#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 0.08 4.04 5.03 -1.26 -2.34 115.26 120.81 1p88 n ASN 26 Ca 0.00 0.00 -0.07 0.00 0.87 0.00 0.00 54.58 55.38 1p88 n ASN 26 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 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 -0.29 -0.97 3.52 3.08 -1.96 -2.46 114.38 115.30 1p88 h ARG 27 Ca 0.00 0.02 0.23 0.00 0.07 0.00 0.00 59.98 60.30 1p88 h ARG 27 Cb 0.00 0.07 -0.18 0.00 0.08 0.00 0.00 29.97 29.93 1p88 h ARG 27 CO 0.00 -0.08 -0.12 0.00 -1.07 0.00 0.00 179.97 178.70 1p88 n ALA 28 N -2.71 0.35 0.01 0.04 0.00 -0.99 0.11 120.51 117.33 1p88 n ALA 28 Ca -0.05 1.05 -0.11 0.00 0.00 0.00 0.00 53.44 54.33 1p88 n ALA 28 Cb 0.18 -0.69 0.03 0.00 0.00 0.00 0.00 19.45 18.96 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 0.63 0.01 0.00 3.38 -1.74 -0.34 115.31 117.25 1p88 h LEU 29 Ca 0.52 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1p88 h LEU 29 Cb 0.94 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1p88 h LEU 29 CO -0.96 1.11 -0.01 0.25 0.09 0.00 0.00 178.44 178.93 1p88 h LEU 30 N 0.40 -0.02 -1.45 1.67 5.85 0.12 -1.02 115.31 120.86 1p88 h LEU 30 Ca -0.01 -0.29 -0.06 0.00 0.84 0.00 0.00 57.88 58.36 1p88 h LEU 30 Cb 1.21 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.24 1p88 h LEU 30 CO 0.12 0.28 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.16 1p88 h LEU 31 N -0.31 0.00 -0.70 2.25 3.38 0.50 0.21 115.31 120.64 1p88 h LEU 31 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1p88 h LEU 31 Cb 0.30 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1p88 h LEU 31 CO 0.00 0.27 0.01 0.00 0.09 0.00 0.00 178.44 178.81 1p88 h ALA 32 N 1.73 0.91 0.21 1.53 0.00 -0.71 -1.49 119.26 121.44 1p88 h ALA 32 Ca -0.00 -0.30 -0.31 0.00 0.00 0.00 0.00 54.91 54.29 1p88 h ALA 32 Cb 0.56 -0.22 0.03 0.00 0.00 0.00 0.00 17.79 18.15 1p88 h ALA 32 CO 0.03 0.65 -1.43 0.00 0.00 0.00 0.00 179.25 178.51 1p88 h ALA 33 N 1.07 -0.06 0.00 0.00 0.00 -0.56 -3.21 119.26 116.50 1p88 h ALA 33 Ca 0.17 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1p88 h ALA 33 Cb 0.53 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1p88 h ALA 33 CO 0.03 0.72 0.00 1.28 0.00 0.00 0.00 179.25 181.28 1p88 n LEU 34 N -3.78 0.00 -5.03 0.00 4.77 0.68 0.77 117.00 114.43 1p88 n LEU 34 Ca -0.19 0.20 -0.21 0.00 -0.03 0.00 0.00 56.01 55.78 1p88 n LEU 34 Cb 1.04 -0.20 0.08 0.00 -2.33 0.00 0.00 43.42 42.01 1p88 n LEU 34 CO 0.55 -0.12 0.42 0.00 -1.33 0.00 0.00 177.39 176.92 1p88 s ALA 35 N -2.40 4.43 -0.28 -1.18 0.00 -0.57 -0.86 121.76 120.90 1p88 s ALA 35 Ca 0.14 -2.08 -0.04 0.00 0.00 0.00 0.00 51.96 49.99 1p88 s ALA 35 Cb 0.09 -1.60 0.03 0.00 0.00 0.00 0.00 23.12 21.63 1p88 s ALA 35 CO 0.18 -1.10 0.02 -1.01 0.00 0.00 0.00 175.76 173.84 1p88 s HIS 36 N -2.84 3.15 0.00 0.00 3.76 0.16 0.17 115.29 119.69 1p88 s HIS 36 Ca 0.64 -1.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.14 1p88 s HIS 36 Cb -0.05 -2.16 0.00 0.00 1.11 0.00 0.00 32.58 31.48 1p88 s HIS 36 CO 0.41 -0.69 0.00 0.41 -0.85 0.00 0.00 174.74 174.02 1p88 n GLY 37 N 4.74 2.27 3.58 -2.22 0.00 -1.26 -1.44 105.19 110.86 1p88 n GLY 37 Ca -0.15 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.38 1p88 n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1p88 s LYS 38 N -2.09 3.81 0.06 1.61 2.20 -1.25 0.28 119.74 124.36 1p88 s LYS 38 Ca 0.00 -0.08 0.09 0.00 -0.36 0.00 0.00 55.97 55.62 1p88 s LYS 38 Cb 0.00 -3.73 -0.03 0.00 -1.51 0.00 0.00 37.83 32.56 1p88 s LYS 38 CO 0.00 -0.44 -0.26 0.99 -0.36 0.00 0.00 175.35 175.28 1p88 s THR 39 N 2.18 2.24 -0.06 3.43 2.01 -0.95 -4.52 115.64 119.97 1p88 s THR 39 Ca 0.16 -1.45 -0.02 0.00 0.31 0.00 0.00 61.69 60.68 1p88 s THR 39 Cb -0.16 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 1p88 s THR 39 CO 0.11 0.30 0.06 -0.69 -0.69 0.00 0.00 174.62 173.72 1p88 s VAL 40 N -0.88 4.74 -0.23 3.82 1.01 0.35 -0.48 120.40 128.73 1p88 s VAL 40 Ca 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.88 1p88 s VAL 40 Cb -0.10 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.22 1p88 s VAL 40 CO 0.03 0.50 -0.10 -0.76 0.00 0.00 0.00 175.10 174.78 1p88 s LEU 41 N -1.28 2.93 0.09 3.92 2.01 0.19 0.22 118.68 126.76 1p88 s LEU 41 Ca 0.18 -0.82 0.02 0.00 0.01 0.00 0.00 54.13 53.52 1p88 s LEU 41 Cb -0.12 -1.62 -0.04 0.00 0.01 0.00 0.00 46.19 44.43 1p88 s LEU 41 CO 0.08 -0.09 0.16 0.28 1.01 0.00 0.00 176.35 177.78 1p88 s THR 42 N 1.31 4.92 -1.33 5.49 -1.32 0.27 -0.45 115.64 124.52 1p88 s THR 42 Ca 0.01 -0.67 0.00 0.00 -1.21 0.00 0.00 61.69 59.82 1p88 s THR 42 Cb -0.16 -3.42 0.00 0.00 -1.51 0.00 0.00 72.50 67.41 1p88 s THR 42 CO -0.06 0.07 0.00 -3.20 -2.21 0.00 0.00 174.62 169.21 1p88 n ASN 43 N 0.16 -4.54 -3.11 8.08 5.15 -0.83 0.34 115.26 120.51 1p88 n ASN 43 Ca -0.07 0.09 -0.07 0.00 -0.60 0.00 0.00 54.58 53.93 1p88 n ASN 43 Cb 0.52 -3.59 0.06 0.00 -0.53 0.00 0.00 39.78 36.25 1p88 n ASN 43 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1p88 n LEU 44 N -1.98 0.00 -4.39 1.20 4.77 0.44 -4.68 117.00 112.35 1p88 n LEU 44 Ca -0.17 -0.19 -0.33 0.00 -0.03 0.00 0.00 56.01 55.29 1p88 n LEU 44 Cb 0.59 -0.26 -0.14 0.00 -2.33 0.00 0.00 43.42 41.28 1p88 n LEU 44 CO 0.21 -1.74 -0.45 -0.22 -1.33 0.00 0.00 177.39 173.86 1p88 s LEU 45 N 0.00 2.73 -0.98 2.23 2.96 -1.26 -4.80 118.68 119.55 1p88 s LEU 45 Ca 0.15 -0.31 -0.18 0.00 -0.22 0.00 0.00 54.13 53.57 1p88 s LEU 45 Cb -0.03 -1.61 0.13 0.00 0.50 0.00 0.00 46.19 45.19 1p88 s LEU 45 CO 0.12 0.19 1.21 -0.62 -1.32 0.00 0.00 176.35 175.94 1p88 s ASP 46 N 0.20 6.68 -0.23 3.68 2.15 -1.26 -4.46 116.67 123.43 1p88 s ASP 46 Ca -0.08 -2.13 -0.27 0.00 0.43 0.00 0.00 52.55 50.51 1p88 s ASP 46 Cb -0.15 -2.42 0.10 0.00 -0.30 0.00 0.00 42.92 40.15 1p88 s ASP 46 CO 0.05 -1.06 0.87 -0.44 -0.17 0.00 0.00 175.17 174.42 1p88 s SER 47 N 3.66 -0.57 0.45 -0.34 0.01 -1.26 -5.01 113.70 110.65 1p88 s SER 47 Ca 0.36 0.97 0.41 0.00 1.31 0.00 0.00 55.95 59.00 1p88 s SER 47 Cb -0.04 0.94 1.42 0.00 0.21 0.00 0.00 66.02 68.55 1p88 s SER 47 CO -0.08 -0.28 1.29 0.47 0.41 0.00 0.00 173.24 175.05 1p88 n ASP 48 N 1.96 0.01 -0.27 2.44 8.00 -1.26 0.20 116.55 127.63 1p88 n ASP 48 Ca -0.14 0.84 -0.02 0.00 0.71 0.00 0.00 54.79 56.19 1p88 n ASP 48 Cb 0.56 -0.42 0.10 0.00 -0.02 0.00 0.00 41.12 41.34 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 0.76 0.11 -2.24 3.04 -1.93 0.50 116.42 116.65 1p88 h ASP 49 Ca 0.78 0.00 -0.23 0.00 -3.24 0.00 0.00 57.03 54.34 1p88 h ASP 49 Cb 3.08 -0.16 0.00 0.00 -1.04 0.00 0.00 39.33 41.21 1p88 h ASP 49 CO -0.04 0.52 -1.16 0.58 -2.04 0.00 0.00 179.24 177.10 1p88 h VAL 50 N 0.90 1.20 -1.00 4.15 2.07 0.20 -1.05 116.25 122.73 1p88 h VAL 50 Ca 0.31 -2.42 0.20 0.00 0.82 0.00 0.00 66.70 65.61 1p88 h VAL 50 Cb 0.06 2.86 -0.10 0.00 -1.52 0.00 0.00 31.29 32.59 1p88 h VAL 50 CO -0.13 0.68 0.62 -0.09 0.02 0.00 0.00 177.57 178.66 1p88 h ARG 51 N -0.40 0.65 0.07 1.57 2.43 -1.11 0.58 114.38 118.17 1p88 h ARG 51 Ca -0.25 -0.04 -0.25 0.00 -0.81 0.00 0.00 59.98 58.64 1p88 h ARG 51 Cb 1.66 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 31.05 1p88 h ARG 51 CO 0.07 0.43 -1.15 0.45 -1.51 0.00 0.00 179.97 178.26 1p88 h HIS 52 N 0.67 0.25 -0.73 2.20 3.86 -0.08 1.32 115.15 122.64 1p88 h HIS 52 Ca 0.57 -0.19 0.13 0.00 -1.16 0.00 0.00 60.37 59.73 1p88 h HIS 52 Cb 1.02 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 29.43 1p88 h HIS 52 CO -0.00 1.15 0.49 1.98 0.86 0.00 0.00 177.93 182.40 1p88 h MET 53 N 0.04 0.46 0.19 2.45 1.85 0.13 3.34 114.93 123.40 1p88 h MET 53 Ca -0.08 -0.03 -0.30 0.00 -0.61 0.00 0.00 59.70 58.68 1p88 h MET 53 Cb 1.88 -0.10 0.02 0.00 0.43 0.00 0.00 31.60 33.83 1p88 h MET 53 CO 0.17 0.31 -1.41 -0.07 -0.40 0.00 0.00 176.91 175.50 1p88 h LEU 54 N 0.48 0.64 -0.86 3.39 3.38 0.09 -3.14 115.31 119.29 1p88 h LEU 54 Ca 0.35 -0.92 0.02 0.00 0.09 0.00 0.00 57.88 57.43 1p88 h LEU 54 Cb 0.72 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 1p88 h LEU 54 CO -0.12 1.66 0.56 -1.13 0.09 0.00 0.00 178.44 179.50 1p88 h ASN 55 N -0.04 0.94 -0.35 -0.43 -1.24 0.56 1.42 115.58 116.44 1p88 h ASN 55 Ca -0.27 -0.01 0.01 0.00 0.71 0.00 0.00 56.30 56.75 1p88 h ASN 55 Cb 1.98 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 40.79 1p88 h ASN 55 CO 0.19 0.66 0.21 0.00 -1.29 0.00 0.00 177.43 177.20 1p88 h ALA 56 N 1.34 0.44 -0.71 1.57 0.00 0.59 0.95 119.26 123.45 1p88 h ALA 56 Ca 0.33 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1p88 h ALA 56 Cb -0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1p88 h ALA 56 CO -0.10 -0.14 0.27 -0.07 0.00 0.00 0.00 179.25 179.21 1p88 h LEU 57 N 0.43 0.99 -1.71 0.00 4.07 -1.30 -1.73 115.31 116.05 1p88 h LEU 57 Ca 0.14 -0.18 0.01 0.00 0.08 0.00 0.00 57.88 57.93 1p88 h LEU 57 Cb -0.00 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.46 1p88 h LEU 57 CO -0.06 0.90 0.20 0.74 -1.08 0.00 0.00 178.44 179.14 1p88 h THR 58 N 1.01 1.06 0.09 0.22 2.02 0.37 0.96 112.91 118.64 1p88 h THR 58 Ca 0.23 -0.13 -0.28 0.00 0.77 0.00 0.00 66.41 67.00 1p88 h THR 58 Cb 0.23 0.64 0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1p88 h THR 58 CO -0.02 0.07 -1.18 0.00 0.37 0.00 0.00 175.52 174.77 1p88 h ALA 59 N 1.81 0.09 0.00 6.16 0.00 0.17 -3.20 119.26 124.28 1p88 h ALA 59 Ca 0.12 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1p88 h ALA 59 Cb -0.01 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1p88 h ALA 59 CO -0.03 0.76 0.00 1.28 0.00 0.00 0.00 179.25 181.26 1p88 n LEU 60 N -3.75 0.50 -0.00 0.00 4.77 -0.73 -4.63 117.00 113.16 1p88 n LEU 60 Ca -0.11 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 1p88 n LEU 60 Cb 0.96 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1p88 n LEU 60 CO 0.56 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1p88 n GLY 61 N 1.37 1.64 3.60 -0.72 0.00 -0.18 -4.29 105.19 106.61 1p88 n GLY 61 Ca 0.06 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.01 4.95 0.03 1.61 1.01 0.31 -4.98 120.40 121.33 1p88 s VAL 62 Ca 0.00 0.86 -0.27 0.00 0.00 0.00 0.00 61.98 62.57 1p88 s VAL 62 Cb 0.00 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 1p88 s VAL 62 CO 0.00 -0.11 0.84 -0.44 0.00 0.00 0.00 175.10 175.39 1p88 s SER 63 N 1.63 7.27 0.30 3.32 0.01 -1.26 -4.16 113.70 120.80 1p88 s SER 63 Ca 0.25 1.53 -0.18 0.00 1.31 0.00 0.00 55.95 58.85 1p88 s SER 63 Cb -0.15 -2.51 0.02 0.00 0.21 0.00 0.00 66.02 63.59 1p88 s SER 63 CO 0.11 -0.08 0.69 -0.72 0.41 0.00 0.00 173.24 173.65 1p88 s TYR 64 N 0.32 -0.01 0.06 2.43 1.13 -1.26 0.22 117.35 120.24 1p88 s TYR 64 Ca 0.43 -0.47 0.05 0.00 -1.41 0.00 0.00 57.07 55.66 1p88 s TYR 64 Cb -0.21 0.63 -0.03 0.00 -1.10 0.00 0.00 41.96 41.25 1p88 s TYR 64 CO 0.25 -1.26 -0.13 0.99 -2.51 0.00 0.00 175.55 172.89 1p88 s THR 65 N -3.61 1.01 -0.10 -3.49 2.01 0.46 -4.94 115.64 106.99 1p88 s THR 65 Ca 0.14 -1.16 0.02 0.00 0.31 0.00 0.00 61.69 61.00 1p88 s THR 65 Cb -0.05 -0.97 -0.02 0.00 0.01 0.00 0.00 72.50 71.47 1p88 s THR 65 CO 0.09 -0.17 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.47 1p88 s LEU 66 N -1.50 2.62 0.00 4.42 2.96 -1.26 -0.57 118.68 125.35 1p88 s LEU 66 Ca -0.02 -0.32 0.00 0.00 -0.22 0.00 0.00 54.13 53.57 1p88 s LEU 66 Cb -0.09 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 45.04 1p88 s LEU 66 CO 0.02 0.23 0.00 -1.20 -1.32 0.00 0.00 176.35 174.08 1p88 n SER 67 N 3.08 -1.36 0.02 3.68 7.64 0.28 -4.92 113.62 122.05 1p88 n SER 67 Ca -0.18 -0.04 -0.21 0.00 1.01 0.00 0.00 58.87 59.45 1p88 n SER 67 Cb 0.52 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.58 1p88 n SER 67 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p88 h ALA 68 N -2.00 0.07 0.00 -0.43 0.00 -2.00 -3.30 119.26 111.60 1p88 h ALA 68 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 53.98 1p88 h ALA 68 Cb 0.00 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1p88 h ALA 68 CO 0.00 0.63 0.00 -3.47 0.00 0.00 0.00 179.25 176.41 1p88 n ASP 69 N -4.04 0.00 -3.63 0.00 2.03 -1.26 -4.86 116.55 104.78 1p88 n ASP 69 Ca -0.21 -0.84 -0.25 0.00 0.52 0.00 0.00 54.79 54.01 1p88 n ASP 69 Cb 0.85 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 41.32 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 -0.91 -7.48 0.00 -0.67 1.74 -1.25 -4.85 116.66 103.25 1p88 n ARG 70 Ca 0.14 0.79 0.00 0.00 -0.77 0.00 0.00 57.85 58.01 1p88 n ARG 70 Cb 0.06 -5.82 0.00 0.00 -1.02 0.00 0.00 32.46 25.69 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 -4.95 0.00 -4.04 0.55 -2.24 -1.26 -4.31 114.28 98.04 1p88 n THR 71 Ca 0.01 -0.14 -0.34 0.00 -2.27 0.00 0.00 64.05 61.31 1p88 n THR 71 Cb 0.56 0.96 -0.15 0.00 -2.10 0.00 0.00 70.33 69.60 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 -0.32 3.24 -0.08 -0.78 0.52 -1.25 0.16 118.95 120.44 1p88 s ARG 72 Ca 0.00 -0.70 0.01 0.00 -0.52 0.00 0.00 55.73 54.52 1p88 s ARG 72 Cb 0.00 -2.83 0.02 0.00 0.52 0.00 0.00 34.95 32.66 1p88 s ARG 72 CO 0.00 -0.18 -0.10 0.00 0.02 0.00 0.00 175.30 175.05 1p88 s GLU 74 N 1.14 3.74 -0.10 0.00 2.12 0.27 0.56 118.70 126.42 1p88 s GLU 74 Ca -0.06 -0.45 0.01 0.00 0.36 0.00 0.00 54.97 54.83 1p88 s GLU 74 Cb -0.14 -3.01 0.02 0.00 0.26 0.00 0.00 34.13 31.25 1p88 s GLU 74 CO -0.02 0.29 -0.12 0.42 -0.54 0.00 0.00 175.26 175.29 1p88 s ILE 75 N 0.28 1.23 -0.61 -3.70 1.01 0.37 0.18 121.20 119.95 1p88 s ILE 75 Ca -0.01 -0.47 -0.26 0.00 0.00 0.00 0.00 60.65 59.91 1p88 s ILE 75 Cb -0.13 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1p88 s ILE 75 CO 0.02 0.39 1.94 0.27 0.00 0.00 0.00 174.94 177.56 1p88 s ILE 76 N 1.18 3.31 0.29 2.92 -0.00 0.60 -2.24 121.20 127.26 1p88 s ILE 76 Ca -0.04 0.16 -0.23 0.00 -0.00 0.00 0.00 60.65 60.54 1p88 s ILE 76 Cb -0.14 -3.82 -0.15 0.00 -0.00 0.00 0.00 42.46 38.35 1p88 s ILE 76 CO -0.03 -0.79 0.26 0.61 -0.00 0.00 0.00 174.94 174.99 1p88 n GLY 77 N 5.78 -2.15 0.01 6.27 0.00 0.79 -4.11 105.19 111.78 1p88 n GLY 77 Ca 0.23 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.51 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 2.05 0.50 0.00 1.61 2.85 0.23 -4.15 115.26 118.35 1p88 n ASN 78 Ca 0.13 -0.16 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 1p88 n ASN 78 Cb 0.31 0.21 0.00 0.00 1.24 0.00 0.00 39.78 41.54 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 1.48 0.75 0.00 8.20 0.00 0.46 -4.90 105.19 111.18 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 -2.15 0.10 3.65 -0.02 0.00 -0.04 -4.76 105.19 101.97 1p88 n GLY 80 Ca 0.00 -1.13 -0.54 0.00 0.00 0.00 0.00 46.02 44.35 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 1.29 -2.33 1.61 -0.02 -1.26 -4.08 135.00 130.21 1p88 n PRO 81 Ca 0.00 0.47 -0.43 0.00 -2.02 0.00 0.00 63.50 61.52 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 2.06 3.61 0.09 2.45 2.01 -1.26 -4.82 118.68 122.82 1p88 s LEU 82 Ca 0.91 0.89 -0.28 0.00 0.01 0.00 0.00 54.13 55.66 1p88 s LEU 82 Cb -0.97 -3.54 -0.06 0.00 0.01 0.00 0.00 46.19 41.64 1p88 s LEU 82 CO 0.54 -1.42 0.87 -1.38 1.01 0.00 0.00 176.35 175.98 1p88 s HIS 83 N 5.43 3.79 -0.24 0.29 -3.43 -1.26 -4.91 115.29 114.96 1p88 s HIS 83 Ca 0.62 1.67 -0.12 0.00 -0.80 0.00 0.00 55.06 56.42 1p88 s HIS 83 Cb -0.14 -2.95 -0.05 0.00 -1.43 0.00 0.00 32.58 28.01 1p88 s HIS 83 CO 0.32 0.26 0.25 0.00 -2.00 0.00 0.00 174.74 173.57 1p88 s ALA 84 N -0.12 3.58 -0.03 -1.38 0.00 -1.26 -4.47 121.76 118.07 1p88 s ALA 84 Ca 0.43 -0.82 -0.30 0.00 0.00 0.00 0.00 51.96 51.27 1p88 s ALA 84 Cb -0.22 -2.47 -0.05 0.00 0.00 0.00 0.00 23.12 20.38 1p88 s ALA 84 CO 0.27 -0.33 1.41 -1.21 0.00 0.00 0.00 175.76 175.90 1p88 s GLU 85 N 1.34 4.26 0.40 0.00 2.02 -1.26 -4.64 118.70 120.83 1p88 s GLU 85 Ca 0.11 1.94 0.00 0.00 0.02 0.00 0.00 54.97 57.04 1p88 s GLU 85 Cb -0.14 -3.66 0.00 0.00 0.10 0.00 0.00 34.13 30.43 1p88 s GLU 85 CO 0.07 -0.63 0.00 0.41 0.02 0.00 0.00 175.26 175.13 1p88 n GLY 86 N 3.70 -2.19 3.77 -1.39 0.00 -1.26 -4.69 105.19 103.13 1p88 n GLY 86 Ca 0.14 -1.10 -0.38 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.68 3.12 0.28 4.61 0.00 -1.26 -4.65 121.76 121.18 1p88 s ALA 87 Ca 0.00 0.85 0.11 0.00 0.00 0.00 0.00 51.96 52.91 1p88 s ALA 87 Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1p88 s ALA 87 CO 0.00 -0.39 -0.08 -1.17 0.00 0.00 0.00 175.76 174.12 1p88 s LEU 88 N -2.53 2.92 -0.24 0.00 2.96 0.51 -4.98 118.68 117.32 1p88 s LEU 88 Ca 0.57 -0.84 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1p88 s LEU 88 Cb -0.27 -1.42 0.08 0.00 0.50 0.00 0.00 46.19 45.09 1p88 s LEU 88 CO 0.34 -0.01 0.11 -1.61 -1.32 0.00 0.00 176.35 173.86 1p88 s GLU 89 N -3.61 0.20 -0.29 1.98 2.02 -1.26 0.21 118.70 117.95 1p88 s GLU 89 Ca 0.31 -0.39 -0.11 0.00 0.02 0.00 0.00 54.97 54.80 1p88 s GLU 89 Cb -0.05 -1.51 -0.04 0.00 0.10 0.00 0.00 34.13 32.63 1p88 s GLU 89 CO 0.18 -0.87 0.19 -0.51 0.02 0.00 0.00 175.26 174.27 1p88 s LEU 90 N 2.07 4.09 -0.72 1.80 1.02 0.46 -4.90 118.68 122.51 1p88 s LEU 90 Ca 0.06 -0.13 -0.19 0.00 0.02 0.00 0.00 54.13 53.89 1p88 s LEU 90 Cb -0.16 -2.10 0.12 0.00 0.02 0.00 0.00 46.19 44.06 1p88 s LEU 90 CO -0.24 -0.09 0.86 -0.36 0.02 0.00 0.00 176.35 176.53 1p88 s PHE 91 N 1.74 3.07 -0.70 0.29 0.40 -1.26 0.14 117.98 121.66 1p88 s PHE 91 Ca 0.07 -1.13 -0.00 0.00 -0.60 0.00 0.00 56.93 55.26 1p88 s PHE 91 Cb -0.16 -4.10 0.39 0.00 0.51 0.00 0.00 43.02 39.65 1p88 s PHE 91 CO 0.10 -1.37 1.81 1.28 0.70 0.00 0.00 175.22 177.75 1p88 n LEU 92 N 6.32 6.90 -0.23 -0.37 7.99 0.51 -4.77 117.00 133.36 1p88 n LEU 92 Ca 0.03 -4.79 0.01 0.00 -0.01 0.00 0.00 56.01 51.24 1p88 n LEU 92 Cb 0.45 -0.89 0.13 0.00 -0.11 0.00 0.00 43.42 42.99 1p88 n LEU 92 CO 0.54 1.81 1.04 1.23 -1.51 0.00 0.00 177.39 180.50 1p88 h GLY 93 N 2.67 0.98 0.04 -0.72 0.00 -1.84 -1.44 103.07 102.76 1p88 h GLY 93 Ca 0.52 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1p88 h GLY 93 CO 1.32 0.03 -0.50 0.70 0.00 0.00 0.00 176.54 178.09 1p88 n ASN 94 N -4.91 1.17 -3.67 0.19 3.02 -1.26 -4.08 115.26 105.71 1p88 n ASN 94 Ca 0.10 -0.94 -0.41 0.00 -0.03 0.00 0.00 54.58 53.30 1p88 n ASN 94 Cb 0.27 0.40 0.01 0.00 -0.61 0.00 0.00 39.78 39.86 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 -0.82 6.05 0.27 5.41 0.00 -0.54 -4.24 120.51 126.64 1p88 n ALA 95 Ca 0.09 -4.55 0.13 0.00 0.00 0.00 0.00 53.44 49.11 1p88 n ALA 95 Cb 0.37 -2.33 0.75 0.00 0.00 0.00 0.00 19.45 18.25 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 4.70 0.00 1.18 0.00 0.00 -1.78 0.20 103.07 107.37 1p88 h GLY 96 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.84 1p88 h GLY 96 CO 1.26 0.00 -0.70 -0.91 0.00 0.00 0.00 176.54 176.19 1p88 h THR 97 N 0.00 0.00 0.00 4.70 1.35 -1.92 -3.35 112.91 113.69 1p88 h THR 97 Ca -0.00 -0.71 -0.31 0.00 -0.55 0.00 0.00 66.41 64.84 1p88 h THR 97 Cb 0.27 1.30 -0.06 0.00 -1.73 0.00 0.00 68.15 67.93 1p88 h THR 97 CO 0.01 0.00 -2.02 0.00 -0.25 0.00 0.00 175.52 173.26 1p88 n ALA 98 N -1.97 1.59 -0.06 6.62 0.00 -0.36 -4.17 120.51 122.16 1p88 n ALA 98 Ca 0.02 -1.01 -0.11 0.00 0.00 0.00 0.00 53.44 52.34 1p88 n ALA 98 Cb 0.49 -0.54 -0.05 0.00 0.00 0.00 0.00 19.45 19.35 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 0.30 0.37 0.00 -1.53 -0.81 0.15 114.93 113.41 1p88 h MET 99 Ca -0.39 -0.07 -0.00 0.00 -3.44 0.00 0.00 59.70 55.80 1p88 h MET 99 Cb 2.05 -0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 33.02 1p88 h MET 99 CO 0.05 0.42 -0.47 0.00 0.14 0.00 0.00 176.91 177.05 1p88 h ARG 100 N 0.13 -0.84 -0.33 0.39 -0.00 -1.77 0.68 114.38 112.64 1p88 h ARG 100 Ca 0.06 0.06 0.01 0.00 -0.50 0.00 0.00 59.98 59.61 1p88 h ARG 100 Cb 0.25 0.19 -0.02 0.00 0.00 0.00 0.00 29.97 30.39 1p88 h ARG 100 CO -0.00 -0.56 0.22 -1.00 0.00 0.00 0.00 179.97 178.63 1p88 h PRO 101 N -0.87 0.40 0.10 0.04 0.13 -1.70 -1.91 132.00 128.19 1p88 h PRO 101 Ca -0.03 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.07 1p88 h PRO 101 Cb 0.79 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1p88 h PRO 101 CO -0.12 0.26 -0.05 -0.07 -0.23 0.00 0.00 178.00 177.79 1p88 h LEU 102 N 0.41 -0.12 -1.91 1.56 3.38 -0.03 0.27 115.31 118.88 1p88 h LEU 102 Ca 0.12 -0.46 0.23 0.00 0.09 0.00 0.00 57.88 57.87 1p88 h LEU 102 Cb 0.00 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1p88 h LEU 102 CO -0.03 0.50 0.68 0.00 0.09 0.00 0.00 178.44 179.68 1p88 h ALA 103 N -0.19 2.67 0.00 1.53 0.00 0.51 0.08 119.26 123.86 1p88 h ALA 103 Ca -0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1p88 h ALA 103 Cb 0.57 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1p88 h ALA 103 CO 0.02 -1.09 -0.65 0.00 0.00 0.00 0.00 179.25 177.53 1p88 h ALA 104 N 1.41 0.10 -0.28 0.00 0.00 -1.27 -3.34 119.26 115.88 1p88 h ALA 104 Ca 0.38 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1p88 h ALA 104 Cb 1.73 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 19.95 1p88 h ALA 104 CO -0.00 0.43 0.19 0.00 0.00 0.00 0.00 179.25 179.87 1p88 h ALA 105 N -0.64 1.81 0.00 0.00 0.00 0.31 -1.72 119.26 119.01 1p88 h ALA 105 Ca -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1p88 h ALA 105 Cb 0.83 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1p88 h ALA 105 CO -0.08 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.62 1p88 n LEU 106 N -4.50 0.49 -0.35 0.00 4.77 -0.06 -3.16 117.00 114.20 1p88 n LEU 106 Ca 0.01 0.55 0.01 0.00 -0.03 0.00 0.00 56.01 56.55 1p88 n LEU 106 Cb 0.07 -0.41 0.02 0.00 -2.33 0.00 0.00 43.42 40.78 1p88 n LEU 106 CO 0.35 -0.14 0.40 0.00 -1.33 0.00 0.00 177.39 176.66 1p88 n LEU 108 N -0.15 0.12 -4.82 0.00 4.77 -1.19 0.48 117.00 116.22 1p88 n LEU 108 Ca 0.02 0.18 -0.35 0.00 -0.03 0.00 0.00 56.01 55.83 1p88 n LEU 108 Cb 0.18 -0.45 -0.06 0.00 -2.33 0.00 0.00 43.42 40.76 1p88 n LEU 108 CO 0.02 -0.45 0.45 -0.83 -1.33 0.00 0.00 177.39 175.25 1p88 s GLY 109 N -2.43 2.55 -0.57 -0.72 0.00 -1.25 -2.84 107.32 102.05 1p88 s GLY 109 Ca 0.00 0.18 -0.26 0.00 0.00 0.00 0.00 44.72 44.64 1p88 s GLY 109 CO 0.00 0.50 2.44 -1.14 0.00 0.00 0.00 173.10 174.90 1p88 n SER 110 N 0.36 2.06 -3.75 1.64 3.41 -1.26 -3.51 113.62 112.57 1p88 n SER 110 Ca 0.00 -0.57 -0.12 0.00 -0.26 0.00 0.00 58.87 57.92 1p88 n SER 110 Cb 0.52 -1.53 -0.12 0.00 -0.26 0.00 0.00 64.21 62.82 1p88 n SER 110 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1p88 s ASN 111 N 11.76 -0.33 -0.60 4.04 -0.87 -1.25 -4.77 114.94 122.91 1p88 s ASN 111 Ca 1.01 0.62 -0.21 0.00 -1.57 0.00 0.00 52.86 52.72 1p88 s ASN 111 Cb -0.26 0.58 0.08 0.00 -0.02 0.00 0.00 41.25 41.63 1p88 s ASN 111 CO 0.26 -0.14 0.81 -1.81 -2.57 0.00 0.00 177.10 173.65 1p88 s ASP 112 N 0.68 6.19 -0.05 -1.22 1.11 -1.12 -1.50 116.67 120.76 1p88 s ASP 112 Ca -0.04 -1.14 0.06 0.00 0.18 0.00 0.00 52.55 51.61 1p88 s ASP 112 Cb -0.05 -2.35 -0.02 0.00 1.07 0.00 0.00 42.92 41.57 1p88 s ASP 112 CO -0.04 -1.22 -0.23 -0.63 1.18 0.00 0.00 175.17 174.23 1p88 s ILE 113 N 3.27 2.24 -0.31 0.77 -1.09 0.14 0.19 121.20 126.42 1p88 s ILE 113 Ca 0.17 -1.02 -0.06 0.00 -2.23 0.00 0.00 60.65 57.52 1p88 s ILE 113 Cb -0.20 -1.81 0.03 0.00 -1.58 0.00 0.00 42.46 38.89 1p88 s ILE 113 CO 0.09 0.57 0.07 -0.69 -1.23 0.00 0.00 174.94 173.75 1p88 s VAL 114 N -0.39 3.68 -0.45 2.92 1.01 0.56 0.21 120.40 127.95 1p88 s VAL 114 Ca 0.03 -0.98 -0.13 0.00 0.00 0.00 0.00 61.98 60.90 1p88 s VAL 114 Cb -0.12 -2.99 0.07 0.00 0.00 0.00 0.00 36.38 33.33 1p88 s VAL 114 CO 0.02 -0.03 0.34 -0.76 0.00 0.00 0.00 175.10 174.66 1p88 s LEU 115 N 1.42 5.39 0.00 3.92 1.43 0.73 0.17 118.68 131.74 1p88 s LEU 115 Ca -0.00 -1.32 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 1p88 s LEU 115 Cb -0.18 -2.11 0.00 0.00 0.03 0.00 0.00 46.19 43.92 1p88 s LEU 115 CO 0.02 -0.58 0.01 0.41 0.23 0.00 0.00 176.35 176.44 1p88 n THR 116 N 5.10 0.00 -3.86 5.49 -1.04 0.12 -1.79 114.28 118.31 1p88 n THR 116 Ca -0.12 -1.33 -0.04 0.00 -2.04 0.00 0.00 64.05 60.52 1p88 n THR 116 Cb 0.44 0.24 0.02 0.00 -1.82 0.00 0.00 70.33 69.20 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 -2.59 0.14 1.06 3.41 0.00 -1.26 0.19 107.32 108.27 1p88 s GLY 117 Ca 0.01 -0.40 -0.15 0.00 0.00 0.00 0.00 44.72 44.19 1p88 s GLY 117 CO 0.01 1.59 1.11 -0.54 0.00 0.00 0.00 173.10 175.27 1p88 s GLU 118 N -2.31 -0.04 0.34 2.90 2.02 -1.26 -4.74 118.70 115.61 1p88 s GLU 118 Ca 0.20 0.26 0.13 0.00 0.02 0.00 0.00 54.97 55.58 1p88 s GLU 118 Cb -0.03 -1.70 1.01 0.00 0.10 0.00 0.00 34.13 33.51 1p88 s GLU 118 CO 0.06 -2.99 1.70 -1.35 0.02 0.00 0.00 175.26 172.70 1p88 h PRO 119 N -2.07 0.42 0.00 0.39 0.11 -2.02 0.68 132.00 129.51 1p88 h PRO 119 Ca -0.51 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.54 1p88 h PRO 119 Cb 1.32 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1p88 h PRO 119 CO 0.51 0.28 -0.14 0.00 -0.21 0.00 0.00 178.00 178.44 1p88 h ARG 120 N 0.44 0.00 -0.54 1.05 -0.00 -1.91 -2.41 114.38 111.01 1p88 h ARG 120 Ca 0.69 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 60.16 1p88 h ARG 120 Cb 1.50 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 31.44 1p88 h ARG 120 CO -0.52 0.14 0.30 1.98 0.00 0.00 0.00 179.97 181.87 1p88 h MET 121 N 0.00 0.73 0.00 0.04 4.05 0.24 -0.01 114.93 119.98 1p88 h MET 121 Ca -0.00 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1p88 h MET 121 Cb 0.50 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 1p88 h MET 121 CO 0.02 0.53 0.00 0.87 0.23 0.00 0.00 176.91 178.56 1p88 h LYS 122 N 0.74 0.00 -0.00 0.39 6.56 -1.45 0.21 116.57 123.02 1p88 h LYS 122 Ca 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 1p88 h LYS 122 Cb 0.01 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.67 1p88 h LYS 122 CO -0.03 0.00 -0.00 -1.91 -2.06 0.00 0.00 179.45 175.45 1p88 n GLU 123 N -2.59 1.04 -3.76 3.15 2.13 -0.02 -4.28 120.64 116.32 1p88 n GLU 123 Ca -0.01 -0.09 -0.28 0.00 0.66 0.00 0.00 57.16 57.44 1p88 n GLU 123 Cb 0.11 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.20 1p88 n GLU 123 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1p88 s ARG 124 N -2.02 1.81 0.59 5.31 0.52 0.75 -5.11 118.95 120.80 1p88 s ARG 124 Ca 0.47 -2.69 -0.19 0.00 -0.52 0.00 0.00 55.73 52.79 1p88 s ARG 124 Cb 0.22 -2.75 -0.04 0.00 0.52 0.00 0.00 34.95 32.90 1p88 s ARG 124 CO 0.37 -1.25 1.11 -0.35 0.02 0.00 0.00 175.30 175.20 1p88 n PRO 125 N 2.66 1.11 0.00 3.54 -0.04 -1.26 -4.35 135.00 136.66 1p88 n PRO 125 Ca 0.17 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 1p88 n PRO 125 Cb 0.37 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 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 -1.58 0.00 -0.33 0.52 0.13 0.21 -4.78 119.36 113.53 1p88 n ILE 126 Ca 0.13 -0.41 0.10 0.00 -1.10 0.00 0.00 62.75 61.47 1p88 n ILE 126 Cb 0.46 1.16 0.30 0.00 -0.84 0.00 0.00 39.64 40.73 1p88 n ILE 126 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1p88 h GLY 127 N 0.00 1.52 0.61 4.50 0.00 -1.78 -0.62 103.07 107.31 1p88 h GLY 127 Ca 0.00 -0.37 0.10 0.00 0.00 0.00 0.00 47.33 47.06 1p88 h GLY 127 CO 0.00 0.09 0.62 0.45 0.00 0.00 0.00 176.54 177.70 1p88 h HIS 128 N 0.84 1.09 -0.03 5.60 3.86 -1.87 0.22 115.15 124.85 1p88 h HIS 128 Ca 0.50 0.03 -0.24 0.00 -1.16 0.00 0.00 60.37 59.50 1p88 h HIS 128 Cb 0.66 -0.35 0.02 0.00 1.06 0.00 0.00 27.41 28.80 1p88 h HIS 128 CO -0.00 0.48 -0.90 1.25 0.86 0.00 0.00 177.93 179.61 1p88 h LEU 129 N 0.99 0.85 -0.34 2.43 5.85 -1.54 -2.68 115.31 120.87 1p88 h LEU 129 Ca 0.46 -0.72 0.05 0.00 0.84 0.00 0.00 57.88 58.51 1p88 h LEU 129 Cb 0.41 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1p88 h LEU 129 CO -0.22 1.45 0.08 0.58 -0.34 0.00 0.00 178.44 179.99 1p88 h VAL 130 N 0.33 0.85 -0.30 1.05 2.07 -0.11 0.31 116.25 120.45 1p88 h VAL 130 Ca -0.10 -0.07 -0.14 0.00 0.82 0.00 0.00 66.70 67.21 1p88 h VAL 130 Cb 1.56 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1p88 h VAL 130 CO 0.18 0.04 -0.39 0.44 0.02 0.00 0.00 177.57 177.86 1p88 h ASP 131 N 0.20 0.74 -0.09 0.57 3.32 -1.08 0.88 116.42 120.97 1p88 h ASP 131 Ca 0.16 -0.33 0.01 0.00 0.02 0.00 0.00 57.03 56.89 1p88 h ASP 131 Cb 0.17 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1p88 h ASP 131 CO -0.20 1.04 0.01 0.00 -1.72 0.00 0.00 179.24 178.38 1p88 h ALA 132 N 0.99 0.08 -0.04 3.45 0.00 -1.02 0.93 119.26 123.65 1p88 h ALA 132 Ca 0.05 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1p88 h ALA 132 Cb 0.92 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1p88 h ALA 132 CO 0.08 -0.45 -0.20 -0.07 0.00 0.00 0.00 179.25 178.61 1p88 h LEU 133 N 0.05 0.25 -2.24 0.00 3.38 -0.27 -2.98 115.31 113.50 1p88 h LEU 133 Ca 0.04 -0.67 0.01 0.00 0.09 0.00 0.00 57.88 57.35 1p88 h LEU 133 Cb 0.03 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1p88 h LEU 133 CO -0.05 0.87 0.03 0.03 0.09 0.00 0.00 178.44 179.41 1p88 h ARG 134 N -0.37 0.00 0.00 1.13 2.47 0.91 0.93 114.38 119.45 1p88 h ARG 134 Ca -0.01 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.61 1p88 h ARG 134 Cb 0.87 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.18 1p88 h ARG 134 CO 0.04 0.00 -0.47 1.25 0.56 0.00 0.00 179.97 181.35 1p88 h LEU 135 N 0.00 0.00 -1.26 3.04 5.85 1.00 -2.57 115.31 121.37 1p88 h LEU 135 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1p88 h LEU 135 Cb 0.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1p88 h LEU 135 CO -0.00 0.47 0.00 0.61 -0.34 0.00 0.00 178.44 179.18 1p88 n GLY 136 N 0.04 1.00 0.64 3.75 0.00 0.23 -4.80 105.19 106.05 1p88 n GLY 136 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 0.49 0.74 3.80 -0.02 0.00 -0.97 -0.04 105.19 109.18 1p88 n GLY 137 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.27 2.77 -0.47 4.61 0.00 -0.63 -3.13 121.76 122.63 1p88 s ALA 138 Ca 0.00 0.49 -0.13 0.00 0.00 0.00 0.00 51.96 52.32 1p88 s ALA 138 Cb 0.00 -3.25 0.09 0.00 0.00 0.00 0.00 23.12 19.96 1p88 s ALA 138 CO 0.00 -0.68 0.38 0.15 0.00 0.00 0.00 175.76 175.61 1p88 s LYS 139 N -3.77 2.84 -0.05 0.00 -0.14 0.17 -4.19 119.74 114.61 1p88 s LYS 139 Ca 0.65 -1.50 0.00 0.00 -1.36 0.00 0.00 55.97 53.77 1p88 s LYS 139 Cb -0.17 -4.07 0.02 0.00 -1.68 0.00 0.00 37.83 31.94 1p88 s LYS 139 CO 0.31 -1.09 -0.03 0.42 -0.76 0.00 0.00 175.35 174.20 1p88 s ILE 140 N 1.55 0.47 -0.02 2.17 1.01 -1.26 -1.26 121.20 123.86 1p88 s ILE 140 Ca 0.04 -0.05 0.06 0.00 0.00 0.00 0.00 60.65 60.69 1p88 s ILE 140 Cb -0.25 -0.54 -0.01 0.00 0.01 0.00 0.00 42.46 41.67 1p88 s ILE 140 CO 0.04 0.23 -0.20 -0.89 0.00 0.00 0.00 174.94 174.12 1p88 s THR 141 N 1.17 1.58 0.03 2.92 2.01 -0.63 -4.94 115.64 117.77 1p88 s THR 141 Ca -0.07 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 60.78 1p88 s THR 141 Cb -0.14 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 1p88 s THR 141 CO -0.01 0.45 1.05 -0.31 -0.69 0.00 0.00 174.62 175.10 1p88 s TYR 142 N -0.39 3.60 0.00 4.92 2.02 -1.26 -0.80 117.35 125.43 1p88 s TYR 142 Ca 0.06 1.58 0.00 0.00 -0.37 0.00 0.00 57.07 58.34 1p88 s TYR 142 Cb -0.08 -3.21 0.00 0.00 -0.40 0.00 0.00 41.96 38.26 1p88 s TYR 142 CO -0.00 -0.41 0.00 1.28 -1.57 0.00 0.00 175.55 174.85 1p88 n LEU 143 N 3.82 0.00 0.00 -1.29 4.32 -1.26 -4.91 117.00 117.69 1p88 n LEU 143 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 1p88 n LEU 143 Cb 0.49 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.29 1p88 n LEU 143 CO 0.53 0.00 0.21 -0.62 -1.22 0.00 0.00 177.39 176.29 1p88 n GLU 144 N 0.00 0.00 -4.28 3.23 1.02 -1.26 -4.86 120.64 114.49 1p88 n GLU 144 Ca 0.00 0.02 -0.28 0.00 -0.02 0.00 0.00 57.16 56.88 1p88 n GLU 144 Cb 0.00 -0.92 -0.10 0.00 -0.02 0.00 0.00 31.44 30.39 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 -0.85 1.98 0.24 3.49 -0.21 -1.26 -5.09 119.66 117.96 1p88 s GLN 145 Ca 0.00 -1.18 -0.30 0.00 0.02 0.00 0.00 55.36 53.90 1p88 s GLN 145 Cb 0.00 -2.17 -0.10 0.00 1.00 0.00 0.00 33.01 31.74 1p88 s GLN 145 CO 0.00 0.47 1.38 -1.21 -2.12 0.00 0.00 175.29 173.81 1p88 s GLU 146 N -2.45 4.32 -1.42 2.91 2.02 -1.26 -2.11 118.70 120.71 1p88 s GLU 146 Ca 0.22 2.21 0.00 0.00 0.02 0.00 0.00 54.97 57.42 1p88 s GLU 146 Cb -0.10 -3.14 0.00 0.00 0.10 0.00 0.00 34.13 31.00 1p88 s GLU 146 CO 0.13 -0.34 0.00 0.09 0.02 0.00 0.00 175.26 175.16 1p88 n ASN 147 N 2.32 -4.66 -4.81 -0.19 4.13 -1.26 -4.86 115.26 105.92 1p88 n ASN 147 Ca 0.06 0.33 -0.23 0.00 1.68 0.00 0.00 54.58 56.42 1p88 n ASN 147 Cb 0.41 -3.34 -0.05 0.00 -1.54 0.00 0.00 39.78 35.26 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 -2.48 2.67 0.08 3.10 1.51 -0.90 0.65 117.35 121.99 1p88 s TYR 148 Ca 0.00 -0.53 -0.16 0.00 -1.01 0.00 0.00 57.07 55.38 1p88 s TYR 148 Cb 0.00 -2.04 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 1p88 s TYR 148 CO 0.00 0.05 0.94 -2.30 -1.11 0.00 0.00 175.55 173.12 1p88 n PRO 149 N -1.38 -0.22 -1.61 -1.71 -0.02 -1.26 -4.33 135.00 124.47 1p88 n PRO 149 Ca 0.01 0.92 -0.40 0.00 -2.02 0.00 0.00 63.50 62.01 1p88 n PRO 149 Cb 0.63 -1.36 0.02 0.00 -0.02 0.00 0.00 33.50 32.78 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 -4.32 1.22 -3.67 0.52 -0.02 -1.05 -4.33 135.00 123.34 1p88 n PRO 150 Ca 0.01 0.45 -0.12 0.00 -2.02 0.00 0.00 63.50 61.82 1p88 n PRO 150 Cb 0.13 -2.09 -0.08 0.00 -0.02 0.00 0.00 33.50 31.44 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 -0.98 -0.36 -0.44 2.45 1.43 -0.74 -4.04 118.68 116.00 1p88 s LEU 151 Ca 0.67 1.21 -0.09 0.00 -1.03 0.00 0.00 54.13 54.88 1p88 s LEU 151 Cb -0.50 1.98 0.09 0.00 0.03 0.00 0.00 46.19 47.79 1p88 s LEU 151 CO 0.54 -0.21 0.30 -0.13 0.23 0.00 0.00 176.35 177.08 1p88 s ARG 152 N 0.76 2.58 0.09 1.70 0.52 0.02 -0.19 118.95 124.43 1p88 s ARG 152 Ca -0.04 -1.56 -0.10 0.00 -0.52 0.00 0.00 55.73 53.51 1p88 s ARG 152 Cb -0.05 -3.85 -0.06 0.00 0.52 0.00 0.00 34.95 31.51 1p88 s ARG 152 CO -0.06 -1.04 0.42 -0.51 0.02 0.00 0.00 175.30 174.13 1p88 s LEU 153 N 1.41 4.34 0.00 2.53 1.43 0.56 -1.61 118.68 127.35 1p88 s LEU 153 Ca 0.04 0.83 0.11 0.00 -1.03 0.00 0.00 54.13 54.08 1p88 s LEU 153 Cb -0.24 -3.05 0.19 0.00 0.03 0.00 0.00 46.19 43.12 1p88 s LEU 153 CO 0.01 0.15 1.02 0.00 0.23 0.00 0.00 176.35 177.76 1p88 n GLN 154 N 0.84 0.00 0.00 1.70 3.00 -0.39 0.25 117.38 122.78 1p88 n GLN 154 Ca -0.07 -1.33 0.00 0.00 -0.01 0.00 0.00 57.00 55.59 1p88 n GLN 154 Cb 0.52 0.03 0.00 0.00 0.00 0.00 0.00 30.24 30.79 1p88 n GLN 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1p88 n GLY 155 N 0.22 0.80 0.00 1.08 0.00 -1.21 -3.87 105.19 102.21 1p88 n GLY 155 Ca -0.05 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.16 1p88 n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 156 N 0.00 1.23 3.68 -0.02 0.00 -1.04 0.45 105.19 109.48 1p88 n GLY 156 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1p88 n GLY 156 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1p88 s PHE 157 N -2.19 1.73 -0.05 1.61 2.19 0.18 -3.81 117.98 117.63 1p88 s PHE 157 Ca 0.00 -0.24 0.03 0.00 0.33 0.00 0.00 56.93 57.05 1p88 s PHE 157 Cb 0.00 -4.22 -0.05 0.00 -1.31 0.00 0.00 43.02 37.44 1p88 s PHE 157 CO 0.00 -5.22 -0.01 0.25 1.83 0.00 0.00 175.22 172.07 1p88 n THR 158 N 5.13 0.33 0.00 0.12 -2.24 0.58 -4.52 114.28 113.67 1p88 n THR 158 Ca 0.19 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1p88 n THR 158 Cb 0.39 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.80 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 2.86 0.90 0.00 3.38 0.00 0.94 0.14 105.19 113.41 1p88 n GLY 159 Ca -0.09 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 43.98 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 2.54 3.69 -0.02 0.00 -0.76 -4.13 105.19 106.52 1p88 n GLY 160 Ca 0.00 -1.83 -0.58 0.00 0.00 0.00 0.00 46.02 43.60 1p88 n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p88 n ASN 161 N 0.00 2.21 -4.46 1.61 3.02 -1.26 -3.66 115.26 112.71 1p88 n ASN 161 Ca 0.00 1.04 -0.33 0.00 -0.03 0.00 0.00 54.58 55.26 1p88 n ASN 161 Cb 0.00 -1.11 -0.13 0.00 -0.61 0.00 0.00 39.78 37.93 1p88 n ASN 161 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1p88 s VAL 162 N 3.78 3.67 -0.29 2.41 1.01 0.63 -4.75 120.40 126.87 1p88 s VAL 162 Ca 1.00 -0.44 -0.12 0.00 0.00 0.00 0.00 61.98 62.43 1p88 s VAL 162 Cb -1.12 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1p88 s VAL 162 CO 0.67 0.50 0.23 -1.81 0.00 0.00 0.00 175.10 174.69 1p88 s ASP 163 N 0.36 6.07 -0.09 3.32 1.01 -1.26 -0.77 116.67 125.31 1p88 s ASP 163 Ca -0.06 -0.00 -0.01 0.00 0.71 0.00 0.00 52.55 53.19 1p88 s ASP 163 Cb -0.15 -2.14 0.03 0.00 1.01 0.00 0.00 42.92 41.67 1p88 s ASP 163 CO 0.04 -0.10 -0.04 -0.69 0.21 0.00 0.00 175.17 174.58 1p88 s VAL 164 N 1.82 0.72 0.37 -1.27 1.01 -0.57 -4.41 120.40 118.08 1p88 s VAL 164 Ca 0.09 -0.10 -0.26 0.00 0.00 0.00 0.00 61.98 61.71 1p88 s VAL 164 Cb -0.16 -0.81 -0.12 0.00 0.00 0.00 0.00 36.38 35.30 1p88 s VAL 164 CO 0.11 0.32 1.11 -0.67 0.00 0.00 0.00 175.10 175.96 1p88 n ASP 165 N 5.02 1.78 0.12 3.32 -0.08 -1.26 -2.65 116.55 122.80 1p88 n ASP 165 Ca -0.10 1.12 -0.13 0.00 -1.51 0.00 0.00 54.79 54.16 1p88 n ASP 165 Cb 0.50 -1.39 -0.08 0.00 2.34 0.00 0.00 41.12 42.50 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 1.94 -0.24 -7.36 0.27 0.00 -1.44 -3.37 103.07 92.88 1p88 h GLY 166 Ca -0.44 0.09 -0.70 0.00 0.00 0.00 0.00 47.33 46.28 1p88 h GLY 166 CO 0.59 -0.09 0.40 -1.35 0.00 0.00 0.00 176.54 176.10 1p88 s SER 167 N -5.01 6.41 -0.31 0.19 1.04 -1.23 0.71 113.70 115.50 1p88 s SER 167 Ca -0.14 -1.75 -0.01 0.00 0.48 0.00 0.00 55.95 54.53 1p88 s SER 167 Cb 0.05 -2.34 0.29 0.00 0.10 0.00 0.00 66.02 64.13 1p88 s SER 167 CO 0.65 -1.07 1.33 0.55 0.98 0.00 0.00 173.24 175.68 1p88 n VAL 168 N 5.35 0.00 -1.60 5.02 3.14 -1.26 -4.99 118.33 123.99 1p88 n VAL 168 Ca 0.05 -0.53 0.00 0.00 -2.96 0.00 0.00 64.34 60.90 1p88 n VAL 168 Cb 0.46 1.02 0.00 0.00 -1.06 0.00 0.00 33.84 34.25 1p88 n VAL 168 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1p88 n SER 169 N 1.22 -7.90 0.19 6.55 7.64 -1.26 -4.44 113.62 115.62 1p88 n SER 169 Ca -0.02 1.10 0.14 0.00 1.01 0.00 0.00 58.87 61.10 1p88 n SER 169 Cb 0.73 -4.03 0.52 0.00 -1.01 0.00 0.00 64.21 60.42 1p88 n SER 169 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1p88 h SER 170 N 2.82 0.00 1.07 6.43 4.64 -1.90 -2.69 113.55 123.92 1p88 h SER 170 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1p88 h SER 170 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1p88 h SER 170 CO 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 176.83 175.87 1p88 n GLN 171 N -2.61 0.09 0.04 4.77 3.00 -1.26 -2.41 117.38 119.00 1p88 n GLN 171 Ca 0.02 0.07 -0.13 0.00 -0.01 0.00 0.00 57.00 56.95 1p88 n GLN 171 Cb 0.31 -1.60 -0.09 0.00 0.00 0.00 0.00 30.24 28.86 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 -0.12 -0.36 1.08 -1.00 -1.69 0.33 116.94 115.18 1p88 h PHE 172 Ca 0.00 -0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.70 1p88 h PHE 172 Cb 0.58 0.04 -0.01 0.00 3.61 0.00 0.00 35.95 40.17 1p88 h PHE 172 CO 0.00 0.31 -0.09 -0.07 -1.61 0.00 0.00 178.31 176.85 1p88 h LEU 173 N -0.61 0.71 -1.65 1.54 3.38 -1.72 -2.31 115.31 114.65 1p88 h LEU 173 Ca -0.01 -0.37 0.13 0.00 0.09 0.00 0.00 57.88 57.72 1p88 h LEU 173 Cb 0.49 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 1p88 h LEU 173 CO 0.02 0.91 0.46 0.74 0.09 0.00 0.00 178.44 180.66 1p88 h THR 174 N 0.50 0.82 -0.51 0.22 2.02 -1.48 0.11 112.91 114.59 1p88 h THR 174 Ca 0.09 -0.12 -0.10 0.00 0.77 0.00 0.00 66.41 67.05 1p88 h THR 174 Cb 0.61 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1p88 h THR 174 CO 0.04 0.07 -0.07 0.00 0.37 0.00 0.00 175.52 175.92 1p88 h ALA 175 N 1.67 0.70 0.01 6.16 0.00 -0.36 -2.73 119.26 124.71 1p88 h ALA 175 Ca 0.33 -0.33 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 1p88 h ALA 175 Cb 0.77 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1p88 h ALA 175 CO -0.09 0.57 -0.94 -0.07 0.00 0.00 0.00 179.25 178.72 1p88 h LEU 176 N 0.81 0.45 -1.28 0.00 3.38 -0.87 -2.05 115.31 115.75 1p88 h LEU 176 Ca 0.14 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1p88 h LEU 176 Cb 0.62 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 1p88 h LEU 176 CO 0.04 1.17 0.43 -0.07 0.09 0.00 0.00 178.44 180.10 1p88 h LEU 177 N 0.19 0.80 0.15 1.67 4.07 -0.81 0.54 115.31 121.92 1p88 h LEU 177 Ca -0.07 -0.03 -0.23 0.00 0.08 0.00 0.00 57.88 57.62 1p88 h LEU 177 Cb 1.58 -0.20 0.02 0.00 1.08 0.00 0.00 40.66 43.13 1p88 h LEU 177 CO 0.16 0.60 -1.07 0.24 -1.08 0.00 0.00 178.44 177.29 1p88 h MET 178 N 0.94 0.32 -0.18 1.13 2.86 -1.47 -3.35 114.93 115.18 1p88 h MET 178 Ca 0.25 -0.55 -0.15 0.00 -2.06 0.00 0.00 59.70 57.19 1p88 h MET 178 Cb -0.07 0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.80 1p88 h MET 178 CO -0.05 1.26 -0.48 1.15 1.06 0.00 0.00 176.91 179.85 1p88 h THR 179 N -0.28 1.33 -0.91 2.22 2.02 -1.22 -3.34 112.91 112.72 1p88 h THR 179 Ca -0.20 -1.73 0.02 0.00 0.77 0.00 0.00 66.41 65.28 1p88 h THR 179 Cb 1.75 1.94 -0.05 0.00 -1.74 0.00 0.00 68.15 70.05 1p88 h THR 179 CO 0.15 0.54 0.60 0.00 0.37 0.00 0.00 175.52 177.17 1p88 h ALA 180 N 0.57 1.39 0.00 6.16 0.00 -0.10 -2.41 119.26 124.88 1p88 h ALA 180 Ca -0.01 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1p88 h ALA 180 Cb 1.10 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1p88 h ALA 180 CO 0.10 0.54 -0.28 -1.00 0.00 0.00 0.00 179.25 178.61 1p88 h PRO 181 N 1.18 0.00 -0.03 0.00 0.13 -1.68 0.55 132.00 132.15 1p88 h PRO 181 Ca 0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.48 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 -0.09 0.28 0.00 1.28 -0.23 0.00 0.00 178.00 179.24 1p88 n LEU 182 N -4.16 0.61 -4.77 1.56 4.77 -0.93 0.22 117.00 114.30 1p88 n LEU 182 Ca -0.02 -0.23 -0.39 0.00 -0.03 0.00 0.00 56.01 55.34 1p88 n LEU 182 Cb 0.33 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.35 1p88 n LEU 182 CO 0.37 0.11 0.46 0.00 -1.33 0.00 0.00 177.39 177.01 1p88 s ALA 183 N -1.96 3.44 0.51 -1.18 0.00 0.18 -4.38 121.76 118.37 1p88 s ALA 183 Ca 0.37 0.31 0.28 0.00 0.00 0.00 0.00 51.96 52.92 1p88 s ALA 183 Cb 0.18 -2.94 1.39 0.00 0.00 0.00 0.00 23.12 21.74 1p88 s ALA 183 CO 0.30 0.23 1.89 -1.00 0.00 0.00 0.00 175.76 177.18 1p88 h PRO 184 N 4.76 0.09 -6.46 0.00 0.13 -1.67 1.89 132.00 130.74 1p88 h PRO 184 Ca -0.46 -0.01 -0.69 0.00 -0.87 0.00 0.00 66.00 63.97 1p88 h PRO 184 Cb 1.21 -0.02 -0.25 0.00 0.13 0.00 0.00 31.00 32.06 1p88 h PRO 184 CO 0.67 0.06 -0.82 -2.00 -0.23 0.00 0.00 178.00 175.69 1p88 s GLU 185 N -5.09 2.29 0.57 0.86 2.56 0.36 -4.18 118.70 116.08 1p88 s GLU 185 Ca -0.06 -0.82 -0.20 0.00 0.00 0.00 0.00 54.97 53.89 1p88 s GLU 185 Cb 0.22 -2.23 -0.05 0.00 2.00 0.00 0.00 34.13 34.06 1p88 s GLU 185 CO 0.77 0.59 1.15 -0.25 -0.56 0.00 0.00 175.26 176.96 1p88 n ASP 186 N 2.22 1.67 -4.31 -1.70 8.00 -1.26 -3.94 116.55 117.24 1p88 n ASP 186 Ca -0.17 0.90 -0.27 0.00 0.71 0.00 0.00 54.79 55.96 1p88 n ASP 186 Cb 0.52 -1.47 -0.14 0.00 -0.02 0.00 0.00 41.12 40.01 1p88 n ASP 186 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1p88 s THR 187 N -1.39 1.89 -0.16 -3.53 2.01 0.15 -1.82 115.64 112.79 1p88 s THR 187 Ca 0.74 -1.45 0.00 0.00 0.31 0.00 0.00 61.69 61.29 1p88 s THR 187 Cb -0.43 -1.66 0.03 0.00 0.01 0.00 0.00 72.50 70.45 1p88 s THR 187 CO 0.48 0.13 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.75 1p88 s VAL 188 N -0.96 1.40 -0.29 3.82 1.01 -1.24 -0.61 120.40 123.53 1p88 s VAL 188 Ca 0.09 -0.65 -0.09 0.00 0.00 0.00 0.00 61.98 61.33 1p88 s VAL 188 Cb -0.10 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 1p88 s VAL 188 CO 0.03 0.32 0.14 -0.63 0.00 0.00 0.00 175.10 174.96 1p88 s ILE 189 N 1.54 4.68 -0.24 2.22 1.09 0.57 0.23 121.20 131.29 1p88 s ILE 189 Ca 0.03 -0.26 -0.11 0.00 -1.10 0.00 0.00 60.65 59.22 1p88 s ILE 189 Cb -0.14 -3.32 -0.05 0.00 -1.06 0.00 0.00 42.46 37.89 1p88 s ILE 189 CO -0.09 0.16 0.17 -0.60 -0.10 0.00 0.00 174.94 174.47 1p88 s ARG 190 N 1.64 4.06 -0.22 2.79 3.52 0.05 0.18 118.95 130.98 1p88 s ARG 190 Ca 0.05 -0.26 -0.16 0.00 -0.13 0.00 0.00 55.73 55.23 1p88 s ARG 190 Cb -0.16 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.64 1p88 s ARG 190 CO 0.07 0.04 0.42 0.42 -0.81 0.00 0.00 175.30 175.44 1p88 s ILE 191 N 1.11 5.17 -0.80 4.11 1.09 -1.25 -1.52 121.20 129.12 1p88 s ILE 191 Ca 0.08 0.73 -0.26 0.00 -1.10 0.00 0.00 60.65 60.10 1p88 s ILE 191 Cb -0.14 -3.75 0.01 0.00 -1.06 0.00 0.00 42.46 37.53 1p88 s ILE 191 CO 0.05 0.20 1.55 -0.54 -0.10 0.00 0.00 174.94 176.10 1p88 s LYS 192 N 1.62 3.06 0.75 2.79 1.02 -1.09 -4.67 119.74 123.22 1p88 s LYS 192 Ca 0.19 -0.25 0.00 0.00 0.02 0.00 0.00 55.97 55.93 1p88 s LYS 192 Cb -0.15 -4.62 0.00 0.00 -0.52 0.00 0.00 37.83 32.54 1p88 s LYS 192 CO 0.09 -2.47 0.00 0.41 -0.92 0.00 0.00 175.35 172.46 1p88 n GLY 193 N 6.00 0.96 3.33 -3.33 0.00 -1.26 -1.35 105.19 109.55 1p88 n GLY 193 Ca 0.19 -1.23 -0.32 0.00 0.00 0.00 0.00 46.02 44.66 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 3.62 0.35 1.61 1.11 -1.26 -4.80 116.67 113.30 1p88 s ASP 194 Ca 0.00 -0.39 -0.24 0.00 0.18 0.00 0.00 52.55 52.10 1p88 s ASP 194 Cb 0.00 -1.28 -0.15 0.00 1.07 0.00 0.00 42.92 42.56 1p88 s ASP 194 CO 0.00 0.21 0.36 0.18 1.18 0.00 0.00 175.17 177.10 1p88 n LEU 195 N 3.20 -1.51 0.17 1.23 4.77 -1.19 -3.54 117.00 120.13 1p88 n LEU 195 Ca -0.18 0.94 0.04 0.00 -0.03 0.00 0.00 56.01 56.77 1p88 n LEU 195 Cb 0.53 -0.98 0.25 0.00 -2.33 0.00 0.00 43.42 40.88 1p88 n LEU 195 CO 0.28 -3.42 0.60 1.62 -1.33 0.00 0.00 177.39 175.14 1p88 h VAL 196 N 0.70 0.98 0.00 4.08 3.04 -0.04 -3.40 116.25 121.60 1p88 h VAL 196 Ca -0.36 -1.79 -0.16 0.00 -1.01 0.00 0.00 66.70 63.38 1p88 h VAL 196 Cb 1.43 2.08 -0.13 0.00 -2.01 0.00 0.00 31.29 32.65 1p88 h VAL 196 CO 0.51 0.44 -0.22 -0.24 -1.01 0.00 0.00 177.57 177.05 1p88 n SER 197 N -3.50 -1.94 -0.31 3.17 2.88 -1.26 -4.86 113.62 107.80 1p88 n SER 197 Ca 0.00 -2.65 0.13 0.00 -1.33 0.00 0.00 58.87 55.02 1p88 n SER 197 Cb 0.58 1.40 0.27 0.00 -0.75 0.00 0.00 64.21 65.71 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 3.08 0.08 -1.09 -1.46 3.11 -1.97 0.66 116.57 118.97 1p88 h LYS 198 Ca -0.20 -0.00 0.30 0.00 -2.81 0.00 0.00 60.65 57.93 1p88 h LYS 198 Cb 1.14 -0.02 -0.09 0.00 -1.00 0.00 0.00 32.23 32.27 1p88 h LYS 198 CO 0.06 0.05 0.72 -1.35 -2.81 0.00 0.00 179.45 176.13 1p88 h PRO 199 N 0.08 0.27 -0.38 1.90 0.11 -1.98 0.84 132.00 132.84 1p88 h PRO 199 Ca 0.56 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.55 1p88 h PRO 199 Cb 1.13 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1p88 h PRO 199 CO -0.80 0.18 -0.14 1.88 -0.21 0.00 0.00 178.00 178.91 1p88 h TYR 200 N 0.27 0.88 -0.95 0.65 0.05 -0.05 -2.58 116.97 115.23 1p88 h TYR 200 Ca 0.60 -0.20 0.01 0.00 0.05 0.00 0.00 58.73 59.19 1p88 h TYR 200 Cb 1.76 -0.21 -0.05 0.00 1.01 0.00 0.00 36.73 39.25 1p88 h TYR 200 CO -0.00 0.93 0.62 0.82 -1.05 0.00 0.00 178.16 179.48 1p88 h ILE 201 N 0.57 1.25 -0.39 -2.88 1.08 0.77 -0.60 117.51 117.32 1p88 h ILE 201 Ca 0.09 -0.46 0.04 0.00 -0.39 0.00 0.00 64.86 64.14 1p88 h ILE 201 Cb 0.67 -0.15 -0.04 0.00 -3.07 0.00 0.00 36.82 34.24 1p88 h ILE 201 CO 0.05 0.24 0.16 -0.78 -0.69 0.00 0.00 178.15 177.12 1p88 h ASP 202 N 1.29 0.20 0.04 1.72 1.82 -0.51 0.36 116.42 121.33 1p88 h ASP 202 Ca 0.35 0.03 -0.00 0.00 -0.39 0.00 0.00 57.03 57.02 1p88 h ASP 202 Cb -0.14 0.00 0.00 0.00 0.68 0.00 0.00 39.33 39.88 1p88 h ASP 202 CO -0.07 0.15 -0.02 0.40 -1.61 0.00 0.00 179.24 178.09 1p88 h ILE 203 N 0.33 0.98 -0.23 2.25 2.04 -1.04 -1.05 117.51 120.79 1p88 h ILE 203 Ca 0.17 -0.06 0.06 0.00 1.00 0.00 0.00 64.86 66.03 1p88 h ILE 203 Cb 0.13 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 1p88 h ILE 203 CO -0.16 0.02 -0.18 0.74 0.00 0.00 0.00 178.15 178.57 1p88 h THR 204 N -0.08 0.51 -0.09 -0.27 2.02 -0.54 2.27 112.91 116.73 1p88 h THR 204 Ca -0.01 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1p88 h THR 204 Cb 0.07 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 1p88 h THR 204 CO 0.01 0.00 -0.20 -0.07 0.37 0.00 0.00 175.52 175.63 1p88 h LEU 205 N -0.18 0.15 0.03 2.58 3.38 -0.85 1.94 115.31 122.35 1p88 h LEU 205 Ca 0.13 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 1p88 h LEU 205 Cb 0.37 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.10 1p88 h LEU 205 CO -0.33 0.36 -0.59 -1.13 0.09 0.00 0.00 178.44 176.84 1p88 h ASN 206 N 0.14 0.46 0.61 -0.43 -1.24 0.22 0.16 115.58 115.51 1p88 h ASN 206 Ca 0.03 -0.81 -0.12 0.00 0.71 0.00 0.00 56.30 56.11 1p88 h ASN 206 Cb 0.44 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.33 1p88 h ASN 206 CO 0.03 1.22 -0.57 0.25 -1.29 0.00 0.00 177.43 177.07 1p88 h LEU 207 N -0.24 0.00 -0.18 0.34 5.85 0.40 -2.01 115.31 119.47 1p88 h LEU 207 Ca -0.08 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.41 1p88 h LEU 207 Cb 1.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.37 1p88 h LEU 207 CO 0.11 0.57 -0.94 0.24 -0.34 0.00 0.00 178.44 178.08 1p88 h MET 208 N 0.00 0.38 -0.79 1.25 2.86 0.31 -3.17 114.93 115.77 1p88 h MET 208 Ca -0.01 -0.42 -0.02 0.00 -2.06 0.00 0.00 59.70 57.20 1p88 h MET 208 Cb 1.03 0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.77 1p88 h MET 208 CO 0.07 1.09 0.43 0.87 1.06 0.00 0.00 176.91 180.43 1p88 h LYS 209 N 0.21 1.10 -0.15 1.72 1.57 -0.20 -0.70 116.57 120.13 1p88 h LYS 209 Ca -0.08 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 1p88 h LYS 209 Cb 1.58 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 33.66 1p88 h LYS 209 CO 0.16 0.81 0.02 0.00 -0.57 0.00 0.00 179.45 179.87 1p88 h THR 210 N 1.11 1.09 0.00 -0.16 1.03 -1.35 0.67 112.91 115.29 1p88 h THR 210 Ca 0.28 -0.33 0.00 0.00 -0.01 0.00 0.00 66.41 66.35 1p88 h THR 210 Cb 0.04 0.96 0.00 0.00 -1.07 0.00 0.00 68.15 68.07 1p88 h THR 210 CO -0.04 0.11 0.00 0.49 -0.01 0.00 0.00 175.52 176.07 1p88 n PHE 211 N -4.43 0.00 0.00 0.00 3.72 -0.30 -4.21 117.46 112.24 1p88 n PHE 211 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1p88 n PHE 211 Cb 0.15 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.42 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 1.10 1.04 3.31 1.37 0.00 0.23 0.13 105.19 112.36 1p88 n GLY 212 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.01 1.61 -7.23 -1.03 -4.82 120.40 108.78 1p88 s VAL 213 Ca 0.00 -1.52 0.04 0.00 -1.81 0.00 0.00 61.98 58.69 1p88 s VAL 213 Cb 0.00 -1.65 -0.01 0.00 0.56 0.00 0.00 36.38 35.27 1p88 s VAL 213 CO 0.00 0.05 -0.14 -1.61 -0.31 0.00 0.00 175.10 173.09 1p88 s GLU 214 N -1.76 1.14 0.09 4.82 2.02 -1.26 -2.22 118.70 121.52 1p88 s GLU 214 Ca 0.09 -0.51 0.09 0.00 0.02 0.00 0.00 54.97 54.66 1p88 s GLU 214 Cb -0.10 -1.10 -0.03 0.00 0.10 0.00 0.00 34.13 33.00 1p88 s GLU 214 CO 0.04 0.30 -0.23 0.42 0.02 0.00 0.00 175.26 175.81 1p88 s ILE 215 N -0.34 1.93 -0.34 -1.63 -1.09 -1.26 -4.55 121.20 113.92 1p88 s ILE 215 Ca 0.05 -1.53 -0.12 0.00 -2.23 0.00 0.00 60.65 56.83 1p88 s ILE 215 Cb -0.05 -1.71 -0.01 0.00 -1.58 0.00 0.00 42.46 39.10 1p88 s ILE 215 CO -0.00 0.09 0.22 -0.70 -1.23 0.00 0.00 174.94 173.32 1p88 s GLU 216 N -1.73 3.42 0.42 2.79 2.12 0.26 -4.93 118.70 121.04 1p88 s GLU 216 Ca 0.10 -0.69 -0.19 0.00 0.36 0.00 0.00 54.97 54.55 1p88 s GLU 216 Cb -0.10 -3.75 -0.10 0.00 0.26 0.00 0.00 34.13 30.44 1p88 s GLU 216 CO 0.04 -0.46 0.90 1.21 -0.54 0.00 0.00 175.26 176.42 1p88 s ASN 217 N 1.69 6.84 0.00 -1.70 2.47 -1.26 0.11 114.94 123.09 1p88 s ASN 217 Ca 0.06 1.56 0.00 0.00 0.42 0.00 0.00 52.86 54.90 1p88 s ASN 217 Cb -0.17 -2.49 0.00 0.00 -1.45 0.00 0.00 41.25 37.14 1p88 s ASN 217 CO 0.09 -0.36 0.00 1.67 -3.72 0.00 0.00 177.10 174.79 1p88 n GLN 218 N -0.73 2.01 -2.00 0.43 -0.06 0.26 -4.89 117.38 112.40 1p88 n GLN 218 Ca 0.06 0.00 -0.42 0.00 -2.00 0.00 0.00 57.00 54.64 1p88 n GLN 218 Cb 0.54 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.72 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 3.20 -2.61 3.69 8.25 -1.26 -4.41 115.22 122.08 1p88 n HIS 219 Ca 0.00 -2.89 -0.17 0.00 -0.26 0.00 0.00 57.72 54.40 1p88 n HIS 219 Cb 0.00 -2.26 -0.00 0.00 1.12 0.00 0.00 29.99 28.85 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 4.89 -1.43 0.00 4.41 9.36 -1.26 -4.73 117.16 128.40 1p88 n TYR 220 Ca 0.47 0.12 0.00 0.00 3.32 0.00 0.00 57.90 61.81 1p88 n TYR 220 Cb 0.37 -3.25 0.00 0.00 -0.63 0.00 0.00 39.34 35.83 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 -3.11 0.00 0.00 2.98 10.64 -1.26 -3.18 117.38 123.45 1p88 n GLN 221 Ca -0.15 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.02 1p88 n GLN 221 Cb 0.62 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.00 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 -4.75 2.61 7.27 -1.17 -3.58 117.38 117.75 1p88 n GLN 222 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.78 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 2.03 -0.28 3.69 0.40 0.48 0.92 117.98 125.22 1p88 s PHE 223 Ca 0.00 -0.86 -0.05 0.00 -0.60 0.00 0.00 56.93 55.42 1p88 s PHE 223 Cb 0.00 -1.42 0.02 0.00 0.51 0.00 0.00 43.02 42.13 1p88 s PHE 223 CO 0.00 -0.40 0.03 0.08 0.70 0.00 0.00 175.22 175.63 1p88 s VAL 224 N 0.67 3.51 -0.15 -0.44 1.01 0.30 -0.31 120.40 124.98 1p88 s VAL 224 Ca -0.13 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 60.95 1p88 s VAL 224 Cb -0.16 -2.84 0.02 0.00 0.00 0.00 0.00 36.38 33.40 1p88 s VAL 224 CO 0.03 0.08 -0.14 0.54 0.00 0.00 0.00 175.10 175.61 1p88 s VAL 225 N 1.41 1.59 0.35 2.92 0.11 0.22 0.91 120.40 127.92 1p88 s VAL 225 Ca 0.01 -0.65 -0.26 0.00 -2.93 0.00 0.00 61.98 58.15 1p88 s VAL 225 Cb -0.17 -1.49 -0.09 0.00 -1.53 0.00 0.00 36.38 33.09 1p88 s VAL 225 CO -0.00 0.46 1.09 -1.59 -3.33 0.00 0.00 175.10 171.72 1p88 s LYS 226 N 1.48 4.33 0.23 1.54 -2.85 -1.26 0.34 119.74 123.55 1p88 s LYS 226 Ca 0.05 1.67 0.00 0.00 -1.00 0.00 0.00 55.97 56.69 1p88 s LYS 226 Cb -0.13 -2.81 0.05 0.00 -2.06 0.00 0.00 37.83 32.88 1p88 s LYS 226 CO -0.11 -0.03 0.32 0.41 0.10 0.00 0.00 175.35 176.04 1p88 n GLY 227 N 0.72 0.81 2.51 0.59 0.00 -1.25 -3.87 105.19 104.69 1p88 n GLY 227 Ca 0.03 -1.99 -0.18 0.00 0.00 0.00 0.00 46.02 43.87 1p88 n GLY 227 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 228 N 2.52 1.54 1.16 -0.02 0.00 0.64 -4.84 105.19 106.19 1p88 n GLY 228 Ca 0.05 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.50 -0.35 -3.58 1.61 6.02 0.59 -4.96 117.38 114.21 1p88 n GLN 229 Ca -0.19 -0.63 -0.16 0.00 -0.01 0.00 0.00 57.00 56.01 1p88 n GLN 229 Cb 0.60 -0.40 -0.07 0.00 1.02 0.00 0.00 30.24 31.40 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 -2.45 -0.60 -0.14 1.08 0.15 -1.26 -4.55 113.70 105.94 1p88 s SER 230 Ca 0.22 0.75 -0.09 0.00 0.70 0.00 0.00 55.95 57.54 1p88 s SER 230 Cb -0.01 0.67 -0.05 0.00 -1.71 0.00 0.00 66.02 64.93 1p88 s SER 230 CO 0.16 -0.51 0.18 -0.31 1.20 0.00 0.00 173.24 173.95 1p88 s TYR 231 N -0.90 3.54 0.09 3.44 2.02 -1.26 -4.55 117.35 119.74 1p88 s TYR 231 Ca -0.09 0.52 0.09 0.00 -0.37 0.00 0.00 57.07 57.21 1p88 s TYR 231 Cb -0.02 -2.08 -0.03 0.00 -0.40 0.00 0.00 41.96 39.43 1p88 s TYR 231 CO 0.07 0.55 -0.23 -0.65 -1.57 0.00 0.00 175.55 173.72 1p88 s GLN 232 N -0.47 1.34 -0.36 -0.62 1.11 0.34 0.36 119.66 121.36 1p88 s GLN 232 Ca 0.14 -1.15 -0.29 0.00 0.01 0.00 0.00 55.36 54.07 1p88 s GLN 232 Cb -0.12 -1.62 -0.00 0.00 -1.01 0.00 0.00 33.01 30.26 1p88 s GLN 232 CO 0.03 0.39 1.54 -1.54 0.01 0.00 0.00 175.29 175.72 1p88 s SER 233 N -1.68 6.24 0.00 5.90 1.04 -0.52 -4.41 113.70 120.27 1p88 s SER 233 Ca 0.09 1.08 0.14 0.00 0.48 0.00 0.00 55.95 57.74 1p88 s SER 233 Cb -0.10 -2.54 0.85 0.00 0.10 0.00 0.00 66.02 64.33 1p88 s SER 233 CO 0.04 -1.46 1.27 -0.81 0.98 0.00 0.00 173.24 173.25 1p88 n PRO 234 N 8.07 0.50 0.00 4.02 -0.04 -1.26 -4.89 135.00 141.40 1p88 n PRO 234 Ca 0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1p88 n PRO 234 Cb 0.47 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 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 -0.00 0.90 3.28 0.55 0.00 -1.26 -4.89 105.19 103.77 1p88 n GLY 235 Ca 0.11 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.05 1p88 n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p88 s THR 236 N 0.00 2.05 -0.06 2.61 2.01 -1.26 0.13 115.64 121.12 1p88 s THR 236 Ca 0.00 -1.08 0.01 0.00 0.31 0.00 0.00 61.69 60.93 1p88 s THR 236 Cb 0.00 -1.72 0.02 0.00 0.01 0.00 0.00 72.50 70.81 1p88 s THR 236 CO 0.00 0.57 -0.06 -0.47 -0.69 0.00 0.00 174.62 173.97 1p88 s TYR 237 N -0.31 0.94 -0.40 4.92 6.14 0.59 -4.87 117.35 124.36 1p88 s TYR 237 Ca 0.01 -0.31 -0.19 0.00 0.64 0.00 0.00 57.07 57.21 1p88 s TYR 237 Cb -0.13 -0.80 0.01 0.00 0.42 0.00 0.00 41.96 41.47 1p88 s TYR 237 CO 0.02 -0.25 0.58 -1.17 0.64 0.00 0.00 175.55 175.37 1p88 s LEU 238 N 1.02 4.49 -0.42 6.97 1.98 -1.26 0.95 118.68 132.40 1p88 s LEU 238 Ca -0.09 -0.25 -0.25 0.00 -2.89 0.00 0.00 54.13 50.65 1p88 s LEU 238 Cb -0.14 -2.64 0.02 0.00 0.66 0.00 0.00 46.19 44.09 1p88 s LEU 238 CO -0.00 -0.65 0.88 -0.69 -1.89 0.00 0.00 176.35 174.00 1p88 s VAL 239 N 2.59 4.57 -2.00 1.68 1.01 0.15 -4.89 120.40 123.51 1p88 s VAL 239 Ca 0.20 0.81 0.32 0.00 0.00 0.00 0.00 61.98 63.30 1p88 s VAL 239 Cb -0.15 -4.36 0.90 0.00 0.00 0.00 0.00 36.38 32.78 1p88 s VAL 239 CO 0.16 -0.68 2.22 -0.62 0.00 0.00 0.00 175.10 176.17