#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 0.03 -3.46 5.03 -1.26 -3.32 115.26 112.28 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 -0.17 -0.79 3.52 3.08 -1.97 -3.14 114.38 114.91 1p88 h ARG 27 Ca 0.00 0.01 0.28 0.00 0.07 0.00 0.00 59.98 60.34 1p88 h ARG 27 Cb 0.00 0.04 -0.14 0.00 0.08 0.00 0.00 29.97 29.94 1p88 h ARG 27 CO 0.00 -0.11 0.25 0.00 -1.07 0.00 0.00 179.97 179.04 1p88 n ALA 28 N -2.65 0.64 0.04 0.04 0.00 -1.21 0.13 120.51 117.50 1p88 n ALA 28 Ca -0.02 0.82 -0.20 0.00 0.00 0.00 0.00 53.44 54.04 1p88 n ALA 28 Cb 0.07 -0.73 -0.10 0.00 0.00 0.00 0.00 19.45 18.70 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 0.88 0.07 0.00 3.38 -1.81 -1.94 115.31 115.89 1p88 h LEU 29 Ca 0.59 -0.70 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1p88 h LEU 29 Cb 1.44 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1p88 h LEU 29 CO -0.66 1.51 -0.03 0.25 0.09 0.00 0.00 178.44 179.59 1p88 h LEU 30 N 0.38 -0.07 -1.67 1.67 5.85 0.11 -1.66 115.31 119.91 1p88 h LEU 30 Ca -0.13 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 1p88 h LEU 30 Cb 1.69 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.73 1p88 h LEU 30 CO 0.20 0.18 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.22 1p88 h LEU 31 N -0.33 0.00 -0.71 2.25 3.38 -0.69 -0.34 115.31 118.86 1p88 h LEU 31 Ca -0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1p88 h LEU 31 Cb 0.29 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1p88 h LEU 31 CO 0.01 0.19 0.16 0.00 0.09 0.00 0.00 178.44 178.89 1p88 h ALA 32 N 1.81 0.93 0.11 1.53 0.00 -0.94 -1.59 119.26 121.11 1p88 h ALA 32 Ca -0.00 -0.26 -0.30 0.00 0.00 0.00 0.00 54.91 54.36 1p88 h ALA 32 Cb 0.39 -0.27 0.03 0.00 0.00 0.00 0.00 17.79 17.94 1p88 h ALA 32 CO 0.03 0.67 -1.23 0.00 0.00 0.00 0.00 179.25 178.71 1p88 h ALA 33 N 1.08 0.02 0.00 0.00 0.00 -0.53 -3.08 119.26 116.74 1p88 h ALA 33 Ca 0.22 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1p88 h ALA 33 Cb 0.40 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1p88 h ALA 33 CO 0.01 0.71 0.00 1.28 0.00 0.00 0.00 179.25 181.25 1p88 n LEU 34 N -3.78 0.00 -5.00 0.00 4.77 -0.21 0.61 117.00 113.39 1p88 n LEU 34 Ca -0.13 0.15 -0.20 0.00 -0.03 0.00 0.00 56.01 55.80 1p88 n LEU 34 Cb 0.98 -0.15 0.05 0.00 -2.33 0.00 0.00 43.42 41.97 1p88 n LEU 34 CO 0.58 -0.07 0.33 0.00 -1.33 0.00 0.00 177.39 176.89 1p88 s ALA 35 N -2.30 4.22 -0.35 -1.18 0.00 -0.61 -1.26 121.76 120.28 1p88 s ALA 35 Ca 0.20 -1.66 -0.06 0.00 0.00 0.00 0.00 51.96 50.45 1p88 s ALA 35 Cb 0.11 -1.81 0.05 0.00 0.00 0.00 0.00 23.12 21.47 1p88 s ALA 35 CO 0.22 -0.74 0.12 -1.01 0.00 0.00 0.00 175.76 174.34 1p88 s HIS 36 N -2.68 3.29 0.00 0.00 3.76 0.18 0.13 115.29 119.96 1p88 s HIS 36 Ca 0.59 -1.56 0.00 0.00 -0.15 0.00 0.00 55.06 53.94 1p88 s HIS 36 Cb -0.09 -2.39 0.00 0.00 1.11 0.00 0.00 32.58 31.21 1p88 s HIS 36 CO 0.38 -0.77 0.00 0.41 -0.85 0.00 0.00 174.74 173.91 1p88 n GLY 37 N 4.79 2.56 3.60 -2.22 0.00 -1.26 -2.20 105.19 110.46 1p88 n GLY 37 Ca -0.12 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.37 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 -1.99 3.98 0.01 1.61 2.20 -1.26 0.29 119.74 124.58 1p88 s LYS 38 Ca 0.00 0.09 0.09 0.00 -0.36 0.00 0.00 55.97 55.79 1p88 s LYS 38 Cb 0.00 -3.68 -0.02 0.00 -1.51 0.00 0.00 37.83 32.62 1p88 s LYS 38 CO 0.00 -0.35 -0.26 0.99 -0.36 0.00 0.00 175.35 175.37 1p88 s THR 39 N 2.18 2.06 -0.12 3.43 2.01 -1.03 -4.37 115.64 119.81 1p88 s THR 39 Ca 0.17 -1.23 -0.06 0.00 0.31 0.00 0.00 61.69 60.88 1p88 s THR 39 Cb -0.16 -1.74 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 1p88 s THR 39 CO 0.10 0.47 0.10 -0.69 -0.69 0.00 0.00 174.62 173.91 1p88 s VAL 40 N -0.70 5.14 -0.26 3.82 1.01 0.45 -1.29 120.40 128.57 1p88 s VAL 40 Ca 0.11 0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.13 1p88 s VAL 40 Cb -0.10 -3.23 0.02 0.00 0.00 0.00 0.00 36.38 33.07 1p88 s VAL 40 CO 0.00 0.60 -0.02 -0.76 0.00 0.00 0.00 175.10 174.93 1p88 s LEU 41 N -0.88 3.40 0.06 3.92 2.01 0.17 0.21 118.68 127.57 1p88 s LEU 41 Ca 0.14 -0.83 0.01 0.00 0.01 0.00 0.00 54.13 53.45 1p88 s LEU 41 Cb -0.12 -1.73 -0.04 0.00 0.01 0.00 0.00 46.19 44.31 1p88 s LEU 41 CO 0.03 -0.15 0.14 0.28 1.01 0.00 0.00 176.35 177.66 1p88 s THR 42 N 1.37 4.96 -1.08 5.49 -1.32 0.30 -0.99 115.64 124.37 1p88 s THR 42 Ca 0.01 -0.54 0.00 0.00 -1.21 0.00 0.00 61.69 59.94 1p88 s THR 42 Cb -0.17 -3.39 0.00 0.00 -1.51 0.00 0.00 72.50 67.44 1p88 s THR 42 CO -0.02 0.16 0.00 -3.20 -2.21 0.00 0.00 174.62 169.35 1p88 n ASN 43 N 0.49 -4.02 -3.30 8.08 2.85 -0.79 -0.33 115.26 118.23 1p88 n ASN 43 Ca -0.08 0.15 -0.15 0.00 -0.11 0.00 0.00 54.58 54.39 1p88 n ASN 43 Cb 0.51 -2.84 0.14 0.00 1.24 0.00 0.00 39.78 38.84 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 -1.42 0.00 -4.52 1.20 4.77 0.41 -4.71 117.00 112.72 1p88 n LEU 44 Ca -0.12 -0.43 -0.34 0.00 -0.03 0.00 0.00 56.01 55.09 1p88 n LEU 44 Cb 0.47 -0.62 -0.12 0.00 -2.33 0.00 0.00 43.42 40.82 1p88 n LEU 44 CO 0.16 -2.25 -0.35 -0.22 -1.33 0.00 0.00 177.39 173.40 1p88 s LEU 45 N 0.00 3.29 -0.96 2.23 2.96 -1.26 -4.73 118.68 120.21 1p88 s LEU 45 Ca 0.33 -0.09 -0.18 0.00 -0.22 0.00 0.00 54.13 53.96 1p88 s LEU 45 Cb -0.06 -1.79 0.13 0.00 0.50 0.00 0.00 46.19 44.98 1p88 s LEU 45 CO 0.28 0.20 1.17 -0.62 -1.32 0.00 0.00 176.35 176.06 1p88 s ASP 46 N 0.18 6.67 -0.20 3.68 -1.08 -1.26 -4.48 116.67 120.19 1p88 s ASP 46 Ca -0.02 -2.13 -0.28 0.00 -0.52 0.00 0.00 52.55 49.61 1p88 s ASP 46 Cb -0.14 -2.41 0.11 0.00 -1.46 0.00 0.00 42.92 39.02 1p88 s ASP 46 CO 0.03 -1.04 0.91 -0.44 0.52 0.00 0.00 175.17 175.14 1p88 s SER 47 N 3.59 -0.51 0.42 -0.34 0.01 -1.26 -5.01 113.70 110.59 1p88 s SER 47 Ca 0.34 0.81 0.35 0.00 1.31 0.00 0.00 55.95 58.76 1p88 s SER 47 Cb -0.04 0.75 1.33 0.00 0.21 0.00 0.00 66.02 68.28 1p88 s SER 47 CO -0.08 -0.30 1.27 0.47 0.41 0.00 0.00 173.24 175.00 1p88 n ASP 48 N 1.64 0.07 -0.30 2.44 8.00 -1.26 0.19 116.55 127.32 1p88 n ASP 48 Ca -0.13 0.93 0.02 0.00 0.71 0.00 0.00 54.79 56.31 1p88 n ASP 48 Cb 0.56 -0.46 0.15 0.00 -0.02 0.00 0.00 41.12 41.36 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 0.74 0.08 -2.24 3.04 -1.94 -0.39 116.42 115.72 1p88 h ASP 49 Ca 0.75 0.03 -0.21 0.00 -3.24 0.00 0.00 57.03 54.36 1p88 h ASP 49 Cb 2.78 -0.12 -0.00 0.00 -1.04 0.00 0.00 39.33 40.96 1p88 h ASP 49 CO -0.15 0.45 -1.04 0.58 -2.04 0.00 0.00 179.24 177.04 1p88 h VAL 50 N 0.86 1.23 -1.02 4.15 2.07 0.18 -2.75 116.25 120.97 1p88 h VAL 50 Ca 0.38 -2.39 0.25 0.00 0.82 0.00 0.00 66.70 65.77 1p88 h VAL 50 Cb 0.27 2.85 -0.11 0.00 -1.52 0.00 0.00 31.29 32.78 1p88 h VAL 50 CO -0.21 0.63 0.63 -0.09 0.02 0.00 0.00 177.57 178.55 1p88 h ARG 51 N -0.53 0.50 0.16 1.57 2.43 -1.19 0.35 114.38 117.67 1p88 h ARG 51 Ca -0.23 -0.03 -0.29 0.00 -0.81 0.00 0.00 59.98 58.62 1p88 h ARG 51 Cb 1.55 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 31.00 1p88 h ARG 51 CO 0.03 0.33 -1.29 0.45 -1.51 0.00 0.00 179.97 177.98 1p88 h HIS 52 N 0.52 0.62 -0.72 2.20 3.86 -1.19 1.15 115.15 121.60 1p88 h HIS 52 Ca 0.63 -0.45 0.19 0.00 -1.16 0.00 0.00 60.37 59.57 1p88 h HIS 52 Cb 1.33 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 29.73 1p88 h HIS 52 CO -0.00 1.35 0.50 1.98 0.86 0.00 0.00 177.93 182.62 1p88 h MET 53 N 0.10 0.14 0.10 2.45 1.85 -0.17 3.60 114.93 122.99 1p88 h MET 53 Ca -0.16 -0.01 -0.20 0.00 -0.61 0.00 0.00 59.70 58.72 1p88 h MET 53 Cb 2.01 -0.03 0.00 0.00 0.43 0.00 0.00 31.60 34.01 1p88 h MET 53 CO 0.22 0.09 -1.00 -0.07 -0.40 0.00 0.00 176.91 175.75 1p88 h LEU 54 N 0.14 0.33 -1.03 3.39 3.38 -0.23 -3.13 115.31 118.16 1p88 h LEU 54 Ca 0.35 -0.88 0.03 0.00 0.09 0.00 0.00 57.88 57.47 1p88 h LEU 54 Cb 1.17 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.76 1p88 h LEU 54 CO -0.05 1.44 0.65 -1.13 0.09 0.00 0.00 178.44 179.44 1p88 h ASN 55 N -0.48 1.09 -0.00 -0.43 -0.73 0.59 0.76 115.58 116.37 1p88 h ASN 55 Ca -0.21 -0.01 -0.00 0.00 1.87 0.00 0.00 56.30 57.95 1p88 h ASN 55 Cb 1.58 -0.25 -0.00 0.00 0.27 0.00 0.00 38.32 39.91 1p88 h ASN 55 CO 0.06 0.75 0.00 0.00 -0.37 0.00 0.00 177.43 177.87 1p88 h ALA 56 N 1.42 0.00 -0.82 1.57 0.00 0.64 0.89 119.26 122.96 1p88 h ALA 56 Ca 0.39 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.29 1p88 h ALA 56 Cb -0.03 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 1p88 h ALA 56 CO -0.11 -0.44 0.54 -0.07 0.00 0.00 0.00 179.25 179.17 1p88 h LEU 57 N -0.11 0.82 -0.47 0.00 4.07 -1.36 -1.07 115.31 117.19 1p88 h LEU 57 Ca 0.00 -0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 1p88 h LEU 57 Cb 0.12 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.66 1p88 h LEU 57 CO -0.00 0.54 0.22 0.74 -1.08 0.00 0.00 178.44 178.86 1p88 h THR 58 N 0.94 1.19 -0.47 0.22 2.02 0.19 1.19 112.91 118.19 1p88 h THR 58 Ca 0.34 -0.56 -0.12 0.00 0.77 0.00 0.00 66.41 66.84 1p88 h THR 58 Cb 0.16 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1p88 h THR 58 CO -0.12 0.21 -0.19 0.00 0.37 0.00 0.00 175.52 175.80 1p88 h ALA 59 N 1.06 0.77 0.00 6.16 0.00 0.20 -2.69 119.26 124.76 1p88 h ALA 59 Ca 0.16 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1p88 h ALA 59 Cb 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1p88 h ALA 59 CO -0.02 0.66 0.00 -0.07 0.00 0.00 0.00 179.25 179.82 1p88 h LEU 60 N 0.82 0.00 0.00 0.00 3.38 -1.21 -3.43 115.31 114.86 1p88 h LEU 60 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1p88 h LEU 60 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1p88 h LEU 60 CO 0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.20 1p88 n GLY 61 N 0.64 1.28 3.68 0.83 0.00 -0.75 -4.28 105.19 106.59 1p88 n GLY 61 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 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 5.08 -0.05 1.61 1.01 0.40 -4.99 120.40 121.46 1p88 s VAL 62 Ca 0.00 1.09 -0.23 0.00 0.00 0.00 0.00 61.98 62.83 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 0.19 0.70 -0.44 0.00 0.00 0.00 175.10 175.55 1p88 s SER 63 N 1.04 7.00 0.27 3.32 0.01 -1.26 -4.30 113.70 119.78 1p88 s SER 63 Ca 0.27 1.21 -0.21 0.00 1.31 0.00 0.00 55.95 58.53 1p88 s SER 63 Cb -0.16 -2.41 0.02 0.00 0.21 0.00 0.00 66.02 63.68 1p88 s SER 63 CO 0.11 -0.09 0.70 -0.72 0.41 0.00 0.00 173.24 173.64 1p88 s TYR 64 N 0.68 -0.21 0.04 2.43 1.13 -1.26 0.18 117.35 120.34 1p88 s TYR 64 Ca 0.37 -0.21 0.03 0.00 -1.41 0.00 0.00 57.07 55.85 1p88 s TYR 64 Cb -0.18 0.68 -0.02 0.00 -1.10 0.00 0.00 41.96 41.34 1p88 s TYR 64 CO 0.18 -1.19 -0.09 0.99 -2.51 0.00 0.00 175.55 172.94 1p88 s THR 65 N -3.90 0.66 -0.06 -3.49 2.01 0.47 -4.94 115.64 106.39 1p88 s THR 65 Ca 0.10 -1.02 0.05 0.00 0.31 0.00 0.00 61.69 61.13 1p88 s THR 65 Cb -0.05 -0.68 -0.02 0.00 0.01 0.00 0.00 72.50 71.76 1p88 s THR 65 CO 0.05 -0.28 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.28 1p88 s LEU 66 N -1.42 2.38 0.00 4.42 2.96 -1.26 -0.24 118.68 125.53 1p88 s LEU 66 Ca -0.07 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.47 1p88 s LEU 66 Cb -0.09 -1.46 0.00 0.00 0.50 0.00 0.00 46.19 45.14 1p88 s LEU 66 CO 0.01 0.28 0.00 -0.24 -1.32 0.00 0.00 176.35 175.08 1p88 n SER 67 N 2.74 0.00 -0.07 3.68 2.88 0.22 -4.95 113.62 118.13 1p88 n SER 67 Ca -0.17 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.25 1p88 n SER 67 Cb 0.52 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.83 1p88 n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1p88 n ALA 68 N -3.00 1.44 1.97 -1.46 0.00 -1.26 -4.10 120.51 114.09 1p88 n ALA 68 Ca 0.00 -1.05 0.14 0.00 0.00 0.00 0.00 53.44 52.54 1p88 n ALA 68 Cb 0.00 -0.45 0.83 0.00 0.00 0.00 0.00 19.45 19.83 1p88 n ALA 68 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1p88 n ASP 69 N -2.97 0.08 -1.98 0.00 2.03 -1.26 -4.88 116.55 107.57 1p88 n ASP 69 Ca -0.29 -1.13 -0.21 0.00 0.52 0.00 0.00 54.79 53.68 1p88 n ASP 69 Cb 1.09 -0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 41.44 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 -0.88 -1.57 0.00 -0.67 1.74 -1.26 -4.79 116.66 109.23 1p88 n ARG 70 Ca 0.21 1.12 0.00 0.00 -0.77 0.00 0.00 57.85 58.42 1p88 n ARG 70 Cb 0.11 -5.64 0.00 0.00 -1.02 0.00 0.00 32.46 25.91 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 -3.14 0.00 -3.91 0.55 -2.24 -1.26 -4.30 114.28 99.97 1p88 n THR 71 Ca -0.23 -0.39 -0.35 0.00 -2.27 0.00 0.00 64.05 60.82 1p88 n THR 71 Cb 0.69 0.93 -0.14 0.00 -2.10 0.00 0.00 70.33 69.71 1p88 n THR 71 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1p88 s ARG 72 N -0.99 3.18 -0.07 -0.78 0.52 -1.25 0.15 118.95 119.71 1p88 s ARG 72 Ca 0.00 -0.76 0.01 0.00 -0.52 0.00 0.00 55.73 54.46 1p88 s ARG 72 Cb 0.00 -3.04 0.02 0.00 0.52 0.00 0.00 34.95 32.45 1p88 s ARG 72 CO 0.00 -0.29 -0.08 0.00 0.02 0.00 0.00 175.30 174.95 1p88 s GLU 74 N 1.01 3.22 -0.10 0.00 2.12 0.67 0.46 118.70 126.08 1p88 s GLU 74 Ca -0.09 -0.62 0.01 0.00 0.36 0.00 0.00 54.97 54.63 1p88 s GLU 74 Cb -0.15 -2.66 0.02 0.00 0.26 0.00 0.00 34.13 31.61 1p88 s GLU 74 CO -0.00 0.36 -0.10 0.42 -0.54 0.00 0.00 175.26 175.39 1p88 s ILE 75 N 0.00 1.12 -0.62 -3.70 1.01 -0.41 0.18 121.20 118.78 1p88 s ILE 75 Ca -0.02 -0.40 -0.26 0.00 0.00 0.00 0.00 60.65 59.97 1p88 s ILE 75 Cb -0.14 -1.09 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 1p88 s ILE 75 CO 0.04 0.37 1.99 0.27 0.00 0.00 0.00 174.94 177.61 1p88 s ILE 76 N 1.28 3.29 0.25 2.92 -0.00 0.47 -2.45 121.20 126.95 1p88 s ILE 76 Ca -0.03 0.11 -0.22 0.00 -0.00 0.00 0.00 60.65 60.52 1p88 s ILE 76 Cb -0.14 -3.75 -0.14 0.00 -0.00 0.00 0.00 42.46 38.43 1p88 s ILE 76 CO -0.04 -0.72 0.29 0.61 -0.00 0.00 0.00 174.94 175.08 1p88 n GLY 77 N 5.89 -1.87 0.04 6.27 0.00 0.85 -4.19 105.19 112.18 1p88 n GLY 77 Ca 0.26 0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.56 1p88 n GLY 77 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1p88 n ASN 78 N 1.85 0.62 0.00 1.61 2.85 0.20 -4.11 115.26 118.28 1p88 n ASN 78 Ca 0.13 -0.08 0.00 0.00 -0.11 0.00 0.00 54.58 54.52 1p88 n ASN 78 Cb 0.27 0.34 0.00 0.00 1.24 0.00 0.00 39.78 41.64 1p88 n ASN 78 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1p88 n GLY 79 N 1.39 0.62 0.00 8.20 0.00 0.34 -4.92 105.19 110.83 1p88 n GLY 79 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.69 0.51 3.63 -0.02 0.00 -0.39 -4.82 105.19 101.40 1p88 n GLY 80 Ca 0.00 -1.54 -0.52 0.00 0.00 0.00 0.00 46.02 43.95 1p88 n GLY 80 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1p88 n PRO 81 N 0.00 1.31 -2.34 1.61 -0.04 -1.26 -4.11 135.00 130.17 1p88 n PRO 81 Ca 0.00 0.48 -0.43 0.00 -0.04 0.00 0.00 63.50 63.51 1p88 n PRO 81 Cb 0.00 -2.15 -0.02 0.00 -0.04 0.00 0.00 33.50 31.29 1p88 n PRO 81 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1p88 s LEU 82 N 1.36 3.55 -0.14 1.53 2.01 -1.26 -4.91 118.68 120.82 1p88 s LEU 82 Ca 0.87 0.76 -0.29 0.00 0.01 0.00 0.00 54.13 55.48 1p88 s LEU 82 Cb -0.94 -3.47 -0.01 0.00 0.01 0.00 0.00 46.19 41.79 1p88 s LEU 82 CO 0.50 -1.49 1.00 -1.38 1.01 0.00 0.00 176.35 175.98 1p88 s HIS 83 N 5.62 3.47 -0.19 0.29 -3.43 -1.26 -4.92 115.29 114.87 1p88 s HIS 83 Ca 0.61 1.54 -0.21 0.00 -0.80 0.00 0.00 55.06 56.20 1p88 s HIS 83 Cb -0.13 -3.19 -0.03 0.00 -1.43 0.00 0.00 32.58 27.80 1p88 s HIS 83 CO 0.32 -0.28 0.62 0.00 -2.00 0.00 0.00 174.74 173.39 1p88 s ALA 84 N 2.27 3.53 -0.03 -1.38 0.00 -1.26 -4.59 121.76 120.31 1p88 s ALA 84 Ca 0.46 -0.25 -0.30 0.00 0.00 0.00 0.00 51.96 51.87 1p88 s ALA 84 Cb -0.17 -2.94 -0.05 0.00 0.00 0.00 0.00 23.12 19.95 1p88 s ALA 84 CO 0.15 -0.49 1.49 -1.21 0.00 0.00 0.00 175.76 175.69 1p88 s GLU 85 N 1.76 4.24 1.06 0.00 8.01 -1.26 -4.63 118.70 127.88 1p88 s GLU 85 Ca 0.29 2.03 0.00 0.00 0.01 0.00 0.00 54.97 57.30 1p88 s GLU 85 Cb -0.16 -3.72 0.00 0.00 -4.31 0.00 0.00 34.13 25.94 1p88 s GLU 85 CO 0.11 -0.69 0.00 0.41 0.01 0.00 0.00 175.26 175.10 1p88 n GLY 86 N 3.82 -1.50 3.80 -1.39 0.00 -1.26 -4.70 105.19 103.97 1p88 n GLY 86 Ca 0.15 -1.10 -0.36 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.06 3.28 0.29 4.61 0.00 -1.26 -4.55 121.76 122.07 1p88 s ALA 87 Ca 0.00 0.36 0.09 0.00 0.00 0.00 0.00 51.96 52.42 1p88 s ALA 87 Cb 0.00 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.05 1p88 s ALA 87 CO 0.00 0.24 0.00 -1.17 0.00 0.00 0.00 175.76 174.83 1p88 s LEU 88 N -2.14 3.10 -0.26 0.00 2.96 0.54 -4.97 118.68 117.92 1p88 s LEU 88 Ca 0.48 -0.78 -0.04 0.00 -0.22 0.00 0.00 54.13 53.58 1p88 s LEU 88 Cb -0.17 -1.58 0.09 0.00 0.50 0.00 0.00 46.19 45.03 1p88 s LEU 88 CO 0.22 -0.09 0.12 -1.61 -1.32 0.00 0.00 176.35 173.66 1p88 s GLU 89 N -3.69 0.18 -0.21 1.98 2.02 -1.26 0.18 118.70 117.90 1p88 s GLU 89 Ca 0.33 -0.42 -0.11 0.00 0.02 0.00 0.00 54.97 54.78 1p88 s GLU 89 Cb -0.04 -1.39 -0.05 0.00 0.10 0.00 0.00 34.13 32.75 1p88 s GLU 89 CO 0.20 -0.92 0.18 -0.51 0.02 0.00 0.00 175.26 174.23 1p88 s LEU 90 N 2.09 4.17 -0.68 1.80 1.02 0.56 -4.89 118.68 122.75 1p88 s LEU 90 Ca 0.07 0.23 -0.16 0.00 0.02 0.00 0.00 54.13 54.29 1p88 s LEU 90 Cb -0.16 -2.16 0.16 0.00 0.02 0.00 0.00 46.19 44.06 1p88 s LEU 90 CO -0.29 0.10 0.65 -0.36 0.02 0.00 0.00 176.35 176.48 1p88 s PHE 91 N 0.74 3.43 -0.85 0.29 0.40 -1.26 0.90 117.98 121.63 1p88 s PHE 91 Ca 0.09 -1.55 -0.00 0.00 -0.60 0.00 0.00 56.93 54.87 1p88 s PHE 91 Cb -0.13 -3.85 0.34 0.00 0.51 0.00 0.00 43.02 39.90 1p88 s PHE 91 CO 0.02 -1.05 1.75 1.28 0.70 0.00 0.00 175.22 177.92 1p88 n LEU 92 N 4.87 6.88 0.06 -0.37 7.99 0.41 -4.84 117.00 132.01 1p88 n LEU 92 Ca -0.01 -5.17 -0.03 0.00 -0.01 0.00 0.00 56.01 50.79 1p88 n LEU 92 Cb 0.43 -1.00 -0.01 0.00 -0.11 0.00 0.00 43.42 42.73 1p88 n LEU 92 CO 0.46 1.98 0.50 1.23 -1.51 0.00 0.00 177.39 180.05 1p88 h GLY 93 N 3.42 -0.59 1.18 -0.72 0.00 -1.86 -2.85 103.07 101.64 1p88 h GLY 93 Ca 0.49 0.26 0.00 0.00 0.00 0.00 0.00 47.33 48.07 1p88 h GLY 93 CO 1.22 -0.21 0.00 0.70 0.00 0.00 0.00 176.54 178.24 1p88 n ASN 94 N -2.68 0.00 -2.34 0.19 3.02 -1.26 -3.82 115.26 108.37 1p88 n ASN 94 Ca -0.02 -0.70 -0.27 0.00 -0.03 0.00 0.00 54.58 53.56 1p88 n ASN 94 Cb 0.07 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 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 -1.09 6.04 -0.08 5.41 0.00 -1.08 -4.15 120.51 125.58 1p88 n ALA 95 Ca 0.20 -2.82 0.26 0.00 0.00 0.00 0.00 53.44 51.08 1p88 n ALA 95 Cb 0.14 -1.84 0.71 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 3.12 0.00 1.12 0.00 0.00 -1.69 1.06 103.07 106.68 1p88 h GLY 96 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 1p88 h GLY 96 CO 1.01 0.00 -0.66 -1.30 0.00 0.00 0.00 176.54 175.59 1p88 n THR 97 N -3.90 0.34 -0.04 4.70 -2.24 -1.26 -4.04 114.28 107.84 1p88 n THR 97 Ca 0.15 -0.27 -0.17 0.00 -2.27 0.00 0.00 64.05 61.48 1p88 n THR 97 Cb 0.90 -0.11 -0.14 0.00 -2.10 0.00 0.00 70.33 68.89 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 -1.83 1.19 -0.12 6.98 0.00 0.34 -4.12 120.51 122.94 1p88 n ALA 98 Ca 0.03 -0.81 -0.07 0.00 0.00 0.00 0.00 53.44 52.58 1p88 n ALA 98 Cb 0.44 -0.53 0.01 0.00 0.00 0.00 0.00 19.45 19.37 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 0.04 0.46 0.28 0.00 -1.53 -1.11 0.18 114.93 113.24 1p88 h MET 99 Ca -0.45 -0.03 -0.00 0.00 -3.44 0.00 0.00 59.70 55.79 1p88 h MET 99 Cb 2.02 -0.10 -0.03 0.00 -0.55 0.00 0.00 31.60 32.93 1p88 h MET 99 CO 0.04 0.31 -0.49 0.00 0.14 0.00 0.00 176.91 176.91 1p88 h ARG 100 N 0.48 -0.79 -0.16 0.39 -0.00 -1.76 0.69 114.38 113.22 1p88 h ARG 100 Ca 0.15 0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.69 1p88 h ARG 100 Cb -0.00 0.18 -0.01 0.00 0.00 0.00 0.00 29.97 30.14 1p88 h ARG 100 CO -0.07 -0.53 0.09 -1.00 0.00 0.00 0.00 179.97 178.47 1p88 h PRO 101 N -0.82 0.21 0.13 0.04 0.13 -1.66 -2.52 132.00 127.51 1p88 h PRO 101 Ca -0.03 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 1p88 h PRO 101 Cb 0.77 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1p88 h PRO 101 CO -0.17 0.16 -0.06 -0.07 -0.23 0.00 0.00 178.00 177.62 1p88 h LEU 102 N 0.22 -0.15 -1.96 1.56 3.38 0.02 0.15 115.31 118.52 1p88 h LEU 102 Ca 0.06 -0.41 0.35 0.00 0.09 0.00 0.00 57.88 57.97 1p88 h LEU 102 Cb 0.00 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 1p88 h LEU 102 CO -0.01 0.45 0.89 0.00 0.09 0.00 0.00 178.44 179.86 1p88 h ALA 103 N -0.26 3.13 0.00 1.53 0.00 0.54 0.13 119.26 124.33 1p88 h ALA 103 Ca -0.02 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1p88 h ALA 103 Cb 0.54 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1p88 h ALA 103 CO 0.03 -1.52 -0.90 0.00 0.00 0.00 0.00 179.25 176.86 1p88 h ALA 104 N 1.35 0.17 -0.55 0.00 0.00 -1.40 -3.34 119.26 115.48 1p88 h ALA 104 Ca 0.57 -0.94 0.01 0.00 0.00 0.00 0.00 54.91 54.55 1p88 h ALA 104 Cb 2.36 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 20.69 1p88 h ALA 104 CO -0.01 0.54 0.37 0.00 0.00 0.00 0.00 179.25 180.15 1p88 h ALA 105 N -0.53 1.62 0.00 0.00 0.00 0.35 -2.13 119.26 118.57 1p88 h ALA 105 Ca -0.23 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1p88 h ALA 105 Cb 1.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1p88 h ALA 105 CO -0.14 0.35 0.00 1.28 0.00 0.00 0.00 179.25 180.75 1p88 n LEU 106 N -4.45 0.16 -1.61 0.00 4.77 0.36 -3.07 117.00 113.17 1p88 n LEU 106 Ca 0.05 0.52 -0.05 0.00 -0.03 0.00 0.00 56.01 56.50 1p88 n LEU 106 Cb 0.06 -0.47 0.19 0.00 -2.33 0.00 0.00 43.42 40.87 1p88 n LEU 106 CO 0.36 -0.07 0.83 0.00 -1.33 0.00 0.00 177.39 177.18 1p88 n LEU 108 N -0.07 1.29 0.00 0.00 4.77 -1.17 0.61 117.00 122.43 1p88 n LEU 108 Ca 0.28 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 1p88 n LEU 108 Cb 1.07 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 1p88 n LEU 108 CO 0.30 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 1p88 n GLY 109 N 2.24 1.26 3.09 -0.72 0.00 -1.26 -2.34 105.19 107.47 1p88 n GLY 109 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.16 -1.02 -0.02 1.61 1.04 -1.26 -0.53 113.70 112.36 1p88 s SER 110 Ca 0.00 -0.34 -0.02 0.00 0.48 0.00 0.00 55.95 56.07 1p88 s SER 110 Cb 0.00 1.73 0.00 0.00 0.10 0.00 0.00 66.02 67.86 1p88 s SER 110 CO 0.00 -0.27 0.05 0.54 0.98 0.00 0.00 173.24 174.54 1p88 s ASN 111 N 2.38 -0.05 -0.61 7.02 2.20 -1.25 -4.79 114.94 119.85 1p88 s ASN 111 Ca 0.12 0.10 -0.18 0.00 -0.94 0.00 0.00 52.86 51.95 1p88 s ASN 111 Cb -0.09 0.10 0.11 0.00 -2.00 0.00 0.00 41.25 39.37 1p88 s ASN 111 CO -0.19 -0.02 0.70 -1.81 -2.94 0.00 0.00 177.10 172.83 1p88 s ASP 112 N 0.01 6.22 0.04 3.54 1.11 -1.14 -1.27 116.67 125.18 1p88 s ASP 112 Ca -0.00 -1.55 0.08 0.00 0.18 0.00 0.00 52.55 51.25 1p88 s ASP 112 Cb -0.00 -2.29 -0.02 0.00 1.07 0.00 0.00 42.92 41.67 1p88 s ASP 112 CO 0.00 -1.06 -0.22 -0.63 1.18 0.00 0.00 175.17 174.44 1p88 s ILE 113 N 2.45 1.79 -0.28 0.77 1.09 0.65 0.20 121.20 127.88 1p88 s ILE 113 Ca 0.11 -1.21 -0.03 0.00 -1.10 0.00 0.00 60.65 58.43 1p88 s ILE 113 Cb -0.24 -1.54 0.03 0.00 -1.06 0.00 0.00 42.46 39.65 1p88 s ILE 113 CO 0.05 0.28 -0.02 -0.69 -0.10 0.00 0.00 174.94 174.46 1p88 s VAL 114 N -0.76 3.09 -0.46 2.92 1.01 0.49 0.15 120.40 126.85 1p88 s VAL 114 Ca 0.09 -1.10 -0.14 0.00 0.00 0.00 0.00 61.98 60.82 1p88 s VAL 114 Cb -0.09 -2.65 0.07 0.00 0.00 0.00 0.00 36.38 33.71 1p88 s VAL 114 CO 0.02 0.07 0.36 -0.76 0.00 0.00 0.00 175.10 174.78 1p88 s LEU 115 N 1.33 5.48 0.00 3.92 1.43 -0.11 0.21 118.68 130.94 1p88 s LEU 115 Ca -0.01 -1.31 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 1p88 s LEU 115 Cb -0.18 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 43.90 1p88 s LEU 115 CO -0.02 -0.61 0.02 0.41 0.23 0.00 0.00 176.35 176.38 1p88 n THR 116 N 5.15 0.00 -2.98 5.49 -1.04 0.26 -2.38 114.28 118.77 1p88 n THR 116 Ca -0.12 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.50 1p88 n THR 116 Cb 0.44 -0.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.90 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 3.96 1.70 3.92 3.41 0.00 -1.26 0.15 105.19 117.07 1p88 n GLY 117 Ca -0.03 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.86 2.64 0.40 1.61 2.02 -1.26 -4.78 118.70 118.46 1p88 s GLU 118 Ca 0.00 -0.10 0.22 0.00 0.02 0.00 0.00 54.97 55.12 1p88 s GLU 118 Cb 0.00 -2.23 1.24 0.00 0.10 0.00 0.00 34.13 33.24 1p88 s GLU 118 CO 0.00 -0.91 1.68 -1.00 0.02 0.00 0.00 175.26 175.04 1p88 h PRO 119 N -0.35 0.23 0.00 0.39 0.13 -2.02 1.32 132.00 131.71 1p88 h PRO 119 Ca -0.45 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 1p88 h PRO 119 Cb 1.28 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 1p88 h PRO 119 CO 0.60 0.15 -0.25 0.00 -0.23 0.00 0.00 178.00 178.28 1p88 h ARG 120 N 0.24 0.00 -0.15 0.86 3.08 -1.93 -1.95 114.38 114.52 1p88 h ARG 120 Ca 0.73 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.75 1p88 h ARG 120 Cb 2.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 32.04 1p88 h ARG 120 CO -0.44 0.25 -0.03 1.98 -1.07 0.00 0.00 179.97 180.66 1p88 h MET 121 N 0.00 0.22 0.00 0.04 4.05 0.15 0.32 114.93 119.72 1p88 h MET 121 Ca -0.00 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1p88 h MET 121 Cb 0.57 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.33 1p88 h MET 121 CO 0.03 0.27 0.00 0.87 0.23 0.00 0.00 176.91 178.32 1p88 h LYS 122 N 0.22 0.00 -0.10 0.39 6.56 -1.30 0.38 116.57 122.72 1p88 h LYS 122 Ca 0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 1p88 h LYS 122 Cb 0.21 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.87 1p88 h LYS 122 CO 0.01 0.00 0.00 0.39 -2.06 0.00 0.00 179.45 177.79 1p88 n GLU 123 N -2.78 1.40 -3.72 3.15 1.02 0.10 -4.36 120.64 115.45 1p88 n GLU 123 Ca -0.02 -0.60 -0.28 0.00 -0.02 0.00 0.00 57.16 56.24 1p88 n GLU 123 Cb 0.09 -1.32 -0.11 0.00 -0.02 0.00 0.00 31.44 30.08 1p88 n GLU 123 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1p88 s ARG 124 N -1.87 1.89 0.60 3.49 0.52 0.13 -5.11 118.95 118.59 1p88 s ARG 124 Ca 0.28 -2.87 -0.19 0.00 -0.52 0.00 0.00 55.73 52.43 1p88 s ARG 124 Cb 0.14 -2.70 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 1p88 s ARG 124 CO 0.22 -1.32 1.10 -0.35 0.02 0.00 0.00 175.30 174.98 1p88 n PRO 125 N 2.33 1.09 -0.01 3.54 -0.04 -1.26 -4.28 135.00 136.38 1p88 n PRO 125 Ca 0.23 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 64.11 1p88 n PRO 125 Cb 0.39 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 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 -1.61 0.72 -0.37 0.52 3.06 0.35 -4.79 119.36 117.24 1p88 n ILE 126 Ca 0.14 -0.73 -0.02 0.00 -2.50 0.00 0.00 62.75 59.64 1p88 n ILE 126 Cb 0.47 0.63 0.12 0.00 0.54 0.00 0.00 39.64 41.39 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 1.40 0.97 4.50 0.00 -1.76 -1.27 103.07 106.90 1p88 h GLY 127 Ca 0.00 -0.52 0.07 0.00 0.00 0.00 0.00 47.33 46.88 1p88 h GLY 127 CO 0.00 0.51 0.51 0.45 0.00 0.00 0.00 176.54 178.01 1p88 h HIS 128 N 1.35 0.85 -0.01 5.60 3.86 -1.88 -0.48 115.15 124.44 1p88 h HIS 128 Ca 0.36 0.02 -0.15 0.00 -1.16 0.00 0.00 60.37 59.45 1p88 h HIS 128 Cb -0.16 -0.28 0.01 0.00 1.06 0.00 0.00 27.41 28.04 1p88 h HIS 128 CO -0.00 0.45 -0.56 1.25 0.86 0.00 0.00 177.93 179.92 1p88 h LEU 129 N 0.84 0.51 -0.37 2.43 5.85 -1.77 -2.57 115.31 120.22 1p88 h LEU 129 Ca 0.34 -0.75 0.06 0.00 0.84 0.00 0.00 57.88 58.36 1p88 h LEU 129 Cb 0.25 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 1p88 h LEU 129 CO -0.12 1.19 0.07 0.58 -0.34 0.00 0.00 178.44 179.83 1p88 h VAL 130 N -0.12 0.81 -0.44 1.05 2.07 -0.67 0.18 116.25 119.13 1p88 h VAL 130 Ca -0.07 -0.07 -0.11 0.00 0.82 0.00 0.00 66.70 67.28 1p88 h VAL 130 Cb 1.27 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1p88 h VAL 130 CO 0.11 0.04 -0.14 0.44 0.02 0.00 0.00 177.57 178.03 1p88 h ASP 131 N 0.20 0.89 -0.66 0.57 5.19 -1.20 1.12 116.42 122.53 1p88 h ASP 131 Ca 0.18 -0.38 0.06 0.00 -0.62 0.00 0.00 57.03 56.27 1p88 h ASP 131 Cb 0.21 -0.24 -0.05 0.00 0.18 0.00 0.00 39.33 39.42 1p88 h ASP 131 CO -0.23 1.07 0.37 0.00 -3.12 0.00 0.00 179.24 177.32 1p88 h ALA 132 N 0.85 0.89 0.02 3.45 0.00 -0.98 0.54 119.26 124.02 1p88 h ALA 132 Ca 0.11 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1p88 h ALA 132 Cb 0.70 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1p88 h ALA 132 CO 0.05 0.05 -0.01 -0.07 0.00 0.00 0.00 179.25 179.27 1p88 h LEU 133 N 0.68 -0.02 -2.10 0.00 3.38 -0.45 -3.19 115.31 113.62 1p88 h LEU 133 Ca 0.30 -0.75 0.09 0.00 0.09 0.00 0.00 57.88 57.60 1p88 h LEU 133 Cb 0.18 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1p88 h LEU 133 CO -0.18 0.80 0.31 0.03 0.09 0.00 0.00 178.44 179.49 1p88 h ARG 134 N -0.89 0.00 -0.10 1.13 2.47 0.15 0.48 114.38 117.61 1p88 h ARG 134 Ca -0.00 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.60 1p88 h ARG 134 Cb 0.77 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 1p88 h ARG 134 CO 0.00 0.00 -0.45 1.25 0.56 0.00 0.00 179.97 181.34 1p88 h LEU 135 N 0.00 0.25 -0.41 3.04 5.85 0.08 -2.43 115.31 121.70 1p88 h LEU 135 Ca 0.15 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1p88 h LEU 135 Cb 0.77 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1p88 h LEU 135 CO -0.00 0.67 0.00 0.61 -0.34 0.00 0.00 178.44 179.38 1p88 n GLY 136 N -0.10 -0.26 0.38 3.75 0.00 0.16 -4.79 105.19 104.33 1p88 n GLY 136 Ca -0.02 -0.06 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 0.48 0.77 3.80 -0.02 0.00 -0.92 -0.09 105.19 109.20 1p88 n GLY 137 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.14 2.91 -0.43 4.61 0.00 -0.92 -3.22 121.76 122.58 1p88 s ALA 138 Ca 0.00 0.58 -0.17 0.00 0.00 0.00 0.00 51.96 52.37 1p88 s ALA 138 Cb 0.00 -3.24 0.03 0.00 0.00 0.00 0.00 23.12 19.91 1p88 s ALA 138 CO 0.00 -0.23 0.44 0.15 0.00 0.00 0.00 175.76 176.12 1p88 s LYS 139 N -3.16 3.08 -0.03 0.00 1.02 -1.01 -4.11 119.74 115.52 1p88 s LYS 139 Ca 0.66 -0.84 -0.01 0.00 0.02 0.00 0.00 55.97 55.80 1p88 s LYS 139 Cb -0.16 -3.99 0.03 0.00 -0.52 0.00 0.00 37.83 33.19 1p88 s LYS 139 CO 0.19 -0.89 0.06 0.42 -0.92 0.00 0.00 175.35 174.21 1p88 s ILE 140 N 2.11 -0.08 -0.02 2.17 1.01 -1.26 -2.07 121.20 123.07 1p88 s ILE 140 Ca 0.11 0.28 0.06 0.00 0.00 0.00 0.00 60.65 61.10 1p88 s ILE 140 Cb -0.18 -0.13 -0.02 0.00 0.01 0.00 0.00 42.46 42.15 1p88 s ILE 140 CO 0.13 0.11 -0.21 -0.89 0.00 0.00 0.00 174.94 174.09 1p88 s THR 141 N 1.44 1.62 -0.00 2.92 2.01 -0.77 -4.95 115.64 117.90 1p88 s THR 141 Ca -0.05 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 60.78 1p88 s THR 141 Cb -0.13 -1.35 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 1p88 s THR 141 CO -0.03 0.46 0.96 -0.31 -0.69 0.00 0.00 174.62 175.00 1p88 s TYR 142 N -0.48 3.66 0.00 4.92 2.02 -1.26 -0.85 117.35 125.36 1p88 s TYR 142 Ca 0.08 1.66 0.00 0.00 -0.37 0.00 0.00 57.07 58.44 1p88 s TYR 142 Cb -0.08 -3.09 0.00 0.00 -0.40 0.00 0.00 41.96 38.39 1p88 s TYR 142 CO -0.01 0.01 0.00 1.28 -1.57 0.00 0.00 175.55 175.26 1p88 n LEU 143 N 3.85 0.86 0.00 -1.29 4.32 -1.26 -4.91 117.00 118.58 1p88 n LEU 143 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.04 1p88 n LEU 143 Cb 0.51 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.31 1p88 n LEU 143 CO 0.52 0.00 0.11 -0.62 -1.22 0.00 0.00 177.39 176.17 1p88 n GLU 144 N -0.46 0.00 -4.17 3.23 1.02 -1.26 -4.90 120.64 114.10 1p88 n GLU 144 Ca 0.00 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.87 1p88 n GLU 144 Cb 0.00 -0.65 -0.07 0.00 -0.02 0.00 0.00 31.44 30.70 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 -0.42 2.52 0.15 3.49 -0.21 -1.26 -5.08 119.66 118.85 1p88 s GLN 145 Ca 0.00 -1.02 -0.31 0.00 0.02 0.00 0.00 55.36 54.06 1p88 s GLN 145 Cb 0.00 -2.44 -0.08 0.00 1.00 0.00 0.00 33.01 31.48 1p88 s GLN 145 CO 0.00 0.47 1.36 -1.21 -2.12 0.00 0.00 175.29 173.80 1p88 s GLU 146 N -2.87 4.34 -0.95 2.91 2.02 -1.26 -2.29 118.70 120.60 1p88 s GLU 146 Ca 0.28 2.08 0.00 0.00 0.02 0.00 0.00 54.97 57.35 1p88 s GLU 146 Cb -0.10 -3.22 0.00 0.00 0.10 0.00 0.00 34.13 30.91 1p88 s GLU 146 CO 0.19 -0.37 0.00 0.09 0.02 0.00 0.00 175.26 175.19 1p88 n ASN 147 N 3.42 -4.09 -4.87 -0.19 4.13 -1.26 -4.86 115.26 107.55 1p88 n ASN 147 Ca 0.09 0.22 -0.21 0.00 1.68 0.00 0.00 54.58 56.37 1p88 n ASN 147 Cb 0.42 -2.37 -0.03 0.00 -1.54 0.00 0.00 39.78 36.26 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 -2.33 2.74 0.16 3.10 1.51 -0.97 0.13 117.35 121.69 1p88 s TYR 148 Ca 0.00 -0.46 -0.20 0.00 -1.01 0.00 0.00 57.07 55.40 1p88 s TYR 148 Cb 0.00 -2.11 0.06 0.00 -0.11 0.00 0.00 41.96 39.81 1p88 s TYR 148 CO 0.00 -0.07 1.24 -2.30 -1.11 0.00 0.00 175.55 173.32 1p88 n PRO 149 N -1.51 -0.28 -1.69 -1.71 -0.02 -1.26 -4.30 135.00 124.23 1p88 n PRO 149 Ca 0.03 1.23 -0.40 0.00 -2.02 0.00 0.00 63.50 62.33 1p88 n PRO 149 Cb 0.61 -1.81 0.03 0.00 -0.02 0.00 0.00 33.50 32.31 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 -5.09 1.61 -3.66 0.52 -0.02 -1.08 -4.36 135.00 122.92 1p88 n PRO 150 Ca 0.05 0.58 -0.11 0.00 -2.02 0.00 0.00 63.50 62.00 1p88 n PRO 150 Cb 0.26 -2.36 -0.08 0.00 -0.02 0.00 0.00 33.50 31.30 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 -2.08 -0.47 -0.42 2.45 1.43 -1.00 -4.05 118.68 114.53 1p88 s LEU 151 Ca 0.67 1.25 -0.10 0.00 -1.03 0.00 0.00 54.13 54.91 1p88 s LEU 151 Cb -0.47 2.04 0.07 0.00 0.03 0.00 0.00 46.19 47.86 1p88 s LEU 151 CO 0.53 -0.22 0.28 -0.13 0.23 0.00 0.00 176.35 177.05 1p88 s ARG 152 N 0.94 2.69 0.07 1.70 0.52 -0.03 -0.93 118.95 123.90 1p88 s ARG 152 Ca -0.05 -1.40 -0.10 0.00 -0.52 0.00 0.00 55.73 53.66 1p88 s ARG 152 Cb -0.05 -3.84 -0.06 0.00 0.52 0.00 0.00 34.95 31.53 1p88 s ARG 152 CO -0.08 -0.94 0.39 -0.51 0.02 0.00 0.00 175.30 174.18 1p88 s LEU 153 N 1.47 4.36 0.00 2.53 1.43 0.40 -1.84 118.68 127.04 1p88 s LEU 153 Ca 0.03 0.79 0.13 0.00 -1.03 0.00 0.00 54.13 54.05 1p88 s LEU 153 Cb -0.23 -2.92 0.22 0.00 0.03 0.00 0.00 46.19 43.29 1p88 s LEU 153 CO 0.03 0.19 1.05 0.00 0.23 0.00 0.00 176.35 177.85 1p88 n GLN 154 N 1.00 0.00 -0.83 1.70 6.02 -0.39 -0.25 117.38 124.62 1p88 n GLN 154 Ca -0.09 -1.43 0.11 0.00 -0.01 0.00 0.00 57.00 55.58 1p88 n GLN 154 Cb 0.52 0.01 -0.03 0.00 1.02 0.00 0.00 30.24 31.76 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 0.26 -1.09 0.00 1.08 0.00 -1.20 -3.83 105.19 100.40 1p88 n GLY 155 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.67 1.23 3.68 -0.02 0.00 0.31 -2.41 105.19 105.31 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 0.00 2.52 -0.02 1.61 -0.00 0.20 -3.87 117.46 117.91 1p88 n PHE 157 Ca 0.00 -0.20 -0.02 0.00 -0.00 0.00 0.00 57.45 57.23 1p88 n PHE 157 Cb 0.00 -2.74 -0.02 0.00 -0.00 0.00 0.00 39.48 36.72 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 5.04 0.18 -0.84 -2.13 -2.24 0.33 -4.48 114.28 110.15 1p88 n THR 158 Ca 0.19 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1p88 n THR 158 Cb 0.37 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 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 3.26 0.41 0.00 3.38 0.00 0.87 0.17 105.19 113.28 1p88 n GLY 159 Ca -0.05 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.21 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 -0.16 2.91 3.64 -0.02 0.00 -0.13 -4.21 105.19 107.23 1p88 n GLY 160 Ca 0.00 -1.85 -0.55 0.00 0.00 0.00 0.00 46.02 43.62 1p88 n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p88 n ASN 161 N 0.00 1.91 -4.43 1.61 3.02 -1.26 -3.61 115.26 112.51 1p88 n ASN 161 Ca 0.00 1.10 -0.31 0.00 -0.03 0.00 0.00 54.58 55.35 1p88 n ASN 161 Cb 0.00 -1.16 -0.13 0.00 -0.61 0.00 0.00 39.78 37.88 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 1.81 2.62 -0.22 2.41 1.01 0.61 -4.68 120.40 123.95 1p88 s VAL 162 Ca 0.91 -1.20 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 1p88 s VAL 162 Cb -1.02 -2.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.29 1p88 s VAL 162 CO 0.56 0.37 -0.06 -1.81 0.00 0.00 0.00 175.10 174.15 1p88 s ASP 163 N -1.31 4.16 -0.11 3.32 1.01 -1.26 -0.75 116.67 121.73 1p88 s ASP 163 Ca 0.14 -0.48 -0.01 0.00 0.71 0.00 0.00 52.55 52.90 1p88 s ASP 163 Cb -0.10 -1.70 0.03 0.00 1.01 0.00 0.00 42.92 42.16 1p88 s ASP 163 CO 0.04 -0.03 -0.04 -0.69 0.21 0.00 0.00 175.17 174.65 1p88 s VAL 164 N 1.44 0.78 0.31 -1.27 1.01 -0.87 -4.25 120.40 117.55 1p88 s VAL 164 Ca 0.05 -0.18 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 1p88 s VAL 164 Cb -0.14 -0.88 -0.13 0.00 0.00 0.00 0.00 36.38 35.23 1p88 s VAL 164 CO -0.05 0.29 1.33 -0.67 0.00 0.00 0.00 175.10 175.99 1p88 n ASP 165 N 5.01 2.76 -0.12 3.32 -0.08 -1.26 -2.74 116.55 123.45 1p88 n ASP 165 Ca -0.10 1.19 -0.09 0.00 -1.51 0.00 0.00 54.79 54.28 1p88 n ASP 165 Cb 0.50 -1.47 -0.01 0.00 2.34 0.00 0.00 41.12 42.48 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 3.07 0.53 -7.57 0.27 0.00 -1.27 -3.35 103.07 94.76 1p88 h GLY 166 Ca -0.46 -0.22 -0.72 0.00 0.00 0.00 0.00 47.33 45.93 1p88 h GLY 166 CO 0.67 0.21 0.83 -0.56 0.00 0.00 0.00 176.54 177.69 1p88 s SER 167 N -5.59 6.78 0.00 0.19 0.01 -1.24 -0.27 113.70 113.57 1p88 s SER 167 Ca -0.13 -2.42 0.00 0.00 1.31 0.00 0.00 55.95 54.71 1p88 s SER 167 Cb 0.10 -2.36 0.00 0.00 0.21 0.00 0.00 66.02 63.97 1p88 s SER 167 CO 0.72 -0.89 0.00 0.52 0.41 0.00 0.00 173.24 174.01 1p88 n VAL 168 N 4.95 0.00 -3.64 3.43 0.31 -1.26 -5.01 118.33 117.11 1p88 n VAL 168 Ca 0.25 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.55 1p88 n VAL 168 Cb 0.47 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.33 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 1.25 -0.45 0.47 4.52 0.01 -1.26 -5.02 113.70 113.22 1p88 s SER 169 Ca 0.00 0.75 0.29 0.00 1.31 0.00 0.00 55.95 58.30 1p88 s SER 169 Cb 0.00 1.07 1.55 0.00 0.21 0.00 0.00 66.02 68.85 1p88 s SER 169 CO 0.00 -0.12 1.86 0.77 0.41 0.00 0.00 173.24 176.16 1p88 h SER 170 N 5.44 0.00 0.80 2.44 4.64 -1.90 0.14 113.55 125.11 1p88 h SER 170 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1p88 h SER 170 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1p88 h SER 170 CO 0.18 0.00 -0.30 0.00 -0.87 0.00 0.00 176.83 175.83 1p88 n GLN 171 N -2.55 0.06 0.08 4.77 3.00 -1.26 -2.51 117.38 118.97 1p88 n GLN 171 Ca -0.02 0.03 -0.06 0.00 -0.01 0.00 0.00 57.00 56.94 1p88 n GLN 171 Cb 0.12 -1.55 -0.03 0.00 0.00 0.00 0.00 30.24 28.78 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 -0.29 -0.88 1.08 -1.00 -1.07 -0.84 116.94 113.94 1p88 h PHE 172 Ca 0.00 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.77 1p88 h PHE 172 Cb 0.55 0.10 -0.04 0.00 3.61 0.00 0.00 35.95 40.16 1p88 h PHE 172 CO 0.00 -0.12 0.54 1.25 -1.61 0.00 0.00 178.31 178.37 1p88 h LEU 173 N -1.06 1.05 -1.11 1.54 6.46 -1.70 -0.95 115.31 119.54 1p88 h LEU 173 Ca -0.03 -0.06 0.01 0.00 -0.12 0.00 0.00 57.88 57.68 1p88 h LEU 173 Cb 0.30 -0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 39.92 1p88 h LEU 173 CO 0.05 0.80 0.60 0.74 -0.62 0.00 0.00 178.44 180.01 1p88 h THR 174 N 1.21 1.22 -0.82 1.05 2.02 -1.57 0.45 112.91 116.47 1p88 h THR 174 Ca 0.32 -0.42 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 1p88 h THR 174 Cb -0.07 -0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.20 1p88 h THR 174 CO -0.06 0.22 0.51 0.00 0.37 0.00 0.00 175.52 176.56 1p88 h ALA 175 N 1.44 1.05 0.02 6.16 0.00 0.24 -1.43 119.26 126.73 1p88 h ALA 175 Ca 0.34 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.96 1p88 h ALA 175 Cb -0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.32 1p88 h ALA 175 CO -0.08 0.50 -0.94 -0.07 0.00 0.00 0.00 179.25 178.66 1p88 h LEU 176 N 1.13 0.19 -1.06 0.00 3.38 -0.89 -2.23 115.31 115.83 1p88 h LEU 176 Ca 0.30 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1p88 h LEU 176 Cb -0.07 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1p88 h LEU 176 CO -0.06 1.03 0.42 -0.07 0.09 0.00 0.00 178.44 179.84 1p88 h LEU 177 N 0.07 0.96 0.21 1.67 4.07 0.40 0.56 115.31 123.25 1p88 h LEU 177 Ca -0.04 -0.08 -0.33 0.00 0.08 0.00 0.00 57.88 57.50 1p88 h LEU 177 Cb 1.61 -0.24 0.02 0.00 1.08 0.00 0.00 40.66 43.13 1p88 h LEU 177 CO 0.14 0.78 -1.54 0.24 -1.08 0.00 0.00 178.44 176.97 1p88 h MET 178 N 1.08 0.45 0.07 1.13 2.86 -1.29 -3.36 114.93 115.86 1p88 h MET 178 Ca 0.27 -0.77 -0.28 0.00 -2.06 0.00 0.00 59.70 56.86 1p88 h MET 178 Cb 0.04 0.29 0.02 0.00 0.06 0.00 0.00 31.60 32.00 1p88 h MET 178 CO -0.04 1.37 -1.16 1.15 1.06 0.00 0.00 176.91 179.28 1p88 h THR 179 N 0.06 1.30 -0.77 2.22 2.02 -1.31 -3.36 112.91 113.07 1p88 h THR 179 Ca -0.29 -2.41 0.03 0.00 0.77 0.00 0.00 66.41 64.51 1p88 h THR 179 Cb 2.08 2.58 -0.05 0.00 -1.74 0.00 0.00 68.15 71.02 1p88 h THR 179 CO 0.21 0.74 0.49 0.00 0.37 0.00 0.00 175.52 177.33 1p88 h ALA 180 N 0.37 1.01 0.00 6.16 0.00 -0.05 -2.46 119.26 124.30 1p88 h ALA 180 Ca -0.16 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1p88 h ALA 180 Cb 1.82 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 1p88 h ALA 180 CO 0.22 0.30 -0.18 -1.00 0.00 0.00 0.00 179.25 178.59 1p88 h PRO 181 N 0.96 0.00 -0.00 0.00 0.13 -1.71 0.14 132.00 131.51 1p88 h PRO 181 Ca 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 1p88 h PRO 181 Cb 0.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1p88 h PRO 181 CO -0.11 0.18 -0.04 1.28 -0.23 0.00 0.00 178.00 179.08 1p88 n LEU 182 N -3.97 0.41 -4.74 1.56 4.77 -0.95 0.20 117.00 114.29 1p88 n LEU 182 Ca -0.02 -0.04 -0.41 0.00 -0.03 0.00 0.00 56.01 55.51 1p88 n LEU 182 Cb 0.27 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.21 1p88 n LEU 182 CO 0.34 0.07 0.72 0.00 -1.33 0.00 0.00 177.39 177.19 1p88 s ALA 183 N -2.24 3.31 0.43 -1.18 0.00 0.47 -4.28 121.76 118.28 1p88 s ALA 183 Ca 0.37 0.68 0.20 0.00 0.00 0.00 0.00 51.96 53.21 1p88 s ALA 183 Cb 0.21 -3.30 1.16 0.00 0.00 0.00 0.00 23.12 21.19 1p88 s ALA 183 CO 0.41 -0.07 1.84 -1.00 0.00 0.00 0.00 175.76 176.94 1p88 h PRO 184 N 5.20 0.33 -6.35 0.00 0.13 -1.66 3.03 132.00 132.68 1p88 h PRO 184 Ca -0.44 -0.02 -0.68 0.00 -0.87 0.00 0.00 66.00 63.99 1p88 h PRO 184 Cb 1.21 -0.07 -0.19 0.00 0.13 0.00 0.00 31.00 32.08 1p88 h PRO 184 CO 0.72 0.22 -0.73 -2.00 -0.23 0.00 0.00 178.00 175.97 1p88 s GLU 185 N -5.36 2.46 0.74 0.86 2.12 0.45 -3.98 118.70 115.97 1p88 s GLU 185 Ca -0.08 -0.76 -0.15 0.00 0.36 0.00 0.00 54.97 54.33 1p88 s GLU 185 Cb 0.23 -2.42 0.03 0.00 0.26 0.00 0.00 34.13 32.22 1p88 s GLU 185 CO 0.79 0.60 1.09 -0.40 -0.54 0.00 0.00 175.26 176.79 1p88 n ASP 186 N 1.69 0.92 -4.06 -1.70 5.68 -1.26 -3.83 116.55 113.98 1p88 n ASP 186 Ca -0.16 0.67 -0.16 0.00 -0.50 0.00 0.00 54.79 54.64 1p88 n ASP 186 Cb 0.52 -1.46 -0.13 0.00 -1.14 0.00 0.00 41.12 38.91 1p88 n ASP 186 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1p88 s THR 187 N -1.83 0.72 -0.17 2.12 2.01 -0.20 -0.95 115.64 117.34 1p88 s THR 187 Ca 0.75 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.94 1p88 s THR 187 Cb -0.33 -0.69 0.03 0.00 0.01 0.00 0.00 72.50 71.52 1p88 s THR 187 CO 0.49 -0.10 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.50 1p88 s VAL 188 N -0.84 1.60 -0.31 3.82 1.01 -1.24 -0.89 120.40 123.55 1p88 s VAL 188 Ca -0.02 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 1p88 s VAL 188 Cb -0.07 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1p88 s VAL 188 CO 0.01 0.33 0.21 -0.63 0.00 0.00 0.00 175.10 175.01 1p88 s ILE 189 N 1.45 5.28 -0.24 2.22 1.09 -0.22 0.22 121.20 131.00 1p88 s ILE 189 Ca 0.02 -0.01 -0.10 0.00 -1.10 0.00 0.00 60.65 59.46 1p88 s ILE 189 Cb -0.14 -3.60 -0.05 0.00 -1.06 0.00 0.00 42.46 37.61 1p88 s ILE 189 CO -0.10 0.13 0.15 -0.60 -0.10 0.00 0.00 174.94 174.43 1p88 s ARG 190 N 1.74 4.03 -0.23 2.79 3.52 0.07 0.19 118.95 131.06 1p88 s ARG 190 Ca 0.07 -0.29 -0.18 0.00 -0.13 0.00 0.00 55.73 55.19 1p88 s ARG 190 Cb -0.17 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.68 1p88 s ARG 190 CO 0.11 0.04 0.50 0.42 -0.81 0.00 0.00 175.30 175.56 1p88 s ILE 191 N 1.09 5.10 -0.82 4.11 1.09 -1.25 -2.06 121.20 128.46 1p88 s ILE 191 Ca 0.07 0.89 -0.26 0.00 -1.10 0.00 0.00 60.65 60.26 1p88 s ILE 191 Cb -0.14 -3.82 0.04 0.00 -1.06 0.00 0.00 42.46 37.48 1p88 s ILE 191 CO 0.05 0.14 1.32 -0.54 -0.10 0.00 0.00 174.94 175.80 1p88 s LYS 192 N 1.91 3.31 0.00 2.79 1.02 -1.11 -4.61 119.74 123.06 1p88 s LYS 192 Ca 0.22 -0.55 0.00 0.00 0.02 0.00 0.00 55.97 55.66 1p88 s LYS 192 Cb -0.15 -4.54 0.00 0.00 -0.52 0.00 0.00 37.83 32.61 1p88 s LYS 192 CO 0.09 -2.15 0.00 0.41 -0.92 0.00 0.00 175.35 172.78 1p88 n GLY 193 N 5.83 0.95 3.28 -3.33 0.00 -1.26 -0.90 105.19 109.76 1p88 n GLY 193 Ca 0.12 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.35 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 3.60 0.35 1.61 1.01 -1.26 -4.82 116.67 113.15 1p88 s ASP 194 Ca 0.00 -0.46 -0.23 0.00 0.71 0.00 0.00 52.55 52.57 1p88 s ASP 194 Cb 0.00 -1.54 -0.16 0.00 1.01 0.00 0.00 42.92 42.24 1p88 s ASP 194 CO 0.00 0.12 0.23 0.18 0.21 0.00 0.00 175.17 175.91 1p88 n LEU 195 N 3.81 -2.25 0.12 1.23 4.77 -1.25 -3.72 117.00 119.71 1p88 n LEU 195 Ca -0.19 0.90 -0.03 0.00 -0.03 0.00 0.00 56.01 56.67 1p88 n LEU 195 Cb 0.52 -0.92 0.15 0.00 -2.33 0.00 0.00 43.42 40.84 1p88 n LEU 195 CO 0.29 -3.79 0.48 1.62 -1.33 0.00 0.00 177.39 174.66 1p88 h VAL 196 N 0.54 1.44 0.00 4.08 3.04 -0.97 -3.41 116.25 120.97 1p88 h VAL 196 Ca -0.35 -2.13 -0.19 0.00 -1.01 0.00 0.00 66.70 63.03 1p88 h VAL 196 Cb 1.44 2.13 -0.14 0.00 -2.01 0.00 0.00 31.29 32.72 1p88 h VAL 196 CO 0.50 0.61 -0.31 -0.24 -1.01 0.00 0.00 177.57 177.13 1p88 n SER 197 N -3.81 -2.15 -0.34 3.17 2.88 -1.26 -4.90 113.62 107.21 1p88 n SER 197 Ca -0.01 -3.03 0.16 0.00 -1.33 0.00 0.00 58.87 54.65 1p88 n SER 197 Cb 0.63 1.62 0.31 0.00 -0.75 0.00 0.00 64.21 66.02 1p88 n SER 197 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1p88 h LYS 198 N 3.10 0.01 -1.16 -1.46 3.64 -1.97 0.78 116.57 119.50 1p88 h LYS 198 Ca -0.17 -0.00 0.33 0.00 -1.27 0.00 0.00 60.65 59.54 1p88 h LYS 198 Cb 1.12 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.85 1p88 h LYS 198 CO 0.12 0.00 0.78 -1.35 -2.27 0.00 0.00 179.45 176.73 1p88 h PRO 199 N 0.01 0.20 -0.28 1.90 0.11 -1.98 1.05 132.00 133.01 1p88 h PRO 199 Ca 0.61 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.58 1p88 h PRO 199 Cb 1.29 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1p88 h PRO 199 CO -0.92 0.13 -0.35 1.88 -0.21 0.00 0.00 178.00 178.53 1p88 h TYR 200 N 0.21 0.90 -0.31 0.65 0.05 0.18 -2.84 116.97 115.80 1p88 h TYR 200 Ca 0.63 -0.29 -0.04 0.00 0.05 0.00 0.00 58.73 59.08 1p88 h TYR 200 Cb 1.98 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 39.52 1p88 h TYR 200 CO -0.00 1.06 0.02 0.82 -1.05 0.00 0.00 178.16 179.01 1p88 h ILE 201 N 0.48 1.17 -0.46 -2.88 1.08 0.11 -1.50 117.51 115.51 1p88 h ILE 201 Ca 0.04 -0.66 -0.00 0.00 -0.39 0.00 0.00 64.86 63.85 1p88 h ILE 201 Cb 0.94 0.92 -0.02 0.00 -3.07 0.00 0.00 36.82 35.58 1p88 h ILE 201 CO 0.08 0.23 0.28 -0.78 -0.69 0.00 0.00 178.15 177.27 1p88 h ASP 202 N 0.45 0.54 0.09 1.72 1.82 -0.30 -1.31 116.42 119.42 1p88 h ASP 202 Ca 0.10 -0.05 -0.00 0.00 -0.39 0.00 0.00 57.03 56.69 1p88 h ASP 202 Cb 0.26 -0.14 0.00 0.00 0.68 0.00 0.00 39.33 40.13 1p88 h ASP 202 CO 0.00 0.43 -0.04 0.40 -1.61 0.00 0.00 179.24 178.42 1p88 h ILE 203 N 0.61 0.98 -0.35 2.25 2.04 -1.22 -1.47 117.51 120.35 1p88 h ILE 203 Ca 0.16 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.86 1p88 h ILE 203 Cb -0.02 1.14 -0.08 0.00 -0.74 0.00 0.00 36.82 37.12 1p88 h ILE 203 CO -0.03 0.06 -0.15 0.74 0.00 0.00 0.00 178.15 178.77 1p88 h THR 204 N -0.22 0.52 0.00 -0.27 2.02 -1.03 1.70 112.91 115.63 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 0.19 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 1p88 h THR 204 CO 0.02 0.00 -0.29 -0.07 0.37 0.00 0.00 175.52 175.55 1p88 h LEU 205 N -0.09 0.00 0.06 2.58 3.38 -1.17 1.50 115.31 121.57 1p88 h LEU 205 Ca 0.18 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 1p88 h LEU 205 Cb 0.36 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.12 1p88 h LEU 205 CO -0.41 0.29 -0.45 -1.13 0.09 0.00 0.00 178.44 176.84 1p88 h ASN 206 N 0.00 0.30 0.53 -0.43 -1.24 0.08 -0.71 115.58 114.10 1p88 h ASN 206 Ca -0.00 -0.90 -0.12 0.00 0.71 0.00 0.00 56.30 55.99 1p88 h ASN 206 Cb 0.57 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.51 1p88 h ASN 206 CO 0.04 1.17 -0.55 0.25 -1.29 0.00 0.00 177.43 177.04 1p88 h LEU 207 N -0.53 0.03 -0.46 0.34 5.85 0.26 -2.57 115.31 118.24 1p88 h LEU 207 Ca -0.07 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.46 1p88 h LEU 207 Cb 1.29 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1p88 h LEU 207 CO 0.08 0.58 -0.67 0.24 -0.34 0.00 0.00 178.44 178.33 1p88 h MET 208 N 0.02 0.42 -0.61 1.25 2.86 0.21 -3.03 114.93 116.06 1p88 h MET 208 Ca -0.00 -0.32 -0.01 0.00 -2.06 0.00 0.00 59.70 57.31 1p88 h MET 208 Cb 0.99 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.68 1p88 h MET 208 CO 0.07 0.94 0.34 0.87 1.06 0.00 0.00 176.91 180.20 1p88 h LYS 209 N 0.30 0.83 0.00 1.72 1.57 -0.73 0.17 116.57 120.43 1p88 h LYS 209 Ca -0.02 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1p88 h LYS 209 Cb 1.23 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 1p88 h LYS 209 CO 0.12 0.60 -0.03 0.00 -0.57 0.00 0.00 179.45 179.56 1p88 h THR 210 N 0.84 0.32 -0.00 -0.16 1.03 -1.36 0.13 112.91 113.71 1p88 h THR 210 Ca 0.22 -0.18 0.00 0.00 -0.01 0.00 0.00 66.41 66.44 1p88 h THR 210 Cb 0.00 1.13 0.00 0.00 -1.07 0.00 0.00 68.15 68.21 1p88 h THR 210 CO -0.04 0.03 -0.26 0.49 -0.01 0.00 0.00 175.52 175.73 1p88 n PHE 211 N -3.48 0.00 0.00 0.00 3.72 0.58 -4.10 117.46 114.18 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 0.13 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.35 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 1.46 1.05 3.31 1.37 0.00 0.45 0.14 105.19 112.98 1p88 n GLY 212 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 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 1.86 -0.03 1.61 -7.23 -1.18 -4.75 120.40 108.68 1p88 s VAL 213 Ca 0.00 -1.54 0.03 0.00 -1.81 0.00 0.00 61.98 58.66 1p88 s VAL 213 Cb 0.00 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.28 1p88 s VAL 213 CO 0.00 0.04 -0.11 -1.61 -0.31 0.00 0.00 175.10 173.11 1p88 s GLU 214 N -1.80 1.11 0.10 4.82 2.02 -1.26 -2.85 118.70 120.84 1p88 s GLU 214 Ca 0.09 -0.37 0.10 0.00 0.02 0.00 0.00 54.97 54.81 1p88 s GLU 214 Cb -0.10 -1.02 -0.04 0.00 0.10 0.00 0.00 34.13 33.07 1p88 s GLU 214 CO 0.04 0.14 -0.23 0.42 0.02 0.00 0.00 175.26 175.66 1p88 s ILE 215 N 0.15 2.51 -0.30 -1.63 -1.09 -1.26 -4.48 121.20 115.09 1p88 s ILE 215 Ca -0.03 -1.55 -0.09 0.00 -2.23 0.00 0.00 60.65 56.75 1p88 s ILE 215 Cb -0.09 -2.10 -0.01 0.00 -1.58 0.00 0.00 42.46 38.68 1p88 s ILE 215 CO 0.01 0.16 0.13 -0.70 -1.23 0.00 0.00 174.94 173.31 1p88 s GLU 216 N -1.89 3.40 0.36 2.79 2.12 0.14 -4.94 118.70 120.67 1p88 s GLU 216 Ca 0.15 -0.67 -0.15 0.00 0.36 0.00 0.00 54.97 54.66 1p88 s GLU 216 Cb -0.10 -3.51 -0.09 0.00 0.26 0.00 0.00 34.13 30.70 1p88 s GLU 216 CO 0.07 -0.37 0.78 0.54 -0.54 0.00 0.00 175.26 175.74 1p88 s ASN 217 N 1.61 6.73 0.00 -1.70 6.03 -1.26 0.11 114.94 126.46 1p88 s ASN 217 Ca 0.05 1.31 0.00 0.00 -1.03 0.00 0.00 52.86 53.19 1p88 s ASN 217 Cb -0.17 -2.39 0.00 0.00 -3.03 0.00 0.00 41.25 35.67 1p88 s ASN 217 CO 0.06 -0.28 0.00 1.67 -2.03 0.00 0.00 177.10 176.51 1p88 n GLN 218 N -0.66 3.32 -1.16 3.55 -0.06 0.23 -4.91 117.38 117.70 1p88 n GLN 218 Ca 0.04 0.00 -0.37 0.00 -2.00 0.00 0.00 57.00 54.67 1p88 n GLN 218 Cb 0.53 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.68 1p88 n GLN 218 CO 0.00 0.00 0.00 0.72 -0.20 0.00 0.00 177.06 177.58 1p88 n HIS 219 N 0.00 2.09 -2.87 3.69 8.25 -1.26 -4.21 115.22 120.92 1p88 n HIS 219 Ca 0.00 -2.18 -0.22 0.00 -0.26 0.00 0.00 57.72 55.07 1p88 n HIS 219 Cb 0.00 -1.92 0.02 0.00 1.12 0.00 0.00 29.99 29.21 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 6.02 -1.69 0.00 4.41 9.36 -1.26 -4.78 117.16 129.21 1p88 n TYR 220 Ca 0.51 0.36 0.00 0.00 3.32 0.00 0.00 57.90 62.09 1p88 n TYR 220 Cb 0.31 -4.14 0.00 0.00 -0.63 0.00 0.00 39.34 34.88 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 -3.70 0.00 0.00 2.98 10.64 -1.26 -3.96 117.38 122.09 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 -5.02 2.61 7.27 -1.21 -3.36 117.38 117.67 1p88 n GLN 222 Ca 0.00 0.00 -0.28 0.00 0.07 0.00 0.00 57.00 56.79 1p88 n GLN 222 Cb 0.00 0.00 -0.15 0.00 2.41 0.00 0.00 30.24 32.50 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 1.98 -0.22 3.69 0.40 0.50 0.78 117.98 125.11 1p88 s PHE 223 Ca 0.00 -0.38 0.01 0.00 -0.60 0.00 0.00 56.93 55.97 1p88 s PHE 223 Cb 0.00 -1.26 0.05 0.00 0.51 0.00 0.00 43.02 42.32 1p88 s PHE 223 CO 0.00 -0.01 -0.10 0.08 0.70 0.00 0.00 175.22 175.89 1p88 s VAL 224 N -0.57 1.80 -0.06 -0.44 1.01 0.31 -1.06 120.40 121.38 1p88 s VAL 224 Ca 0.09 -1.23 0.06 0.00 0.00 0.00 0.00 61.98 60.90 1p88 s VAL 224 Cb -0.09 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.38 1p88 s VAL 224 CO -0.00 0.09 -0.24 0.54 0.00 0.00 0.00 175.10 175.48 1p88 s VAL 225 N 1.30 2.15 -0.08 2.92 0.11 -0.07 0.24 120.40 126.97 1p88 s VAL 225 Ca -0.04 -1.03 -0.26 0.00 -2.93 0.00 0.00 61.98 57.72 1p88 s VAL 225 Cb -0.18 -1.79 -0.03 0.00 -1.53 0.00 0.00 36.38 32.86 1p88 s VAL 225 CO -0.07 0.57 0.83 -0.54 -3.33 0.00 0.00 175.10 172.56 1p88 s LYS 226 N -0.17 4.43 0.71 1.54 3.01 -1.26 -1.03 119.74 126.97 1p88 s LYS 226 Ca -0.03 1.10 -0.09 0.00 -1.01 0.00 0.00 55.97 55.93 1p88 s LYS 226 Cb -0.14 -3.49 0.05 0.00 -1.01 0.00 0.00 37.83 33.24 1p88 s LYS 226 CO 0.04 -0.11 1.06 0.20 0.51 0.00 0.00 175.35 177.04 1p88 s GLY 227 N 0.98 1.63 -0.25 -3.33 0.00 -1.26 -4.20 107.32 100.90 1p88 s GLY 227 Ca 0.42 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.45 1p88 s GLY 227 CO 0.19 -0.30 0.00 0.61 0.00 0.00 0.00 173.10 173.60 1p88 n GLY 228 N -2.99 0.56 2.39 0.20 0.00 1.01 -4.75 105.19 101.62 1p88 n GLY 228 Ca 0.07 -0.96 -0.19 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.92 -1.25 -3.80 1.61 6.02 0.53 -4.96 117.38 112.61 1p88 n GLN 229 Ca -0.02 -1.25 -0.12 0.00 -0.01 0.00 0.00 57.00 55.59 1p88 n GLN 229 Cb 0.08 -0.92 -0.10 0.00 1.02 0.00 0.00 30.24 30.33 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 -3.90 -0.14 -0.17 1.08 0.15 -1.26 -4.57 113.70 104.89 1p88 s SER 230 Ca 0.47 0.10 -0.07 0.00 0.70 0.00 0.00 55.95 57.15 1p88 s SER 230 Cb -0.02 0.34 -0.04 0.00 -1.71 0.00 0.00 66.02 64.58 1p88 s SER 230 CO 0.34 -0.34 0.07 -0.31 1.20 0.00 0.00 173.24 174.20 1p88 s TYR 231 N -1.01 3.30 0.21 3.44 2.02 -1.26 -4.48 117.35 119.57 1p88 s TYR 231 Ca -0.11 0.16 0.11 0.00 -0.37 0.00 0.00 57.07 56.87 1p88 s TYR 231 Cb -0.05 -2.04 -0.05 0.00 -0.40 0.00 0.00 41.96 39.42 1p88 s TYR 231 CO 0.03 0.27 -0.23 -0.65 -1.57 0.00 0.00 175.55 173.40 1p88 s GLN 232 N 0.08 1.57 -0.48 -0.62 -0.21 0.37 0.47 119.66 120.84 1p88 s GLN 232 Ca 0.06 -1.55 -0.27 0.00 0.02 0.00 0.00 55.36 53.61 1p88 s GLN 232 Cb -0.12 -1.85 0.03 0.00 1.00 0.00 0.00 33.01 32.07 1p88 s GLN 232 CO 0.00 0.39 1.04 -1.54 -2.12 0.00 0.00 175.29 173.07 1p88 s SER 233 N -2.81 6.56 0.00 5.90 1.04 -0.94 -4.41 113.70 119.04 1p88 s SER 233 Ca 0.22 0.27 0.13 0.00 0.48 0.00 0.00 55.95 57.05 1p88 s SER 233 Cb -0.07 -2.50 0.74 0.00 0.10 0.00 0.00 66.02 64.28 1p88 s SER 233 CO 0.11 -1.18 1.27 -0.81 0.98 0.00 0.00 173.24 173.61 1p88 n PRO 234 N 7.57 0.32 0.00 4.02 -0.04 -1.26 -4.88 135.00 140.73 1p88 n PRO 234 Ca 0.09 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1p88 n PRO 234 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 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 -0.17 0.79 3.24 0.55 0.00 -1.26 -4.90 105.19 103.43 1p88 n GLY 235 Ca 0.08 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 1p88 n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p88 s THR 236 N 0.00 1.90 -0.03 2.61 2.01 -1.26 0.17 115.64 121.04 1p88 s THR 236 Ca 0.00 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.04 1p88 s THR 236 Cb 0.00 -1.61 0.01 0.00 0.01 0.00 0.00 72.50 70.91 1p88 s THR 236 CO 0.00 0.53 -0.07 -0.47 -0.69 0.00 0.00 174.62 173.92 1p88 s TYR 237 N -0.12 0.80 -0.37 4.92 6.14 0.56 -4.87 117.35 124.40 1p88 s TYR 237 Ca -0.03 -0.20 -0.15 0.00 0.64 0.00 0.00 57.07 57.33 1p88 s TYR 237 Cb -0.13 -0.60 0.00 0.00 0.42 0.00 0.00 41.96 41.65 1p88 s TYR 237 CO 0.03 -0.11 0.31 -1.17 0.64 0.00 0.00 175.55 175.26 1p88 s LEU 238 N 0.35 4.72 -0.40 6.97 1.98 -1.26 0.11 118.68 131.15 1p88 s LEU 238 Ca -0.05 -0.55 -0.26 0.00 -2.89 0.00 0.00 54.13 50.38 1p88 s LEU 238 Cb -0.09 -2.22 0.02 0.00 0.66 0.00 0.00 46.19 44.55 1p88 s LEU 238 CO 0.00 -0.37 0.92 -0.69 -1.89 0.00 0.00 176.35 174.32 1p88 s VAL 239 N 1.83 4.55 -2.22 1.68 1.01 0.55 -4.91 120.40 122.89 1p88 s VAL 239 Ca 0.08 1.01 0.30 0.00 0.00 0.00 0.00 61.98 63.37 1p88 s VAL 239 Cb -0.18 -4.36 0.75 0.00 0.00 0.00 0.00 36.38 32.59 1p88 s VAL 239 CO 0.11 -0.64 2.02 -0.62 0.00 0.00 0.00 175.10 175.97