#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 0.27 6.43 6.94 -1.26 0.10 115.26 127.74 1p88 n ASN 26 Ca 0.00 0.71 -0.15 0.00 -0.02 0.00 0.00 54.58 55.12 1p88 n ASN 26 Cb 0.00 -0.26 -0.08 0.00 -2.36 0.00 0.00 39.78 37.08 1p88 n ASN 26 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 1p88 h ARG 27 N 0.00 -0.67 -0.98 -3.83 -0.00 -1.98 -1.54 114.38 105.38 1p88 h ARG 27 Ca 0.00 0.05 0.25 0.00 -0.50 0.00 0.00 59.98 59.77 1p88 h ARG 27 Cb 0.00 0.15 -0.18 0.00 0.00 0.00 0.00 29.97 29.94 1p88 h ARG 27 CO 0.00 -0.37 -0.05 0.00 0.00 0.00 0.00 179.97 179.55 1p88 h ALA 28 N -0.50 1.01 -0.00 0.04 0.00 -1.90 1.02 119.26 118.92 1p88 h ALA 28 Ca -0.07 0.35 -0.22 0.00 0.00 0.00 0.00 54.91 54.97 1p88 h ALA 28 Cb 0.60 0.64 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1p88 h ALA 28 CO 0.12 -0.52 -0.92 -0.07 0.00 0.00 0.00 179.25 177.86 1p88 h LEU 29 N 0.01 0.49 -0.01 0.00 3.38 0.71 -1.03 115.31 118.86 1p88 h LEU 29 Ca 0.56 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1p88 h LEU 29 Cb 1.08 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 1p88 h LEU 29 CO -0.94 1.19 -0.01 0.25 0.09 0.00 0.00 178.44 179.02 1p88 h LEU 30 N 0.22 0.02 -1.39 1.67 5.85 0.89 -1.37 115.31 121.20 1p88 h LEU 30 Ca -0.07 -0.45 -0.06 0.00 0.84 0.00 0.00 57.88 58.14 1p88 h LEU 30 Cb 1.55 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.57 1p88 h LEU 30 CO 0.16 0.46 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.37 1p88 h LEU 31 N -0.42 0.00 -0.59 2.25 3.38 0.71 0.19 115.31 120.83 1p88 h LEU 31 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1p88 h LEU 31 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1p88 h LEU 31 CO 0.00 0.28 -0.01 0.00 0.09 0.00 0.00 178.44 178.80 1p88 h ALA 32 N 1.72 0.80 0.21 1.53 0.00 -0.98 -1.53 119.26 121.02 1p88 h ALA 32 Ca -0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 54.91 54.29 1p88 h ALA 32 Cb 0.61 -0.22 0.03 0.00 0.00 0.00 0.00 17.79 18.21 1p88 h ALA 32 CO 0.04 0.65 -1.36 0.00 0.00 0.00 0.00 179.25 178.57 1p88 h ALA 33 N 0.98 -0.09 0.00 0.00 0.00 -0.75 -3.17 119.26 116.23 1p88 h ALA 33 Ca 0.17 -0.87 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 18.58 1p88 h ALA 33 CO 0.03 0.67 0.00 1.28 0.00 0.00 0.00 179.25 181.23 1p88 n LEU 34 N -3.81 0.00 -5.01 0.00 4.77 0.61 0.11 117.00 113.67 1p88 n LEU 34 Ca -0.18 0.21 -0.21 0.00 -0.03 0.00 0.00 56.01 55.80 1p88 n LEU 34 Cb 1.02 -0.21 0.07 0.00 -2.33 0.00 0.00 43.42 41.97 1p88 n LEU 34 CO 0.56 -0.13 0.39 0.00 -1.33 0.00 0.00 177.39 176.88 1p88 s ALA 35 N -2.42 4.31 -0.31 -1.18 0.00 -0.58 -1.08 121.76 120.50 1p88 s ALA 35 Ca 0.13 -1.89 -0.06 0.00 0.00 0.00 0.00 51.96 50.14 1p88 s ALA 35 Cb 0.08 -1.70 0.03 0.00 0.00 0.00 0.00 23.12 21.53 1p88 s ALA 35 CO 0.17 -0.97 0.07 -1.01 0.00 0.00 0.00 175.76 174.02 1p88 s HIS 36 N -2.79 3.19 0.00 0.00 3.76 0.15 0.12 115.29 119.72 1p88 s HIS 36 Ca 0.62 -1.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.27 1p88 s HIS 36 Cb -0.06 -2.24 0.00 0.00 1.11 0.00 0.00 32.58 31.39 1p88 s HIS 36 CO 0.40 -0.67 0.00 0.41 -0.85 0.00 0.00 174.74 174.03 1p88 n GLY 37 N 4.81 2.60 3.58 -2.22 0.00 -1.26 -1.00 105.19 111.71 1p88 n GLY 37 Ca -0.14 -2.07 -0.40 0.00 0.00 0.00 0.00 46.02 43.41 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 -2.33 3.84 0.10 1.61 2.20 -1.25 0.28 119.74 124.19 1p88 s LYS 38 Ca 0.00 -0.07 0.10 0.00 -0.36 0.00 0.00 55.97 55.64 1p88 s LYS 38 Cb 0.00 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 1p88 s LYS 38 CO 0.00 -0.43 -0.25 0.99 -0.36 0.00 0.00 175.35 175.31 1p88 s THR 39 N 2.17 2.35 -0.14 3.43 2.01 -0.94 -4.40 115.64 120.12 1p88 s THR 39 Ca 0.16 -1.59 -0.06 0.00 0.31 0.00 0.00 61.69 60.51 1p88 s THR 39 Cb -0.16 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.30 1p88 s THR 39 CO 0.11 0.18 0.06 -0.69 -0.69 0.00 0.00 174.62 173.59 1p88 s VAL 40 N -1.00 4.84 -0.26 3.82 1.01 0.45 -0.22 120.40 129.04 1p88 s VAL 40 Ca 0.14 -0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.04 1p88 s VAL 40 Cb -0.10 -3.12 0.01 0.00 0.00 0.00 0.00 36.38 33.17 1p88 s VAL 40 CO 0.06 0.55 0.01 -0.76 0.00 0.00 0.00 175.10 174.95 1p88 s LEU 41 N -0.38 3.45 0.07 3.92 2.01 0.31 0.22 118.68 128.29 1p88 s LEU 41 Ca 0.09 -0.70 0.02 0.00 0.01 0.00 0.00 54.13 53.56 1p88 s LEU 41 Cb -0.12 -1.78 -0.04 0.00 0.01 0.00 0.00 46.19 44.26 1p88 s LEU 41 CO 0.02 -0.14 0.11 0.28 1.01 0.00 0.00 176.35 177.63 1p88 s THR 42 N 1.44 4.73 -1.07 5.49 -1.32 0.25 -0.50 115.64 124.66 1p88 s THR 42 Ca 0.02 -0.67 0.00 0.00 -1.21 0.00 0.00 61.69 59.83 1p88 s THR 42 Cb -0.16 -3.28 0.00 0.00 -1.51 0.00 0.00 72.50 67.54 1p88 s THR 42 CO -0.01 0.13 0.00 -3.20 -2.21 0.00 0.00 174.62 169.34 1p88 n ASN 43 N 0.44 -3.96 -3.16 8.08 2.85 -0.86 0.29 115.26 118.94 1p88 n ASN 43 Ca -0.08 0.11 -0.12 0.00 -0.11 0.00 0.00 54.58 54.38 1p88 n ASN 43 Cb 0.51 -2.90 0.11 0.00 1.24 0.00 0.00 39.78 38.75 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 -1.50 0.00 -4.46 1.20 4.77 0.47 -4.70 117.00 112.78 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 0.51 -0.44 -0.13 0.00 -2.33 0.00 0.00 43.42 41.04 1p88 n LEU 44 CO 0.16 -2.02 -0.40 -0.22 -1.33 0.00 0.00 177.39 173.59 1p88 s LEU 45 N 0.00 3.01 -0.95 2.23 2.96 -1.26 -4.75 118.68 119.91 1p88 s LEU 45 Ca 0.26 -0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 53.79 1p88 s LEU 45 Cb -0.05 -1.69 0.13 0.00 0.50 0.00 0.00 46.19 45.08 1p88 s LEU 45 CO 0.22 0.20 1.17 -0.62 -1.32 0.00 0.00 176.35 176.00 1p88 s ASP 46 N 0.16 6.65 -0.23 3.68 -1.08 -1.26 -4.48 116.67 120.11 1p88 s ASP 46 Ca -0.04 -2.06 -0.27 0.00 -0.52 0.00 0.00 52.55 49.66 1p88 s ASP 46 Cb -0.14 -2.41 0.10 0.00 -1.46 0.00 0.00 42.92 39.00 1p88 s ASP 46 CO 0.04 -1.07 0.86 -0.44 0.52 0.00 0.00 175.17 175.08 1p88 s SER 47 N 3.68 -0.58 0.45 -0.34 0.01 -1.26 -5.01 113.70 110.64 1p88 s SER 47 Ca 0.34 1.00 0.39 0.00 1.31 0.00 0.00 55.95 59.00 1p88 s SER 47 Cb -0.04 0.97 1.41 0.00 0.21 0.00 0.00 66.02 68.57 1p88 s SER 47 CO -0.09 -0.28 1.30 0.47 0.41 0.00 0.00 173.24 175.06 1p88 n ASP 48 N 2.01 0.04 -0.27 2.44 9.92 -1.26 0.20 116.55 129.63 1p88 n ASP 48 Ca -0.14 0.90 -0.03 0.00 -0.53 0.00 0.00 54.79 55.00 1p88 n ASP 48 Cb 0.56 -0.45 0.09 0.00 -0.64 0.00 0.00 41.12 40.68 1p88 n ASP 48 CO 0.00 0.00 0.00 -2.24 0.13 0.00 0.00 177.20 175.09 1p88 h ASP 49 N 0.00 0.80 0.14 -2.24 3.04 -1.94 0.19 116.42 116.40 1p88 h ASP 49 Ca 0.78 -0.00 -0.22 0.00 -3.24 0.00 0.00 57.03 54.35 1p88 h ASP 49 Cb 3.01 -0.18 0.01 0.00 -1.04 0.00 0.00 39.33 41.14 1p88 h ASP 49 CO -0.09 0.55 -1.02 0.58 -2.04 0.00 0.00 179.24 177.22 1p88 h VAL 50 N 0.94 1.36 -1.00 4.15 2.07 0.21 -1.66 116.25 122.32 1p88 h VAL 50 Ca 0.30 -2.50 0.22 0.00 0.82 0.00 0.00 66.70 65.55 1p88 h VAL 50 Cb 0.01 3.05 -0.12 0.00 -1.52 0.00 0.00 31.29 32.71 1p88 h VAL 50 CO -0.11 0.71 0.60 -0.09 0.02 0.00 0.00 177.57 178.70 1p88 h ARG 51 N -0.34 0.63 0.05 1.57 2.43 -1.05 0.47 114.38 118.14 1p88 h ARG 51 Ca -0.20 -0.04 -0.24 0.00 -0.81 0.00 0.00 59.98 58.70 1p88 h ARG 51 Cb 1.70 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 31.09 1p88 h ARG 51 CO 0.13 0.41 -1.09 0.45 -1.51 0.00 0.00 179.97 178.36 1p88 h HIS 52 N 0.65 0.23 -0.84 2.20 3.86 -0.69 1.17 115.15 121.73 1p88 h HIS 52 Ca 0.62 -0.16 0.16 0.00 -1.16 0.00 0.00 60.37 59.82 1p88 h HIS 52 Cb 1.10 -0.01 -0.06 0.00 1.06 0.00 0.00 27.41 29.50 1p88 h HIS 52 CO -0.01 1.11 0.55 1.98 0.86 0.00 0.00 177.93 182.43 1p88 h MET 53 N 0.04 0.51 0.09 2.45 1.85 0.81 3.88 114.93 124.56 1p88 h MET 53 Ca -0.06 -0.03 -0.20 0.00 -0.61 0.00 0.00 59.70 58.79 1p88 h MET 53 Cb 1.83 -0.12 -0.00 0.00 0.43 0.00 0.00 31.60 33.74 1p88 h MET 53 CO 0.16 0.34 -1.01 -0.07 -0.40 0.00 0.00 176.91 175.93 1p88 h LEU 54 N 0.53 0.29 -1.37 3.39 3.38 -0.58 -3.11 115.31 117.84 1p88 h LEU 54 Ca 0.42 -0.86 0.06 0.00 0.09 0.00 0.00 57.88 57.59 1p88 h LEU 54 Cb 0.86 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 1p88 h LEU 54 CO -0.17 1.45 0.48 -1.13 0.09 0.00 0.00 178.44 179.15 1p88 h ASN 55 N -0.53 0.68 -0.45 -0.43 -1.24 0.36 1.69 115.58 115.67 1p88 h ASN 55 Ca -0.22 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 56.73 1p88 h ASN 55 Cb 1.55 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 40.44 1p88 h ASN 55 CO 0.04 0.44 0.03 0.00 -1.29 0.00 0.00 177.43 176.65 1p88 h ALA 56 N 1.60 0.60 -0.57 1.57 0.00 0.72 0.71 119.26 123.90 1p88 h ALA 56 Ca 0.31 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1p88 h ALA 56 Cb 0.22 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1p88 h ALA 56 CO -0.10 0.36 0.04 -0.07 0.00 0.00 0.00 179.25 179.48 1p88 h LEU 57 N 0.62 0.91 -0.93 0.00 4.07 -1.06 -2.26 115.31 116.67 1p88 h LEU 57 Ca 0.13 -0.23 -0.02 0.00 0.08 0.00 0.00 57.88 57.84 1p88 h LEU 57 Cb 0.45 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 41.91 1p88 h LEU 57 CO 0.02 0.95 0.46 0.74 -1.08 0.00 0.00 178.44 179.52 1p88 h THR 58 N 0.88 1.26 -0.22 0.22 2.02 0.34 1.08 112.91 118.49 1p88 h THR 58 Ca 0.17 -0.66 -0.17 0.00 0.77 0.00 0.00 66.41 66.52 1p88 h THR 58 Cb 0.47 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1p88 h THR 58 CO 0.02 0.29 -0.53 0.00 0.37 0.00 0.00 175.52 175.67 1p88 h ALA 59 N 1.28 0.65 0.00 6.16 0.00 0.83 -2.98 119.26 125.20 1p88 h ALA 59 Ca 0.30 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1p88 h ALA 59 Cb 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1p88 h ALA 59 CO -0.05 0.68 -0.01 -0.07 0.00 0.00 0.00 179.25 179.81 1p88 h LEU 60 N 0.50 0.00 0.00 0.00 3.38 -1.23 -3.44 115.31 114.52 1p88 h LEU 60 Ca 0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1p88 h LEU 60 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1p88 h LEU 60 CO 0.11 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.25 1p88 n GLY 61 N 1.25 1.44 3.65 0.83 0.00 -0.47 -4.50 105.19 107.40 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 -0.01 1.61 1.01 0.36 -4.99 120.40 121.43 1p88 s VAL 62 Ca 0.00 1.05 -0.25 0.00 0.00 0.00 0.00 61.98 62.78 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 0.11 0.76 -0.44 0.00 0.00 0.00 175.10 175.53 1p88 s SER 63 N 1.30 7.13 0.30 3.32 0.01 -1.26 -4.26 113.70 120.24 1p88 s SER 63 Ca 0.25 1.35 -0.18 0.00 1.31 0.00 0.00 55.95 58.68 1p88 s SER 63 Cb -0.16 -2.45 0.02 0.00 0.21 0.00 0.00 66.02 63.64 1p88 s SER 63 CO 0.09 -0.08 0.70 -0.72 0.41 0.00 0.00 173.24 173.65 1p88 s TYR 64 N 0.47 -0.02 0.05 2.43 1.13 -1.26 0.25 117.35 120.41 1p88 s TYR 64 Ca 0.40 -0.47 0.04 0.00 -1.41 0.00 0.00 57.07 55.63 1p88 s TYR 64 Cb -0.19 0.66 -0.03 0.00 -1.10 0.00 0.00 41.96 41.30 1p88 s TYR 64 CO 0.21 -1.28 -0.13 0.99 -2.51 0.00 0.00 175.55 172.83 1p88 s THR 65 N -3.54 0.99 -0.06 -3.49 2.01 0.59 -4.93 115.64 107.20 1p88 s THR 65 Ca 0.14 -1.14 0.06 0.00 0.31 0.00 0.00 61.69 61.06 1p88 s THR 65 Cb -0.05 -0.95 -0.01 0.00 0.01 0.00 0.00 72.50 71.50 1p88 s THR 65 CO 0.09 -0.17 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.38 1p88 s LEU 66 N -1.48 2.11 0.00 4.42 2.96 -1.26 -0.42 118.68 125.01 1p88 s LEU 66 Ca -0.02 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.39 1p88 s LEU 66 Cb -0.09 -1.39 0.00 0.00 0.50 0.00 0.00 46.19 45.21 1p88 s LEU 66 CO 0.02 0.24 0.00 -1.54 -1.32 0.00 0.00 176.35 173.74 1p88 n SER 67 N 3.00 -1.69 0.08 3.68 3.41 0.31 -4.91 113.62 117.49 1p88 n SER 67 Ca -0.18 -0.08 -0.23 0.00 -0.26 0.00 0.00 58.87 58.13 1p88 n SER 67 Cb 0.52 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.32 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 -2.00 0.01 0.00 7.33 0.00 -2.01 -3.28 119.26 119.32 1p88 h ALA 68 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 53.95 1p88 h ALA 68 Cb 0.00 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1p88 h ALA 68 CO 0.00 0.76 0.00 -0.25 0.00 0.00 0.00 179.25 179.76 1p88 n ASP 69 N -3.81 0.00 -2.40 0.00 9.92 -1.26 -4.86 116.55 114.14 1p88 n ASP 69 Ca -0.20 -1.04 -0.21 0.00 -0.53 0.00 0.00 54.79 52.81 1p88 n ASP 69 Cb 1.00 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.47 1p88 n ASP 69 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1p88 n ARG 70 N -0.90 -1.70 -0.00 -1.24 1.74 -1.24 -4.83 116.66 108.50 1p88 n ARG 70 Ca 0.17 1.01 0.00 0.00 -0.77 0.00 0.00 57.85 58.26 1p88 n ARG 70 Cb 0.08 -5.68 -0.00 0.00 -1.02 0.00 0.00 32.46 25.83 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 -4.01 0.00 -3.94 0.55 -2.24 -1.26 -4.32 114.28 99.06 1p88 n THR 71 Ca -0.25 -0.26 -0.35 0.00 -2.27 0.00 0.00 64.05 60.92 1p88 n THR 71 Cb 0.69 0.76 -0.14 0.00 -2.10 0.00 0.00 70.33 69.53 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 -1.51 3.24 -0.07 -0.78 0.52 -1.25 0.18 118.95 119.28 1p88 s ARG 72 Ca 0.00 -0.71 0.01 0.00 -0.52 0.00 0.00 55.73 54.51 1p88 s ARG 72 Cb 0.00 -2.95 0.02 0.00 0.52 0.00 0.00 34.95 32.54 1p88 s ARG 72 CO 0.02 -0.23 -0.08 0.00 0.02 0.00 0.00 175.30 175.03 1p88 s GLU 74 N 1.07 3.55 -0.11 0.00 2.12 0.44 0.11 118.70 125.89 1p88 s GLU 74 Ca -0.08 -0.58 0.01 0.00 0.36 0.00 0.00 54.97 54.68 1p88 s GLU 74 Cb -0.14 -2.83 0.02 0.00 0.26 0.00 0.00 34.13 31.44 1p88 s GLU 74 CO -0.01 0.19 -0.13 0.42 -0.54 0.00 0.00 175.26 175.20 1p88 s ILE 75 N 0.46 1.35 -0.61 -3.70 1.01 0.70 0.22 121.20 120.63 1p88 s ILE 75 Ca -0.06 -0.53 -0.26 0.00 0.00 0.00 0.00 60.65 59.80 1p88 s ILE 75 Cb -0.15 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 1p88 s ILE 75 CO 0.03 0.42 1.99 0.27 0.00 0.00 0.00 174.94 177.65 1p88 s ILE 76 N 1.23 3.28 0.35 2.92 -0.00 0.68 -2.22 121.20 127.43 1p88 s ILE 76 Ca -0.02 0.12 -0.19 0.00 -0.00 0.00 0.00 60.65 60.56 1p88 s ILE 76 Cb -0.14 -3.74 -0.14 0.00 -0.00 0.00 0.00 42.46 38.44 1p88 s ILE 76 CO -0.04 -0.72 0.10 0.61 -0.00 0.00 0.00 174.94 174.89 1p88 n GLY 77 N 5.85 -2.39 0.01 6.27 0.00 0.82 -4.06 105.19 111.69 1p88 n GLY 77 Ca 0.25 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.40 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 2.06 0.57 0.00 1.61 4.05 0.30 -4.22 115.26 119.64 1p88 n ASN 78 Ca 0.10 -0.24 0.00 0.00 0.45 0.00 0.00 54.58 54.89 1p88 n ASN 78 Cb 0.35 0.35 0.00 0.00 1.23 0.00 0.00 39.78 41.70 1p88 n ASN 78 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1p88 n GLY 79 N 1.46 0.80 0.00 8.20 0.00 0.33 -4.89 105.19 111.09 1p88 n GLY 79 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.00 -0.07 3.62 -0.02 0.00 -0.24 -4.75 105.19 101.74 1p88 n GLY 80 Ca 0.00 -1.02 -0.52 0.00 0.00 0.00 0.00 46.02 44.48 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 1.32 -2.49 1.61 -0.02 -1.26 -4.14 135.00 130.02 1p88 n PRO 81 Ca 0.00 0.48 -0.42 0.00 -2.02 0.00 0.00 63.50 61.54 1p88 n PRO 81 Cb 0.00 -2.15 -0.02 0.00 -0.02 0.00 0.00 33.50 31.30 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 1.19 3.42 -0.06 2.45 2.01 -1.26 -4.88 118.68 121.55 1p88 s LEU 82 Ca 0.86 0.19 -0.28 0.00 0.01 0.00 0.00 54.13 54.92 1p88 s LEU 82 Cb -0.93 -3.11 -0.03 0.00 0.01 0.00 0.00 46.19 42.13 1p88 s LEU 82 CO 0.49 -1.59 0.90 -1.38 1.01 0.00 0.00 176.35 175.78 1p88 s HIS 83 N 5.47 3.58 -0.17 0.29 -3.43 -1.26 -4.89 115.29 114.87 1p88 s HIS 83 Ca 0.47 1.51 -0.18 0.00 -0.80 0.00 0.00 55.06 56.07 1p88 s HIS 83 Cb -0.09 -3.05 -0.04 0.00 -1.43 0.00 0.00 32.58 27.97 1p88 s HIS 83 CO 0.25 -0.07 0.47 0.00 -2.00 0.00 0.00 174.74 173.40 1p88 s ALA 84 N 1.34 3.53 -0.03 -1.38 0.00 -1.26 -4.71 121.76 119.24 1p88 s ALA 84 Ca 0.46 -0.36 -0.30 0.00 0.00 0.00 0.00 51.96 51.76 1p88 s ALA 84 Cb -0.19 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 1p88 s ALA 84 CO 0.21 -0.26 1.41 -1.21 0.00 0.00 0.00 175.76 175.92 1p88 s GLU 85 N 1.21 4.27 0.43 0.00 8.01 -1.26 -4.63 118.70 126.73 1p88 s GLU 85 Ca 0.23 1.94 0.00 0.00 0.01 0.00 0.00 54.97 57.16 1p88 s GLU 85 Cb -0.15 -3.65 0.00 0.00 -4.31 0.00 0.00 34.13 26.02 1p88 s GLU 85 CO 0.09 -0.62 0.00 0.41 0.01 0.00 0.00 175.26 175.15 1p88 n GLY 86 N 3.69 -2.43 3.77 -1.39 0.00 -1.26 -4.71 105.19 102.87 1p88 n GLY 86 Ca 0.14 -1.12 -0.37 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.94 3.13 0.28 4.61 0.00 -1.26 -4.63 121.76 120.94 1p88 s ALA 87 Ca 0.00 0.81 0.10 0.00 0.00 0.00 0.00 51.96 52.87 1p88 s ALA 87 Cb 0.00 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 1p88 s ALA 87 CO 0.00 -0.33 -0.01 -1.17 0.00 0.00 0.00 175.76 174.24 1p88 s LEU 88 N -2.51 3.13 -0.27 0.00 2.96 0.54 -4.97 118.68 117.56 1p88 s LEU 88 Ca 0.57 -0.71 -0.04 0.00 -0.22 0.00 0.00 54.13 53.73 1p88 s LEU 88 Cb -0.26 -1.64 0.09 0.00 0.50 0.00 0.00 46.19 44.88 1p88 s LEU 88 CO 0.33 -0.02 0.12 -1.61 -1.32 0.00 0.00 176.35 173.84 1p88 s GLU 89 N -3.67 0.18 -0.19 1.98 2.02 -1.26 0.21 118.70 117.97 1p88 s GLU 89 Ca 0.32 -0.45 -0.09 0.00 0.02 0.00 0.00 54.97 54.77 1p88 s GLU 89 Cb -0.06 -1.33 -0.05 0.00 0.10 0.00 0.00 34.13 32.80 1p88 s GLU 89 CO 0.20 -0.94 0.10 -0.51 0.02 0.00 0.00 175.26 174.12 1p88 s LEU 90 N 2.09 4.05 -0.62 1.80 1.02 0.59 -4.89 118.68 122.71 1p88 s LEU 90 Ca 0.07 0.17 -0.14 0.00 0.02 0.00 0.00 54.13 54.25 1p88 s LEU 90 Cb -0.16 -2.04 0.16 0.00 0.02 0.00 0.00 46.19 44.17 1p88 s LEU 90 CO -0.31 0.18 0.56 -0.36 0.02 0.00 0.00 176.35 176.44 1p88 s PHE 91 N 0.36 3.43 -0.66 0.29 0.08 -1.26 0.14 117.98 120.35 1p88 s PHE 91 Ca 0.06 -1.60 0.02 0.00 0.12 0.00 0.00 56.93 55.53 1p88 s PHE 91 Cb -0.12 -3.76 0.38 0.00 -0.57 0.00 0.00 43.02 38.95 1p88 s PHE 91 CO -0.01 -1.00 1.53 1.28 -0.10 0.00 0.00 175.22 176.92 1p88 n LEU 92 N 4.78 6.05 0.40 -0.37 7.99 0.38 -4.83 117.00 131.41 1p88 n LEU 92 Ca -0.04 -5.10 -0.18 0.00 -0.01 0.00 0.00 56.01 50.68 1p88 n LEU 92 Cb 0.42 -0.77 -0.09 0.00 -0.11 0.00 0.00 43.42 42.88 1p88 n LEU 92 CO 0.46 2.03 0.53 1.23 -1.51 0.00 0.00 177.39 180.13 1p88 h GLY 93 N 2.88 -1.25 1.32 -0.72 0.00 -1.85 -2.39 103.07 101.06 1p88 h GLY 93 Ca 0.42 0.50 0.00 0.00 0.00 0.00 0.00 47.33 48.25 1p88 h GLY 93 CO 1.12 -0.43 0.00 0.70 0.00 0.00 0.00 176.54 177.93 1p88 n ASN 94 N -5.23 0.00 -3.22 0.19 3.02 -1.26 -3.95 115.26 104.81 1p88 n ASN 94 Ca -0.14 -0.42 -0.37 0.00 -0.03 0.00 0.00 54.58 53.62 1p88 n ASN 94 Cb 0.46 -0.16 -0.00 0.00 -0.61 0.00 0.00 39.78 39.46 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 -1.16 6.49 0.10 5.41 0.00 -0.90 -4.15 120.51 126.31 1p88 n ALA 95 Ca 0.16 -4.01 0.15 0.00 0.00 0.00 0.00 53.44 49.75 1p88 n ALA 95 Cb 0.16 -2.36 0.67 0.00 0.00 0.00 0.00 19.45 17.92 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 4.45 0.00 0.05 0.00 0.00 -1.72 0.52 103.07 106.38 1p88 h GLY 96 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.90 1p88 h GLY 96 CO 1.26 0.00 -0.45 -1.30 0.00 0.00 0.00 176.54 176.05 1p88 n THR 97 N -4.44 0.00 -0.11 4.70 -2.24 -1.26 -3.97 114.28 106.95 1p88 n THR 97 Ca 0.05 -0.12 -0.15 0.00 -2.27 0.00 0.00 64.05 61.56 1p88 n THR 97 Cb 0.41 0.66 -0.12 0.00 -2.10 0.00 0.00 70.33 69.18 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 -0.76 1.50 -0.13 6.98 0.00 0.71 -4.23 120.51 124.58 1p88 n ALA 98 Ca 0.09 -1.07 -0.09 0.00 0.00 0.00 0.00 53.44 52.38 1p88 n ALA 98 Cb 0.37 -0.07 -0.00 0.00 0.00 0.00 0.00 19.45 19.75 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 0.00 0.56 0.36 0.00 -1.53 -0.31 0.26 114.93 114.27 1p88 h MET 99 Ca -0.53 -0.07 -0.01 0.00 -3.44 0.00 0.00 59.70 55.66 1p88 h MET 99 Cb 1.90 -0.11 -0.03 0.00 -0.55 0.00 0.00 31.60 32.81 1p88 h MET 99 CO -0.06 0.46 -0.50 0.00 0.14 0.00 0.00 176.91 176.95 1p88 h ARG 100 N 0.51 -0.85 -0.30 0.39 -0.00 -1.78 0.58 114.38 112.92 1p88 h ARG 100 Ca 0.14 0.06 -0.01 0.00 -0.50 0.00 0.00 59.98 59.67 1p88 h ARG 100 Cb 0.07 0.19 -0.02 0.00 0.00 0.00 0.00 29.97 30.21 1p88 h ARG 100 CO -0.02 -0.57 0.16 -1.00 0.00 0.00 0.00 179.97 178.54 1p88 h PRO 101 N -0.89 0.41 0.13 0.04 0.13 -1.68 -2.12 132.00 128.03 1p88 h PRO 101 Ca -0.04 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1p88 h PRO 101 Cb 0.80 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1p88 h PRO 101 CO -0.14 0.31 -0.06 -0.07 -0.23 0.00 0.00 178.00 177.81 1p88 h LEU 102 N 0.42 -0.15 -1.96 1.56 3.38 0.08 0.39 115.31 119.03 1p88 h LEU 102 Ca 0.11 -0.39 0.21 0.00 0.09 0.00 0.00 57.88 57.90 1p88 h LEU 102 Cb 0.02 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1p88 h LEU 102 CO -0.02 0.38 0.59 0.00 0.09 0.00 0.00 178.44 179.48 1p88 h ALA 103 N -0.07 2.61 0.00 1.53 0.00 0.31 -0.38 119.26 123.26 1p88 h ALA 103 Ca -0.02 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1p88 h ALA 103 Cb 0.54 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1p88 h ALA 103 CO 0.03 -0.97 -0.71 0.00 0.00 0.00 0.00 179.25 177.59 1p88 h ALA 104 N 1.51 0.13 -0.40 0.00 0.00 -1.22 -3.34 119.26 115.94 1p88 h ALA 104 Ca 0.35 -0.81 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1p88 h ALA 104 Cb 1.53 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 1p88 h ALA 104 CO -0.00 0.44 0.24 0.00 0.00 0.00 0.00 179.25 179.92 1p88 h ALA 105 N -0.50 1.67 0.00 0.00 0.00 0.37 -2.49 119.26 118.30 1p88 h ALA 105 Ca -0.18 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1p88 h ALA 105 Cb 0.98 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1p88 h ALA 105 CO -0.11 0.29 0.00 -0.07 0.00 0.00 0.00 179.25 179.37 1p88 h LEU 106 N 0.55 0.00 -2.23 0.00 3.38 -1.28 -3.15 115.31 112.58 1p88 h LEU 106 Ca 0.14 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1p88 h LEU 106 Cb -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1p88 h LEU 106 CO -0.03 0.00 0.07 0.00 0.09 0.00 0.00 178.44 178.58 1p88 n LEU 108 N 0.14 0.97 0.00 0.00 4.77 -1.19 0.65 117.00 122.34 1p88 n LEU 108 Ca 0.14 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 1p88 n LEU 108 Cb 0.72 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1p88 n LEU 108 CO 0.16 -0.25 0.00 0.61 -1.33 0.00 0.00 177.39 176.58 1p88 n GLY 109 N 2.16 0.40 2.88 -0.72 0.00 -1.26 -2.66 105.19 105.99 1p88 n GLY 109 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 1p88 n GLY 109 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p88 s SER 110 N -1.27 0.60 -0.10 1.61 1.04 -1.26 -1.37 113.70 112.95 1p88 s SER 110 Ca 0.00 -0.81 -0.11 0.00 0.48 0.00 0.00 55.95 55.52 1p88 s SER 110 Cb 0.00 0.95 0.03 0.00 0.10 0.00 0.00 66.02 67.10 1p88 s SER 110 CO 0.00 -0.32 0.29 0.54 0.98 0.00 0.00 173.24 174.74 1p88 s ASN 111 N 2.14 -0.29 -0.56 7.02 6.03 -1.26 -4.68 114.94 123.35 1p88 s ASN 111 Ca 0.12 0.54 -0.19 0.00 -1.03 0.00 0.00 52.86 52.30 1p88 s ASN 111 Cb -0.13 0.58 0.08 0.00 -3.03 0.00 0.00 41.25 38.75 1p88 s ASN 111 CO -0.21 -0.13 0.68 -1.81 -2.03 0.00 0.00 177.10 173.60 1p88 s ASP 112 N 0.02 6.20 -0.01 3.54 1.11 -1.16 -1.72 116.67 124.66 1p88 s ASP 112 Ca -0.01 -1.18 0.08 0.00 0.18 0.00 0.00 52.55 51.62 1p88 s ASP 112 Cb -0.02 -2.30 -0.02 0.00 1.07 0.00 0.00 42.92 41.64 1p88 s ASP 112 CO 0.01 -1.03 -0.24 -0.63 1.18 0.00 0.00 175.17 174.45 1p88 s ILE 113 N 2.72 1.93 -0.30 0.77 -1.09 0.75 0.20 121.20 126.19 1p88 s ILE 113 Ca 0.14 -1.10 -0.04 0.00 -2.23 0.00 0.00 60.65 57.42 1p88 s ILE 113 Cb -0.22 -1.61 0.03 0.00 -1.58 0.00 0.00 42.46 39.08 1p88 s ILE 113 CO 0.09 0.50 0.04 -0.69 -1.23 0.00 0.00 174.94 173.64 1p88 s VAL 114 N -0.62 3.44 -0.45 2.92 1.01 0.55 0.21 120.40 127.47 1p88 s VAL 114 Ca 0.10 -1.06 -0.13 0.00 0.00 0.00 0.00 61.98 60.89 1p88 s VAL 114 Cb -0.09 -2.87 0.07 0.00 0.00 0.00 0.00 36.38 33.49 1p88 s VAL 114 CO -0.00 -0.01 0.34 -0.76 0.00 0.00 0.00 175.10 174.66 1p88 s LEU 115 N 1.37 5.39 0.00 3.92 1.43 0.66 0.22 118.68 131.67 1p88 s LEU 115 Ca -0.01 -1.32 0.00 0.00 -1.03 0.00 0.00 54.13 51.77 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 0.00 -0.58 0.01 0.41 0.23 0.00 0.00 176.35 176.42 1p88 n THR 116 N 5.11 0.00 -3.82 5.49 -1.04 0.36 -1.69 114.28 118.69 1p88 n THR 116 Ca -0.12 -0.11 -0.01 0.00 -2.04 0.00 0.00 64.05 61.77 1p88 n THR 116 Cb 0.44 -0.24 0.01 0.00 -1.82 0.00 0.00 70.33 68.71 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 -1.40 -0.13 1.02 3.41 0.00 -1.26 0.14 107.32 109.10 1p88 s GLY 117 Ca 0.01 0.07 -0.12 0.00 0.00 0.00 0.00 44.72 44.68 1p88 s GLY 117 CO 0.01 2.06 1.09 -0.54 0.00 0.00 0.00 173.10 175.71 1p88 s GLU 118 N -2.42 0.27 0.34 2.90 0.41 -1.26 -4.75 118.70 114.19 1p88 s GLU 118 Ca 0.20 0.55 0.13 0.00 -0.41 0.00 0.00 54.97 55.44 1p88 s GLU 118 Cb -0.00 -1.72 1.05 0.00 -1.78 0.00 0.00 34.13 31.68 1p88 s GLU 118 CO 0.01 -2.85 1.65 -1.00 -0.49 0.00 0.00 175.26 172.59 1p88 h PRO 119 N -1.98 0.27 0.00 0.39 0.13 -2.02 0.98 132.00 129.77 1p88 h PRO 119 Ca -0.55 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.53 1p88 h PRO 119 Cb 1.33 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 1p88 h PRO 119 CO 0.57 0.18 -0.14 0.07 -0.23 0.00 0.00 178.00 178.44 1p88 h ARG 120 N 0.27 0.00 -0.45 0.86 -0.00 -1.93 -2.20 114.38 110.94 1p88 h ARG 120 Ca 0.72 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 60.67 1p88 h ARG 120 Cb 1.63 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 31.58 1p88 h ARG 120 CO -0.64 0.14 0.17 1.98 -0.00 0.00 0.00 179.97 181.62 1p88 h MET 121 N 0.00 0.64 0.00 0.08 4.05 0.81 0.15 114.93 120.66 1p88 h MET 121 Ca -0.00 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 1p88 h MET 121 Cb 0.48 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.16 1p88 h MET 121 CO 0.02 0.54 0.00 -0.22 0.23 0.00 0.00 176.91 177.48 1p88 h LYS 122 N 0.63 0.00 -0.05 0.39 1.63 -1.39 0.28 116.57 118.07 1p88 h LYS 122 Ca 0.15 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.95 1p88 h LYS 122 Cb 0.14 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.77 1p88 h LYS 122 CO -0.01 0.00 0.00 0.39 -3.45 0.00 0.00 179.45 176.38 1p88 n GLU 123 N -2.58 1.49 -3.74 1.90 -0.58 0.04 -4.45 120.64 112.71 1p88 n GLU 123 Ca -0.01 -0.72 -0.28 0.00 -0.42 0.00 0.00 57.16 55.72 1p88 n GLU 123 Cb 0.09 -1.44 -0.12 0.00 -0.57 0.00 0.00 31.44 29.40 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 -1.94 1.73 0.58 3.49 0.52 0.98 -5.11 118.95 119.21 1p88 s ARG 124 Ca 0.37 -2.61 -0.19 0.00 -0.52 0.00 0.00 55.73 52.78 1p88 s ARG 124 Cb 0.19 -2.67 -0.05 0.00 0.52 0.00 0.00 34.95 32.94 1p88 s ARG 124 CO 0.31 -1.25 1.09 -2.30 0.02 0.00 0.00 175.30 173.17 1p88 n PRO 125 N 2.75 1.11 0.00 3.54 -0.02 -1.26 -4.34 135.00 136.79 1p88 n PRO 125 Ca 0.17 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1p88 n PRO 125 Cb 0.37 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1p88 n PRO 125 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1p88 n ILE 126 N -1.53 0.67 -0.14 4.25 3.06 0.22 -4.76 119.36 121.13 1p88 n ILE 126 Ca 0.13 -0.73 -0.00 0.00 -2.50 0.00 0.00 62.75 59.65 1p88 n ILE 126 Cb 0.46 0.70 0.26 0.00 0.54 0.00 0.00 39.64 41.60 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 0.89 0.73 4.50 0.00 -1.79 -1.14 103.07 106.25 1p88 h GLY 127 Ca 0.00 -0.40 0.07 0.00 0.00 0.00 0.00 47.33 46.99 1p88 h GLY 127 CO 0.00 0.39 0.65 0.45 0.00 0.00 0.00 176.54 178.02 1p88 h HIS 128 N 0.83 1.20 -0.03 5.60 -0.00 -1.88 0.52 115.15 121.39 1p88 h HIS 128 Ca 0.21 0.03 -0.22 0.00 -0.00 0.00 0.00 60.37 60.39 1p88 h HIS 128 Cb 0.07 -0.39 0.02 0.00 -0.00 0.00 0.00 27.41 27.10 1p88 h HIS 128 CO 0.01 0.61 -0.85 1.25 -0.00 0.00 0.00 177.93 178.95 1p88 h LEU 129 N 1.17 0.80 -0.37 2.43 5.85 -1.81 -2.55 115.31 120.83 1p88 h LEU 129 Ca 0.43 -0.72 0.05 0.00 0.84 0.00 0.00 57.88 58.48 1p88 h LEU 129 Cb 0.18 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 1p88 h LEU 129 CO -0.18 1.41 0.11 0.58 -0.34 0.00 0.00 178.44 180.03 1p88 h VAL 130 N 0.27 0.87 -0.04 1.05 2.07 -0.50 0.45 116.25 120.41 1p88 h VAL 130 Ca -0.10 -0.09 -0.14 0.00 0.82 0.00 0.00 66.70 67.19 1p88 h VAL 130 Cb 1.52 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1p88 h VAL 130 CO 0.17 0.05 -0.61 0.44 0.02 0.00 0.00 177.57 177.64 1p88 h ASP 131 N 0.25 0.18 -0.01 0.57 5.19 -1.00 0.84 116.42 122.44 1p88 h ASP 131 Ca 0.17 -0.10 -0.00 0.00 -0.62 0.00 0.00 57.03 56.48 1p88 h ASP 131 Cb 0.16 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 39.62 1p88 h ASP 131 CO -0.19 0.74 0.00 0.00 -3.12 0.00 0.00 179.24 176.68 1p88 h ALA 132 N 1.26 0.02 -0.03 3.45 0.00 -0.90 0.59 119.26 123.64 1p88 h ALA 132 Ca -0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1p88 h ALA 132 Cb 1.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1p88 h ALA 132 CO 0.09 -0.38 -0.06 -0.07 0.00 0.00 0.00 179.25 178.83 1p88 h LEU 133 N -0.18 0.11 -2.15 0.00 3.38 -0.05 -2.91 115.31 113.50 1p88 h LEU 133 Ca 0.00 -0.58 0.05 0.00 0.09 0.00 0.00 57.88 57.44 1p88 h LEU 133 Cb 0.21 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1p88 h LEU 133 CO -0.00 0.67 0.14 0.03 0.09 0.00 0.00 178.44 179.37 1p88 h ARG 134 N -0.45 0.00 -0.19 1.13 2.47 0.73 0.24 114.38 118.30 1p88 h ARG 134 Ca 0.00 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.63 1p88 h ARG 134 Cb 0.65 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.96 1p88 h ARG 134 CO 0.01 0.00 -0.27 1.25 0.56 0.00 0.00 179.97 181.52 1p88 h LEU 135 N 0.00 0.36 -0.52 3.04 5.85 0.37 -2.00 115.31 122.42 1p88 h LEU 135 Ca 0.08 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1p88 h LEU 135 Cb 0.37 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1p88 h LEU 135 CO -0.00 0.63 0.00 0.61 -0.34 0.00 0.00 178.44 179.34 1p88 n GLY 136 N -0.42 -0.05 0.49 3.75 0.00 0.75 -4.79 105.19 104.92 1p88 n GLY 136 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.46 0.70 3.78 -0.02 0.00 -0.76 0.50 105.19 109.84 1p88 n GLY 137 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.24 2.80 -0.52 4.61 0.00 -0.71 -3.20 121.76 122.49 1p88 s ALA 138 Ca 0.00 0.77 -0.17 0.00 0.00 0.00 0.00 51.96 52.56 1p88 s ALA 138 Cb 0.00 -3.33 0.09 0.00 0.00 0.00 0.00 23.12 19.88 1p88 s ALA 138 CO 0.00 -0.59 0.52 0.15 0.00 0.00 0.00 175.76 175.84 1p88 s LYS 139 N -3.17 3.03 -0.06 0.00 1.02 -0.40 -4.10 119.74 116.05 1p88 s LYS 139 Ca 0.69 -1.32 0.00 0.00 0.02 0.00 0.00 55.97 55.37 1p88 s LYS 139 Cb -0.22 -4.18 0.02 0.00 -0.52 0.00 0.00 37.83 32.93 1p88 s LYS 139 CO 0.26 -1.23 -0.04 0.42 -0.92 0.00 0.00 175.35 173.84 1p88 s ILE 140 N 2.04 0.56 -0.02 2.17 1.01 -1.26 -1.75 121.20 123.96 1p88 s ILE 140 Ca 0.08 -0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.69 1p88 s ILE 140 Cb -0.24 -0.61 -0.02 0.00 0.01 0.00 0.00 42.46 41.60 1p88 s ILE 140 CO 0.07 0.25 -0.21 -0.89 0.00 0.00 0.00 174.94 174.15 1p88 s THR 141 N 1.18 1.69 0.05 2.92 2.01 -0.84 -4.96 115.64 117.69 1p88 s THR 141 Ca -0.07 -0.91 -0.29 0.00 0.31 0.00 0.00 61.69 60.74 1p88 s THR 141 Cb -0.14 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 70.92 1p88 s THR 141 CO -0.01 0.48 0.91 -0.31 -0.69 0.00 0.00 174.62 174.99 1p88 s TYR 142 N -0.47 3.73 0.00 4.92 2.02 -1.26 -0.96 117.35 125.32 1p88 s TYR 142 Ca 0.07 1.66 0.00 0.00 -0.37 0.00 0.00 57.07 58.44 1p88 s TYR 142 Cb -0.09 -3.01 0.00 0.00 -0.40 0.00 0.00 41.96 38.46 1p88 s TYR 142 CO -0.01 0.13 0.00 1.28 -1.57 0.00 0.00 175.55 175.39 1p88 n LEU 143 N 3.26 1.14 0.00 -1.29 4.32 -1.25 -4.88 117.00 118.30 1p88 n LEU 143 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.01 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 0.50 0.00 0.24 -1.84 -1.22 0.00 0.00 177.39 175.08 1p88 n GLU 144 N -0.78 0.00 -4.40 3.23 0.28 -1.26 -4.89 120.64 112.82 1p88 n GLU 144 Ca 0.00 0.09 -0.26 0.00 -0.16 0.00 0.00 57.16 56.83 1p88 n GLU 144 Cb 0.00 -1.00 -0.12 0.00 1.43 0.00 0.00 31.44 31.75 1p88 n GLU 144 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 1p88 s GLN 145 N -1.15 1.44 0.27 3.44 -0.21 -1.26 -5.09 119.66 117.09 1p88 s GLN 145 Ca 0.00 -1.48 -0.30 0.00 0.02 0.00 0.00 55.36 53.60 1p88 s GLN 145 Cb 0.00 -1.71 -0.10 0.00 1.00 0.00 0.00 33.01 32.20 1p88 s GLN 145 CO 0.00 0.37 1.46 -1.21 -2.12 0.00 0.00 175.29 173.78 1p88 s GLU 146 N -2.65 4.24 -0.80 2.91 2.02 -1.26 -2.19 118.70 120.98 1p88 s GLU 146 Ca 0.19 2.35 0.00 0.00 0.02 0.00 0.00 54.97 57.53 1p88 s GLU 146 Cb -0.08 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 31.07 1p88 s GLU 146 CO 0.09 -0.44 0.00 0.09 0.02 0.00 0.00 175.26 175.02 1p88 n ASN 147 N 2.12 -4.06 -4.83 -0.19 3.02 -1.26 -4.87 115.26 105.18 1p88 n ASN 147 Ca 0.06 0.19 -0.22 0.00 -0.03 0.00 0.00 54.58 54.58 1p88 n ASN 147 Cb 0.40 -2.22 -0.04 0.00 -0.61 0.00 0.00 39.78 37.31 1p88 n ASN 147 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1p88 s TYR 148 N -2.23 2.78 0.08 3.10 1.51 -0.93 0.71 117.35 122.38 1p88 s TYR 148 Ca 0.00 -0.40 -0.16 0.00 -1.01 0.00 0.00 57.07 55.50 1p88 s TYR 148 Cb 0.00 -1.92 -0.04 0.00 -0.11 0.00 0.00 41.96 39.90 1p88 s TYR 148 CO 0.00 0.10 1.07 -2.30 -1.11 0.00 0.00 175.55 173.31 1p88 n PRO 149 N -1.39 -0.23 -1.55 -1.71 -0.02 -1.26 -4.31 135.00 124.53 1p88 n PRO 149 Ca -0.00 1.05 -0.41 0.00 -2.02 0.00 0.00 63.50 62.13 1p88 n PRO 149 Cb 0.61 -1.56 0.02 0.00 -0.02 0.00 0.00 33.50 32.55 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 -4.26 0.98 -3.68 0.52 -0.02 -0.98 -4.38 135.00 123.19 1p88 n PRO 150 Ca 0.01 0.36 -0.12 0.00 -2.02 0.00 0.00 63.50 61.73 1p88 n PRO 150 Cb 0.14 -1.86 -0.09 0.00 -0.02 0.00 0.00 33.50 31.67 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 0.10 -0.29 -0.45 2.45 1.43 -0.68 -3.89 118.68 117.34 1p88 s LEU 151 Ca 0.65 1.17 -0.09 0.00 -1.03 0.00 0.00 54.13 54.83 1p88 s LEU 151 Cb -0.54 1.94 0.11 0.00 0.03 0.00 0.00 46.19 47.72 1p88 s LEU 151 CO 0.56 -0.20 0.32 -0.13 0.23 0.00 0.00 176.35 177.12 1p88 s ARG 152 N 0.66 2.52 0.14 1.70 0.52 -0.14 -0.24 118.95 124.11 1p88 s ARG 152 Ca -0.03 -1.67 -0.12 0.00 -0.52 0.00 0.00 55.73 53.39 1p88 s ARG 152 Cb -0.05 -3.88 -0.07 0.00 0.52 0.00 0.00 34.95 31.48 1p88 s ARG 152 CO -0.04 -1.12 0.51 -0.51 0.02 0.00 0.00 175.30 174.16 1p88 s LEU 153 N 1.38 4.32 0.00 2.53 1.43 0.58 -1.98 118.68 126.94 1p88 s LEU 153 Ca 0.05 0.98 0.15 0.00 -1.03 0.00 0.00 54.13 54.27 1p88 s LEU 153 Cb -0.25 -3.24 0.24 0.00 0.03 0.00 0.00 46.19 42.97 1p88 s LEU 153 CO 0.00 0.10 1.08 0.00 0.23 0.00 0.00 176.35 177.77 1p88 n GLN 154 N 0.72 0.00 -0.03 1.70 6.02 -0.70 -0.18 117.38 124.92 1p88 n GLN 154 Ca -0.05 -1.54 0.00 0.00 -0.01 0.00 0.00 57.00 55.40 1p88 n GLN 154 Cb 0.52 0.16 -0.00 0.00 1.02 0.00 0.00 30.24 31.94 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 0.28 -0.54 0.00 1.08 0.00 -1.21 -4.11 105.19 100.70 1p88 n GLY 155 Ca -0.07 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.08 1.41 3.68 -0.02 0.00 -0.47 -1.28 105.19 108.43 1p88 n GLY 156 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.52 2.52 -0.04 1.61 7.35 0.21 -3.88 117.46 124.71 1p88 n PHE 157 Ca 0.00 -0.19 -0.06 0.00 -0.76 0.00 0.00 57.45 56.44 1p88 n PHE 157 Cb 0.00 -2.74 -0.04 0.00 0.35 0.00 0.00 39.48 37.05 1p88 n PHE 157 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1p88 n THR 158 N 5.01 0.51 0.00 -2.13 -2.24 0.67 -4.47 114.28 111.63 1p88 n THR 158 Ca 0.19 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1p88 n THR 158 Cb 0.37 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 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 2.99 0.96 0.00 3.38 0.00 0.18 0.12 105.19 112.82 1p88 n GLY 159 Ca -0.15 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 43.95 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 2.74 3.56 -0.02 0.00 -0.61 -4.16 105.19 106.70 1p88 n GLY 160 Ca 0.00 -1.85 -0.57 0.00 0.00 0.00 0.00 46.02 43.60 1p88 n GLY 160 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1p88 n ASN 161 N 0.00 1.96 -4.62 1.61 0.23 -1.26 -3.57 115.26 109.61 1p88 n ASN 161 Ca 0.00 0.83 -0.34 0.00 -0.53 0.00 0.00 54.58 54.53 1p88 n ASN 161 Cb 0.00 -1.12 -0.10 0.00 -2.08 0.00 0.00 39.78 36.48 1p88 n ASN 161 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1p88 s VAL 162 N 5.01 4.11 -0.25 3.53 1.01 0.60 -4.75 120.40 129.66 1p88 s VAL 162 Ca 1.06 -0.31 -0.07 0.00 0.00 0.00 0.00 61.98 62.66 1p88 s VAL 162 Cb -1.11 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1p88 s VAL 162 CO 0.62 0.58 0.05 -1.81 0.00 0.00 0.00 175.10 174.54 1p88 s ASP 163 N -0.58 5.01 -0.09 3.32 1.11 -1.26 -0.56 116.67 123.61 1p88 s ASP 163 Ca 0.09 -0.26 -0.01 0.00 0.18 0.00 0.00 52.55 52.56 1p88 s ASP 163 Cb -0.12 -1.89 0.03 0.00 1.07 0.00 0.00 42.92 42.00 1p88 s ASP 163 CO 0.02 -0.04 -0.04 -0.69 1.18 0.00 0.00 175.17 175.60 1p88 s VAL 164 N 1.59 0.75 0.31 -1.27 1.01 -0.65 -4.43 120.40 117.72 1p88 s VAL 164 Ca 0.06 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.63 1p88 s VAL 164 Cb -0.15 -0.82 -0.13 0.00 0.00 0.00 0.00 36.38 35.28 1p88 s VAL 164 CO 0.03 0.32 1.33 -0.67 0.00 0.00 0.00 175.10 176.10 1p88 n ASP 165 N 4.98 2.79 0.15 3.32 2.03 -1.26 -2.40 116.55 126.16 1p88 n ASP 165 Ca -0.11 1.19 0.01 0.00 0.52 0.00 0.00 54.79 56.40 1p88 n ASP 165 Cb 0.50 -1.47 0.32 0.00 -0.72 0.00 0.00 41.12 39.75 1p88 n ASP 165 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1p88 h GLY 166 N 3.04 0.11 -6.41 0.27 0.00 -0.74 -3.28 103.07 96.07 1p88 h GLY 166 Ca -0.46 -0.10 -0.80 0.00 0.00 0.00 0.00 47.33 45.98 1p88 h GLY 166 CO 0.66 0.09 1.22 -1.26 0.00 0.00 0.00 176.54 177.25 1p88 n SER 167 N -4.09 6.94 0.00 0.19 2.88 -1.22 0.14 113.62 118.46 1p88 n SER 167 Ca -0.02 -3.48 0.00 0.00 -1.33 0.00 0.00 58.87 54.05 1p88 n SER 167 Cb 0.41 -1.26 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 1p88 n SER 167 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1p88 n VAL 168 N 0.93 0.00 -4.21 2.46 0.31 -1.24 -4.96 118.33 111.62 1p88 n VAL 168 Ca 0.41 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.56 1p88 n VAL 168 Cb 0.29 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 33.07 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 1.00 0.88 0.49 4.52 0.01 -1.26 -4.81 113.70 114.52 1p88 s SER 169 Ca 0.00 -0.13 0.26 0.00 1.31 0.00 0.00 55.95 57.39 1p88 s SER 169 Cb 0.00 -0.30 1.40 0.00 0.21 0.00 0.00 66.02 67.33 1p88 s SER 169 CO 0.00 0.01 1.76 0.77 0.41 0.00 0.00 173.24 176.19 1p88 h SER 170 N 6.66 0.00 0.51 2.44 4.64 -1.95 0.27 113.55 126.12 1p88 h SER 170 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1p88 h SER 170 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1p88 h SER 170 CO 0.49 0.00 -0.88 0.00 -0.87 0.00 0.00 176.83 175.57 1p88 n GLN 171 N -2.53 0.24 0.15 4.77 3.00 -1.26 -2.79 117.38 118.96 1p88 n GLN 171 Ca -0.02 0.01 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 1p88 n GLN 171 Cb 0.23 -1.59 -0.08 0.00 0.00 0.00 0.00 30.24 28.79 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 -0.37 -0.28 1.08 -1.00 -0.80 0.85 116.94 116.42 1p88 h PHE 172 Ca 0.00 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.74 1p88 h PHE 172 Cb 0.69 0.12 -0.01 0.00 3.61 0.00 0.00 35.95 40.36 1p88 h PHE 172 CO 0.00 -0.04 0.06 -0.07 -1.61 0.00 0.00 178.31 176.65 1p88 h LEU 173 N -0.73 0.44 -1.70 1.54 3.38 -1.71 -2.35 115.31 114.18 1p88 h LEU 173 Ca -0.04 -0.25 0.13 0.00 0.09 0.00 0.00 57.88 57.81 1p88 h LEU 173 Cb 0.49 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 1p88 h LEU 173 CO 0.07 0.58 0.44 0.74 0.09 0.00 0.00 178.44 180.35 1p88 h THR 174 N 0.29 0.81 -0.51 0.22 2.02 -1.51 0.35 112.91 114.59 1p88 h THR 174 Ca 0.09 -0.11 -0.09 0.00 0.77 0.00 0.00 66.41 67.08 1p88 h THR 174 Cb 0.32 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1p88 h THR 174 CO 0.00 0.06 -0.02 0.00 0.37 0.00 0.00 175.52 175.93 1p88 h ALA 175 N 1.69 0.68 0.01 6.16 0.00 -0.28 -2.21 119.26 125.32 1p88 h ALA 175 Ca 0.31 -0.30 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 1p88 h ALA 175 Cb 0.78 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1p88 h ALA 175 CO -0.08 0.51 -0.91 -0.07 0.00 0.00 0.00 179.25 178.70 1p88 h LEU 176 N 0.77 0.23 -1.07 0.00 3.38 -0.87 -1.57 115.31 116.17 1p88 h LEU 176 Ca 0.14 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1p88 h LEU 176 Cb 0.54 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1p88 h LEU 176 CO 0.03 1.02 0.63 -0.07 0.09 0.00 0.00 178.44 180.14 1p88 h LEU 177 N 0.09 1.08 0.20 1.67 4.07 -0.22 0.93 115.31 123.12 1p88 h LEU 177 Ca -0.05 -0.03 -0.30 0.00 0.08 0.00 0.00 57.88 57.58 1p88 h LEU 177 Cb 1.56 -0.27 0.02 0.00 1.08 0.00 0.00 40.66 43.05 1p88 h LEU 177 CO 0.14 0.78 -1.41 0.24 -1.08 0.00 0.00 178.44 177.11 1p88 h MET 178 N 1.27 0.42 -0.24 1.13 2.86 -1.39 -3.35 114.93 115.64 1p88 h MET 178 Ca 0.35 -0.72 -0.15 0.00 -2.06 0.00 0.00 59.70 57.12 1p88 h MET 178 Cb -0.14 0.27 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1p88 h MET 178 CO -0.08 1.34 -0.42 1.15 1.06 0.00 0.00 176.91 179.97 1p88 h THR 179 N -0.03 1.31 -0.97 2.22 2.02 -1.09 -3.33 112.91 113.04 1p88 h THR 179 Ca -0.26 -1.62 0.03 0.00 0.77 0.00 0.00 66.41 65.33 1p88 h THR 179 Cb 2.00 1.74 -0.05 0.00 -1.74 0.00 0.00 68.15 70.09 1p88 h THR 179 CO 0.20 0.51 0.64 0.00 0.37 0.00 0.00 175.52 177.24 1p88 h ALA 180 N 0.64 1.27 0.00 6.16 0.00 0.73 -2.46 119.26 125.60 1p88 h ALA 180 Ca 0.02 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1p88 h ALA 180 Cb 1.01 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1p88 h ALA 180 CO 0.09 0.55 -0.30 -1.00 0.00 0.00 0.00 179.25 178.60 1p88 h PRO 181 N 1.26 0.00 -0.03 0.00 0.13 -1.69 -0.21 132.00 131.45 1p88 h PRO 181 Ca 0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.51 1p88 h PRO 181 Cb -0.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.08 1p88 h PRO 181 CO -0.11 0.30 0.00 1.28 -0.23 0.00 0.00 178.00 179.24 1p88 n LEU 182 N -4.01 0.73 -4.77 1.56 4.77 -0.95 0.20 117.00 114.53 1p88 n LEU 182 Ca -0.02 -0.27 -0.40 0.00 -0.03 0.00 0.00 56.01 55.30 1p88 n LEU 182 Cb 0.36 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.37 1p88 n LEU 182 CO 0.37 0.13 0.53 0.00 -1.33 0.00 0.00 177.39 177.10 1p88 s ALA 183 N -1.96 3.41 0.46 -1.18 0.00 -0.09 -4.37 121.76 118.02 1p88 s ALA 183 Ca 0.39 0.44 0.21 0.00 0.00 0.00 0.00 51.96 53.00 1p88 s ALA 183 Cb 0.19 -3.04 1.20 0.00 0.00 0.00 0.00 23.12 21.48 1p88 s ALA 183 CO 0.31 0.24 1.88 -1.00 0.00 0.00 0.00 175.76 177.19 1p88 h PRO 184 N 4.40 0.27 -6.43 0.00 0.13 -1.55 2.12 132.00 130.94 1p88 h PRO 184 Ca -0.46 -0.02 -0.69 0.00 -0.87 0.00 0.00 66.00 63.97 1p88 h PRO 184 Cb 1.20 -0.06 -0.22 0.00 0.13 0.00 0.00 31.00 32.06 1p88 h PRO 184 CO 0.67 0.18 -0.78 -1.21 -0.23 0.00 0.00 178.00 176.63 1p88 s GLU 185 N -5.29 2.32 0.51 0.86 8.01 0.33 -4.10 118.70 121.34 1p88 s GLU 185 Ca -0.07 -0.83 -0.23 0.00 0.01 0.00 0.00 54.97 53.85 1p88 s GLU 185 Cb 0.22 -2.31 -0.06 0.00 -4.31 0.00 0.00 34.13 27.67 1p88 s GLU 185 CO 0.78 0.58 1.31 -0.40 0.01 0.00 0.00 175.26 177.53 1p88 n ASP 186 N 1.83 2.54 -4.30 -0.19 5.75 -1.26 -3.92 116.55 117.00 1p88 n ASP 186 Ca -0.16 1.01 -0.28 0.00 -0.01 0.00 0.00 54.79 55.35 1p88 n ASP 186 Cb 0.52 -1.54 -0.14 0.00 -1.03 0.00 0.00 41.12 38.93 1p88 n ASP 186 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1p88 s THR 187 N -1.28 1.92 -0.18 2.12 2.01 0.74 -1.58 115.64 119.39 1p88 s THR 187 Ca 0.68 -1.29 0.01 0.00 0.31 0.00 0.00 61.69 61.40 1p88 s THR 187 Cb -0.44 -1.65 0.03 0.00 0.01 0.00 0.00 72.50 70.45 1p88 s THR 187 CO 0.52 0.30 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.91 1p88 s VAL 188 N -0.79 1.82 -0.30 3.82 1.01 -1.23 -0.78 120.40 123.93 1p88 s VAL 188 Ca 0.10 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 1p88 s VAL 188 Cb -0.09 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1p88 s VAL 188 CO 0.02 0.37 0.19 -0.63 0.00 0.00 0.00 175.10 175.05 1p88 s ILE 189 N 1.36 5.05 -0.26 2.22 1.09 0.54 0.22 121.20 131.42 1p88 s ILE 189 Ca 0.02 -0.11 -0.11 0.00 -1.10 0.00 0.00 60.65 59.35 1p88 s ILE 189 Cb -0.14 -3.50 -0.05 0.00 -1.06 0.00 0.00 42.46 37.71 1p88 s ILE 189 CO -0.10 0.14 0.20 -0.60 -0.10 0.00 0.00 174.94 174.48 1p88 s ARG 190 N 1.70 4.02 -0.27 2.79 3.52 0.27 0.19 118.95 131.17 1p88 s ARG 190 Ca 0.06 -0.24 -0.17 0.00 -0.13 0.00 0.00 55.73 55.25 1p88 s ARG 190 Cb -0.17 -3.60 -0.03 0.00 -1.56 0.00 0.00 34.95 29.60 1p88 s ARG 190 CO 0.09 -0.07 0.47 0.42 -0.81 0.00 0.00 175.30 175.40 1p88 s ILE 191 N 1.45 5.10 -0.78 4.11 1.09 -1.25 -1.63 121.20 129.29 1p88 s ILE 191 Ca 0.08 0.75 -0.26 0.00 -1.10 0.00 0.00 60.65 60.13 1p88 s ILE 191 Cb -0.15 -3.79 0.01 0.00 -1.06 0.00 0.00 42.46 37.46 1p88 s ILE 191 CO 0.08 0.09 1.60 -0.54 -0.10 0.00 0.00 174.94 176.07 1p88 s LYS 192 N 2.24 2.98 1.17 2.79 1.02 -1.01 -4.64 119.74 124.30 1p88 s LYS 192 Ca 0.19 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.04 1p88 s LYS 192 Cb -0.16 -4.60 0.00 0.00 -0.52 0.00 0.00 37.83 32.56 1p88 s LYS 192 CO 0.10 -2.54 0.00 0.41 -0.92 0.00 0.00 175.35 172.39 1p88 n GLY 193 N 5.99 0.88 3.37 -3.33 0.00 -1.26 -0.11 105.19 110.72 1p88 n GLY 193 Ca 0.20 -1.33 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 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 3.54 0.42 1.61 1.11 -1.26 -4.75 116.67 113.34 1p88 s ASP 194 Ca 0.00 -0.36 -0.21 0.00 0.18 0.00 0.00 52.55 52.16 1p88 s ASP 194 Cb 0.00 -0.84 -0.15 0.00 1.07 0.00 0.00 42.92 43.00 1p88 s ASP 194 CO 0.00 0.29 0.12 0.18 1.18 0.00 0.00 175.17 176.94 1p88 n LEU 195 N 2.69 -2.59 0.28 1.23 4.77 -1.23 -3.46 117.00 118.68 1p88 n LEU 195 Ca -0.17 0.81 0.16 0.00 -0.03 0.00 0.00 56.01 56.78 1p88 n LEU 195 Cb 0.52 -0.91 0.72 0.00 -2.33 0.00 0.00 43.42 41.42 1p88 n LEU 195 CO 0.26 -4.10 0.99 1.62 -1.33 0.00 0.00 177.39 174.82 1p88 h VAL 196 N 0.34 0.14 0.00 4.08 3.04 0.97 -3.41 116.25 121.41 1p88 h VAL 196 Ca -0.38 -0.55 0.00 0.00 -1.01 0.00 0.00 66.70 64.77 1p88 h VAL 196 Cb 1.44 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 32.19 1p88 h VAL 196 CO 0.47 0.05 0.00 -0.24 -1.01 0.00 0.00 177.57 176.83 1p88 n SER 197 N -3.19 -0.02 0.00 3.17 2.88 -1.26 -4.93 113.62 110.26 1p88 n SER 197 Ca -0.00 0.12 0.00 0.00 -1.33 0.00 0.00 58.87 57.66 1p88 n SER 197 Cb 0.29 0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 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 -2.76 0.00 0.27 -1.46 0.00 -1.26 -4.72 118.16 108.24 1p88 n LYS 198 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 58.31 58.44 1p88 n LYS 198 Cb 0.00 0.00 0.77 0.00 0.00 0.00 0.00 35.03 35.80 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 0.00 -0.10 1.64 0.13 -1.98 0.14 132.00 131.83 1p88 h PRO 199 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 1p88 h PRO 199 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1p88 h PRO 199 CO 0.00 0.08 -0.02 -0.92 -0.23 0.00 0.00 178.00 176.90 1p88 h TYR 200 N 0.00 0.21 -0.41 1.56 3.20 -1.94 -1.57 116.97 118.02 1p88 h TYR 200 Ca -0.00 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.78 1p88 h TYR 200 Cb 0.19 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 1p88 h TYR 200 CO 0.00 0.50 0.08 0.82 -1.64 0.00 0.00 178.16 177.92 1p88 h ILE 201 N -0.14 1.19 -0.58 1.81 1.08 -1.50 -1.73 117.51 117.64 1p88 h ILE 201 Ca 0.02 -0.70 -0.03 0.00 -0.39 0.00 0.00 64.86 63.76 1p88 h ILE 201 Cb 0.44 0.80 -0.03 0.00 -3.07 0.00 0.00 36.82 34.96 1p88 h ILE 201 CO 0.01 0.25 0.24 0.44 -0.69 0.00 0.00 178.15 178.40 1p88 h ASP 202 N 0.60 0.79 0.08 1.72 5.19 -0.54 -0.64 116.42 123.62 1p88 h ASP 202 Ca 0.13 -0.17 -0.00 0.00 -0.62 0.00 0.00 57.03 56.37 1p88 h ASP 202 Cb 0.26 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.56 1p88 h ASP 202 CO -0.00 0.74 -0.04 0.40 -3.12 0.00 0.00 179.24 177.23 1p88 h ILE 203 N 0.80 0.94 -0.20 0.35 2.04 -0.78 0.13 117.51 120.79 1p88 h ILE 203 Ca 0.19 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 66.07 1p88 h ILE 203 Cb 0.19 0.96 -0.06 0.00 -0.74 0.00 0.00 36.82 37.18 1p88 h ILE 203 CO -0.02 0.01 -0.16 0.74 0.00 0.00 0.00 178.15 178.72 1p88 h THR 204 N -0.12 0.55 -0.04 -0.27 2.02 -1.05 2.61 112.91 116.61 1p88 h THR 204 Ca -0.01 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 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 0.02 0.00 -0.26 -0.07 0.37 0.00 0.00 175.52 175.58 1p88 h LEU 205 N -0.17 0.07 0.05 2.58 3.38 -0.94 1.81 115.31 122.09 1p88 h LEU 205 Ca 0.12 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1p88 h LEU 205 Cb 0.35 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.09 1p88 h LEU 205 CO -0.30 0.33 -0.47 0.78 0.09 0.00 0.00 178.44 178.87 1p88 h ASN 206 N 0.06 0.33 0.45 -0.43 2.35 0.81 -2.30 115.58 116.85 1p88 h ASN 206 Ca 0.01 -0.87 -0.09 0.00 -0.55 0.00 0.00 56.30 54.80 1p88 h ASN 206 Cb 0.49 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1p88 h ASN 206 CO 0.04 1.16 -0.43 0.25 -1.65 0.00 0.00 177.43 176.80 1p88 h LEU 207 N -0.46 0.00 -0.80 1.61 5.85 0.47 -2.16 115.31 119.82 1p88 h LEU 207 Ca -0.07 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.52 1p88 h LEU 207 Cb 1.28 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1p88 h LEU 207 CO 0.09 0.43 -0.47 0.24 -0.34 0.00 0.00 178.44 178.39 1p88 h MET 208 N 0.00 0.30 -0.90 1.25 2.86 0.28 -2.67 114.93 116.05 1p88 h MET 208 Ca -0.00 -0.16 0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1p88 h MET 208 Cb 0.77 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.38 1p88 h MET 208 CO 0.06 0.71 0.59 0.87 1.06 0.00 0.00 176.91 180.20 1p88 h LYS 209 N 0.25 1.00 0.00 1.72 1.79 -0.79 0.59 116.57 121.13 1p88 h LYS 209 Ca 0.01 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1p88 h LYS 209 Cb 0.92 -0.23 -0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1p88 h LYS 209 CO 0.08 0.66 -0.02 0.00 -1.08 0.00 0.00 179.45 179.09 1p88 h THR 210 N 1.03 0.74 -0.00 -0.16 1.03 -1.41 0.91 112.91 115.05 1p88 h THR 210 Ca 0.39 -0.08 0.00 0.00 -0.01 0.00 0.00 66.41 66.70 1p88 h THR 210 Cb 0.18 1.05 0.00 0.00 -1.07 0.00 0.00 68.15 68.31 1p88 h THR 210 CO -0.14 0.02 -0.23 0.49 -0.01 0.00 0.00 175.52 175.65 1p88 n PHE 211 N -4.11 0.00 0.00 0.00 3.72 0.18 -4.10 117.46 113.15 1p88 n PHE 211 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1p88 n PHE 211 Cb 0.11 -0.33 0.00 0.00 -0.94 0.00 0.00 39.48 38.32 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 1.45 1.22 3.29 1.37 0.00 0.31 0.15 105.19 112.99 1p88 n GLY 212 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 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 1.79 0.00 1.61 -7.23 -1.13 -4.77 120.40 108.67 1p88 s VAL 213 Ca 0.00 -1.50 0.04 0.00 -1.81 0.00 0.00 61.98 58.71 1p88 s VAL 213 Cb 0.00 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.32 1p88 s VAL 213 CO 0.00 0.02 -0.14 -1.61 -0.31 0.00 0.00 175.10 173.07 1p88 s GLU 214 N -1.77 1.04 0.09 4.82 2.02 -1.26 -2.68 118.70 120.96 1p88 s GLU 214 Ca 0.08 -0.57 0.09 0.00 0.02 0.00 0.00 54.97 54.59 1p88 s GLU 214 Cb -0.10 -1.02 -0.03 0.00 0.10 0.00 0.00 34.13 33.07 1p88 s GLU 214 CO 0.04 0.27 -0.23 0.42 0.02 0.00 0.00 175.26 175.79 1p88 s ILE 215 N -0.48 1.85 -0.30 -1.63 -1.09 -1.26 -4.51 121.20 113.78 1p88 s ILE 215 Ca 0.04 -1.50 -0.09 0.00 -2.23 0.00 0.00 60.65 56.87 1p88 s ILE 215 Cb -0.06 -1.65 -0.01 0.00 -1.58 0.00 0.00 42.46 39.16 1p88 s ILE 215 CO 0.00 0.06 0.14 -0.70 -1.23 0.00 0.00 174.94 173.21 1p88 s GLU 216 N -1.73 3.39 0.39 2.79 2.12 0.20 -4.94 118.70 120.93 1p88 s GLU 216 Ca 0.09 -0.68 -0.18 0.00 0.36 0.00 0.00 54.97 54.56 1p88 s GLU 216 Cb -0.10 -3.52 -0.10 0.00 0.26 0.00 0.00 34.13 30.68 1p88 s GLU 216 CO 0.04 -0.37 0.86 0.54 -0.54 0.00 0.00 175.26 175.79 1p88 s ASN 217 N 1.61 6.86 0.00 -1.70 2.20 -1.26 0.11 114.94 122.76 1p88 s ASN 217 Ca 0.05 1.51 0.00 0.00 -0.94 0.00 0.00 52.86 53.48 1p88 s ASN 217 Cb -0.17 -2.47 0.00 0.00 -2.00 0.00 0.00 41.25 36.62 1p88 s ASN 217 CO 0.06 -0.30 0.00 0.00 -2.94 0.00 0.00 177.10 173.91 1p88 n GLN 218 N -0.56 3.80 -0.65 3.55 1.13 0.18 -4.90 117.38 119.93 1p88 n GLN 218 Ca 0.05 0.00 -0.24 0.00 -1.94 0.00 0.00 57.00 54.88 1p88 n GLN 218 Cb 0.54 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.86 1p88 n GLN 218 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 1p88 n HIS 219 N 0.00 1.08 -2.89 1.08 -0.00 -1.26 -4.12 115.22 109.11 1p88 n HIS 219 Ca 0.00 -1.50 -0.22 0.00 -0.00 0.00 0.00 57.72 56.00 1p88 n HIS 219 Cb 0.00 -1.38 0.02 0.00 -0.00 0.00 0.00 29.99 28.63 1p88 n HIS 219 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.34 177.32 1p88 n TYR 220 N 5.47 -1.73 0.00 1.57 9.36 -1.26 -4.78 117.16 125.79 1p88 n TYR 220 Ca 0.36 0.39 0.00 0.00 3.32 0.00 0.00 57.90 61.97 1p88 n TYR 220 Cb 0.19 -4.23 0.00 0.00 -0.63 0.00 0.00 39.34 34.66 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 -3.76 0.00 0.00 2.98 10.64 -1.26 -4.25 117.38 121.73 1p88 n GLN 221 Ca -0.14 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.03 1p88 n GLN 221 Cb 0.63 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.01 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 -4.74 2.61 7.27 -1.17 -3.64 117.38 117.71 1p88 n GLN 222 Ca 0.00 0.00 -0.26 0.00 0.07 0.00 0.00 57.00 56.81 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 1.73 -0.27 3.69 0.40 0.49 0.48 117.98 124.50 1p88 s PHE 223 Ca 0.00 -0.67 -0.02 0.00 -0.60 0.00 0.00 56.93 55.64 1p88 s PHE 223 Cb 0.00 -1.23 0.03 0.00 0.51 0.00 0.00 43.02 42.33 1p88 s PHE 223 CO 0.00 -0.32 -0.03 0.08 0.70 0.00 0.00 175.22 175.66 1p88 s VAL 224 N 0.59 3.05 -0.12 -0.44 1.01 0.30 -0.34 120.40 124.45 1p88 s VAL 224 Ca -0.15 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 60.76 1p88 s VAL 224 Cb -0.16 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1p88 s VAL 224 CO 0.05 0.10 -0.18 0.54 0.00 0.00 0.00 175.10 175.61 1p88 s VAL 225 N 1.33 1.72 0.29 2.92 0.11 0.04 0.61 120.40 127.42 1p88 s VAL 225 Ca -0.01 -0.78 -0.28 0.00 -2.93 0.00 0.00 61.98 57.98 1p88 s VAL 225 Cb -0.18 -1.55 -0.09 0.00 -1.53 0.00 0.00 36.38 33.03 1p88 s VAL 225 CO -0.03 0.48 1.03 -1.59 -3.33 0.00 0.00 175.10 171.67 1p88 s LYS 226 N 0.89 4.61 0.64 1.54 -2.85 -1.26 -0.19 119.74 123.12 1p88 s LYS 226 Ca -0.07 1.62 -0.02 0.00 -1.00 0.00 0.00 55.97 56.50 1p88 s LYS 226 Cb -0.15 -3.06 0.13 0.00 -2.06 0.00 0.00 37.83 32.69 1p88 s LYS 226 CO -0.01 0.24 0.87 0.41 0.10 0.00 0.00 175.35 176.96 1p88 n GLY 227 N 1.05 0.45 2.41 0.59 0.00 -1.26 -4.01 105.19 104.44 1p88 n GLY 227 Ca 0.00 -1.99 -0.14 0.00 0.00 0.00 0.00 46.02 43.89 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 -1.57 1.44 1.46 -0.02 0.00 0.72 -4.83 105.19 102.38 1p88 n GLY 228 Ca 0.14 -0.35 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.58 -0.79 -3.65 1.61 6.02 0.52 -4.96 117.38 113.55 1p88 n GLN 229 Ca -0.14 -0.77 -0.15 0.00 -0.01 0.00 0.00 57.00 55.93 1p88 n GLN 229 Cb 0.47 -0.55 -0.08 0.00 1.02 0.00 0.00 30.24 31.10 1p88 n GLN 229 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1p88 s SER 230 N -2.82 -0.47 -0.16 1.08 0.01 -1.26 -4.57 113.70 105.50 1p88 s SER 230 Ca 0.29 0.59 -0.10 0.00 1.31 0.00 0.00 55.95 58.04 1p88 s SER 230 Cb -0.01 0.60 -0.05 0.00 0.21 0.00 0.00 66.02 66.77 1p88 s SER 230 CO 0.20 -0.45 0.16 -0.31 0.41 0.00 0.00 173.24 173.26 1p88 s TYR 231 N -0.88 3.49 0.11 2.43 2.02 -1.26 -4.52 117.35 118.74 1p88 s TYR 231 Ca -0.09 0.46 0.10 0.00 -0.37 0.00 0.00 57.07 57.17 1p88 s TYR 231 Cb -0.03 -2.11 -0.04 0.00 -0.40 0.00 0.00 41.96 39.38 1p88 s TYR 231 CO 0.06 0.45 -0.26 -0.65 -1.57 0.00 0.00 175.55 173.58 1p88 s GLN 232 N -0.16 1.44 -0.40 -0.62 -0.21 0.39 0.32 119.66 120.42 1p88 s GLN 232 Ca 0.12 -1.27 -0.29 0.00 0.02 0.00 0.00 55.36 53.94 1p88 s GLN 232 Cb -0.12 -1.84 0.01 0.00 1.00 0.00 0.00 33.01 32.07 1p88 s GLN 232 CO 0.01 0.44 1.31 -1.54 -2.12 0.00 0.00 175.29 173.40 1p88 s SER 233 N -1.87 6.50 0.00 5.90 1.04 -0.17 -4.41 113.70 120.69 1p88 s SER 233 Ca 0.12 0.84 0.13 0.00 0.48 0.00 0.00 55.95 57.52 1p88 s SER 233 Cb -0.10 -2.54 0.73 0.00 0.10 0.00 0.00 66.02 64.20 1p88 s SER 233 CO 0.05 -1.29 1.26 -0.81 0.98 0.00 0.00 173.24 173.43 1p88 n PRO 234 N 7.81 0.32 0.00 4.02 -0.04 -1.26 -4.89 135.00 140.96 1p88 n PRO 234 Ca 0.15 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 1p88 n PRO 234 Cb 0.48 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 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 -0.19 1.55 2.95 0.55 0.00 -1.26 -4.85 105.19 103.94 1p88 n GLY 235 Ca 0.08 -0.53 -0.24 0.00 0.00 0.00 0.00 46.02 45.34 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 0.93 -0.04 2.61 2.01 -1.26 0.17 115.64 120.06 1p88 s THR 236 Ca 0.00 -0.32 0.03 0.00 0.31 0.00 0.00 61.69 61.71 1p88 s THR 236 Cb 0.00 -0.90 0.00 0.00 0.01 0.00 0.00 72.50 71.61 1p88 s THR 236 CO 0.00 0.32 -0.11 -0.47 -0.69 0.00 0.00 174.62 173.67 1p88 s TYR 237 N 1.02 1.20 -0.41 4.92 6.14 0.60 -4.88 117.35 125.94 1p88 s TYR 237 Ca -0.08 -0.34 -0.16 0.00 0.64 0.00 0.00 57.07 57.13 1p88 s TYR 237 Cb -0.15 -0.85 0.02 0.00 0.42 0.00 0.00 41.96 41.40 1p88 s TYR 237 CO -0.00 -0.15 0.38 -1.17 0.64 0.00 0.00 175.55 175.25 1p88 s LEU 238 N 0.27 4.89 -0.41 6.97 1.98 -1.26 0.85 118.68 131.97 1p88 s LEU 238 Ca -0.05 -0.69 -0.28 0.00 -2.89 0.00 0.00 54.13 50.21 1p88 s LEU 238 Cb -0.11 -2.30 0.02 0.00 0.66 0.00 0.00 46.19 44.46 1p88 s LEU 238 CO 0.01 -0.50 1.04 -0.69 -1.89 0.00 0.00 176.35 174.32 1p88 s VAL 239 N 1.96 4.41 -2.10 1.68 1.01 0.15 -4.89 120.40 122.62 1p88 s VAL 239 Ca 0.10 1.29 0.31 0.00 0.00 0.00 0.00 61.98 63.68 1p88 s VAL 239 Cb -0.18 -4.47 0.83 0.00 0.00 0.00 0.00 36.38 32.57 1p88 s VAL 239 CO 0.12 -0.73 2.13 -0.62 0.00 0.00 0.00 175.10 176.00