.00 0.07 0.00 0.00 57.00 56.79 1p88 n GLN 222 Cb 0.00 0.00 -0.17 0.00 2.41 0.00 0.00 30.24 32.48 1p88 n GLN 222 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1p88 s PHE 223 N 0.00 1.91 -0.26 3.69 0.40 0.43 0.79 117.98 124.94 1p88 s PHE 223 Ca 0.00 -0.75 -0.02 0.00 -0.60 0.00 0.00 56.93 55.56 1p88 s PHE 223 Cb 0.00 -1.33 0.03 0.00 0.51 0.00 0.00 43.02 42.23 1p88 s PHE 223 CO 0.00 -0.34 -0.04 0.08 0.70 0.00 0.00 175.22 175.62 1p88 s VAL 224 N 0.54 2.92 -0.14 -0.44 1.01 0.31 -0.45 120.40 124.15 1p88 s VAL 224 Ca -0.16 -1.10 0.02 0.00 0.00 0.00 0.00 61.98 60.74 1p88 s VAL 224 Cb -0.17 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.69 1p88 s VAL 224 CO 0.06 0.12 -0.21 0.54 0.00 0.00 0.00 175.10 175.61 1p88 s VAL 225 N 1.31 2.02 -0.07 2.92 0.11 0.07 0.92 120.40 127.67 1p88 s VAL 225 Ca -0.01 -0.95 -0.30 0.00 -2.93 0.00 0.00 61.98 57.79 1p88 s VAL 225 Cb -0.17 -1.80 -0.03 0.00 -1.53 0.00 0.00 36.38 32.85 1p88 s VAL 225 CO -0.03 0.54 1.15 -0.54 -3.33 0.00 0.00 175.10 172.88 1p88 s LYS 226 N 0.90 4.37 0.86 1.54 3.01 -1.26 -0.66 119.74 128.49 1p88 s LYS 226 Ca -0.05 1.59 -0.15 0.00 -1.01 0.00 0.00 55.97 56.35 1p88 s LYS 226 Cb -0.15 -3.56 0.20 0.00 -1.01 0.00 0.00 37.83 33.31 1p88 s LYS 226 CO -0.04 -0.42 1.10 0.41 0.51 0.00 0.00 175.35 176.92 1p88 n GLY 227 N 3.30 -1.62 2.44 -3.33 0.00 -1.26 -4.26 105.19 100.46 1p88 n GLY 227 Ca 0.10 -1.67 -0.16 0.00 0.00 0.00 0.00 46.02 44.29 1p88 n GLY 227 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 228 N -2.55 1.37 3.78 -0.02 0.00 0.80 -4.81 105.19 103.75 1p88 n GLY 228 Ca 0.14 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 1p88 n GLY 228 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1p88 s GLN 229 N -3.53 0.03 0.03 1.61 -0.21 0.54 -4.96 119.66 113.17 1p88 s GLN 229 Ca 0.00 -0.15 0.02 0.00 0.02 0.00 0.00 55.36 55.25 1p88 s GLN 229 Cb 0.00 -1.75 -0.02 0.00 1.00 0.00 0.00 33.01 32.24 1p88 s GLN 229 CO 0.00 -2.86 -0.07 -1.54 -2.12 0.00 0.00 175.29 168.70 1p88 s SER 230 N -4.35 0.79 -0.14 5.90 1.04 -1.26 -4.59 113.70 111.08 1p88 s SER 230 Ca 0.71 -0.45 -0.04 0.00 0.48 0.00 0.00 55.95 56.65 1p88 s SER 230 Cb -0.08 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.02 1p88 s SER 230 CO 0.54 -0.15 -0.01 -0.31 0.98 0.00 0.00 173.24 174.29 1p88 s TYR 231 N -1.11 3.09 0.08 5.02 2.02 -1.26 -4.41 117.35 120.78 1p88 s TYR 231 Ca -0.08 -0.13 0.08 0.00 -0.37 0.00 0.00 57.07 56.57 1p88 s TYR 231 Cb -0.08 -1.94 -0.03 0.00 -0.40 0.00 0.00 41.96 39.50 1p88 s TYR 231 CO 0.00 0.10 -0.21 -0.65 -1.57 0.00 0.00 175.55 173.22 1p88 s GLN 232 N 0.10 1.25 -0.38 -0.62 -0.21 0.29 -0.49 119.66 119.59 1p88 s GLN 232 Ca 0.01 -1.08 -0.29 0.00 0.02 0.00 0.00 55.36 54.02 1p88 s GLN 232 Cb -0.13 -1.46 0.01 0.00 1.00 0.00 0.00 33.01 32.42 1p88 s GLN 232 CO 0.02 0.35 1.37 -1.12 -2.12 0.00 0.00 175.29 173.80 1p88 s SER 233 N -1.62 6.44 0.00 5.90 0.01 -0.60 -4.42 113.70 119.41 1p88 s SER 233 Ca 0.07 0.92 0.11 0.00 1.31 0.00 0.00 55.95 58.36 1p88 s SER 233 Cb -0.10 -2.54 0.64 0.00 0.21 0.00 0.00 66.02 64.23 1p88 s SER 233 CO 0.03 -1.33 1.07 -0.81 0.41 0.00 0.00 173.24 172.61 1p88 n PRO 234 N 7.86 0.48 0.00 12.44 -0.04 -1.26 -4.89 135.00 149.59 1p88 n PRO 234 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1p88 n PRO 234 Cb 0.48 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1p88 n PRO 234 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p88 n GLY 235 N -0.03 1.12 3.41 0.55 0.00 -1.26 -4.87 105.19 104.11 1p88 n GLY 235 Ca 0.08 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 1p88 n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p88 s THR 236 N 0.00 2.84 -0.06 2.61 2.01 -1.26 0.19 115.64 121.96 1p88 s THR 236 Ca 0.00 -0.79 0.01 0.00 0.31 0.00 0.00 61.69 61.22 1p88 s THR 236 Cb 0.00 -2.11 0.02 0.00 0.01 0.00 0.00 72.50 70.42 1p88 s THR 236 CO 0.00 0.57 -0.06 -0.47 -0.69 0.00 0.00 174.62 173.98 1p88 s TYR 237 N -0.40 0.98 -0.41 4.92 6.14 0.70 -4.87 117.35 124.41 1p88 s TYR 237 Ca 0.04 -0.34 -0.19 0.00 0.64 0.00 0.00 57.07 57.22 1p88 s TYR 237 Cb -0.12 -0.85 0.02 0.00 0.42 0.00 0.00 41.96 41.42 1p88 s TYR 237 CO 0.02 -0.28 0.52 -1.17 0.64 0.00 0.00 175.55 175.28 1p88 s LEU 238 N 1.15 4.64 -0.39 6.97 1.98 -1.26 0.10 118.68 131.87 1p88 s LEU 238 Ca -0.07 -0.44 -0.28 0.00 -2.89 0.00 0.00 54.13 50.45 1p88 s LEU 238 Cb -0.14 -2.54 0.02 0.00 0.66 0.00 0.00 46.19 44.20 1p88 s LEU 238 CO -0.01 -0.62 1.06 -0.69 -1.89 0.00 0.00 176.35 174.20 1p88 s VAL 239 N 2.41 4.41 -2.29 1.68 1.01 0.13 -4.89 120.40 122.85 1p88 s VAL 239 Ca 0.17 1.40 0.30 0.00 0.00 0.00 0.00 61.98 63.84 1p88 s VAL 239 Cb -0.16 -4.47 0.70 0.00 0.00 0.00 0.00 36.38 32.45 1p88 s VAL 239 CO 0.15 -0.71 1.94 -0.62 0.00 0.00 0.00 175.10 175.87