#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p88 n ASN 26 N 0.00 0.00 0.05 -3.46 5.03 -1.26 -3.54 115.26 112.08 1p88 n ASN 26 Ca 0.00 0.00 -0.03 0.00 0.87 0.00 0.00 54.58 55.42 1p88 n ASN 26 Cb 0.00 0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 38.75 1p88 n ASN 26 CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 1p88 h ARG 27 N 0.00 -0.20 -0.76 3.52 3.08 -1.98 -2.90 114.38 115.14 1p88 h ARG 27 Ca 0.00 0.01 0.23 0.00 0.07 0.00 0.00 59.98 60.29 1p88 h ARG 27 Cb 0.00 0.04 -0.14 0.00 0.08 0.00 0.00 29.97 29.95 1p88 h ARG 27 CO 0.00 -0.13 0.09 0.00 -1.07 0.00 0.00 179.97 178.85 1p88 n ALA 28 N -2.57 0.46 0.04 0.04 0.00 -1.23 0.13 120.51 117.37 1p88 n ALA 28 Ca -0.03 0.81 -0.18 0.00 0.00 0.00 0.00 53.44 54.04 1p88 n ALA 28 Cb 0.08 -0.63 -0.09 0.00 0.00 0.00 0.00 19.45 18.82 1p88 n ALA 28 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1p88 h LEU 29 N 0.00 0.83 -0.02 0.00 3.38 -1.82 -1.18 115.31 116.49 1p88 h LEU 29 Ca 0.49 -0.65 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1p88 h LEU 29 Cb 1.08 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1p88 h LEU 29 CO -0.69 1.45 0.00 0.25 0.09 0.00 0.00 178.44 179.54 1p88 h LEU 30 N 0.37 0.04 -1.49 1.67 5.85 0.12 -1.08 115.31 120.78 1p88 h LEU 30 Ca -0.11 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.30 1p88 h LEU 30 Cb 1.64 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.65 1p88 h LEU 30 CO 0.19 0.29 -0.24 -0.07 -0.34 0.00 0.00 178.44 178.26 1p88 h LEU 31 N -0.22 0.00 -0.61 2.25 3.38 -0.09 0.28 115.31 120.30 1p88 h LEU 31 Ca 0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1p88 h LEU 31 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1p88 h LEU 31 CO 0.00 0.24 -0.01 0.00 0.09 0.00 0.00 178.44 178.77 1p88 h ALA 32 N 1.76 0.82 0.21 1.53 0.00 -0.78 -1.09 119.26 121.71 1p88 h ALA 32 Ca -0.00 -0.32 -0.31 0.00 0.00 0.00 0.00 54.91 54.29 1p88 h ALA 32 Cb 0.54 -0.22 0.03 0.00 0.00 0.00 0.00 17.79 18.14 1p88 h ALA 32 CO 0.03 0.67 -1.38 0.00 0.00 0.00 0.00 179.25 178.57 1p88 h ALA 33 N 0.99 -0.08 0.00 0.00 0.00 -0.60 -3.17 119.26 116.38 1p88 h ALA 33 Ca 0.17 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1p88 h ALA 33 Cb 0.57 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1p88 h ALA 33 CO 0.03 0.68 0.00 1.28 0.00 0.00 0.00 179.25 181.24 1p88 n LEU 34 N -3.80 0.00 -5.03 0.00 4.77 0.92 0.54 117.00 114.40 1p88 n LEU 34 Ca -0.18 0.18 -0.20 0.00 -0.03 0.00 0.00 56.01 55.79 1p88 n LEU 34 Cb 1.03 -0.18 0.06 0.00 -2.33 0.00 0.00 43.42 41.99 1p88 n LEU 34 CO 0.56 -0.11 0.34 0.00 -1.33 0.00 0.00 177.39 176.84 1p88 s ALA 35 N -2.37 4.71 -0.28 -1.18 0.00 -0.42 -1.43 121.76 120.80 1p88 s ALA 35 Ca 0.14 -2.12 -0.03 0.00 0.00 0.00 0.00 51.96 49.95 1p88 s ALA 35 Cb 0.08 -1.45 0.03 0.00 0.00 0.00 0.00 23.12 21.78 1p88 s ALA 35 CO 0.17 -0.84 -0.00 -1.01 0.00 0.00 0.00 175.76 174.08 1p88 s HIS 36 N -2.66 3.14 0.00 0.00 3.76 0.11 0.14 115.29 119.78 1p88 s HIS 36 Ca 0.61 -1.48 0.00 0.00 -0.15 0.00 0.00 55.06 54.04 1p88 s HIS 36 Cb -0.06 -2.13 0.00 0.00 1.11 0.00 0.00 32.58 31.50 1p88 s HIS 36 CO 0.38 -0.71 0.00 0.41 -0.85 0.00 0.00 174.74 173.98 1p88 n GLY 37 N 4.72 2.51 3.58 -2.22 0.00 -1.26 -2.05 105.19 110.48 1p88 n GLY 37 Ca -0.15 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.38 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 -2.21 3.84 0.10 1.61 2.20 -1.25 0.28 119.74 124.31 1p88 s LYS 38 Ca 0.00 -0.09 0.10 0.00 -0.36 0.00 0.00 55.97 55.63 1p88 s LYS 38 Cb 0.00 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.57 1p88 s LYS 38 CO 0.00 -0.41 -0.27 0.99 -0.36 0.00 0.00 175.35 175.31 1p88 s THR 39 N 2.13 2.20 -0.06 3.43 2.01 -1.02 -4.50 115.64 119.85 1p88 s THR 39 Ca 0.15 -1.63 -0.01 0.00 0.31 0.00 0.00 61.69 60.52 1p88 s THR 39 Cb -0.16 -1.93 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 1p88 s THR 39 CO 0.11 0.18 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.52 1p88 s VAL 40 N -0.98 4.23 -0.24 3.82 1.01 0.36 -0.48 120.40 128.12 1p88 s VAL 40 Ca 0.13 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 1p88 s VAL 40 Cb -0.10 -2.81 0.02 0.00 0.00 0.00 0.00 36.38 33.49 1p88 s VAL 40 CO 0.05 0.53 -0.09 -0.76 0.00 0.00 0.00 175.10 174.83 1p88 s LEU 41 N -1.12 3.01 0.12 3.92 2.01 0.40 0.23 118.68 127.25 1p88 s LEU 41 Ca 0.15 -0.84 0.03 0.00 0.01 0.00 0.00 54.13 53.49 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 0.15 0.28 1.01 0.00 0.00 176.35 177.74 1p88 s THR 42 N 1.31 4.76 -1.39 5.49 -1.32 0.26 0.09 115.64 124.85 1p88 s THR 42 Ca 0.01 -0.83 0.00 0.00 -1.21 0.00 0.00 61.69 59.66 1p88 s THR 42 Cb -0.16 -3.38 0.00 0.00 -1.51 0.00 0.00 72.50 67.45 1p88 s THR 42 CO -0.06 -0.00 0.00 -3.20 -2.21 0.00 0.00 174.62 169.15 1p88 n ASN 43 N -0.06 -4.63 -3.12 8.08 2.85 0.33 0.02 115.26 118.72 1p88 n ASN 43 Ca -0.08 0.11 -0.07 0.00 -0.11 0.00 0.00 54.58 54.43 1p88 n ASN 43 Cb 0.53 -3.67 0.07 0.00 1.24 0.00 0.00 39.78 37.95 1p88 n ASN 43 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1p88 n LEU 44 N -2.02 0.00 -4.45 1.20 4.77 0.46 -4.70 117.00 112.27 1p88 n LEU 44 Ca -0.17 -0.21 -0.33 0.00 -0.03 0.00 0.00 56.01 55.27 1p88 n LEU 44 Cb 0.59 -0.28 -0.13 0.00 -2.33 0.00 0.00 43.42 41.27 1p88 n LEU 44 CO 0.21 -1.77 -0.40 -0.22 -1.33 0.00 0.00 177.39 173.88 1p88 s LEU 45 N 0.00 2.98 -0.98 2.23 2.96 -1.26 -4.80 118.68 119.81 1p88 s LEU 45 Ca 0.16 -0.21 -0.19 0.00 -0.22 0.00 0.00 54.13 53.67 1p88 s LEU 45 Cb -0.03 -1.69 0.12 0.00 0.50 0.00 0.00 46.19 45.10 1p88 s LEU 45 CO 0.13 0.19 1.22 -0.62 -1.32 0.00 0.00 176.35 175.96 1p88 s ASP 46 N 0.20 6.66 -0.23 3.68 -1.08 -1.26 -4.47 116.67 120.17 1p88 s ASP 46 Ca -0.05 -2.05 -0.26 0.00 -0.52 0.00 0.00 52.55 49.66 1p88 s ASP 46 Cb -0.15 -2.43 0.10 0.00 -1.46 0.00 0.00 42.92 38.98 1p88 s ASP 46 CO 0.04 -1.11 0.86 -0.44 0.52 0.00 0.00 175.17 175.05 1p88 s SER 47 N 3.78 -0.58 0.49 -0.34 0.01 -1.26 -5.01 113.70 110.79 1p88 s SER 47 Ca 0.36 1.01 0.44 0.00 1.31 0.00 0.00 55.95 59.07 1p88 s SER 47 Cb -0.04 0.98 1.51 0.00 0.21 0.00 0.00 66.02 68.69 1p88 s SER 47 CO -0.08 -0.28 1.37 0.47 0.41 0.00 0.00 173.24 175.13 1p88 n ASP 48 N 2.02 0.00 -0.28 2.44 8.00 -1.26 0.20 116.55 127.67 1p88 n ASP 48 Ca -0.14 0.87 -0.02 0.00 0.71 0.00 0.00 54.79 56.21 1p88 n ASP 48 Cb 0.56 -0.43 0.10 0.00 -0.02 0.00 0.00 41.12 41.33 1p88 n ASP 48 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 1p88 h ASP 49 N 0.00 0.80 0.11 -2.24 3.04 -1.93 0.22 116.42 116.42 1p88 h ASP 49 Ca 0.82 0.00 -0.23 0.00 -3.24 0.00 0.00 57.03 54.38 1p88 h ASP 49 Cb 3.32 -0.17 0.00 0.00 -1.04 0.00 0.00 39.33 41.44 1p88 h ASP 49 CO -0.01 0.54 -1.16 0.58 -2.04 0.00 0.00 179.24 177.15 1p88 h VAL 50 N 0.94 1.20 -1.01 4.15 2.07 0.20 -1.86 116.25 121.94 1p88 h VAL 50 Ca 0.32 -2.43 0.23 0.00 0.82 0.00 0.00 66.70 65.64 1p88 h VAL 50 Cb 0.05 2.87 -0.12 0.00 -1.52 0.00 0.00 31.29 32.57 1p88 h VAL 50 CO -0.13 0.68 0.61 -0.09 0.02 0.00 0.00 177.57 178.66 1p88 h ARG 51 N -0.39 0.60 0.07 1.57 2.43 -1.08 0.44 114.38 118.02 1p88 h ARG 51 Ca -0.24 -0.04 -0.25 0.00 -0.81 0.00 0.00 59.98 58.64 1p88 h ARG 51 Cb 1.67 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 31.07 1p88 h ARG 51 CO 0.07 0.40 -1.20 0.45 -1.51 0.00 0.00 179.97 178.18 1p88 h HIS 52 N 0.62 0.25 -0.81 2.20 3.86 -0.64 0.87 115.15 121.50 1p88 h HIS 52 Ca 0.62 -0.18 0.16 0.00 -1.16 0.00 0.00 60.37 59.81 1p88 h HIS 52 Cb 1.15 -0.01 -0.06 0.00 1.06 0.00 0.00 27.41 29.56 1p88 h HIS 52 CO -0.01 1.16 0.54 1.98 0.86 0.00 0.00 177.93 182.46 1p88 h MET 53 N 0.04 0.42 0.13 2.45 1.85 0.58 3.53 114.93 123.93 1p88 h MET 53 Ca -0.10 -0.03 -0.22 0.00 -0.61 0.00 0.00 59.70 58.74 1p88 h MET 53 Cb 1.89 -0.10 0.01 0.00 0.43 0.00 0.00 31.60 33.84 1p88 h MET 53 CO 0.16 0.28 -1.04 -0.07 -0.40 0.00 0.00 176.91 175.84 1p88 h LEU 54 N 0.44 0.42 -0.80 3.39 3.38 -0.43 -3.13 115.31 118.56 1p88 h LEU 54 Ca 0.40 -0.90 0.04 0.00 0.09 0.00 0.00 57.88 57.51 1p88 h LEU 54 Cb 0.92 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 1p88 h LEU 54 CO -0.14 1.47 0.50 -1.13 0.09 0.00 0.00 178.44 179.24 1p88 h ASN 55 N -0.37 0.81 -0.42 -0.43 -0.73 0.42 1.26 115.58 116.12 1p88 h ASN 55 Ca -0.21 0.01 0.04 0.00 1.87 0.00 0.00 56.30 58.01 1p88 h ASN 55 Cb 1.67 -0.17 -0.04 0.00 0.27 0.00 0.00 38.32 40.05 1p88 h ASN 55 CO 0.10 0.54 0.19 0.00 -0.37 0.00 0.00 177.43 177.89 1p88 h ALA 56 N 1.36 0.51 -0.56 1.57 0.00 0.63 1.32 119.26 124.09 1p88 h ALA 56 Ca 0.33 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.21 1p88 h ALA 56 Cb 0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1p88 h ALA 56 CO -0.14 -0.19 0.10 -0.07 0.00 0.00 0.00 179.25 178.96 1p88 h LEU 57 N 0.38 0.83 -1.32 0.00 4.07 -1.23 -2.03 115.31 116.00 1p88 h LEU 57 Ca 0.18 -0.17 -0.05 0.00 0.08 0.00 0.00 57.88 57.92 1p88 h LEU 57 Cb 0.12 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.63 1p88 h LEU 57 CO -0.15 0.84 -0.07 0.74 -1.08 0.00 0.00 178.44 178.71 1p88 h THR 58 N 0.84 1.19 0.01 0.22 2.02 0.46 1.08 112.91 118.73 1p88 h THR 58 Ca 0.18 -0.78 -0.25 0.00 0.77 0.00 0.00 66.41 66.33 1p88 h THR 58 Cb 0.36 1.09 0.01 0.00 -1.74 0.00 0.00 68.15 67.87 1p88 h THR 58 CO 0.01 0.25 -1.01 0.00 0.37 0.00 0.00 175.52 175.13 1p88 h ALA 59 N 1.58 0.24 0.00 6.16 0.00 0.22 -3.18 119.26 124.29 1p88 h ALA 59 Ca 0.07 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1p88 h ALA 59 Cb 0.35 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1p88 h ALA 59 CO 0.02 0.77 -0.09 1.28 0.00 0.00 0.00 179.25 181.23 1p88 n LEU 60 N -3.78 0.45 -0.03 0.00 4.77 -0.89 -4.75 117.00 112.77 1p88 n LEU 60 Ca -0.09 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1p88 n LEU 60 Cb 0.87 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1p88 n LEU 60 CO 0.54 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1p88 n GLY 61 N 1.40 1.37 3.65 -0.72 0.00 -0.59 -4.54 105.19 105.77 1p88 n GLY 61 Ca 0.06 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.05 5.06 -0.02 1.61 1.01 0.36 -4.99 120.40 121.37 1p88 s VAL 62 Ca 0.00 1.07 -0.25 0.00 0.00 0.00 0.00 61.98 62.80 1p88 s VAL 62 Cb 0.00 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 1p88 s VAL 62 CO 0.00 0.13 0.75 -0.44 0.00 0.00 0.00 175.10 175.54 1p88 s SER 63 N 1.23 7.10 0.29 3.32 0.01 -1.26 -4.27 113.70 120.12 1p88 s SER 63 Ca 0.26 1.32 -0.19 0.00 1.31 0.00 0.00 55.95 58.65 1p88 s SER 63 Cb -0.16 -2.45 0.02 0.00 0.21 0.00 0.00 66.02 63.65 1p88 s SER 63 CO 0.10 -0.09 0.69 -0.72 0.41 0.00 0.00 173.24 173.63 1p88 s TYR 64 N 0.55 -0.06 0.04 2.43 1.13 -1.26 0.22 117.35 120.41 1p88 s TYR 64 Ca 0.39 -0.40 0.03 0.00 -1.41 0.00 0.00 57.07 55.67 1p88 s TYR 64 Cb -0.19 0.64 -0.02 0.00 -1.10 0.00 0.00 41.96 41.29 1p88 s TYR 64 CO 0.21 -1.24 -0.09 0.99 -2.51 0.00 0.00 175.55 172.91 1p88 s THR 65 N -3.75 0.61 -0.03 -3.49 2.01 0.58 -4.93 115.64 106.65 1p88 s THR 65 Ca 0.13 -1.03 0.07 0.00 0.31 0.00 0.00 61.69 61.18 1p88 s THR 65 Cb -0.05 -0.65 -0.02 0.00 0.01 0.00 0.00 72.50 71.79 1p88 s THR 65 CO 0.08 -0.31 -0.25 -0.22 -0.69 0.00 0.00 174.62 173.23 1p88 s LEU 66 N -1.46 2.05 0.00 4.42 2.96 -1.26 0.32 118.68 125.71 1p88 s LEU 66 Ca -0.08 -0.48 -0.12 0.00 -0.22 0.00 0.00 54.13 53.24 1p88 s LEU 66 Cb -0.09 -1.33 0.18 0.00 0.50 0.00 0.00 46.19 45.45 1p88 s LEU 66 CO 0.01 0.30 0.41 -1.54 -1.32 0.00 0.00 176.35 174.20 1p88 n SER 67 N 2.59 -2.95 0.10 3.68 3.41 0.34 -4.90 113.62 115.89 1p88 n SER 67 Ca -0.16 -0.42 -0.23 0.00 -0.26 0.00 0.00 58.87 57.80 1p88 n SER 67 Cb 0.51 -0.51 -0.15 0.00 -0.26 0.00 0.00 64.21 63.81 1p88 n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1p88 h ALA 68 N -2.74 -0.13 0.00 7.33 0.00 -2.01 -3.24 119.26 118.48 1p88 h ALA 68 Ca -0.19 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 53.94 1p88 h ALA 68 Cb 0.63 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1p88 h ALA 68 CO 0.11 0.54 0.00 -3.47 0.00 0.00 0.00 179.25 176.43 1p88 n ASP 69 N -3.92 0.00 -3.39 0.00 2.03 -1.26 -4.89 116.55 105.11 1p88 n ASP 69 Ca -0.16 -0.88 -0.17 0.00 0.52 0.00 0.00 54.79 54.11 1p88 n ASP 69 Cb 0.97 0.00 0.08 0.00 -0.72 0.00 0.00 41.12 41.45 1p88 n ASP 69 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1p88 n ARG 70 N -0.97 -4.93 0.00 -0.67 1.74 -1.22 -4.91 116.66 105.70 1p88 n ARG 70 Ca 0.18 0.83 0.00 0.00 -0.77 0.00 0.00 57.85 58.10 1p88 n ARG 70 Cb 0.08 -5.77 0.00 0.00 -1.02 0.00 0.00 32.46 25.75 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 -3.84 0.00 -3.68 0.55 -2.24 -1.26 -4.30 114.28 99.50 1p88 n THR 71 Ca -0.21 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.30 1p88 n THR 71 Cb 0.65 0.86 -0.17 0.00 -2.10 0.00 0.00 70.33 69.57 1p88 n THR 71 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1p88 s ARG 72 N 0.00 0.39 -0.06 -0.78 3.52 -1.25 0.17 118.95 120.95 1p88 s ARG 72 Ca 0.00 -0.24 0.05 0.00 -0.13 0.00 0.00 55.73 55.42 1p88 s ARG 72 Cb 0.00 -1.90 -0.01 0.00 -1.56 0.00 0.00 34.95 31.48 1p88 s ARG 72 CO 0.00 -0.63 -0.23 0.00 -0.81 0.00 0.00 175.30 173.63 1p88 s GLU 74 N -0.03 3.08 -0.11 0.00 2.12 0.15 0.15 118.70 124.06 1p88 s GLU 74 Ca -0.06 -0.73 0.01 0.00 0.36 0.00 0.00 54.97 54.54 1p88 s GLU 74 Cb -0.14 -2.49 0.02 0.00 0.26 0.00 0.00 34.13 31.78 1p88 s GLU 74 CO 0.04 0.31 -0.11 0.42 -0.54 0.00 0.00 175.26 175.38 1p88 s ILE 75 N 0.07 1.22 -0.58 -3.70 1.01 0.37 0.22 121.20 119.80 1p88 s ILE 75 Ca -0.07 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 59.87 1p88 s ILE 75 Cb -0.15 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 1p88 s ILE 75 CO 0.05 0.39 1.98 0.27 0.00 0.00 0.00 174.94 177.63 1p88 s ILE 76 N 1.29 3.28 0.33 2.92 -0.00 0.61 -2.42 121.20 127.20 1p88 s ILE 76 Ca -0.02 0.16 -0.22 0.00 -0.00 0.00 0.00 60.65 60.57 1p88 s ILE 76 Cb -0.14 -3.74 -0.15 0.00 -0.00 0.00 0.00 42.46 38.43 1p88 s ILE 76 CO -0.04 -0.71 0.21 0.61 -0.00 0.00 0.00 174.94 175.00 1p88 n GLY 77 N 5.76 -2.34 0.03 6.27 0.00 0.80 -4.04 105.19 111.67 1p88 n GLY 77 Ca 0.24 0.09 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 2.15 0.59 0.00 1.61 5.15 0.19 -4.13 115.26 120.81 1p88 n ASN 78 Ca 0.13 -0.11 0.00 0.00 -0.60 0.00 0.00 54.58 54.00 1p88 n ASN 78 Cb 0.34 0.30 0.00 0.00 -0.53 0.00 0.00 39.78 39.89 1p88 n ASN 78 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1p88 n GLY 79 N 1.42 0.66 0.00 8.20 0.00 0.36 -4.94 105.19 110.90 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 -2.04 0.05 3.67 -0.02 0.00 -0.51 -4.75 105.19 101.59 1p88 n GLY 80 Ca 0.00 -1.12 -0.54 0.00 0.00 0.00 0.00 46.02 44.37 1p88 n GLY 80 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1p88 n PRO 81 N 0.00 1.38 -2.30 1.61 -0.02 -1.26 -4.10 135.00 130.30 1p88 n PRO 81 Ca 0.00 0.50 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 1p88 n PRO 81 Cb 0.00 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 1p88 n PRO 81 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1p88 s LEU 82 N 2.61 3.45 0.01 2.45 2.01 -1.26 -4.84 118.68 123.11 1p88 s LEU 82 Ca 0.92 0.55 -0.26 0.00 0.01 0.00 0.00 54.13 55.35 1p88 s LEU 82 Cb -0.95 -3.17 -0.05 0.00 0.01 0.00 0.00 46.19 42.03 1p88 s LEU 82 CO 0.56 -1.72 0.82 -1.38 1.01 0.00 0.00 176.35 175.65 1p88 s HIS 83 N 6.34 3.69 -0.20 0.29 -3.43 -1.26 -4.89 115.29 115.82 1p88 s HIS 83 Ca 0.59 1.50 -0.13 0.00 -0.80 0.00 0.00 55.06 56.22 1p88 s HIS 83 Cb -0.13 -2.91 -0.04 0.00 -1.43 0.00 0.00 32.58 28.07 1p88 s HIS 83 CO 0.27 0.16 0.28 0.00 -2.00 0.00 0.00 174.74 173.45 1p88 s ALA 84 N 0.40 3.59 -0.03 -1.38 0.00 -1.26 -4.67 121.76 118.40 1p88 s ALA 84 Ca 0.42 -0.62 -0.30 0.00 0.00 0.00 0.00 51.96 51.46 1p88 s ALA 84 Cb -0.20 -2.45 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 1p88 s ALA 84 CO 0.24 -0.13 1.40 -1.21 0.00 0.00 0.00 175.76 176.05 1p88 s GLU 85 N 0.95 4.27 0.41 0.00 8.01 -1.26 -4.65 118.70 126.43 1p88 s GLU 85 Ca 0.14 1.93 0.00 0.00 0.01 0.00 0.00 54.97 57.05 1p88 s GLU 85 Cb -0.14 -3.64 0.00 0.00 -4.31 0.00 0.00 34.13 26.04 1p88 s GLU 85 CO 0.05 -0.61 0.00 0.41 0.01 0.00 0.00 175.26 175.12 1p88 n GLY 86 N 3.68 -2.26 3.78 -1.39 0.00 -1.26 -4.71 105.19 103.02 1p88 n GLY 86 Ca 0.14 -1.13 -0.37 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 -2.72 3.13 0.29 4.61 0.00 -1.26 -4.58 121.76 121.22 1p88 s ALA 87 Ca 0.00 0.78 0.10 0.00 0.00 0.00 0.00 51.96 52.84 1p88 s ALA 87 Cb 0.00 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.77 1p88 s ALA 87 CO 0.00 -0.28 -0.04 -1.17 0.00 0.00 0.00 175.76 174.26 1p88 s LEU 88 N -2.49 3.01 -0.14 0.00 2.96 0.53 -4.96 118.68 117.58 1p88 s LEU 88 Ca 0.56 -0.81 -0.04 0.00 -0.22 0.00 0.00 54.13 53.62 1p88 s LEU 88 Cb -0.25 -1.49 0.05 0.00 0.50 0.00 0.00 46.19 45.00 1p88 s LEU 88 CO 0.31 -0.05 0.09 -0.70 -1.32 0.00 0.00 176.35 174.69 1p88 s GLU 89 N -3.65 0.04 -0.26 1.98 2.12 -1.26 0.20 118.70 117.87 1p88 s GLU 89 Ca 0.32 0.04 -0.06 0.00 0.36 0.00 0.00 54.97 55.63 1p88 s GLU 89 Cb -0.05 -1.50 -0.01 0.00 0.26 0.00 0.00 34.13 32.83 1p88 s GLU 89 CO 0.19 -0.59 0.04 -0.51 -0.54 0.00 0.00 175.26 173.85 1p88 s LEU 90 N 2.16 3.46 -0.75 2.70 1.02 0.31 -4.90 118.68 122.68 1p88 s LEU 90 Ca 0.03 -0.46 -0.21 0.00 0.02 0.00 0.00 54.13 53.50 1p88 s LEU 90 Cb -0.15 -1.85 0.09 0.00 0.02 0.00 0.00 46.19 44.30 1p88 s LEU 90 CO -0.08 -0.09 1.00 0.12 0.02 0.00 0.00 176.35 177.32 1p88 s PHE 91 N 1.53 2.84 -0.79 0.29 5.36 -1.26 -0.72 117.98 125.22 1p88 s PHE 91 Ca 0.05 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.16 1p88 s PHE 91 Cb -0.16 -4.27 0.36 0.00 -0.34 0.00 0.00 43.02 38.61 1p88 s PHE 91 CO 0.01 -1.57 1.73 1.28 -1.46 0.00 0.00 175.22 175.20 1p88 n LEU 92 N 7.24 6.72 0.00 6.12 7.99 0.39 -4.86 117.00 140.61 1p88 n LEU 92 Ca 0.05 -5.10 0.00 0.00 -0.01 0.00 0.00 56.01 50.95 1p88 n LEU 92 Cb 0.46 -0.94 0.00 0.00 -0.11 0.00 0.00 43.42 42.84 1p88 n LEU 92 CO 0.59 1.96 0.37 0.61 -1.51 0.00 0.00 177.39 179.42 1p88 n GLY 93 N -0.40 -2.95 0.00 -0.72 0.00 -1.24 -2.41 105.19 97.47 1p88 n GLY 93 Ca 0.48 0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.86 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 -1.49 0.00 -2.24 1.61 4.13 -1.26 -3.85 115.26 112.16 1p88 n ASN 94 Ca 0.00 -0.64 -0.21 0.00 1.68 0.00 0.00 54.58 55.41 1p88 n ASN 94 Cb 0.00 -0.05 -0.06 0.00 -1.54 0.00 0.00 39.78 38.13 1p88 n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1p88 n ALA 95 N -1.05 6.09 0.25 5.41 0.00 -1.01 -4.14 120.51 126.05 1p88 n ALA 95 Ca 0.17 -2.42 0.18 0.00 0.00 0.00 0.00 53.44 51.37 1p88 n ALA 95 Cb 0.10 -1.99 0.89 0.00 0.00 0.00 0.00 19.45 18.46 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 3.83 0.00 0.71 0.00 0.00 -1.71 0.46 103.07 106.36 1p88 h GLY 96 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1p88 h GLY 96 CO 0.69 0.00 -1.08 -1.30 0.00 0.00 0.00 176.54 174.86 1p88 n THR 97 N -3.50 0.30 -0.07 4.70 -2.24 -1.26 -4.10 114.28 108.11 1p88 n THR 97 Ca 0.00 -0.36 -0.17 0.00 -2.27 0.00 0.00 64.05 61.26 1p88 n THR 97 Cb 0.31 -0.01 -0.14 0.00 -2.10 0.00 0.00 70.33 68.40 1p88 n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p88 n ALA 98 N -1.97 1.27 -0.20 6.98 0.00 0.12 -4.13 120.51 122.58 1p88 n ALA 98 Ca 0.01 -0.93 -0.06 0.00 0.00 0.00 0.00 53.44 52.47 1p88 n ALA 98 Cb 0.48 -0.40 0.04 0.00 0.00 0.00 0.00 19.45 19.57 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 0.02 0.70 0.42 0.00 -1.53 -0.57 0.39 114.93 114.37 1p88 h MET 99 Ca -0.49 -0.04 -0.01 0.00 -3.44 0.00 0.00 59.70 55.72 1p88 h MET 99 Cb 2.01 -0.16 -0.03 0.00 -0.55 0.00 0.00 31.60 32.88 1p88 h MET 99 CO 0.01 0.47 -0.51 0.00 0.14 0.00 0.00 176.91 177.02 1p88 h ARG 100 N 0.72 -0.91 -0.26 0.39 -0.00 -1.77 0.49 114.38 113.05 1p88 h ARG 100 Ca 0.22 0.06 -0.02 0.00 -0.50 0.00 0.00 59.98 59.74 1p88 h ARG 100 Cb -0.03 0.21 -0.01 0.00 0.00 0.00 0.00 29.97 30.13 1p88 h ARG 100 CO -0.07 -0.61 0.06 -1.00 0.00 0.00 0.00 179.97 178.35 1p88 h PRO 101 N -0.95 0.36 0.13 0.04 0.13 -1.65 -2.45 132.00 127.62 1p88 h PRO 101 Ca -0.05 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.02 1p88 h PRO 101 Cb 0.84 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1p88 h PRO 101 CO -0.11 0.34 -0.06 -0.07 -0.23 0.00 0.00 178.00 177.87 1p88 h LEU 102 N 0.36 -0.15 -1.97 1.56 3.38 0.29 0.36 115.31 119.14 1p88 h LEU 102 Ca 0.09 -0.38 0.21 0.00 0.09 0.00 0.00 57.88 57.88 1p88 h LEU 102 Cb 0.15 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1p88 h LEU 102 CO -0.00 0.36 0.57 0.00 0.09 0.00 0.00 178.44 179.46 1p88 h ALA 103 N -0.01 2.61 0.00 1.53 0.00 0.08 -0.39 119.26 123.09 1p88 h ALA 103 Ca -0.02 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1p88 h ALA 103 Cb 0.53 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1p88 h ALA 103 CO 0.03 -0.94 -0.64 0.00 0.00 0.00 0.00 179.25 177.70 1p88 h ALA 104 N 1.53 0.12 -0.42 0.00 0.00 -1.27 -3.33 119.26 115.89 1p88 h ALA 104 Ca 0.34 -0.75 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1p88 h ALA 104 Cb 1.49 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 1p88 h ALA 104 CO -0.00 0.39 0.24 0.00 0.00 0.00 0.00 179.25 179.88 1p88 h ALA 105 N -0.51 1.65 0.00 0.00 0.00 0.27 -2.50 119.26 118.16 1p88 h ALA 105 Ca -0.15 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1p88 h ALA 105 Cb 0.92 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1p88 h ALA 105 CO -0.09 0.31 0.00 -0.07 0.00 0.00 0.00 179.25 179.39 1p88 h LEU 106 N 0.57 0.00 -1.83 0.00 3.38 -1.28 -3.16 115.31 112.99 1p88 h LEU 106 Ca 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1p88 h LEU 106 Cb -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1p88 h LEU 106 CO -0.03 0.00 0.04 0.00 0.09 0.00 0.00 178.44 178.54 1p88 n LEU 108 N 0.14 0.58 0.00 0.00 4.77 -1.20 0.54 117.00 121.82 1p88 n LEU 108 Ca 0.08 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1p88 n LEU 108 Cb 0.55 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1p88 n LEU 108 CO 0.09 -0.31 0.00 0.61 -1.33 0.00 0.00 177.39 176.46 1p88 n GLY 109 N 2.04 -0.19 2.85 -0.72 0.00 -1.26 -2.54 105.19 105.37 1p88 n GLY 109 Ca 0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.34 0.75 -0.09 1.61 0.01 -1.26 -1.41 113.70 111.97 1p88 s SER 110 Ca 0.00 -1.08 -0.08 0.00 1.31 0.00 0.00 55.95 56.11 1p88 s SER 110 Cb 0.00 0.84 0.03 0.00 0.21 0.00 0.00 66.02 67.10 1p88 s SER 110 CO 0.00 -0.29 0.23 0.54 0.41 0.00 0.00 173.24 174.13 1p88 s ASN 111 N 1.89 -0.24 -0.58 2.44 2.20 -1.26 -4.64 114.94 114.75 1p88 s ASN 111 Ca 0.14 0.48 -0.19 0.00 -0.94 0.00 0.00 52.86 52.35 1p88 s ASN 111 Cb -0.13 0.46 0.10 0.00 -2.00 0.00 0.00 41.25 39.68 1p88 s ASN 111 CO -0.15 -0.09 0.67 -1.81 -2.94 0.00 0.00 177.10 172.78 1p88 s ASP 112 N 0.31 6.19 0.09 3.54 1.11 -1.15 -1.55 116.67 125.20 1p88 s ASP 112 Ca -0.02 -1.41 0.10 0.00 0.18 0.00 0.00 52.55 51.40 1p88 s ASP 112 Cb -0.03 -2.29 -0.03 0.00 1.07 0.00 0.00 42.92 41.63 1p88 s ASP 112 CO -0.01 -1.07 -0.26 -0.63 1.18 0.00 0.00 175.17 174.38 1p88 s ILE 113 N 2.58 2.14 -0.25 0.77 1.09 0.29 0.20 121.20 128.02 1p88 s ILE 113 Ca 0.11 -1.58 0.00 0.00 -1.10 0.00 0.00 60.65 58.08 1p88 s ILE 113 Cb -0.24 -1.87 0.04 0.00 -1.06 0.00 0.00 42.46 39.33 1p88 s ILE 113 CO 0.06 0.18 -0.09 -0.69 -0.10 0.00 0.00 174.94 174.31 1p88 s VAL 114 N -0.96 2.52 -0.45 2.92 1.01 0.53 0.17 120.40 126.14 1p88 s VAL 114 Ca 0.12 -1.29 -0.13 0.00 0.00 0.00 0.00 61.98 60.68 1p88 s VAL 114 Cb -0.10 -2.35 0.07 0.00 0.00 0.00 0.00 36.38 34.00 1p88 s VAL 114 CO 0.04 0.12 0.35 -0.76 0.00 0.00 0.00 175.10 174.85 1p88 s LEU 115 N 1.23 5.44 0.00 3.92 1.43 0.36 0.11 118.68 131.17 1p88 s LEU 115 Ca -0.03 -1.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.71 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 -0.05 -0.60 0.02 0.41 0.23 0.00 0.00 176.35 176.35 1p88 n THR 116 N 5.11 0.00 -3.04 5.49 -1.04 0.10 -2.12 114.28 118.77 1p88 n THR 116 Ca -0.12 -0.52 0.00 0.00 -2.04 0.00 0.00 64.05 61.37 1p88 n THR 116 Cb 0.44 0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 1p88 n THR 116 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1p88 n GLY 117 N 3.64 1.77 3.87 3.41 0.00 -1.26 0.15 105.19 116.76 1p88 n GLY 117 Ca -0.04 -0.91 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 1p88 n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p88 s GLU 118 N -1.39 1.37 0.32 1.61 2.02 -1.26 -4.75 118.70 116.62 1p88 s GLU 118 Ca 0.00 0.05 0.09 0.00 0.02 0.00 0.00 54.97 55.13 1p88 s GLU 118 Cb 0.00 -1.89 0.86 0.00 0.10 0.00 0.00 34.13 33.20 1p88 s GLU 118 CO 0.00 -1.99 1.75 -1.35 0.02 0.00 0.00 175.26 173.69 1p88 h PRO 119 N -1.35 0.60 0.00 0.39 0.11 -2.02 0.47 132.00 130.20 1p88 h PRO 119 Ca -0.47 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1p88 h PRO 119 Cb 1.31 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1p88 h PRO 119 CO 0.58 0.40 -0.14 0.00 -0.21 0.00 0.00 178.00 178.63 1p88 h ARG 120 N 0.62 0.00 -0.43 1.05 3.08 -1.94 -2.47 114.38 114.29 1p88 h ARG 120 Ca 0.62 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.66 1p88 h ARG 120 Cb 1.14 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.17 1p88 h ARG 120 CO -0.42 0.14 0.24 1.98 -1.07 0.00 0.00 179.97 180.83 1p88 h MET 121 N 0.00 0.58 0.00 0.04 4.05 -0.30 0.79 114.93 120.09 1p88 h MET 121 Ca -0.00 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1p88 h MET 121 Cb 0.52 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.20 1p88 h MET 121 CO 0.02 0.42 0.00 0.87 0.23 0.00 0.00 176.91 178.45 1p88 h LYS 122 N 0.59 0.00 -0.04 0.39 1.57 -1.46 0.29 116.57 117.90 1p88 h LYS 122 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1p88 h LYS 122 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1p88 h LYS 122 CO -0.03 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.24 1p88 n GLU 123 N -2.57 1.24 -3.74 3.15 -0.58 0.27 -4.40 120.64 114.01 1p88 n GLU 123 Ca -0.01 -0.36 -0.29 0.00 -0.42 0.00 0.00 57.16 56.08 1p88 n GLU 123 Cb 0.08 -1.37 -0.12 0.00 -0.57 0.00 0.00 31.44 29.46 1p88 n GLU 123 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1p88 s ARG 124 N -1.95 1.69 0.59 3.49 0.52 0.10 -5.12 118.95 118.28 1p88 s ARG 124 Ca 0.33 -2.55 -0.19 0.00 -0.52 0.00 0.00 55.73 52.80 1p88 s ARG 124 Cb 0.16 -2.64 -0.04 0.00 0.52 0.00 0.00 34.95 32.95 1p88 s ARG 124 CO 0.26 -1.24 1.13 -0.35 0.02 0.00 0.00 175.30 175.12 1p88 n PRO 125 N 2.83 1.14 0.00 3.54 -0.04 -1.26 -4.21 135.00 137.01 1p88 n PRO 125 Ca 0.16 0.44 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 1p88 n PRO 125 Cb 0.37 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 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 -1.56 0.08 -0.34 0.52 3.06 0.33 -4.77 119.36 116.68 1p88 n ILE 126 Ca 0.13 -0.48 0.10 0.00 -2.50 0.00 0.00 62.75 60.01 1p88 n ILE 126 Cb 0.46 1.07 0.29 0.00 0.54 0.00 0.00 39.64 42.01 1p88 n ILE 126 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 1p88 h GLY 127 N 0.00 1.61 0.61 4.50 0.00 -1.76 0.21 103.07 108.24 1p88 h GLY 127 Ca 0.00 -0.38 0.08 0.00 0.00 0.00 0.00 47.33 47.03 1p88 h GLY 127 CO 0.00 0.07 0.53 0.45 0.00 0.00 0.00 176.54 177.60 1p88 h HIS 128 N 0.86 0.97 -0.02 5.60 3.86 -1.87 0.34 115.15 124.89 1p88 h HIS 128 Ca 0.52 0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.60 1p88 h HIS 128 Cb 0.68 -0.31 0.01 0.00 1.06 0.00 0.00 27.41 28.85 1p88 h HIS 128 CO -0.00 0.44 -0.60 1.25 0.86 0.00 0.00 177.93 179.88 1p88 h LEU 129 N 0.92 0.56 -0.40 2.43 5.85 -1.47 -2.59 115.31 120.61 1p88 h LEU 129 Ca 0.41 -0.74 0.05 0.00 0.84 0.00 0.00 57.88 58.43 1p88 h LEU 129 Cb 0.29 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 1p88 h LEU 129 CO -0.22 1.22 0.14 0.58 -0.34 0.00 0.00 178.44 179.83 1p88 h VAL 130 N -0.05 0.88 -0.38 1.05 2.07 -0.00 0.16 116.25 119.97 1p88 h VAL 130 Ca -0.07 -0.10 -0.15 0.00 0.82 0.00 0.00 66.70 67.20 1p88 h VAL 130 Cb 1.30 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1p88 h VAL 130 CO 0.12 0.05 -0.34 0.44 0.02 0.00 0.00 177.57 177.87 1p88 h ASP 131 N 0.30 0.91 -0.16 0.57 3.32 -0.44 0.78 116.42 121.70 1p88 h ASP 131 Ca 0.18 -0.39 0.02 0.00 0.02 0.00 0.00 57.03 56.86 1p88 h ASP 131 Cb 0.17 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1p88 h ASP 131 CO -0.19 1.16 0.04 0.00 -1.72 0.00 0.00 179.24 178.53 1p88 h ALA 132 N 0.89 0.17 0.02 3.45 0.00 -1.02 1.06 119.26 123.83 1p88 h ALA 132 Ca 0.07 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1p88 h ALA 132 Cb 0.91 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1p88 h ALA 132 CO 0.08 -0.40 -0.01 -0.07 0.00 0.00 0.00 179.25 178.85 1p88 h LEU 133 N 0.11 -0.02 -2.15 0.00 3.38 -0.59 -2.75 115.31 113.29 1p88 h LEU 133 Ca 0.07 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 57.61 1p88 h LEU 133 Cb 0.06 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1p88 h LEU 133 CO -0.09 0.47 0.13 0.03 0.09 0.00 0.00 178.44 179.07 1p88 h ARG 134 N -0.52 0.00 -0.03 1.13 2.47 0.76 0.18 114.38 118.36 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 0.50 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 1p88 h ARG 134 CO 0.00 0.00 -0.48 1.25 0.56 0.00 0.00 179.97 181.30 1p88 h LEU 135 N 0.00 0.09 -0.93 3.04 5.85 0.14 -2.51 115.31 120.98 1p88 h LEU 135 Ca 0.07 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1p88 h LEU 135 Cb 0.32 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1p88 h LEU 135 CO -0.00 0.56 0.00 0.61 -0.34 0.00 0.00 178.44 179.27 1p88 n GLY 136 N -0.10 0.63 0.69 3.75 0.00 0.54 -4.79 105.19 105.91 1p88 n GLY 136 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 0.42 0.80 3.82 -0.02 0.00 -0.95 -0.23 105.19 109.03 1p88 n GLY 137 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.13 2.97 -0.48 4.61 0.00 -0.75 -2.93 121.76 123.06 1p88 s ALA 138 Ca 0.00 0.37 -0.15 0.00 0.00 0.00 0.00 51.96 52.18 1p88 s ALA 138 Cb 0.00 -3.17 0.09 0.00 0.00 0.00 0.00 23.12 20.03 1p88 s ALA 138 CO 0.00 -0.20 0.40 0.15 0.00 0.00 0.00 175.76 176.12 1p88 s LYS 139 N -3.59 2.94 -0.06 0.00 1.02 0.18 -4.16 119.74 116.07 1p88 s LYS 139 Ca 0.62 -1.45 -0.00 0.00 0.02 0.00 0.00 55.97 55.16 1p88 s LYS 139 Cb -0.12 -4.13 0.03 0.00 -0.52 0.00 0.00 37.83 33.09 1p88 s LYS 139 CO 0.23 -1.09 -0.01 0.42 -0.92 0.00 0.00 175.35 173.98 1p88 s ILE 140 N 1.61 0.38 -0.02 2.17 1.01 -1.26 -1.52 121.20 123.56 1p88 s ILE 140 Ca 0.04 0.06 0.08 0.00 0.00 0.00 0.00 60.65 60.82 1p88 s ILE 140 Cb -0.25 -0.49 -0.02 0.00 0.01 0.00 0.00 42.46 41.71 1p88 s ILE 140 CO 0.05 0.23 -0.25 -0.89 0.00 0.00 0.00 174.94 174.08 1p88 s THR 141 N 1.54 2.00 0.05 2.92 2.01 -0.71 -4.95 115.64 118.49 1p88 s THR 141 Ca -0.02 -1.08 -0.29 0.00 0.31 0.00 0.00 61.69 60.62 1p88 s THR 141 Cb -0.13 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1p88 s THR 141 CO -0.03 0.56 0.93 -0.31 -0.69 0.00 0.00 174.62 175.08 1p88 s TYR 142 N -0.55 3.73 0.00 4.92 2.02 -1.26 -0.68 117.35 125.52 1p88 s TYR 142 Ca 0.08 1.68 0.00 0.00 -0.37 0.00 0.00 57.07 58.47 1p88 s TYR 142 Cb -0.10 -3.03 0.00 0.00 -0.40 0.00 0.00 41.96 38.42 1p88 s TYR 142 CO -0.00 0.12 0.00 1.28 -1.57 0.00 0.00 175.55 175.37 1p88 n LEU 143 N 3.30 0.32 0.00 -1.29 4.32 -1.26 -4.89 117.00 117.50 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 0.19 -0.62 -1.22 0.00 0.00 177.39 176.25 1p88 n GLU 144 N -0.32 0.00 -4.34 3.23 1.02 -1.26 -4.85 120.64 114.11 1p88 n GLU 144 Ca 0.00 0.05 -0.27 0.00 -0.02 0.00 0.00 57.16 56.92 1p88 n GLU 144 Cb 0.00 -0.88 -0.10 0.00 -0.02 0.00 0.00 31.44 30.44 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 -0.75 1.84 0.19 3.49 -0.21 -1.26 -5.08 119.66 117.87 1p88 s GLN 145 Ca 0.00 -1.37 -0.31 0.00 0.02 0.00 0.00 55.36 53.70 1p88 s GLN 145 Cb 0.00 -2.03 -0.09 0.00 1.00 0.00 0.00 33.01 31.89 1p88 s GLN 145 CO 0.00 0.42 1.43 -1.21 -2.12 0.00 0.00 175.29 173.81 1p88 s GLU 146 N -2.76 4.29 -0.68 2.91 2.02 -1.26 -2.00 118.70 121.23 1p88 s GLU 146 Ca 0.23 2.21 0.00 0.00 0.02 0.00 0.00 54.97 57.43 1p88 s GLU 146 Cb -0.08 -3.17 0.00 0.00 0.10 0.00 0.00 34.13 30.98 1p88 s GLU 146 CO 0.13 -0.42 0.00 0.09 0.02 0.00 0.00 175.26 175.08 1p88 n ASN 147 N 3.07 -4.14 -4.86 -0.19 4.13 -1.26 -4.87 115.26 107.14 1p88 n ASN 147 Ca 0.09 0.16 -0.21 0.00 1.68 0.00 0.00 54.58 56.30 1p88 n ASN 147 Cb 0.41 -2.20 -0.03 0.00 -1.54 0.00 0.00 39.78 36.41 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 -2.11 2.77 0.12 3.10 1.51 -0.85 0.12 117.35 122.02 1p88 s TYR 148 Ca 0.00 -0.43 -0.24 0.00 -1.01 0.00 0.00 57.07 55.39 1p88 s TYR 148 Cb 0.00 -2.03 -0.05 0.00 -0.11 0.00 0.00 41.96 39.77 1p88 s TYR 148 CO 0.00 0.00 1.21 -2.30 -1.11 0.00 0.00 175.55 173.36 1p88 n PRO 149 N -1.47 -0.34 -1.59 -1.71 -0.02 -1.26 -4.28 135.00 124.33 1p88 n PRO 149 Ca 0.01 1.19 -0.40 0.00 -2.02 0.00 0.00 63.50 62.28 1p88 n PRO 149 Cb 0.61 -1.75 0.02 0.00 -0.02 0.00 0.00 33.50 32.36 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 -4.92 1.13 -3.67 0.52 -0.02 -1.04 -4.40 135.00 122.60 1p88 n PRO 150 Ca 0.02 0.41 -0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1p88 n PRO 150 Cb 0.20 -1.99 -0.08 0.00 -0.02 0.00 0.00 33.50 31.60 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 -0.51 -0.34 -0.43 2.45 1.43 -0.90 -4.00 118.68 116.39 1p88 s LEU 151 Ca 0.66 1.21 -0.07 0.00 -1.03 0.00 0.00 54.13 54.90 1p88 s LEU 151 Cb -0.52 2.01 0.10 0.00 0.03 0.00 0.00 46.19 47.81 1p88 s LEU 151 CO 0.55 -0.21 0.26 -0.13 0.23 0.00 0.00 176.35 177.05 1p88 s ARG 152 N 0.61 2.35 0.20 1.70 0.52 0.14 -0.49 118.95 123.98 1p88 s ARG 152 Ca -0.02 -1.69 -0.12 0.00 -0.52 0.00 0.00 55.73 53.38 1p88 s ARG 152 Cb -0.05 -3.75 -0.07 0.00 0.52 0.00 0.00 34.95 31.61 1p88 s ARG 152 CO -0.03 -1.07 0.56 -0.51 0.02 0.00 0.00 175.30 174.26 1p88 s LEU 153 N 1.30 4.23 0.00 2.53 1.43 0.45 -1.74 118.68 126.87 1p88 s LEU 153 Ca 0.05 1.00 0.06 0.00 -1.03 0.00 0.00 54.13 54.22 1p88 s LEU 153 Cb -0.24 -3.54 0.10 0.00 0.03 0.00 0.00 46.19 42.54 1p88 s LEU 153 CO -0.01 -0.01 0.91 0.00 0.23 0.00 0.00 176.35 177.47 1p88 n GLN 154 N 0.22 0.00 0.00 1.70 6.02 -0.58 -0.54 117.38 124.20 1p88 n GLN 154 Ca -0.02 -0.99 0.00 0.00 -0.01 0.00 0.00 57.00 55.99 1p88 n GLN 154 Cb 0.52 -0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.77 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 0.12 0.54 0.00 1.08 0.00 -1.23 -4.00 105.19 101.71 1p88 n GLY 155 Ca -0.05 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 2.07 3.68 -0.02 0.00 -0.50 0.47 105.19 110.89 1p88 n GLY 156 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1p88 n GLY 156 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1p88 n PHE 157 N -1.26 2.51 -0.03 1.61 -0.00 0.19 -3.82 117.46 116.65 1p88 n PHE 157 Ca 0.00 -0.19 -0.03 0.00 -0.00 0.00 0.00 57.45 57.23 1p88 n PHE 157 Cb 0.00 -2.74 -0.04 0.00 -0.00 0.00 0.00 39.48 36.70 1p88 n PHE 157 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1p88 n THR 158 N 5.07 0.37 0.00 -2.13 -2.24 0.41 -4.55 114.28 111.21 1p88 n THR 158 Ca 0.20 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1p88 n THR 158 Cb 0.37 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 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 2.77 0.92 0.00 3.38 0.00 0.68 0.14 105.19 113.07 1p88 n GLY 159 Ca -0.09 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.99 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 3.60 -0.02 0.00 -0.70 -4.12 105.19 106.47 1p88 n GLY 160 Ca 0.00 -1.80 -0.57 0.00 0.00 0.00 0.00 46.02 43.65 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 2.03 -4.64 1.61 3.02 -1.26 -3.65 115.26 112.37 1p88 n ASN 161 Ca 0.00 0.88 -0.32 0.00 -0.03 0.00 0.00 54.58 55.11 1p88 n ASN 161 Cb 0.00 -1.12 -0.10 0.00 -0.61 0.00 0.00 39.78 37.96 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 4.69 3.89 -0.21 2.41 1.01 0.62 -4.78 120.40 128.03 1p88 s VAL 162 Ca 1.04 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 1p88 s VAL 162 Cb -1.11 -2.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 1p88 s VAL 162 CO 0.63 0.36 -0.07 -1.81 0.00 0.00 0.00 175.10 174.22 1p88 s ASP 163 N -1.55 4.08 -0.09 3.32 1.01 -1.26 -0.48 116.67 121.69 1p88 s ASP 163 Ca 0.19 -0.44 -0.00 0.00 0.71 0.00 0.00 52.55 53.00 1p88 s ASP 163 Cb -0.11 -1.69 0.02 0.00 1.01 0.00 0.00 42.92 42.15 1p88 s ASP 163 CO 0.09 -0.02 -0.05 -0.69 0.21 0.00 0.00 175.17 174.72 1p88 s VAL 164 N 1.44 0.78 0.29 -1.27 1.01 -0.65 -4.41 120.40 117.58 1p88 s VAL 164 Ca 0.06 -0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 1p88 s VAL 164 Cb -0.14 -0.84 -0.13 0.00 0.00 0.00 0.00 36.38 35.27 1p88 s VAL 164 CO -0.05 0.32 1.27 -0.67 0.00 0.00 0.00 175.10 175.97 1p88 n ASP 165 N 4.87 2.40 0.30 3.32 -0.08 -1.26 -2.64 116.55 123.47 1p88 n ASP 165 Ca -0.12 1.18 0.19 0.00 -1.51 0.00 0.00 54.79 54.52 1p88 n ASP 165 Cb 0.50 -1.41 1.02 0.00 2.34 0.00 0.00 41.12 43.57 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 3.04 0.00 0.00 0.27 0.00 -1.22 -3.41 103.07 101.75 1p88 h GLY 166 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1p88 h GLY 166 CO 0.67 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.65 1p88 n SER 167 N -3.46 0.00 0.00 0.19 7.64 -1.26 0.16 113.62 116.89 1p88 n SER 167 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1p88 n SER 167 Cb 0.14 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 1p88 n SER 167 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1p88 n VAL 168 N 0.00 0.00 -4.07 0.44 0.31 -1.26 -4.25 118.33 109.50 1p88 n VAL 168 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 1p88 n VAL 168 Cb 0.00 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 32.80 1p88 n VAL 168 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1p88 s SER 169 N -4.00 0.60 0.50 4.52 0.15 -1.26 -4.93 113.70 109.28 1p88 s SER 169 Ca 0.00 -0.32 0.34 0.00 0.70 0.00 0.00 55.95 56.67 1p88 s SER 169 Cb 0.00 0.00 1.80 0.00 -1.71 0.00 0.00 66.02 66.11 1p88 s SER 169 CO 0.00 -0.09 2.03 0.77 1.20 0.00 0.00 173.24 177.14 1p88 h SER 170 N 5.25 0.00 0.98 5.45 4.64 -1.89 0.19 113.55 128.18 1p88 h SER 170 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1p88 h SER 170 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1p88 h SER 170 CO 0.45 0.00 -0.12 0.00 -0.87 0.00 0.00 176.83 176.29 1p88 n GLN 171 N -2.69 0.06 0.04 4.77 3.00 -1.26 -2.34 117.38 118.96 1p88 n GLN 171 Ca -0.02 0.04 -0.10 0.00 -0.01 0.00 0.00 57.00 56.91 1p88 n GLN 171 Cb 0.07 -1.56 -0.07 0.00 0.00 0.00 0.00 30.24 28.68 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 -0.18 -0.51 1.08 -1.00 -1.31 -1.49 116.94 113.53 1p88 h PHE 172 Ca 0.00 -0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.69 1p88 h PHE 172 Cb 0.55 0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.15 1p88 h PHE 172 CO 0.00 0.25 -0.01 1.25 -1.61 0.00 0.00 178.31 178.18 1p88 h LEU 173 N -0.90 0.84 -1.55 1.54 6.46 -1.67 -2.00 115.31 118.03 1p88 h LEU 173 Ca -0.02 -0.22 0.05 0.00 -0.12 0.00 0.00 57.88 57.57 1p88 h LEU 173 Cb 0.51 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.19 1p88 h LEU 173 CO 0.03 0.91 0.37 0.74 -0.62 0.00 0.00 178.44 179.87 1p88 h THR 174 N 0.80 1.02 -0.44 1.05 2.02 -1.52 0.96 112.91 116.81 1p88 h THR 174 Ca 0.15 -0.20 -0.13 0.00 0.77 0.00 0.00 66.41 67.00 1p88 h THR 174 Cb 0.50 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1p88 h THR 174 CO 0.02 0.10 -0.24 0.00 0.37 0.00 0.00 175.52 175.78 1p88 h ALA 175 N 1.69 0.74 0.02 6.16 0.00 -0.50 -2.69 119.26 124.68 1p88 h ALA 175 Ca 0.23 -0.40 -0.22 0.00 0.00 0.00 0.00 54.91 54.53 1p88 h ALA 175 Cb 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1p88 h ALA 175 CO -0.06 0.66 -0.97 -0.07 0.00 0.00 0.00 179.25 178.81 1p88 h LEU 176 N 0.78 0.39 -1.17 0.00 3.38 -1.14 -2.12 115.31 115.43 1p88 h LEU 176 Ca 0.10 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.75 1p88 h LEU 176 Cb 0.80 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 1p88 h LEU 176 CO 0.07 1.15 0.57 -0.07 0.09 0.00 0.00 178.44 180.25 1p88 h LEU 177 N 0.15 0.96 0.15 1.67 4.07 -0.76 0.64 115.31 122.19 1p88 h LEU 177 Ca -0.07 -0.02 -0.24 0.00 0.08 0.00 0.00 57.88 57.63 1p88 h LEU 177 Cb 1.62 -0.24 0.02 0.00 1.08 0.00 0.00 40.66 43.14 1p88 h LEU 177 CO 0.16 0.69 -1.09 0.24 -1.08 0.00 0.00 178.44 177.36 1p88 h MET 178 N 1.13 0.32 -0.18 1.13 2.86 -1.48 -3.35 114.93 115.37 1p88 h MET 178 Ca 0.32 -0.55 -0.22 0.00 -2.06 0.00 0.00 59.70 57.19 1p88 h MET 178 Cb -0.09 0.20 0.01 0.00 0.06 0.00 0.00 31.60 31.78 1p88 h MET 178 CO -0.08 1.26 -0.74 1.15 1.06 0.00 0.00 176.91 179.56 1p88 h THR 179 N -0.27 1.28 -0.86 2.22 2.02 -1.25 -3.33 112.91 112.71 1p88 h THR 179 Ca -0.21 -1.94 0.02 0.00 0.77 0.00 0.00 66.41 65.06 1p88 h THR 179 Cb 1.76 1.92 -0.05 0.00 -1.74 0.00 0.00 68.15 70.05 1p88 h THR 179 CO 0.14 0.62 0.56 0.00 0.37 0.00 0.00 175.52 177.21 1p88 h ALA 180 N 0.58 1.10 0.00 6.16 0.00 0.13 -2.39 119.26 124.84 1p88 h ALA 180 Ca -0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1p88 h ALA 180 Cb 1.37 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1p88 h ALA 180 CO 0.16 0.45 -0.23 -1.00 0.00 0.00 0.00 179.25 178.63 1p88 h PRO 181 N 1.13 0.00 -0.00 0.00 0.13 -1.69 0.14 132.00 131.71 1p88 h PRO 181 Ca 0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.46 1p88 h PRO 181 Cb -0.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.05 1p88 h PRO 181 CO -0.09 0.23 -0.00 1.28 -0.23 0.00 0.00 178.00 179.19 1p88 n LEU 182 N -4.02 0.47 -4.75 1.56 4.77 -0.93 0.18 117.00 114.28 1p88 n LEU 182 Ca -0.02 -0.15 -0.40 0.00 -0.03 0.00 0.00 56.01 55.41 1p88 n LEU 182 Cb 0.31 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.33 1p88 n LEU 182 CO 0.35 0.08 0.57 0.00 -1.33 0.00 0.00 177.39 177.06 1p88 s ALA 183 N -2.02 3.35 0.46 -1.18 0.00 0.50 -4.33 121.76 118.54 1p88 s ALA 183 Ca 0.44 0.46 0.24 0.00 0.00 0.00 0.00 51.96 53.10 1p88 s ALA 183 Cb 0.22 -3.11 1.25 0.00 0.00 0.00 0.00 23.12 21.48 1p88 s ALA 183 CO 0.36 0.13 1.85 -1.00 0.00 0.00 0.00 175.76 177.11 1p88 h PRO 184 N 4.93 0.23 -6.24 0.00 0.13 -1.62 2.66 132.00 132.09 1p88 h PRO 184 Ca -0.45 -0.01 -0.69 0.00 -0.87 0.00 0.00 66.00 63.98 1p88 h PRO 184 Cb 1.21 -0.05 -0.22 0.00 0.13 0.00 0.00 31.00 32.06 1p88 h PRO 184 CO 0.69 0.15 -0.75 -2.00 -0.23 0.00 0.00 178.00 175.86 1p88 s GLU 185 N -5.25 2.60 0.45 0.86 2.12 0.37 -4.08 118.70 115.76 1p88 s GLU 185 Ca -0.07 -0.66 -0.23 0.00 0.36 0.00 0.00 54.97 54.37 1p88 s GLU 185 Cb 0.23 -2.44 -0.09 0.00 0.26 0.00 0.00 34.13 32.08 1p88 s GLU 185 CO 0.78 0.61 1.03 -0.25 -0.54 0.00 0.00 175.26 176.90 1p88 n ASP 186 N 2.35 1.34 -4.28 -1.70 9.92 -1.26 -3.91 116.55 119.01 1p88 n ASP 186 Ca -0.17 1.00 -0.26 0.00 -0.53 0.00 0.00 54.79 54.83 1p88 n ASP 186 Cb 0.52 -1.38 -0.14 0.00 -0.64 0.00 0.00 41.12 39.49 1p88 n ASP 186 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1p88 s THR 187 N -1.31 1.77 -0.15 -3.53 2.01 0.15 -1.71 115.64 112.86 1p88 s THR 187 Ca 0.65 -1.31 0.00 0.00 0.31 0.00 0.00 61.69 61.34 1p88 s THR 187 Cb -0.52 -1.55 0.03 0.00 0.01 0.00 0.00 72.50 70.47 1p88 s THR 187 CO 0.55 0.18 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.87 1p88 s VAL 188 N -0.87 1.36 -0.30 3.82 1.01 -1.24 -0.65 120.40 123.53 1p88 s VAL 188 Ca 0.08 -0.63 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 1p88 s VAL 188 Cb -0.09 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 1p88 s VAL 188 CO 0.02 0.30 0.19 -0.63 0.00 0.00 0.00 175.10 174.99 1p88 s ILE 189 N 1.55 5.12 -0.24 2.22 1.09 -0.03 0.23 121.20 131.14 1p88 s ILE 189 Ca 0.03 -0.05 -0.10 0.00 -1.10 0.00 0.00 60.65 59.43 1p88 s ILE 189 Cb -0.14 -3.51 -0.05 0.00 -1.06 0.00 0.00 42.46 37.70 1p88 s ILE 189 CO -0.09 0.16 0.14 -0.60 -0.10 0.00 0.00 174.94 174.45 1p88 s ARG 190 N 1.72 4.02 -0.22 2.79 3.52 0.37 0.22 118.95 131.36 1p88 s ARG 190 Ca 0.06 -0.30 -0.17 0.00 -0.13 0.00 0.00 55.73 55.20 1p88 s ARG 190 Cb -0.16 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.70 1p88 s ARG 190 CO 0.10 0.05 0.44 0.42 -0.81 0.00 0.00 175.30 175.49 1p88 s ILE 191 N 1.07 5.15 -0.80 4.11 1.09 -1.25 -1.64 121.20 128.94 1p88 s ILE 191 Ca 0.07 0.77 -0.24 0.00 -1.10 0.00 0.00 60.65 60.15 1p88 s ILE 191 Cb -0.14 -3.77 0.05 0.00 -1.06 0.00 0.00 42.46 37.55 1p88 s ILE 191 CO 0.04 0.19 1.22 -0.54 -0.10 0.00 0.00 174.94 175.76 1p88 s LYS 192 N 1.66 3.30 0.00 2.79 1.02 -1.08 -4.60 119.74 122.82 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 -4.52 0.00 0.00 -0.52 0.00 0.00 37.83 32.64 1p88 s LYS 192 CO 0.09 -2.04 0.00 0.41 -0.92 0.00 0.00 175.35 172.89 1p88 n GLY 193 N 5.70 0.94 3.28 -3.33 0.00 -1.26 -0.81 105.19 109.71 1p88 n GLY 193 Ca 0.10 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.28 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 3.65 0.35 1.61 1.01 -1.26 -4.82 116.67 113.21 1p88 s ASP 194 Ca 0.00 -0.45 -0.23 0.00 0.71 0.00 0.00 52.55 52.58 1p88 s ASP 194 Cb 0.00 -1.55 -0.15 0.00 1.01 0.00 0.00 42.92 42.23 1p88 s ASP 194 CO 0.00 0.12 0.30 0.18 0.21 0.00 0.00 175.17 175.98 1p88 n LEU 195 N 3.84 -1.85 0.12 1.23 4.77 -1.22 -3.99 117.00 119.91 1p88 n LEU 195 Ca -0.19 0.92 -0.02 0.00 -0.03 0.00 0.00 56.01 56.68 1p88 n LEU 195 Cb 0.52 -0.95 0.14 0.00 -2.33 0.00 0.00 43.42 40.80 1p88 n LEU 195 CO 0.29 -3.60 0.46 1.62 -1.33 0.00 0.00 177.39 174.83 1p88 h VAL 196 N 0.62 1.46 0.00 4.08 3.04 0.13 -3.40 116.25 122.17 1p88 h VAL 196 Ca -0.35 -2.20 -0.22 0.00 -1.01 0.00 0.00 66.70 62.92 1p88 h VAL 196 Cb 1.43 2.18 -0.14 0.00 -2.01 0.00 0.00 31.29 32.75 1p88 h VAL 196 CO 0.51 0.63 -0.39 -0.24 -1.01 0.00 0.00 177.57 177.07 1p88 n SER 197 N -3.78 -2.33 -0.34 3.17 2.88 -1.26 -4.88 113.62 107.08 1p88 n SER 197 Ca -0.01 -3.39 0.16 0.00 -1.33 0.00 0.00 58.87 54.30 1p88 n SER 197 Cb 0.64 1.81 0.32 0.00 -0.75 0.00 0.00 64.21 66.23 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 0.68 -0.08 -0.34 -1.46 4.81 -1.26 0.11 118.16 120.62 1p88 n LYS 198 Ca 0.05 1.46 0.23 0.00 -0.87 0.00 0.00 58.31 59.19 1p88 n LYS 198 Cb 0.69 -2.35 0.50 0.00 0.02 0.00 0.00 35.03 33.88 1p88 n LYS 198 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1p88 h PRO 199 N 0.00 0.38 -0.31 1.64 0.11 -1.97 0.75 132.00 132.60 1p88 h PRO 199 Ca 0.62 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.68 1p88 h PRO 199 Cb 1.33 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1p88 h PRO 199 CO -0.91 0.25 0.09 1.88 -0.21 0.00 0.00 178.00 179.11 1p88 h TYR 200 N 0.39 0.51 -0.70 0.65 0.05 0.43 -2.29 116.97 116.01 1p88 h TYR 200 Ca 0.64 -0.05 -0.00 0.00 0.05 0.00 0.00 58.73 59.36 1p88 h TYR 200 Cb 1.58 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 39.14 1p88 h TYR 200 CO -0.00 0.53 0.42 0.82 -1.05 0.00 0.00 178.16 178.87 1p88 h ILE 201 N 0.35 1.20 -0.36 -2.88 1.08 0.48 -0.28 117.51 117.10 1p88 h ILE 201 Ca 0.10 -0.44 0.02 0.00 -0.39 0.00 0.00 64.86 64.14 1p88 h ILE 201 Cb 0.26 0.21 -0.02 0.00 -3.07 0.00 0.00 36.82 34.20 1p88 h ILE 201 CO -0.00 0.21 0.21 0.44 -0.69 0.00 0.00 178.15 178.31 1p88 h ASP 202 N 0.97 0.33 -0.35 1.72 3.32 -0.07 0.39 116.42 122.73 1p88 h ASP 202 Ca 0.25 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.30 1p88 h ASP 202 Cb -0.03 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1p88 h ASP 202 CO -0.05 0.24 0.20 0.40 -1.72 0.00 0.00 179.24 178.32 1p88 h ILE 203 N 0.42 1.13 -0.19 0.35 2.04 -0.87 -0.48 117.51 119.91 1p88 h ILE 203 Ca 0.14 -0.31 0.05 0.00 1.00 0.00 0.00 64.86 65.74 1p88 h ILE 203 Cb 0.01 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 36.74 1p88 h ILE 203 CO -0.07 0.13 -0.14 0.74 0.00 0.00 0.00 178.15 178.81 1p88 h THR 204 N 0.45 0.60 0.00 -0.27 2.02 -0.36 2.88 112.91 118.23 1p88 h THR 204 Ca 0.12 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.23 1p88 h THR 204 Cb 0.03 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 1p88 h THR 204 CO -0.02 0.00 -0.36 -0.07 0.37 0.00 0.00 175.52 175.44 1p88 h LEU 205 N -0.14 0.00 0.05 2.58 3.38 -0.76 1.46 115.31 121.88 1p88 h LEU 205 Ca 0.11 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 1p88 h LEU 205 Cb 0.31 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1p88 h LEU 205 CO -0.28 0.36 -0.49 -1.13 0.09 0.00 0.00 178.44 176.99 1p88 h ASN 206 N 0.00 0.35 0.09 -0.43 -1.24 0.14 0.02 115.58 114.50 1p88 h ASN 206 Ca -0.00 -0.87 -0.13 0.00 0.71 0.00 0.00 56.30 56.02 1p88 h ASN 206 Cb 0.70 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.63 1p88 h ASN 206 CO 0.05 1.18 -0.43 0.25 -1.29 0.00 0.00 177.43 177.19 1p88 h LEU 207 N -0.43 0.45 -0.54 0.34 5.85 0.53 -1.96 115.31 119.54 1p88 h LEU 207 Ca -0.08 -0.20 -0.16 0.00 0.84 0.00 0.00 57.88 58.28 1p88 h LEU 207 Cb 1.30 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 1p88 h LEU 207 CO 0.09 0.83 -0.65 0.24 -0.34 0.00 0.00 178.44 178.61 1p88 h MET 208 N 0.35 0.32 -0.64 1.25 2.86 0.20 -3.00 114.93 116.27 1p88 h MET 208 Ca 0.03 -0.24 -0.03 0.00 -2.06 0.00 0.00 59.70 57.40 1p88 h MET 208 Cb 0.90 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.57 1p88 h MET 208 CO 0.08 0.86 0.27 0.87 1.06 0.00 0.00 176.91 180.04 1p88 h LYS 209 N 0.23 0.93 0.00 1.72 1.57 -0.52 -0.44 116.57 120.06 1p88 h LYS 209 Ca -0.01 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 1p88 h LYS 209 Cb 1.19 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 1p88 h LYS 209 CO 0.11 0.75 -0.12 0.00 -0.57 0.00 0.00 179.45 179.62 1p88 h THR 210 N 0.92 0.93 -0.00 -0.16 1.03 -1.22 -0.07 112.91 114.34 1p88 h THR 210 Ca 0.22 -0.44 0.00 0.00 -0.01 0.00 0.00 66.41 66.18 1p88 h THR 210 Cb 0.16 1.25 0.00 0.00 -1.07 0.00 0.00 68.15 68.49 1p88 h THR 210 CO -0.02 0.12 -0.09 0.49 -0.01 0.00 0.00 175.52 176.01 1p88 n PHE 211 N -4.17 0.00 0.00 0.00 3.72 -0.21 -4.18 117.46 112.62 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 0.20 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.48 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 1.32 1.12 3.30 1.37 0.00 -0.04 0.12 105.19 112.38 1p88 n GLY 212 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 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 1.84 -0.00 1.61 -7.23 -0.99 -4.76 120.40 108.87 1p88 s VAL 213 Ca 0.00 -1.51 0.04 0.00 -1.81 0.00 0.00 61.98 58.70 1p88 s VAL 213 Cb 0.00 -1.64 -0.01 0.00 0.56 0.00 0.00 36.38 35.28 1p88 s VAL 213 CO 0.00 0.05 -0.14 -1.61 -0.31 0.00 0.00 175.10 173.09 1p88 s GLU 214 N -1.76 1.08 0.09 4.82 2.02 -1.26 -2.35 118.70 121.33 1p88 s GLU 214 Ca 0.08 -0.52 0.09 0.00 0.02 0.00 0.00 54.97 54.65 1p88 s GLU 214 Cb -0.10 -1.05 -0.03 0.00 0.10 0.00 0.00 34.13 33.05 1p88 s GLU 214 CO 0.04 0.29 -0.23 0.42 0.02 0.00 0.00 175.26 175.80 1p88 s ILE 215 N -0.38 1.87 -0.27 -1.63 -1.09 -1.26 -4.46 121.20 113.98 1p88 s ILE 215 Ca 0.05 -1.50 -0.09 0.00 -2.23 0.00 0.00 60.65 56.87 1p88 s ILE 215 Cb -0.06 -1.66 -0.03 0.00 -1.58 0.00 0.00 42.46 39.13 1p88 s ILE 215 CO -0.00 0.08 0.13 -0.70 -1.23 0.00 0.00 174.94 173.21 1p88 s GLU 216 N -1.72 3.71 0.40 2.79 2.12 0.18 -4.94 118.70 121.24 1p88 s GLU 216 Ca 0.09 -0.46 -0.17 0.00 0.36 0.00 0.00 54.97 54.79 1p88 s GLU 216 Cb -0.10 -3.50 -0.09 0.00 0.26 0.00 0.00 34.13 30.70 1p88 s GLU 216 CO 0.04 -0.23 0.86 0.54 -0.54 0.00 0.00 175.26 175.93 1p88 s ASN 217 N 1.67 6.79 0.00 -1.70 6.03 -1.26 0.96 114.94 127.43 1p88 s ASN 217 Ca 0.06 1.46 0.00 0.00 -1.03 0.00 0.00 52.86 53.35 1p88 s ASN 217 Cb -0.16 -2.45 0.00 0.00 -3.03 0.00 0.00 41.25 35.61 1p88 s ASN 217 CO 0.07 -0.34 0.00 0.00 -2.03 0.00 0.00 177.10 174.80 1p88 n GLN 218 N -0.75 3.61 -0.82 3.55 6.02 0.17 -4.89 117.38 124.27 1p88 n GLN 218 Ca 0.05 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.71 1p88 n GLN 218 Cb 0.54 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.75 1p88 n GLN 218 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1p88 n HIS 219 N 0.00 1.25 -3.13 1.08 8.25 -1.26 -4.12 115.22 117.29 1p88 n HIS 219 Ca 0.00 -1.51 -0.21 0.00 -0.26 0.00 0.00 57.72 55.73 1p88 n HIS 219 Cb 0.00 -1.43 0.01 0.00 1.12 0.00 0.00 29.99 29.69 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 6.55 -1.78 0.00 4.41 9.36 -1.26 -4.71 117.16 129.73 1p88 n TYR 220 Ca 0.42 0.42 0.00 0.00 3.32 0.00 0.00 57.90 62.06 1p88 n TYR 220 Cb 0.29 -3.39 0.00 0.00 -0.63 0.00 0.00 39.34 35.61 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 -3.69 0.00 0.00 2.98 10.64 -1.26 -4.20 117.38 121.85 1p88 n GLN 221 Ca -0.06 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.11 1p88 n GLN 221 Cb 0.58 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.96 1p88 n GLN 221 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 1p88 n GLN 222 N 0.00 0.00 -4.96 2.61 6.02 -1.19 -3.74 117.38 116.11 1p88 n GLN 222 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.72 1p88 n GLN 222 Cb 0.00 0.00 -0.16 0.00 1.02 0.00 0.00 30.24 31.10 1p88 n GLN 222 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1p88 s PHE 223 N 0.00 1.79 -0.22 1.08 0.40 0.58 0.41 117.98 122.02 1p88 s PHE 223 Ca 0.00 -0.37 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 1p88 s PHE 223 Cb 0.00 -1.16 0.04 0.00 0.51 0.00 0.00 43.02 42.42 1p88 s PHE 223 CO 0.00 -0.05 -0.13 0.08 0.70 0.00 0.00 175.22 175.81 1p88 s VAL 224 N -0.39 2.02 -0.12 -0.44 1.01 0.27 -0.86 120.40 121.89 1p88 s VAL 224 Ca 0.06 -1.30 0.02 0.00 0.00 0.00 0.00 61.98 60.76 1p88 s VAL 224 Cb -0.08 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1p88 s VAL 224 CO -0.00 0.18 -0.20 0.54 0.00 0.00 0.00 175.10 175.62 1p88 s VAL 225 N 1.22 1.83 -0.01 2.92 0.11 0.18 0.49 120.40 127.14 1p88 s VAL 225 Ca -0.03 -0.85 -0.30 0.00 -2.93 0.00 0.00 61.98 57.87 1p88 s VAL 225 Cb -0.17 -1.63 -0.04 0.00 -1.53 0.00 0.00 36.38 33.01 1p88 s VAL 225 CO -0.08 0.51 1.23 -0.54 -3.33 0.00 0.00 175.10 172.88 1p88 s LYS 226 N 0.80 4.37 0.86 1.54 3.01 -1.26 -0.68 119.74 128.38 1p88 s LYS 226 Ca -0.09 1.74 -0.13 0.00 -1.01 0.00 0.00 55.97 56.49 1p88 s LYS 226 Cb -0.16 -3.49 0.20 0.00 -1.01 0.00 0.00 37.83 33.37 1p88 s LYS 226 CO -0.00 -0.40 1.17 0.41 0.51 0.00 0.00 175.35 177.04 1p88 n GLY 227 N 3.36 -1.15 2.41 -3.33 0.00 -1.26 -4.26 105.19 100.96 1p88 n GLY 227 Ca 0.11 -1.76 -0.15 0.00 0.00 0.00 0.00 46.02 44.22 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 -2.83 1.29 2.35 -0.02 0.00 0.89 -4.80 105.19 102.07 1p88 n GLY 228 Ca 0.15 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.67 1p88 n GLY 228 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1p88 n GLN 229 N -2.55 -0.99 -3.78 1.61 6.02 0.49 -4.96 117.38 113.21 1p88 n GLN 229 Ca -0.15 -1.24 -0.13 0.00 -0.01 0.00 0.00 57.00 55.47 1p88 n GLN 229 Cb 0.50 -0.87 -0.09 0.00 1.02 0.00 0.00 30.24 30.80 1p88 n GLN 229 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1p88 s SER 230 N -3.92 -0.19 -0.18 1.08 0.15 -1.26 -4.58 113.70 104.80 1p88 s SER 230 Ca 0.46 0.16 -0.08 0.00 0.70 0.00 0.00 55.95 57.20 1p88 s SER 230 Cb -0.02 0.37 -0.04 0.00 -1.71 0.00 0.00 66.02 64.62 1p88 s SER 230 CO 0.33 -0.36 0.07 -0.31 1.20 0.00 0.00 173.24 174.16 1p88 s TYR 231 N -1.01 3.27 0.09 3.44 2.02 -1.26 -4.47 117.35 119.44 1p88 s TYR 231 Ca -0.11 0.10 0.10 0.00 -0.37 0.00 0.00 57.07 56.79 1p88 s TYR 231 Cb -0.05 -2.09 -0.03 0.00 -0.40 0.00 0.00 41.96 39.39 1p88 s TYR 231 CO 0.03 0.17 -0.25 -0.65 -1.57 0.00 0.00 175.55 173.28 1p88 s GLN 232 N 0.36 1.44 -0.34 -0.62 -0.21 0.32 0.07 119.66 120.67 1p88 s GLN 232 Ca 0.04 -1.21 -0.29 0.00 0.02 0.00 0.00 55.36 53.92 1p88 s GLN 232 Cb -0.12 -1.77 -0.01 0.00 1.00 0.00 0.00 33.01 32.11 1p88 s GLN 232 CO -0.00 0.43 1.59 -1.54 -2.12 0.00 0.00 175.29 173.65 1p88 s SER 233 N -1.73 6.19 0.00 5.90 1.04 -0.87 -4.41 113.70 119.82 1p88 s SER 233 Ca 0.11 1.15 0.13 0.00 0.48 0.00 0.00 55.95 57.83 1p88 s SER 233 Cb -0.10 -2.53 0.80 0.00 0.10 0.00 0.00 66.02 64.29 1p88 s SER 233 CO 0.04 -1.49 1.23 -0.81 0.98 0.00 0.00 173.24 173.19 1p88 n PRO 234 N 8.11 0.50 0.00 4.02 -0.04 -1.26 -4.89 135.00 141.45 1p88 n PRO 234 Ca 0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 1p88 n PRO 234 Cb 0.47 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 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 0.01 0.99 3.36 0.55 0.00 -1.26 -4.88 105.19 103.95 1p88 n GLY 235 Ca 0.10 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 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 2.50 -0.06 2.61 2.01 -1.26 0.13 115.64 121.57 1p88 s THR 236 Ca 0.00 -0.92 0.00 0.00 0.31 0.00 0.00 61.69 61.08 1p88 s THR 236 Cb 0.00 -1.94 0.02 0.00 0.01 0.00 0.00 72.50 70.59 1p88 s THR 236 CO 0.00 0.58 -0.03 -0.47 -0.69 0.00 0.00 174.62 174.00 1p88 s TYR 237 N -0.44 0.79 -0.41 4.92 6.14 0.62 -4.87 117.35 124.09 1p88 s TYR 237 Ca 0.05 -0.24 -0.18 0.00 0.64 0.00 0.00 57.07 57.34 1p88 s TYR 237 Cb -0.12 -0.76 0.02 0.00 0.42 0.00 0.00 41.96 41.52 1p88 s TYR 237 CO 0.01 -0.27 0.51 -1.17 0.64 0.00 0.00 175.55 175.28 1p88 s LEU 238 N 1.34 4.66 -0.45 6.97 1.98 -1.26 0.90 118.68 132.83 1p88 s LEU 238 Ca -0.04 -0.46 -0.28 0.00 -2.89 0.00 0.00 54.13 50.46 1p88 s LEU 238 Cb -0.13 -2.52 0.03 0.00 0.66 0.00 0.00 46.19 44.22 1p88 s LEU 238 CO -0.02 -0.62 1.06 -0.69 -1.89 0.00 0.00 176.35 174.19 1p88 s VAL 239 N 2.38 4.33 -2.22 1.68 1.01 0.10 -4.89 120.40 122.79 1p88 s VAL 239 Ca 0.16 1.16 0.30 0.00 0.00 0.00 0.00 61.98 63.60 1p88 s VAL 239 Cb -0.16 -4.52 0.75 0.00 0.00 0.00 0.00 36.38 32.45 1p88 s VAL 239 CO 0.15 -0.87 2.01 -0.62 0.00 0.00 0.00 175.10 175.77