#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 0.09 -3.46 4.13 -1.26 -3.10 115.26 111.66 1p88 n ASN 26 Ca 0.00 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.22 1p88 n ASN 26 Cb 0.00 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.22 1p88 n ASN 26 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 1p88 h ARG 27 N 0.00 -0.28 -0.86 3.52 3.08 -1.97 -2.56 114.38 115.31 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 0.06 -0.16 0.00 0.08 0.00 0.00 29.97 29.95 1p88 h ARG 27 CO 0.00 -0.19 0.00 0.00 -1.07 0.00 0.00 179.97 178.71 1p88 n ALA 28 N -2.51 0.42 0.08 0.04 0.00 -1.18 0.15 120.51 117.52 1p88 n ALA 28 Ca -0.04 0.93 -0.09 0.00 0.00 0.00 0.00 53.44 54.24 1p88 n ALA 28 Cb 0.11 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 18.90 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 0.29 -0.01 0.00 3.38 -1.80 -0.75 115.31 116.42 1p88 h LEU 29 Ca 0.51 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1p88 h LEU 29 Cb 1.04 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 1p88 h LEU 29 CO -0.82 1.01 -0.01 0.25 0.09 0.00 0.00 178.44 178.97 1p88 h LEU 30 N 0.13 0.03 -1.30 1.67 5.85 0.18 -1.80 115.31 120.08 1p88 h LEU 30 Ca -0.04 -0.43 -0.06 0.00 0.84 0.00 0.00 57.88 58.18 1p88 h LEU 30 Cb 1.46 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.47 1p88 h LEU 30 CO 0.13 0.45 -0.30 -0.07 -0.34 0.00 0.00 178.44 178.31 1p88 h LEU 31 N -0.39 0.00 -0.88 2.25 3.38 0.16 -0.35 115.31 119.48 1p88 h LEU 31 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 1p88 h LEU 31 Cb 0.44 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1p88 h LEU 31 CO 0.00 0.30 0.01 0.00 0.09 0.00 0.00 178.44 178.84 1p88 h ALA 32 N 1.70 1.07 0.22 1.53 0.00 -0.93 -1.76 119.26 121.09 1p88 h ALA 32 Ca -0.00 -0.27 -0.31 0.00 0.00 0.00 0.00 54.91 54.33 1p88 h ALA 32 Cb 0.67 -0.20 0.03 0.00 0.00 0.00 0.00 17.79 18.29 1p88 h ALA 32 CO 0.04 0.59 -1.37 0.00 0.00 0.00 0.00 179.25 178.51 1p88 h ALA 33 N 1.22 -0.11 0.00 0.00 0.00 -0.77 -3.17 119.26 116.43 1p88 h ALA 33 Ca 0.15 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1p88 h ALA 33 Cb 0.46 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1p88 h ALA 33 CO 0.02 0.66 0.00 1.28 0.00 0.00 0.00 179.25 181.21 1p88 n LEU 34 N -3.80 0.00 -4.93 0.00 4.77 -0.19 0.79 117.00 113.64 1p88 n LEU 34 Ca -0.17 0.19 -0.27 0.00 -0.03 0.00 0.00 56.01 55.72 1p88 n LEU 34 Cb 1.04 -0.19 0.10 0.00 -2.33 0.00 0.00 43.42 42.03 1p88 n LEU 34 CO 0.57 -0.12 0.70 0.00 -1.33 0.00 0.00 177.39 177.21 1p88 s ALA 35 N -2.38 2.91 -0.36 -1.18 0.00 -0.67 -1.52 121.76 118.56 1p88 s ALA 35 Ca 0.13 -0.96 0.06 0.00 0.00 0.00 0.00 51.96 51.19 1p88 s ALA 35 Cb 0.08 -2.68 0.49 0.00 0.00 0.00 0.00 23.12 21.01 1p88 s ALA 35 CO 0.16 -1.61 1.50 1.58 0.00 0.00 0.00 175.76 177.40 1p88 n HIS 36 N -3.16 2.00 -3.82 0.00 -0.00 0.62 0.21 115.22 111.07 1p88 n HIS 36 Ca 0.10 -2.06 -0.03 0.00 0.46 0.00 0.00 57.72 56.20 1p88 n HIS 36 Cb 0.60 -0.64 0.01 0.00 -0.12 0.00 0.00 29.99 29.84 1p88 n HIS 36 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1p88 s GLY 37 N -2.69 -0.05 -0.30 1.57 0.00 -1.26 -4.77 107.32 99.82 1p88 s GLY 37 Ca 0.50 -0.09 -0.16 0.00 0.00 0.00 0.00 44.72 44.98 1p88 s GLY 37 CO 0.01 1.62 0.41 1.25 0.00 0.00 0.00 173.10 176.39 1p88 s LYS 38 N -2.52 3.83 0.09 2.90 2.20 -1.25 0.20 119.74 125.19 1p88 s LYS 38 Ca 0.19 -0.09 0.09 0.00 -0.36 0.00 0.00 55.97 55.79 1p88 s LYS 38 Cb -0.01 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.55 1p88 s LYS 38 CO 0.03 -0.42 -0.23 0.99 -0.36 0.00 0.00 175.35 175.37 1p88 s THR 39 N 2.14 1.89 -0.07 3.43 2.01 -1.04 -4.45 115.64 119.54 1p88 s THR 39 Ca 0.15 -1.51 -0.03 0.00 0.31 0.00 0.00 61.69 60.62 1p88 s THR 39 Cb -0.16 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 1p88 s THR 39 CO 0.11 0.08 0.05 -0.69 -0.69 0.00 0.00 174.62 173.48 1p88 s VAL 40 N -1.02 4.68 -0.24 3.82 1.01 0.44 -0.52 120.40 128.56 1p88 s VAL 40 Ca 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1p88 s VAL 40 Cb -0.10 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.27 1p88 s VAL 40 CO 0.04 0.54 -0.06 -0.76 0.00 0.00 0.00 175.10 174.86 1p88 s LEU 41 N -1.14 3.13 0.10 3.92 2.01 0.30 0.22 118.68 127.21 1p88 s LEU 41 Ca 0.16 -0.77 0.02 0.00 0.01 0.00 0.00 54.13 53.55 1p88 s LEU 41 Cb -0.12 -1.68 -0.04 0.00 0.01 0.00 0.00 46.19 44.37 1p88 s LEU 41 CO 0.06 -0.11 0.16 0.28 1.01 0.00 0.00 176.35 177.75 1p88 s THR 42 N 1.36 4.91 -1.18 5.49 -1.32 0.35 -0.67 115.64 124.58 1p88 s THR 42 Ca 0.01 -0.70 0.00 0.00 -1.21 0.00 0.00 61.69 59.80 1p88 s THR 42 Cb -0.16 -3.43 0.00 0.00 -1.51 0.00 0.00 72.50 67.40 1p88 s THR 42 CO -0.04 0.05 0.00 -3.20 -2.21 0.00 0.00 174.62 169.22 1p88 n ASN 43 N 0.10 -4.18 -3.22 8.08 2.85 -0.54 0.35 115.26 118.69 1p88 n ASN 43 Ca -0.07 0.13 -0.12 0.00 -0.11 0.00 0.00 54.58 54.41 1p88 n ASN 43 Cb 0.52 -3.12 0.11 0.00 1.24 0.00 0.00 39.78 38.53 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 -1.63 0.00 -4.41 1.20 4.77 0.47 -4.73 117.00 112.68 1p88 n LEU 44 Ca -0.14 -0.33 -0.33 0.00 -0.03 0.00 0.00 56.01 55.18 1p88 n LEU 44 Cb 0.52 -0.47 -0.14 0.00 -2.33 0.00 0.00 43.42 41.01 1p88 n LEU 44 CO 0.18 -2.04 -0.43 -0.22 -1.33 0.00 0.00 177.39 173.55 1p88 s LEU 45 N 0.00 2.84 -1.04 2.23 2.96 -1.26 -4.76 118.68 119.64 1p88 s LEU 45 Ca 0.26 -0.27 -0.19 0.00 -0.22 0.00 0.00 54.13 53.70 1p88 s LEU 45 Cb -0.05 -1.64 0.10 0.00 0.50 0.00 0.00 46.19 45.11 1p88 s LEU 45 CO 0.21 0.18 1.34 1.51 -1.32 0.00 0.00 176.35 178.28 1p88 s ASP 46 N 0.25 6.68 -0.22 3.68 -4.77 -1.26 -4.45 116.67 116.57 1p88 s ASP 46 Ca -0.08 -2.04 -0.27 0.00 -3.30 0.00 0.00 52.55 46.86 1p88 s ASP 46 Cb -0.15 -2.47 0.10 0.00 -1.09 0.00 0.00 42.92 39.30 1p88 s ASP 46 CO 0.05 -1.17 0.86 -0.44 0.70 0.00 0.00 175.17 175.17 1p88 s SER 47 N 4.01 -0.58 0.42 2.11 0.01 -1.26 -5.01 113.70 113.40 1p88 s SER 47 Ca 0.41 0.99 0.36 0.00 1.31 0.00 0.00 55.95 59.02 1p88 s SER 47 Cb -0.02 0.96 1.36 0.00 0.21 0.00 0.00 66.02 68.52 1p88 s SER 47 CO -0.06 -0.28 1.28 0.47 0.41 0.00 0.00 173.24 175.05 1p88 n ASP 48 N 1.98 0.06 -0.28 2.44 8.00 -1.26 0.20 116.55 127.69 1p88 n ASP 48 Ca -0.14 0.93 -0.01 0.00 0.71 0.00 0.00 54.79 56.28 1p88 n ASP 48 Cb 0.56 -0.46 0.11 0.00 -0.02 0.00 0.00 41.12 41.31 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 0.09 -2.24 2.03 -1.93 0.30 116.42 115.43 1p88 h ASP 49 Ca 0.76 0.01 -0.18 0.00 -0.73 0.00 0.00 57.03 56.88 1p88 h ASP 49 Cb 2.84 -0.15 0.01 0.00 -0.83 0.00 0.00 39.33 41.20 1p88 h ASP 49 CO -0.14 0.50 -0.89 0.58 -1.03 0.00 0.00 179.24 178.27 1p88 h VAL 50 N 0.90 1.36 -1.00 4.15 2.07 0.20 -1.93 116.25 122.00 1p88 h VAL 50 Ca 0.33 -2.43 0.24 0.00 0.82 0.00 0.00 66.70 65.66 1p88 h VAL 50 Cb 0.10 3.00 -0.12 0.00 -1.52 0.00 0.00 31.29 32.75 1p88 h VAL 50 CO -0.15 0.66 0.59 -0.09 0.02 0.00 0.00 177.57 178.60 1p88 h ARG 51 N -0.52 0.57 0.06 1.57 2.43 -1.05 0.63 114.38 118.06 1p88 h ARG 51 Ca -0.18 -0.03 -0.23 0.00 -0.81 0.00 0.00 59.98 58.72 1p88 h ARG 51 Cb 1.53 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.94 1p88 h ARG 51 CO 0.06 0.38 -1.06 0.45 -1.51 0.00 0.00 179.97 178.29 1p88 h HIS 52 N 0.59 0.33 -0.67 2.20 3.86 -0.48 1.09 115.15 122.06 1p88 h HIS 52 Ca 0.64 -0.22 0.15 0.00 -1.16 0.00 0.00 60.37 59.79 1p88 h HIS 52 Cb 1.20 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 29.61 1p88 h HIS 52 CO -0.01 1.12 0.46 1.98 0.86 0.00 0.00 177.93 182.34 1p88 h MET 53 N 0.08 0.23 0.16 2.45 1.85 0.95 4.12 114.93 124.75 1p88 h MET 53 Ca -0.08 -0.01 -0.29 0.00 -0.61 0.00 0.00 59.70 58.71 1p88 h MET 53 Cb 1.77 -0.05 0.01 0.00 0.43 0.00 0.00 31.60 33.75 1p88 h MET 53 CO 0.16 0.15 -1.40 -0.07 -0.40 0.00 0.00 176.91 175.35 1p88 h LEU 54 N 0.24 0.51 -0.73 3.39 3.38 -0.33 -3.15 115.31 118.62 1p88 h LEU 54 Ca 0.32 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.40 1p88 h LEU 54 Cb 0.94 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 1p88 h LEU 54 CO -0.07 1.63 0.47 -1.13 0.09 0.00 0.00 178.44 179.44 1p88 h ASN 55 N -0.16 0.85 -0.36 -0.43 -1.24 0.55 1.28 115.58 116.07 1p88 h ASN 55 Ca -0.28 -0.03 0.03 0.00 0.71 0.00 0.00 56.30 56.73 1p88 h ASN 55 Cb 1.88 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 40.68 1p88 h ASN 55 CO 0.13 0.63 0.16 0.00 -1.29 0.00 0.00 177.43 177.06 1p88 h ALA 56 N 1.26 0.44 -0.72 1.57 0.00 0.76 1.37 119.26 123.93 1p88 h ALA 56 Ca 0.27 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 1p88 h ALA 56 Cb -0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1p88 h ALA 56 CO -0.06 -0.22 0.20 -0.07 0.00 0.00 0.00 179.25 179.11 1p88 h LEU 57 N 0.34 1.07 -1.35 0.00 4.07 -1.36 -1.84 115.31 116.23 1p88 h LEU 57 Ca 0.16 -0.21 -0.02 0.00 0.08 0.00 0.00 57.88 57.89 1p88 h LEU 57 Cb 0.10 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.53 1p88 h LEU 57 CO -0.13 1.00 0.24 0.74 -1.08 0.00 0.00 178.44 179.22 1p88 h THR 58 N 1.08 1.17 0.00 0.22 2.02 0.38 1.12 112.91 118.91 1p88 h THR 58 Ca 0.23 -0.45 -0.25 0.00 0.77 0.00 0.00 66.41 66.71 1p88 h THR 58 Cb 0.34 0.52 0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1p88 h THR 58 CO -0.00 0.19 -1.00 0.00 0.37 0.00 0.00 175.52 175.07 1p88 h ALA 59 N 1.58 0.23 0.00 6.16 0.00 0.23 -3.18 119.26 124.28 1p88 h ALA 59 Ca 0.17 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1p88 h ALA 59 Cb 0.06 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1p88 h ALA 59 CO -0.02 0.75 -0.04 1.28 0.00 0.00 0.00 179.25 181.21 1p88 n LEU 60 N -3.80 0.68 -0.01 0.00 4.77 -0.75 -4.71 117.00 113.18 1p88 n LEU 60 Ca -0.09 0.54 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1p88 n LEU 60 Cb 0.87 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1p88 n LEU 60 CO 0.54 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1p88 n GLY 61 N 1.34 1.46 3.64 -0.72 0.00 -0.30 -4.48 105.19 106.13 1p88 n GLY 61 Ca 0.06 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.03 5.04 0.04 1.61 1.01 0.37 -4.99 120.40 121.46 1p88 s VAL 62 Ca 0.00 1.06 -0.24 0.00 0.00 0.00 0.00 61.98 62.80 1p88 s VAL 62 Cb 0.00 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.43 1p88 s VAL 62 CO 0.00 0.09 0.73 -0.55 0.00 0.00 0.00 175.10 175.37 1p88 s SER 63 N 1.35 7.17 0.28 3.32 0.15 -1.26 -4.23 113.70 120.49 1p88 s SER 63 Ca 0.25 1.39 -0.21 0.00 0.70 0.00 0.00 55.95 58.09 1p88 s SER 63 Cb -0.16 -2.45 0.04 0.00 -1.71 0.00 0.00 66.02 61.74 1p88 s SER 63 CO 0.09 0.05 0.78 -0.72 1.20 0.00 0.00 173.24 174.65 1p88 s TYR 64 N -0.17 -0.11 0.03 3.44 1.13 -1.26 0.20 117.35 120.61 1p88 s TYR 64 Ca 0.37 -0.37 0.02 0.00 -1.41 0.00 0.00 57.07 55.68 1p88 s TYR 64 Cb -0.20 0.73 -0.02 0.00 -1.10 0.00 0.00 41.96 41.37 1p88 s TYR 64 CO 0.22 -1.23 -0.07 0.99 -2.51 0.00 0.00 175.55 172.94 1p88 s THR 65 N -3.44 0.53 -0.06 -3.49 2.01 0.59 -4.94 115.64 106.85 1p88 s THR 65 Ca 0.12 -0.79 0.05 0.00 0.31 0.00 0.00 61.69 61.39 1p88 s THR 65 Cb -0.05 -0.54 -0.02 0.00 0.01 0.00 0.00 72.50 71.90 1p88 s THR 65 CO 0.07 -0.19 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.38 1p88 s LEU 66 N -1.07 2.31 0.00 4.42 2.96 -1.26 0.31 118.68 126.36 1p88 s LEU 66 Ca -0.05 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.45 1p88 s LEU 66 Cb -0.07 -1.44 0.00 0.00 0.50 0.00 0.00 46.19 45.17 1p88 s LEU 66 CO 0.00 0.27 0.00 -0.24 -1.32 0.00 0.00 176.35 175.06 1p88 n SER 67 N 2.78 -0.54 -0.05 3.68 2.88 0.26 -4.93 113.62 117.70 1p88 n SER 67 Ca -0.17 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.29 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 1.57 2.00 -1.46 0.00 -1.26 -4.03 120.51 114.33 1p88 n ALA 68 Ca 0.00 -1.01 0.13 0.00 0.00 0.00 0.00 53.44 52.56 1p88 n ALA 68 Cb 0.00 -0.55 0.77 0.00 0.00 0.00 0.00 19.45 19.67 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 -2.87 0.00 -2.89 0.00 2.03 -1.26 -4.88 116.55 106.68 1p88 n ASP 69 Ca -0.23 -1.19 -0.21 0.00 0.52 0.00 0.00 54.79 53.68 1p88 n ASP 69 Cb 1.07 -0.00 0.01 0.00 -0.72 0.00 0.00 41.12 41.48 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 -0.90 -3.60 0.00 -0.67 1.74 -1.26 -4.81 116.66 107.17 1p88 n ARG 70 Ca 0.19 0.79 0.00 0.00 -0.77 0.00 0.00 57.85 58.07 1p88 n ARG 70 Cb 0.09 -5.55 0.00 0.00 -1.02 0.00 0.00 32.46 25.98 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 -4.13 0.00 -4.20 0.55 -2.24 -1.26 -4.23 114.28 98.76 1p88 n THR 71 Ca -0.12 -0.23 -0.33 0.00 -2.27 0.00 0.00 64.05 61.10 1p88 n THR 71 Cb 0.62 1.04 -0.15 0.00 -2.10 0.00 0.00 70.33 69.73 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 -0.42 3.12 -0.06 -0.78 0.52 -1.25 0.18 118.95 120.26 1p88 s ARG 72 Ca 0.00 -0.77 0.01 0.00 -0.52 0.00 0.00 55.73 54.45 1p88 s ARG 72 Cb 0.00 -2.66 0.02 0.00 0.52 0.00 0.00 34.95 32.83 1p88 s ARG 72 CO 0.00 -0.15 -0.07 0.00 0.02 0.00 0.00 175.30 175.10 1p88 s GLU 74 N 0.88 3.47 -0.12 0.00 2.12 0.15 0.11 118.70 125.30 1p88 s GLU 74 Ca -0.11 -0.62 0.01 0.00 0.36 0.00 0.00 54.97 54.60 1p88 s GLU 74 Cb -0.15 -2.73 0.02 0.00 0.26 0.00 0.00 34.13 31.53 1p88 s GLU 74 CO 0.01 0.24 -0.13 0.42 -0.54 0.00 0.00 175.26 175.26 1p88 s ILE 75 N 0.31 1.37 -0.49 -3.70 1.01 0.32 0.22 121.20 120.25 1p88 s ILE 75 Ca -0.08 -0.53 -0.27 0.00 0.00 0.00 0.00 60.65 59.77 1p88 s ILE 75 Cb -0.15 -1.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.99 1p88 s ILE 75 CO 0.05 0.42 1.92 0.27 0.00 0.00 0.00 174.94 177.60 1p88 s ILE 76 N 1.35 3.34 0.59 2.92 -0.00 0.52 -2.51 121.20 127.43 1p88 s ILE 76 Ca 0.00 0.27 -0.18 0.00 -0.00 0.00 0.00 60.65 60.75 1p88 s ILE 76 Cb -0.13 -3.69 -0.12 0.00 -0.00 0.00 0.00 42.46 38.51 1p88 s ILE 76 CO -0.07 -0.59 0.04 0.61 -0.00 0.00 0.00 174.94 174.93 1p88 n GLY 77 N 5.64 -2.76 0.03 6.27 0.00 0.55 -4.02 105.19 110.90 1p88 n GLY 77 Ca 0.24 -0.26 0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 1.80 0.40 0.00 1.61 5.15 0.41 -4.38 115.26 120.26 1p88 n ASN 78 Ca 0.08 -0.16 0.00 0.00 -0.60 0.00 0.00 54.58 53.90 1p88 n ASN 78 Cb 0.48 1.37 0.00 0.00 -0.53 0.00 0.00 39.78 41.10 1p88 n ASN 78 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1p88 n GLY 79 N 1.31 0.48 0.00 8.20 0.00 0.55 -4.91 105.19 110.82 1p88 n GLY 79 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.99 -0.17 3.66 -0.02 0.00 -0.58 -4.78 105.19 101.31 1p88 n GLY 80 Ca 0.00 -1.01 -0.52 0.00 0.00 0.00 0.00 46.02 44.48 1p88 n GLY 80 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1p88 n PRO 81 N 0.00 1.44 -2.29 1.61 -0.02 -1.26 -4.18 135.00 130.29 1p88 n PRO 81 Ca 0.00 0.52 -0.42 0.00 -2.02 0.00 0.00 63.50 61.59 1p88 n PRO 81 Cb 0.00 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.23 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 2.09 3.45 0.07 2.45 2.01 -1.26 -4.85 118.68 122.63 1p88 s LEU 82 Ca 0.90 0.55 -0.28 0.00 0.01 0.00 0.00 54.13 55.30 1p88 s LEU 82 Cb -0.92 -3.17 -0.05 0.00 0.01 0.00 0.00 46.19 42.06 1p88 s LEU 82 CO 0.53 -1.72 0.90 -1.38 1.01 0.00 0.00 176.35 175.68 1p88 s HIS 83 N 6.36 3.76 -0.17 0.29 -3.43 -1.26 -4.91 115.29 115.92 1p88 s HIS 83 Ca 0.60 1.67 -0.13 0.00 -0.80 0.00 0.00 55.06 56.39 1p88 s HIS 83 Cb -0.13 -2.98 -0.05 0.00 -1.43 0.00 0.00 32.58 27.99 1p88 s HIS 83 CO 0.27 0.19 0.26 0.00 -2.00 0.00 0.00 174.74 173.46 1p88 s ALA 84 N 0.15 3.61 -0.03 -1.38 0.00 -1.26 -4.63 121.76 118.22 1p88 s ALA 84 Ca 0.45 -0.52 -0.30 0.00 0.00 0.00 0.00 51.96 51.59 1p88 s ALA 84 Cb -0.22 -2.35 -0.05 0.00 0.00 0.00 0.00 23.12 20.50 1p88 s ALA 84 CO 0.27 0.09 1.39 -1.21 0.00 0.00 0.00 175.76 176.30 1p88 s GLU 85 N 0.49 4.27 0.53 0.00 8.01 -1.26 -4.66 118.70 126.07 1p88 s GLU 85 Ca 0.14 1.93 0.00 0.00 0.01 0.00 0.00 54.97 57.05 1p88 s GLU 85 Cb -0.13 -3.64 0.00 0.00 -4.31 0.00 0.00 34.13 26.05 1p88 s GLU 85 CO 0.03 -0.61 0.00 0.41 0.01 0.00 0.00 175.26 175.10 1p88 n GLY 86 N 3.67 -1.75 3.78 -1.39 0.00 -1.26 -4.69 105.19 103.56 1p88 n GLY 86 Ca 0.13 -1.11 -0.37 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 -2.19 3.21 0.28 4.61 0.00 -1.26 -4.56 121.76 121.86 1p88 s ALA 87 Ca 0.00 0.52 0.10 0.00 0.00 0.00 0.00 51.96 52.58 1p88 s ALA 87 Cb 0.00 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 1p88 s ALA 87 CO 0.00 0.18 -0.03 -1.17 0.00 0.00 0.00 175.76 174.74 1p88 s LEU 88 N -2.08 3.06 -0.23 0.00 2.96 0.41 -4.96 118.68 117.84 1p88 s LEU 88 Ca 0.50 -0.77 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1p88 s LEU 88 Cb -0.18 -1.55 0.08 0.00 0.50 0.00 0.00 46.19 45.03 1p88 s LEU 88 CO 0.23 -0.05 0.10 -1.61 -1.32 0.00 0.00 176.35 173.71 1p88 s GLU 89 N -3.66 0.18 -0.29 1.98 8.01 -1.26 0.20 118.70 123.86 1p88 s GLU 89 Ca 0.32 -0.34 -0.09 0.00 0.01 0.00 0.00 54.97 54.88 1p88 s GLU 89 Cb -0.05 -1.57 -0.01 0.00 -4.31 0.00 0.00 34.13 28.19 1p88 s GLU 89 CO 0.19 -0.83 0.12 -0.51 0.01 0.00 0.00 175.26 174.24 1p88 s LEU 90 N 2.08 3.89 -0.67 1.80 1.02 0.48 -4.89 118.68 122.40 1p88 s LEU 90 Ca 0.05 -0.44 -0.17 0.00 0.02 0.00 0.00 54.13 53.59 1p88 s LEU 90 Cb -0.16 -1.97 0.14 0.00 0.02 0.00 0.00 46.19 44.22 1p88 s LEU 90 CO -0.22 -0.14 0.71 -0.36 0.02 0.00 0.00 176.35 176.36 1p88 s PHE 91 N 1.61 3.24 -0.90 0.29 0.40 -1.26 0.16 117.98 121.51 1p88 s PHE 91 Ca 0.05 -1.31 -0.00 0.00 -0.60 0.00 0.00 56.93 55.07 1p88 s PHE 91 Cb -0.16 -3.95 0.33 0.00 0.51 0.00 0.00 43.02 39.75 1p88 s PHE 91 CO 0.05 -1.19 1.71 1.28 0.70 0.00 0.00 175.22 177.77 1p88 n LEU 92 N 5.58 6.86 0.02 -0.37 7.99 0.43 -4.78 117.00 132.72 1p88 n LEU 92 Ca -0.02 -5.32 -0.03 0.00 -0.01 0.00 0.00 56.01 50.63 1p88 n LEU 92 Cb 0.44 -1.03 -0.02 0.00 -0.11 0.00 0.00 43.42 42.70 1p88 n LEU 92 CO 0.51 2.05 0.50 1.23 -1.51 0.00 0.00 177.39 180.17 1p88 h GLY 93 N 3.72 -1.29 0.89 -0.72 0.00 -1.85 -1.74 103.07 102.08 1p88 h GLY 93 Ca 0.47 0.59 0.00 0.00 0.00 0.00 0.00 47.33 48.39 1p88 h GLY 93 CO 1.16 -0.46 0.00 0.70 0.00 0.00 0.00 176.54 177.95 1p88 n ASN 94 N -3.07 0.00 -3.21 0.19 3.02 -1.26 -3.90 115.26 107.02 1p88 n ASN 94 Ca -0.02 -0.91 -0.40 0.00 -0.03 0.00 0.00 54.58 53.22 1p88 n ASN 94 Cb 0.08 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.28 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 -0.95 6.35 0.21 5.41 0.00 -0.65 -4.35 120.51 126.54 1p88 n ALA 95 Ca 0.18 -4.31 0.17 0.00 0.00 0.00 0.00 53.44 49.48 1p88 n ALA 95 Cb 0.08 -2.08 0.84 0.00 0.00 0.00 0.00 19.45 18.29 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 3.51 0.00 1.10 0.00 0.00 -1.69 0.32 103.07 106.31 1p88 h GLY 96 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.89 1p88 h GLY 96 CO 1.33 0.00 -0.65 -1.30 0.00 0.00 0.00 176.54 175.92 1p88 n THR 97 N -3.77 0.30 -0.08 4.70 -2.24 -1.26 -4.07 114.28 107.86 1p88 n THR 97 Ca 0.01 -0.24 -0.12 0.00 -2.27 0.00 0.00 64.05 61.43 1p88 n THR 97 Cb 0.31 -0.06 -0.15 0.00 -2.10 0.00 0.00 70.33 68.34 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 -1.79 1.44 -0.22 6.98 0.00 0.95 -4.12 120.51 123.75 1p88 n ALA 98 Ca 0.03 -1.10 -0.07 0.00 0.00 0.00 0.00 53.44 52.31 1p88 n ALA 98 Cb 0.43 -0.37 0.03 0.00 0.00 0.00 0.00 19.45 19.54 1p88 n ALA 98 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1p88 h MET 99 N 0.01 0.85 0.66 0.00 -1.53 -1.16 0.33 114.93 114.09 1p88 h MET 99 Ca -0.48 -0.10 -0.03 0.00 -3.44 0.00 0.00 59.70 55.65 1p88 h MET 99 Cb 2.12 -0.16 -0.01 0.00 -0.55 0.00 0.00 31.60 32.99 1p88 h MET 99 CO 0.03 0.66 -0.48 0.00 0.14 0.00 0.00 176.91 177.25 1p88 h ARG 100 N 0.83 -1.05 -0.55 0.39 -0.00 -1.76 0.80 114.38 113.03 1p88 h ARG 100 Ca 0.21 0.07 0.04 0.00 -0.50 0.00 0.00 59.98 59.81 1p88 h ARG 100 Cb 0.06 0.24 -0.03 0.00 0.00 0.00 0.00 29.97 30.23 1p88 h ARG 100 CO -0.03 -0.70 0.37 -1.00 0.00 0.00 0.00 179.97 178.60 1p88 h PRO 101 N -1.09 0.58 0.10 0.04 0.13 -1.68 -0.10 132.00 129.98 1p88 h PRO 101 Ca -0.09 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.00 1p88 h PRO 101 Cb 0.90 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1p88 h PRO 101 CO 0.04 0.39 -0.05 -0.07 -0.23 0.00 0.00 178.00 178.08 1p88 h LEU 102 N 0.60 -0.11 -1.99 1.56 3.38 0.00 0.65 115.31 119.40 1p88 h LEU 102 Ca 0.23 -0.45 0.16 0.00 0.09 0.00 0.00 57.88 57.90 1p88 h LEU 102 Cb 0.15 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1p88 h LEU 102 CO -0.06 0.45 0.46 0.00 0.09 0.00 0.00 178.44 179.38 1p88 h ALA 103 N 0.01 2.37 0.00 1.53 0.00 0.94 -0.16 119.26 123.95 1p88 h ALA 103 Ca -0.01 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1p88 h ALA 103 Cb 0.56 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1p88 h ALA 103 CO 0.02 -0.74 -0.60 0.00 0.00 0.00 0.00 179.25 177.93 1p88 h ALA 104 N 1.58 0.10 -0.43 0.00 0.00 -0.83 -3.31 119.26 116.36 1p88 h ALA 104 Ca 0.26 -0.68 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 1p88 h ALA 104 Cb 1.18 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1p88 h ALA 104 CO -0.00 0.40 0.25 0.00 0.00 0.00 0.00 179.25 179.90 1p88 h ALA 105 N -0.63 1.63 0.00 0.00 0.00 0.75 -2.70 119.26 118.31 1p88 h ALA 105 Ca -0.13 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1p88 h ALA 105 Cb 0.81 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1p88 h ALA 105 CO -0.08 0.32 -0.28 -0.07 0.00 0.00 0.00 179.25 179.14 1p88 h LEU 106 N 0.59 0.00 -0.61 0.00 3.38 -1.23 -3.17 115.31 114.27 1p88 h LEU 106 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1p88 h LEU 106 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1p88 h LEU 106 CO -0.03 0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.79 1p88 n LEU 108 N -0.17 1.48 0.00 0.00 4.77 -1.20 0.86 117.00 122.74 1p88 n LEU 108 Ca 0.00 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1p88 n LEU 108 Cb 0.14 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1p88 n LEU 108 CO 0.00 -0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.46 1p88 n GLY 109 N 2.26 -0.46 2.93 -0.72 0.00 -1.26 -2.17 105.19 105.77 1p88 n GLY 109 Ca 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 1p88 n GLY 109 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p88 s SER 110 N -1.47 0.20 -0.07 1.61 1.04 -1.26 -0.83 113.70 112.92 1p88 s SER 110 Ca 0.00 -0.88 -0.06 0.00 0.48 0.00 0.00 55.95 55.48 1p88 s SER 110 Cb 0.00 1.12 0.02 0.00 0.10 0.00 0.00 66.02 67.26 1p88 s SER 110 CO 0.00 -0.28 0.19 0.54 0.98 0.00 0.00 173.24 174.67 1p88 s ASN 111 N 2.01 -0.20 -0.61 7.02 4.22 -1.26 -4.65 114.94 121.47 1p88 s ASN 111 Ca 0.14 0.39 -0.17 0.00 -2.14 0.00 0.00 52.86 51.07 1p88 s ASN 111 Cb -0.12 0.38 0.13 0.00 1.28 0.00 0.00 41.25 42.93 1p88 s ASN 111 CO -0.16 -0.07 0.63 -1.81 -2.04 0.00 0.00 177.10 173.65 1p88 s ASP 112 N 0.20 6.28 0.10 3.54 1.11 -1.14 -1.21 116.67 125.54 1p88 s ASP 112 Ca -0.01 -1.80 0.10 0.00 0.18 0.00 0.00 52.55 51.02 1p88 s ASP 112 Cb -0.02 -2.25 -0.04 0.00 1.07 0.00 0.00 42.92 41.68 1p88 s ASP 112 CO -0.00 -0.92 -0.26 -0.63 1.18 0.00 0.00 175.17 174.53 1p88 s ILE 113 N 1.83 2.18 -0.26 0.77 1.09 0.34 0.16 121.20 127.31 1p88 s ILE 113 Ca 0.09 -1.61 -0.01 0.00 -1.10 0.00 0.00 60.65 58.02 1p88 s ILE 113 Cb -0.24 -1.91 0.03 0.00 -1.06 0.00 0.00 42.46 39.28 1p88 s ILE 113 CO 0.02 0.18 -0.05 -0.69 -0.10 0.00 0.00 174.94 174.30 1p88 s VAL 114 N -0.97 2.86 -0.44 2.92 1.01 0.53 0.16 120.40 126.47 1p88 s VAL 114 Ca 0.13 -1.14 -0.14 0.00 0.00 0.00 0.00 61.98 60.83 1p88 s VAL 114 Cb -0.10 -2.51 0.06 0.00 0.00 0.00 0.00 36.38 33.83 1p88 s VAL 114 CO 0.04 0.12 0.34 -0.76 0.00 0.00 0.00 175.10 174.84 1p88 s LEU 115 N 1.30 5.37 0.00 3.92 1.43 0.43 0.18 118.68 131.31 1p88 s LEU 115 Ca -0.02 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.82 1p88 s LEU 115 Cb -0.17 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 43.92 1p88 s LEU 115 CO -0.04 -0.57 0.00 0.41 0.23 0.00 0.00 176.35 176.38 1p88 n THR 116 N 5.12 0.00 -3.93 5.49 -1.04 0.12 -1.98 114.28 118.07 1p88 n THR 116 Ca -0.12 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.88 1p88 n THR 116 Cb 0.44 -0.05 0.02 0.00 -1.82 0.00 0.00 70.33 68.92 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 5.00 0.48 3.68 3.41 0.00 -1.26 0.16 105.19 116.66 1p88 n GLY 117 Ca 0.00 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.04 0.44 0.34 1.61 2.02 -1.26 -4.75 118.70 115.06 1p88 s GLU 118 Ca 0.25 0.49 0.14 0.00 0.02 0.00 0.00 54.97 55.87 1p88 s GLU 118 Cb -0.02 -1.74 1.07 0.00 0.10 0.00 0.00 34.13 33.54 1p88 s GLU 118 CO 0.03 -2.72 1.67 -1.00 0.02 0.00 0.00 175.26 173.26 1p88 h PRO 119 N -1.88 0.34 0.00 0.39 0.13 -2.02 0.94 132.00 129.89 1p88 h PRO 119 Ca -0.54 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.53 1p88 h PRO 119 Cb 1.33 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1p88 h PRO 119 CO 0.58 0.22 -0.15 0.00 -0.23 0.00 0.00 178.00 178.42 1p88 h ARG 120 N 0.35 0.00 -0.59 0.86 3.08 -1.92 -2.44 114.38 113.72 1p88 h ARG 120 Ca 0.73 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.77 1p88 h ARG 120 Cb 1.63 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.65 1p88 h ARG 120 CO -0.60 0.15 0.33 1.98 -1.07 0.00 0.00 179.97 180.77 1p88 h MET 121 N 0.00 0.80 0.00 0.04 4.05 0.72 0.38 114.93 120.93 1p88 h MET 121 Ca -0.00 -0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1p88 h MET 121 Cb 0.51 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 1p88 h MET 121 CO 0.02 0.58 0.00 0.87 0.23 0.00 0.00 176.91 178.61 1p88 h LYS 122 N 0.81 0.00 -0.05 0.39 6.56 -1.44 0.38 116.57 123.22 1p88 h LYS 122 Ca 0.21 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.80 1p88 h LYS 122 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1p88 h LYS 122 CO -0.04 0.00 0.00 0.39 -2.06 0.00 0.00 179.45 177.74 1p88 n GLU 123 N -2.53 1.29 -3.72 3.15 1.02 0.12 -4.39 120.64 115.58 1p88 n GLU 123 Ca -0.01 -0.43 -0.28 0.00 -0.02 0.00 0.00 57.16 56.41 1p88 n GLU 123 Cb 0.08 -1.37 -0.12 0.00 -0.02 0.00 0.00 31.44 30.01 1p88 n GLU 123 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1p88 s ARG 124 N -1.94 1.73 0.61 3.49 0.52 0.13 -5.12 118.95 118.38 1p88 s ARG 124 Ca 0.33 -2.64 -0.19 0.00 -0.52 0.00 0.00 55.73 52.71 1p88 s ARG 124 Cb 0.16 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.97 1p88 s ARG 124 CO 0.26 -1.27 1.09 -2.30 0.02 0.00 0.00 175.30 173.11 1p88 n PRO 125 N 2.67 1.04 0.00 3.54 -0.02 -1.26 -4.23 135.00 136.73 1p88 n PRO 125 Ca 0.19 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1p88 n PRO 125 Cb 0.38 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1p88 n PRO 125 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1p88 n ILE 126 N -1.69 0.47 -0.37 4.25 3.06 0.30 -4.83 119.36 120.56 1p88 n ILE 126 Ca 0.14 -0.51 -0.02 0.00 -2.50 0.00 0.00 62.75 59.86 1p88 n ILE 126 Cb 0.47 0.82 0.12 0.00 0.54 0.00 0.00 39.64 41.60 1p88 n ILE 126 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 1p88 h GLY 127 N 0.00 1.40 0.69 4.50 0.00 -1.77 -1.36 103.07 106.54 1p88 h GLY 127 Ca 0.00 -0.52 0.10 0.00 0.00 0.00 0.00 47.33 46.91 1p88 h GLY 127 CO 0.00 0.50 0.57 0.45 0.00 0.00 0.00 176.54 178.07 1p88 h HIS 128 N 1.34 0.94 -0.03 5.60 3.86 -1.87 0.38 115.15 125.36 1p88 h HIS 128 Ca 0.37 0.03 -0.25 0.00 -1.16 0.00 0.00 60.37 59.35 1p88 h HIS 128 Cb -0.14 -0.30 0.02 0.00 1.06 0.00 0.00 27.41 28.04 1p88 h HIS 128 CO -0.00 0.42 -0.95 1.25 0.86 0.00 0.00 177.93 179.51 1p88 h LEU 129 N 0.86 0.89 -0.34 2.43 5.85 -1.80 -1.90 115.31 121.30 1p88 h LEU 129 Ca 0.42 -0.72 0.04 0.00 0.84 0.00 0.00 57.88 58.46 1p88 h LEU 129 Cb 0.45 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1p88 h LEU 129 CO -0.18 1.48 0.10 0.58 -0.34 0.00 0.00 178.44 180.08 1p88 h VAL 130 N 0.37 0.87 -0.14 1.05 2.07 -0.09 0.43 116.25 120.82 1p88 h VAL 130 Ca -0.11 -0.08 -0.17 0.00 0.82 0.00 0.00 66.70 67.16 1p88 h VAL 130 Cb 1.60 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1p88 h VAL 130 CO 0.19 0.04 -0.63 0.44 0.02 0.00 0.00 177.57 177.63 1p88 h ASP 131 N 0.23 0.58 -0.33 0.57 5.19 -1.06 0.71 116.42 122.31 1p88 h ASP 131 Ca 0.16 -0.34 0.04 0.00 -0.62 0.00 0.00 57.03 56.26 1p88 h ASP 131 Cb 0.15 -0.17 -0.04 0.00 0.18 0.00 0.00 39.33 39.46 1p88 h ASP 131 CO -0.18 1.06 0.12 0.00 -3.12 0.00 0.00 179.24 177.12 1p88 h ALA 132 N 0.94 0.39 0.01 3.45 0.00 -0.56 0.95 119.26 124.43 1p88 h ALA 132 Ca -0.01 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1p88 h ALA 132 Cb 1.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1p88 h ALA 132 CO 0.11 -0.27 -0.00 -0.07 0.00 0.00 0.00 179.25 179.02 1p88 h LEU 133 N 0.27 -0.01 -2.03 0.00 3.38 -0.08 -3.17 115.31 113.67 1p88 h LEU 133 Ca 0.15 -0.77 0.13 0.00 0.09 0.00 0.00 57.88 57.47 1p88 h LEU 133 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1p88 h LEU 133 CO -0.15 0.78 0.36 0.03 0.09 0.00 0.00 178.44 179.55 1p88 h ARG 134 N -0.81 0.00 -0.08 1.13 2.47 0.59 0.35 114.38 118.04 1p88 h ARG 134 Ca -0.00 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.61 1p88 h ARG 134 Cb 0.78 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.09 1p88 h ARG 134 CO 0.00 0.00 -0.42 1.25 0.56 0.00 0.00 179.97 181.36 1p88 h LEU 135 N 0.00 0.19 -0.42 3.04 5.85 0.97 -2.29 115.31 122.65 1p88 h LEU 135 Ca 0.21 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1p88 h LEU 135 Cb 0.93 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1p88 h LEU 135 CO -0.00 0.59 0.00 0.61 -0.34 0.00 0.00 178.44 179.30 1p88 n GLY 136 N -0.19 -0.29 0.18 3.75 0.00 0.12 -4.65 105.19 104.10 1p88 n GLY 136 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 0.52 0.82 3.81 -0.02 0.00 -0.87 0.11 105.19 109.56 1p88 n GLY 137 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1p88 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p88 s ALA 138 N -2.05 2.88 -0.43 4.61 0.00 -0.87 -2.93 121.76 122.96 1p88 s ALA 138 Ca 0.00 0.37 -0.13 0.00 0.00 0.00 0.00 51.96 52.20 1p88 s ALA 138 Cb 0.00 -3.20 0.06 0.00 0.00 0.00 0.00 23.12 19.98 1p88 s ALA 138 CO 0.00 -0.51 0.31 0.15 0.00 0.00 0.00 175.76 175.72 1p88 s LYS 139 N -3.89 2.83 -0.04 0.00 1.02 0.79 -4.17 119.74 116.29 1p88 s LYS 139 Ca 0.63 -1.31 -0.00 0.00 0.02 0.00 0.00 55.97 55.30 1p88 s LYS 139 Cb -0.14 -3.94 0.03 0.00 -0.52 0.00 0.00 37.83 33.26 1p88 s LYS 139 CO 0.31 -0.93 0.01 0.42 -0.92 0.00 0.00 175.35 174.25 1p88 s ILE 140 N 1.56 0.14 -0.02 2.17 1.01 -1.26 -1.82 121.20 122.99 1p88 s ILE 140 Ca 0.03 0.17 0.06 0.00 0.00 0.00 0.00 60.65 60.92 1p88 s ILE 140 Cb -0.23 -0.29 -0.02 0.00 0.01 0.00 0.00 42.46 41.94 1p88 s ILE 140 CO 0.06 0.17 -0.21 -0.89 0.00 0.00 0.00 174.94 174.06 1p88 s THR 141 N 1.45 1.68 0.03 2.92 2.01 -0.72 -4.95 115.64 118.06 1p88 s THR 141 Ca -0.04 -0.91 -0.30 0.00 0.31 0.00 0.00 61.69 60.75 1p88 s THR 141 Cb -0.13 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 1p88 s THR 141 CO -0.03 0.48 0.99 -0.31 -0.69 0.00 0.00 174.62 175.06 1p88 s TYR 142 N -0.45 3.68 0.00 4.92 2.02 -1.26 -0.56 117.35 125.70 1p88 s TYR 142 Ca 0.07 1.70 0.00 0.00 -0.37 0.00 0.00 57.07 58.47 1p88 s TYR 142 Cb -0.09 -3.12 0.00 0.00 -0.40 0.00 0.00 41.96 38.35 1p88 s TYR 142 CO -0.00 -0.02 0.00 1.28 -1.57 0.00 0.00 175.55 175.23 1p88 n LEU 143 N 3.65 0.00 0.00 -1.29 4.32 -1.26 -4.91 117.00 117.51 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 0.50 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.30 1p88 n LEU 143 CO 0.52 0.00 0.21 -0.62 -1.22 0.00 0.00 177.39 176.28 1p88 n GLU 144 N 0.00 0.00 -4.23 3.23 -0.58 -1.26 -4.84 120.64 112.96 1p88 n GLU 144 Ca 0.00 0.03 -0.29 0.00 -0.42 0.00 0.00 57.16 56.48 1p88 n GLU 144 Cb 0.00 -0.92 -0.09 0.00 -0.57 0.00 0.00 31.44 29.86 1p88 n GLU 144 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1p88 s GLN 145 N -0.83 2.16 0.13 3.49 -0.21 -1.26 -5.08 119.66 118.05 1p88 s GLN 145 Ca 0.00 -1.07 -0.31 0.00 0.02 0.00 0.00 55.36 54.00 1p88 s GLN 145 Cb 0.00 -2.30 -0.09 0.00 1.00 0.00 0.00 33.01 31.63 1p88 s GLN 145 CO 0.00 0.49 1.46 -1.21 -2.12 0.00 0.00 175.29 173.91 1p88 s GLU 146 N -2.40 4.28 -0.79 2.91 2.02 -1.26 -1.94 118.70 121.52 1p88 s GLU 146 Ca 0.23 2.18 0.00 0.00 0.02 0.00 0.00 54.97 57.39 1p88 s GLU 146 Cb -0.11 -3.23 0.00 0.00 0.10 0.00 0.00 34.13 30.89 1p88 s GLU 146 CO 0.15 -0.51 0.00 0.09 0.02 0.00 0.00 175.26 175.01 1p88 n ASN 147 N 4.04 -4.18 -4.84 -0.19 4.13 -1.26 -4.87 115.26 108.09 1p88 n ASN 147 Ca 0.12 0.18 -0.22 0.00 1.68 0.00 0.00 54.58 56.35 1p88 n ASN 147 Cb 0.41 -2.33 -0.04 0.00 -1.54 0.00 0.00 39.78 36.28 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 -2.18 2.70 0.07 3.10 1.51 -0.82 0.11 117.35 121.84 1p88 s TYR 148 Ca 0.00 -0.50 -0.13 0.00 -1.01 0.00 0.00 57.07 55.43 1p88 s TYR 148 Cb 0.00 -2.08 -0.03 0.00 -0.11 0.00 0.00 41.96 39.74 1p88 s TYR 148 CO 0.00 -0.01 0.80 -2.30 -1.11 0.00 0.00 175.55 172.92 1p88 n PRO 149 N -1.45 -0.18 -1.60 -1.71 -0.02 -1.26 -4.34 135.00 124.44 1p88 n PRO 149 Ca 0.02 0.79 -0.41 0.00 -2.02 0.00 0.00 63.50 61.88 1p88 n PRO 149 Cb 0.62 -1.16 0.02 0.00 -0.02 0.00 0.00 33.50 32.96 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 -4.14 1.22 -3.68 0.52 -0.02 -1.08 -4.35 135.00 123.47 1p88 n PRO 150 Ca 0.01 0.44 -0.12 0.00 -2.02 0.00 0.00 63.50 61.81 1p88 n PRO 150 Cb 0.11 -2.01 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 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 -0.52 -0.30 -0.43 2.45 1.43 -0.84 -4.00 118.68 116.48 1p88 s LEU 151 Ca 0.65 1.17 -0.08 0.00 -1.03 0.00 0.00 54.13 54.84 1p88 s LEU 151 Cb -0.54 1.94 0.10 0.00 0.03 0.00 0.00 46.19 47.72 1p88 s LEU 151 CO 0.56 -0.20 0.27 -0.13 0.23 0.00 0.00 176.35 177.07 1p88 s ARG 152 N 0.69 2.46 0.15 1.70 0.52 0.27 -0.43 118.95 124.32 1p88 s ARG 152 Ca -0.03 -1.61 -0.13 0.00 -0.52 0.00 0.00 55.73 53.44 1p88 s ARG 152 Cb -0.05 -3.77 -0.07 0.00 0.52 0.00 0.00 34.95 31.58 1p88 s ARG 152 CO -0.05 -1.04 0.54 -0.51 0.02 0.00 0.00 175.30 174.26 1p88 s LEU 153 N 1.35 4.31 0.00 2.53 1.43 0.42 -1.76 118.68 126.96 1p88 s LEU 153 Ca 0.04 1.02 0.09 0.00 -1.03 0.00 0.00 54.13 54.25 1p88 s LEU 153 Cb -0.24 -3.31 0.14 0.00 0.03 0.00 0.00 46.19 42.81 1p88 s LEU 153 CO 0.00 0.08 0.97 0.00 0.23 0.00 0.00 176.35 177.63 1p88 n GLN 154 N 0.65 0.00 0.00 1.70 6.02 -0.35 -0.50 117.38 124.90 1p88 n GLN 154 Ca -0.05 -1.15 0.00 0.00 -0.01 0.00 0.00 57.00 55.79 1p88 n GLN 154 Cb 0.52 0.04 0.00 0.00 1.02 0.00 0.00 30.24 31.82 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 0.17 0.35 0.00 1.08 0.00 -1.21 -4.01 105.19 101.55 1p88 n GLY 155 Ca -0.06 -0.80 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 2.09 3.68 -0.02 0.00 -0.01 -0.15 105.19 110.78 1p88 n GLY 156 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1p88 n GLY 156 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1p88 n PHE 157 N -1.16 2.51 -0.01 1.61 7.35 0.25 -3.84 117.46 124.16 1p88 n PHE 157 Ca 0.00 -0.16 -0.01 0.00 -0.76 0.00 0.00 57.45 56.51 1p88 n PHE 157 Cb 0.00 -2.73 -0.02 0.00 0.35 0.00 0.00 39.48 37.08 1p88 n PHE 157 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1p88 n THR 158 N 4.96 0.19 0.00 -2.13 -2.24 0.08 -4.57 114.28 110.57 1p88 n THR 158 Ca 0.19 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1p88 n THR 158 Cb 0.36 -0.76 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 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 2.75 0.26 0.00 3.38 0.00 0.29 0.15 105.19 112.02 1p88 n GLY 159 Ca -0.05 -2.29 0.00 0.00 0.00 0.00 0.00 46.02 43.68 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 0.33 3.44 -0.02 0.00 0.04 -4.29 105.19 104.69 1p88 n GLY 160 Ca 0.00 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 1p88 n GLY 160 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p88 s ASN 161 N -4.00 4.43 -0.09 1.61 0.01 -1.26 0.78 114.94 116.42 1p88 s ASN 161 Ca 0.00 -0.22 0.00 0.00 -0.71 0.00 0.00 52.86 51.94 1p88 s ASN 161 Cb 0.00 -1.68 0.02 0.00 0.41 0.00 0.00 41.25 40.00 1p88 s ASN 161 CO 0.00 0.17 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.00 1p88 s VAL 162 N 0.31 0.96 -0.28 1.60 1.01 0.37 -4.20 120.40 120.17 1p88 s VAL 162 Ca -0.07 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 61.50 1p88 s VAL 162 Cb -0.15 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 1p88 s VAL 162 CO 0.04 0.34 0.23 -1.81 0.00 0.00 0.00 175.10 173.90 1p88 s ASP 163 N 1.38 6.06 -0.11 3.32 1.01 -1.26 -0.59 116.67 126.48 1p88 s ASP 163 Ca -0.02 0.05 -0.00 0.00 0.71 0.00 0.00 52.55 53.29 1p88 s ASP 163 Cb -0.14 -2.14 0.02 0.00 1.01 0.00 0.00 42.92 41.68 1p88 s ASP 163 CO -0.04 -0.08 -0.07 -0.69 0.21 0.00 0.00 175.17 174.50 1p88 s VAL 164 N 1.82 0.96 0.27 -1.27 1.01 -0.43 -4.36 120.40 118.40 1p88 s VAL 164 Ca 0.09 -0.25 -0.30 0.00 0.00 0.00 0.00 61.98 61.52 1p88 s VAL 164 Cb -0.16 -0.99 -0.14 0.00 0.00 0.00 0.00 36.38 35.09 1p88 s VAL 164 CO 0.11 0.36 1.18 0.47 0.00 0.00 0.00 175.10 177.21 1p88 n ASP 165 N 4.91 1.93 0.06 3.32 9.92 -1.26 -2.53 116.55 132.90 1p88 n ASP 165 Ca -0.12 1.17 -0.12 0.00 -0.53 0.00 0.00 54.79 55.18 1p88 n ASP 165 Cb 0.50 -1.35 -0.07 0.00 -0.64 0.00 0.00 41.12 39.57 1p88 n ASP 165 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1p88 h GLY 166 N 2.83 -0.07 -7.58 0.44 0.00 -1.47 -3.35 103.07 93.87 1p88 h GLY 166 Ca -0.43 0.04 -0.74 0.00 0.00 0.00 0.00 47.33 46.20 1p88 h GLY 166 CO 0.66 -0.04 0.32 -1.35 0.00 0.00 0.00 176.54 176.13 1p88 s SER 167 N -5.12 6.61 -0.33 0.19 1.04 -1.24 0.13 113.70 114.98 1p88 s SER 167 Ca -0.13 -2.26 0.04 0.00 0.48 0.00 0.00 55.95 54.07 1p88 s SER 167 Cb 0.06 -2.28 0.29 0.00 0.10 0.00 0.00 66.02 64.18 1p88 s SER 167 CO 0.66 -0.82 1.33 0.55 0.98 0.00 0.00 173.24 175.94 1p88 n VAL 168 N 4.74 0.00 -1.20 5.02 3.14 -1.26 -5.00 118.33 123.76 1p88 n VAL 168 Ca 0.12 -0.72 0.00 0.00 -2.96 0.00 0.00 64.34 60.78 1p88 n VAL 168 Cb 0.47 1.02 0.00 0.00 -1.06 0.00 0.00 33.84 34.27 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 0.29 -6.66 0.18 6.55 7.64 -1.26 -4.57 113.62 115.79 1p88 n SER 169 Ca -0.09 0.85 0.13 0.00 1.01 0.00 0.00 58.87 60.78 1p88 n SER 169 Cb 0.74 -2.88 0.42 0.00 -1.01 0.00 0.00 64.21 61.48 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 1.99 0.00 0.43 6.43 4.64 -1.90 -3.02 113.55 122.12 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 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1p88 n GLN 171 N -2.68 0.29 0.02 4.77 0.00 -1.26 -2.24 117.38 116.27 1p88 n GLN 171 Ca 0.03 0.08 -0.08 0.00 0.00 0.00 0.00 57.00 57.04 1p88 n GLN 171 Cb 0.39 -1.50 -0.06 0.00 0.00 0.00 0.00 30.24 29.07 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 -0.14 -0.81 2.61 -1.00 -1.77 -1.80 116.94 114.02 1p88 h PHE 172 Ca 0.00 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1p88 h PHE 172 Cb 0.22 0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.78 1p88 h PHE 172 CO 0.00 0.24 0.44 -0.07 -1.61 0.00 0.00 178.31 177.31 1p88 h LEU 173 N -0.97 1.03 -1.36 1.54 3.38 -1.76 -1.24 115.31 115.94 1p88 h LEU 173 Ca -0.02 -0.11 0.10 0.00 0.09 0.00 0.00 57.88 57.95 1p88 h LEU 173 Cb 0.45 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.88 1p88 h LEU 173 CO 0.03 0.84 0.52 0.74 0.09 0.00 0.00 178.44 180.66 1p88 h THR 174 N 1.14 0.92 -0.42 0.22 2.02 -1.53 0.51 112.91 115.78 1p88 h THR 174 Ca 0.29 -0.24 -0.15 0.00 0.77 0.00 0.00 66.41 67.08 1p88 h THR 174 Cb 0.05 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.61 1p88 h THR 174 CO -0.04 0.13 -0.31 0.00 0.37 0.00 0.00 175.52 175.66 1p88 h ALA 175 N 1.60 0.60 0.02 6.16 0.00 -0.32 -2.90 119.26 124.41 1p88 h ALA 175 Ca 0.38 -0.43 -0.21 0.00 0.00 0.00 0.00 54.91 54.65 1p88 h ALA 175 Cb 0.50 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1p88 h ALA 175 CO -0.15 0.65 -0.93 -0.07 0.00 0.00 0.00 179.25 178.76 1p88 h LEU 176 N 0.77 0.30 -1.19 0.00 3.38 -0.75 -2.38 115.31 115.44 1p88 h LEU 176 Ca 0.08 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.81 1p88 h LEU 176 Cb 0.90 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 1p88 h LEU 176 CO 0.08 1.08 0.55 -0.07 0.09 0.00 0.00 178.44 180.17 1p88 h LEU 177 N 0.12 0.93 0.16 1.67 4.07 0.03 0.67 115.31 122.97 1p88 h LEU 177 Ca -0.06 -0.02 -0.26 0.00 0.08 0.00 0.00 57.88 57.63 1p88 h LEU 177 Cb 1.58 -0.23 0.02 0.00 1.08 0.00 0.00 40.66 43.10 1p88 h LEU 177 CO 0.15 0.67 -1.19 0.24 -1.08 0.00 0.00 178.44 177.23 1p88 h MET 178 N 1.10 0.34 -0.25 1.13 2.86 -1.52 -3.34 114.93 115.25 1p88 h MET 178 Ca 0.31 -0.59 -0.17 0.00 -2.06 0.00 0.00 59.70 57.19 1p88 h MET 178 Cb -0.10 0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1p88 h MET 178 CO -0.07 1.28 -0.50 1.15 1.06 0.00 0.00 176.91 179.83 1p88 h THR 179 N -0.21 1.29 -0.80 2.22 2.02 -1.28 -3.33 112.91 112.83 1p88 h THR 179 Ca -0.23 -1.70 0.01 0.00 0.77 0.00 0.00 66.41 65.27 1p88 h THR 179 Cb 1.82 1.72 -0.04 0.00 -1.74 0.00 0.00 68.15 69.91 1p88 h THR 179 CO 0.15 0.54 0.52 0.00 0.37 0.00 0.00 175.52 177.11 1p88 h ALA 180 N 0.65 1.02 0.00 6.16 0.00 0.20 -2.53 119.26 124.75 1p88 h ALA 180 Ca 0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1p88 h ALA 180 Cb 1.11 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1p88 h ALA 180 CO 0.11 0.40 -0.22 -1.00 0.00 0.00 0.00 179.25 178.55 1p88 h PRO 181 N 1.06 0.00 -0.03 0.00 0.13 -1.69 0.16 132.00 131.64 1p88 h PRO 181 Ca 0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.43 1p88 h PRO 181 Cb -0.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.03 1p88 h PRO 181 CO -0.07 0.22 0.00 1.28 -0.23 0.00 0.00 178.00 179.19 1p88 n LEU 182 N -4.14 0.59 -4.76 1.56 4.77 -0.98 0.20 117.00 114.23 1p88 n LEU 182 Ca -0.02 -0.22 -0.40 0.00 -0.03 0.00 0.00 56.01 55.35 1p88 n LEU 182 Cb 0.28 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.30 1p88 n LEU 182 CO 0.36 0.11 0.51 0.00 -1.33 0.00 0.00 177.39 177.03 1p88 s ALA 183 N -1.97 3.41 0.49 -1.18 0.00 0.57 -4.38 121.76 118.71 1p88 s ALA 183 Ca 0.39 0.38 0.26 0.00 0.00 0.00 0.00 51.96 52.99 1p88 s ALA 183 Cb 0.19 -3.01 1.32 0.00 0.00 0.00 0.00 23.12 21.63 1p88 s ALA 183 CO 0.31 0.22 1.89 -1.00 0.00 0.00 0.00 175.76 177.18 1p88 h PRO 184 N 4.66 0.15 -6.47 0.00 0.13 -1.66 2.23 132.00 131.04 1p88 h PRO 184 Ca -0.46 -0.01 -0.69 0.00 -0.87 0.00 0.00 66.00 63.98 1p88 h PRO 184 Cb 1.21 -0.03 -0.22 0.00 0.13 0.00 0.00 31.00 32.09 1p88 h PRO 184 CO 0.68 0.10 -0.78 -2.00 -0.23 0.00 0.00 178.00 175.76 1p88 s GLU 185 N -5.15 2.26 0.39 0.86 2.12 0.39 -4.15 118.70 115.42 1p88 s GLU 185 Ca -0.06 -0.87 -0.27 0.00 0.36 0.00 0.00 54.97 54.13 1p88 s GLU 185 Cb 0.22 -2.28 -0.11 0.00 0.26 0.00 0.00 34.13 32.22 1p88 s GLU 185 CO 0.77 0.57 1.37 -3.47 -0.54 0.00 0.00 175.26 173.96 1p88 n ASP 186 N 1.76 3.11 -4.38 -1.70 -0.08 -1.26 -3.97 116.55 110.03 1p88 n ASP 186 Ca -0.16 1.18 -0.30 0.00 -1.51 0.00 0.00 54.79 54.00 1p88 n ASP 186 Cb 0.52 -1.55 -0.14 0.00 2.34 0.00 0.00 41.12 42.30 1p88 n ASP 186 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1p88 s THR 187 N -1.14 2.33 -0.15 5.18 2.01 0.52 -0.78 115.64 123.62 1p88 s THR 187 Ca 0.57 -1.42 0.00 0.00 0.31 0.00 0.00 61.69 61.15 1p88 s THR 187 Cb -0.51 -1.96 0.03 0.00 0.01 0.00 0.00 72.50 70.07 1p88 s THR 187 CO 0.61 0.30 -0.12 -0.69 -0.69 0.00 0.00 174.62 174.03 1p88 s VAL 188 N -0.89 1.46 -0.29 3.82 1.01 0.23 -0.63 120.40 125.10 1p88 s VAL 188 Ca 0.13 -0.62 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 1p88 s VAL 188 Cb -0.10 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 1p88 s VAL 188 CO 0.04 0.38 0.14 -0.63 0.00 0.00 0.00 175.10 175.03 1p88 s ILE 189 N 1.52 4.65 -0.25 2.22 1.09 0.17 0.14 121.20 130.74 1p88 s ILE 189 Ca 0.04 -0.29 -0.11 0.00 -1.10 0.00 0.00 60.65 59.19 1p88 s ILE 189 Cb -0.13 -3.31 -0.05 0.00 -1.06 0.00 0.00 42.46 37.91 1p88 s ILE 189 CO -0.10 0.14 0.17 -0.60 -0.10 0.00 0.00 174.94 174.46 1p88 s ARG 190 N 1.64 4.04 -0.24 2.79 3.52 0.24 0.14 118.95 131.07 1p88 s ARG 190 Ca 0.05 -0.27 -0.17 0.00 -0.13 0.00 0.00 55.73 55.21 1p88 s ARG 190 Cb -0.17 -3.57 -0.03 0.00 -1.56 0.00 0.00 34.95 29.62 1p88 s ARG 190 CO 0.06 -0.01 0.47 0.42 -0.81 0.00 0.00 175.30 175.43 1p88 s ILE 191 N 1.27 5.12 -0.77 4.11 1.09 -1.25 -1.31 121.20 129.45 1p88 s ILE 191 Ca 0.08 0.81 -0.26 0.00 -1.10 0.00 0.00 60.65 60.18 1p88 s ILE 191 Cb -0.14 -3.79 0.00 0.00 -1.06 0.00 0.00 42.46 37.47 1p88 s ILE 191 CO 0.06 0.15 1.61 -0.54 -0.10 0.00 0.00 174.94 176.13 1p88 s LYS 192 N 1.94 2.96 0.87 2.79 1.02 -1.05 -4.66 119.74 123.62 1p88 s LYS 192 Ca 0.20 -0.12 0.00 0.00 0.02 0.00 0.00 55.97 56.08 1p88 s LYS 192 Cb -0.15 -4.60 0.00 0.00 -0.52 0.00 0.00 37.83 32.56 1p88 s LYS 192 CO 0.09 -2.56 0.00 0.41 -0.92 0.00 0.00 175.35 172.37 1p88 n GLY 193 N 5.99 0.96 3.34 -3.33 0.00 -1.26 -1.44 105.19 109.44 1p88 n GLY 193 Ca 0.20 -1.22 -0.32 0.00 0.00 0.00 0.00 46.02 44.68 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 3.58 0.36 1.61 1.11 -1.26 -4.78 116.67 113.29 1p88 s ASP 194 Ca 0.00 -0.40 -0.23 0.00 0.18 0.00 0.00 52.55 52.10 1p88 s ASP 194 Cb 0.00 -1.20 -0.15 0.00 1.07 0.00 0.00 42.92 42.64 1p88 s ASP 194 CO 0.00 0.22 0.33 0.18 1.18 0.00 0.00 175.17 177.09 1p88 n LEU 195 N 3.11 -1.63 0.18 1.23 4.77 -1.23 -3.62 117.00 119.82 1p88 n LEU 195 Ca -0.18 0.92 0.05 0.00 -0.03 0.00 0.00 56.01 56.78 1p88 n LEU 195 Cb 0.52 -0.97 0.26 0.00 -2.33 0.00 0.00 43.42 40.91 1p88 n LEU 195 CO 0.28 -3.50 0.64 1.62 -1.33 0.00 0.00 177.39 175.10 1p88 h VAL 196 N 0.66 0.82 0.00 4.08 3.04 0.82 -3.41 116.25 122.26 1p88 h VAL 196 Ca -0.36 -1.67 -0.16 0.00 -1.01 0.00 0.00 66.70 63.51 1p88 h VAL 196 Cb 1.43 2.05 -0.13 0.00 -2.01 0.00 0.00 31.29 32.63 1p88 h VAL 196 CO 0.51 0.38 -0.22 -0.24 -1.01 0.00 0.00 177.57 176.99 1p88 n SER 197 N -3.41 -1.93 -0.34 3.17 2.88 -1.26 -4.83 113.62 107.90 1p88 n SER 197 Ca 0.01 -2.67 0.15 0.00 -1.33 0.00 0.00 58.87 55.03 1p88 n SER 197 Cb 0.57 1.41 0.30 0.00 -0.75 0.00 0.00 64.21 65.74 1p88 n SER 197 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1p88 n LYS 198 N 0.97 -0.08 -0.32 -1.46 3.00 -1.26 0.11 118.16 119.12 1p88 n LYS 198 Ca 0.02 1.45 0.21 0.00 -0.00 0.00 0.00 58.31 60.00 1p88 n LYS 198 Cb 0.70 -2.32 0.48 0.00 0.00 0.00 0.00 35.03 33.89 1p88 n LYS 198 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 1p88 h PRO 199 N 0.00 0.43 -0.36 1.64 0.11 -1.98 0.49 132.00 132.33 1p88 h PRO 199 Ca 0.60 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.64 1p88 h PRO 199 Cb 1.27 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1p88 h PRO 199 CO -0.91 0.29 0.03 -0.92 -0.21 0.00 0.00 178.00 176.28 1p88 h TYR 200 N 0.45 0.65 -0.80 0.65 3.20 0.37 -2.35 116.97 119.13 1p88 h TYR 200 Ca 0.58 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 62.34 1p88 h TYR 200 Cb 1.38 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.43 1p88 h TYR 200 CO -0.00 0.68 0.47 0.82 -1.64 0.00 0.00 178.16 178.49 1p88 h ILE 201 N 0.43 1.22 -0.65 1.81 1.08 0.00 -1.10 117.51 120.31 1p88 h ILE 201 Ca 0.11 -0.50 0.02 0.00 -0.39 0.00 0.00 64.86 64.09 1p88 h ILE 201 Cb 0.40 0.10 -0.04 0.00 -3.07 0.00 0.00 36.82 34.22 1p88 h ILE 201 CO 0.01 0.24 0.42 0.44 -0.69 0.00 0.00 178.15 178.57 1p88 h ASP 202 N 1.10 0.72 0.09 1.72 5.19 -0.26 -0.27 116.42 124.71 1p88 h ASP 202 Ca 0.29 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.68 1p88 h ASP 202 Cb -0.03 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.31 1p88 h ASP 202 CO -0.05 0.51 -0.04 0.40 -3.12 0.00 0.00 179.24 176.94 1p88 h ILE 203 N 0.85 0.99 -0.20 0.35 2.04 -0.88 -1.32 117.51 119.34 1p88 h ILE 203 Ca 0.25 -0.27 0.05 0.00 1.00 0.00 0.00 64.86 65.89 1p88 h ILE 203 Cb -0.05 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 37.14 1p88 h ILE 203 CO -0.07 0.07 -0.15 0.74 0.00 0.00 0.00 178.15 178.73 1p88 h THR 204 N -0.24 0.57 -0.01 -0.27 2.02 -0.81 1.88 112.91 116.06 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 0.20 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1p88 h THR 204 CO 0.02 0.00 -0.26 -0.07 0.37 0.00 0.00 175.52 175.58 1p88 h LEU 205 N -0.15 0.02 0.04 2.58 3.38 -1.01 1.97 115.31 122.13 1p88 h LEU 205 Ca 0.12 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.98 1p88 h LEU 205 Cb 0.33 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.09 1p88 h LEU 205 CO -0.30 0.28 -0.44 -1.13 0.09 0.00 0.00 178.44 176.94 1p88 h ASN 206 N 0.02 0.33 0.56 -0.43 -1.24 -0.02 0.10 115.58 114.90 1p88 h ASN 206 Ca 0.00 -0.85 -0.12 0.00 0.71 0.00 0.00 56.30 56.04 1p88 h ASN 206 Cb 0.47 -0.10 -0.02 0.00 0.73 0.00 0.00 38.32 39.40 1p88 h ASN 206 CO 0.03 1.14 -0.56 0.25 -1.29 0.00 0.00 177.43 177.00 1p88 h LEU 207 N -0.45 0.00 -0.25 0.34 5.85 0.31 -2.09 115.31 119.02 1p88 h LEU 207 Ca -0.07 -0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.44 1p88 h LEU 207 Cb 1.24 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1p88 h LEU 207 CO 0.09 0.56 -0.87 0.24 -0.34 0.00 0.00 178.44 178.12 1p88 h MET 208 N 0.00 0.42 -0.75 1.25 2.86 0.31 -3.13 114.93 115.90 1p88 h MET 208 Ca -0.01 -0.41 -0.00 0.00 -2.06 0.00 0.00 59.70 57.22 1p88 h MET 208 Cb 1.00 0.11 -0.04 0.00 0.06 0.00 0.00 31.60 32.73 1p88 h MET 208 CO 0.07 1.07 0.45 0.87 1.06 0.00 0.00 176.91 180.43 1p88 h LYS 209 N 0.25 1.01 0.00 1.72 1.57 -0.35 -0.14 116.57 120.63 1p88 h LYS 209 Ca -0.06 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 1p88 h LYS 209 Cb 1.48 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 33.57 1p88 h LYS 209 CO 0.15 0.70 -0.12 0.00 -0.57 0.00 0.00 179.45 179.61 1p88 h THR 210 N 1.03 0.97 -0.00 -0.16 1.03 -1.33 0.27 112.91 114.72 1p88 h THR 210 Ca 0.27 -0.41 0.00 0.00 -0.01 0.00 0.00 66.41 66.26 1p88 h THR 210 Cb -0.05 1.23 0.00 0.00 -1.07 0.00 0.00 68.15 68.26 1p88 h THR 210 CO -0.05 0.11 -0.02 0.49 -0.01 0.00 0.00 175.52 176.04 1p88 n PHE 211 N -4.24 0.00 0.00 0.00 3.72 -0.09 -4.10 117.46 112.75 1p88 n PHE 211 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1p88 n PHE 211 Cb 0.19 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 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 1.35 1.16 3.31 1.37 0.00 0.08 0.12 105.19 112.58 1p88 n GLY 212 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 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 1.87 -0.03 1.61 -7.23 -1.09 -4.75 120.40 108.78 1p88 s VAL 213 Ca 0.00 -1.52 0.03 0.00 -1.81 0.00 0.00 61.98 58.68 1p88 s VAL 213 Cb 0.00 -1.67 0.00 0.00 0.56 0.00 0.00 36.38 35.27 1p88 s VAL 213 CO 0.00 0.06 -0.11 -1.61 -0.31 0.00 0.00 175.10 173.13 1p88 s GLU 214 N -1.75 1.12 0.10 4.82 2.02 -1.26 -2.50 118.70 121.24 1p88 s GLU 214 Ca 0.09 -0.38 0.10 0.00 0.02 0.00 0.00 54.97 54.80 1p88 s GLU 214 Cb -0.10 -1.03 -0.04 0.00 0.10 0.00 0.00 34.13 33.06 1p88 s GLU 214 CO 0.04 0.16 -0.24 0.42 0.02 0.00 0.00 175.26 175.66 1p88 s ILE 215 N 0.11 2.43 -0.30 -1.63 -1.09 -1.26 -4.57 121.20 114.89 1p88 s ILE 215 Ca -0.02 -1.55 -0.11 0.00 -2.23 0.00 0.00 60.65 56.74 1p88 s ILE 215 Cb -0.09 -2.05 -0.04 0.00 -1.58 0.00 0.00 42.46 38.70 1p88 s ILE 215 CO 0.01 0.19 0.20 -0.70 -1.23 0.00 0.00 174.94 173.40 1p88 s GLU 216 N -1.82 3.75 0.40 2.79 2.12 0.13 -4.94 118.70 121.12 1p88 s GLU 216 Ca 0.14 -0.46 -0.17 0.00 0.36 0.00 0.00 54.97 54.85 1p88 s GLU 216 Cb -0.10 -3.68 -0.09 0.00 0.26 0.00 0.00 34.13 30.51 1p88 s GLU 216 CO 0.06 -0.28 0.85 1.21 -0.54 0.00 0.00 175.26 176.56 1p88 s ASN 217 N 1.73 6.80 0.00 -1.70 3.84 -1.26 0.88 114.94 125.22 1p88 s ASN 217 Ca 0.07 1.46 0.00 0.00 0.21 0.00 0.00 52.86 54.60 1p88 s ASN 217 Cb -0.16 -2.45 0.00 0.00 -0.55 0.00 0.00 41.25 38.09 1p88 s ASN 217 CO 0.10 -0.33 0.00 1.67 -2.79 0.00 0.00 177.10 175.75 1p88 n GLN 218 N -0.71 2.48 -1.90 0.43 -0.06 0.28 -4.89 117.38 113.01 1p88 n GLN 218 Ca 0.05 0.00 -0.41 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 26.71 1p88 n GLN 218 CO 0.00 0.00 0.00 1.58 -0.20 0.00 0.00 177.06 178.44 1p88 n HIS 219 N 0.00 2.98 -2.76 3.69 -0.00 -1.26 -4.43 115.22 113.43 1p88 n HIS 219 Ca 0.00 -2.91 -0.22 0.00 0.46 0.00 0.00 57.72 55.05 1p88 n HIS 219 Cb 0.00 -2.22 0.02 0.00 -0.12 0.00 0.00 29.99 27.67 1p88 n HIS 219 CO 0.00 0.00 0.00 0.98 0.46 0.00 0.00 176.34 177.78 1p88 n TYR 220 N 4.19 -1.57 0.00 1.57 9.36 -1.26 -4.77 117.16 124.67 1p88 n TYR 220 Ca 0.54 0.31 0.00 0.00 3.32 0.00 0.00 57.90 62.07 1p88 n TYR 220 Cb 0.33 -4.31 0.00 0.00 -0.63 0.00 0.00 39.34 34.73 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 -3.62 0.00 0.00 2.98 10.64 -1.26 -3.49 117.38 122.63 1p88 n GLN 221 Ca -0.17 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.00 1p88 n GLN 221 Cb 0.65 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.03 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 -4.88 2.61 7.27 -1.17 -3.63 117.38 117.58 1p88 n GLN 222 Ca 0.00 0.00 -0.27 0.00 0.07 0.00 0.00 57.00 56.80 1p88 n GLN 222 Cb 0.00 0.00 -0.16 0.00 2.41 0.00 0.00 30.24 32.49 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 1.86 -0.25 3.69 0.40 0.36 0.99 117.98 125.03 1p88 s PHE 223 Ca 0.00 -0.61 -0.00 0.00 -0.60 0.00 0.00 56.93 55.72 1p88 s PHE 223 Cb 0.00 -1.26 0.04 0.00 0.51 0.00 0.00 43.02 42.30 1p88 s PHE 223 CO 0.00 -0.23 -0.08 0.08 0.70 0.00 0.00 175.22 175.69 1p88 s VAL 224 N 0.20 2.61 -0.16 -0.44 1.01 0.25 -0.66 120.40 123.21 1p88 s VAL 224 Ca -0.08 -1.24 0.02 0.00 0.00 0.00 0.00 61.98 60.67 1p88 s VAL 224 Cb -0.14 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.87 1p88 s VAL 224 CO 0.04 0.13 -0.21 0.54 0.00 0.00 0.00 175.10 175.60 1p88 s VAL 225 N 1.25 2.04 -0.11 2.92 0.11 0.20 0.17 120.40 126.97 1p88 s VAL 225 Ca -0.03 -0.94 -0.30 0.00 -2.93 0.00 0.00 61.98 57.79 1p88 s VAL 225 Cb -0.18 -1.82 -0.02 0.00 -1.53 0.00 0.00 36.38 32.83 1p88 s VAL 225 CO -0.05 0.54 1.16 -0.54 -3.33 0.00 0.00 175.10 172.88 1p88 s LYS 226 N 1.08 4.33 0.79 1.54 3.01 -1.26 -0.36 119.74 128.87 1p88 s LYS 226 Ca -0.00 1.58 -0.13 0.00 -1.01 0.00 0.00 55.97 56.40 1p88 s LYS 226 Cb -0.14 -3.61 0.19 0.00 -1.01 0.00 0.00 37.83 33.26 1p88 s LYS 226 CO -0.08 -0.50 0.89 0.41 0.51 0.00 0.00 175.35 176.58 1p88 n GLY 227 N 3.36 -1.97 2.42 -3.33 0.00 -1.26 -4.28 105.19 100.13 1p88 n GLY 227 Ca 0.11 -1.60 -0.15 0.00 0.00 0.00 0.00 46.02 44.38 1p88 n GLY 227 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 228 N -1.95 1.24 3.85 -0.02 0.00 0.75 -4.82 105.19 104.23 1p88 n GLY 228 Ca 0.12 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 1p88 n GLY 228 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1p88 s GLN 229 N -3.54 -0.12 0.02 1.61 -0.21 0.54 -4.96 119.66 113.00 1p88 s GLN 229 Ca 0.00 -0.43 0.01 0.00 0.02 0.00 0.00 55.36 54.96 1p88 s GLN 229 Cb 0.00 -1.76 -0.02 0.00 1.00 0.00 0.00 33.01 32.23 1p88 s GLN 229 CO 0.00 -2.92 -0.05 0.45 -2.12 0.00 0.00 175.29 170.65 1p88 s SER 230 N -4.71 0.49 -0.21 5.90 0.15 -1.26 -4.58 113.70 109.48 1p88 s SER 230 Ca 0.75 -0.42 -0.06 0.00 0.70 0.00 0.00 55.95 56.93 1p88 s SER 230 Cb -0.04 0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.29 1p88 s SER 230 CO 0.54 -0.19 0.02 -0.31 1.20 0.00 0.00 173.24 174.50 1p88 s TYR 231 N -1.12 3.06 0.29 3.44 2.02 -1.26 -4.44 117.35 119.34 1p88 s TYR 231 Ca -0.10 -0.44 0.11 0.00 -0.37 0.00 0.00 57.07 56.27 1p88 s TYR 231 Cb -0.08 -2.12 -0.05 0.00 -0.40 0.00 0.00 41.96 39.31 1p88 s TYR 231 CO -0.00 -0.25 -0.12 -0.65 -1.57 0.00 0.00 175.55 172.96 1p88 s GLN 232 N 1.12 1.88 -0.38 -0.62 -0.21 0.32 -0.27 119.66 121.50 1p88 s GLN 232 Ca 0.03 -1.71 -0.20 0.00 0.02 0.00 0.00 55.36 53.49 1p88 s GLN 232 Cb -0.14 -1.87 0.01 0.00 1.00 0.00 0.00 33.01 32.01 1p88 s GLN 232 CO 0.02 0.29 0.64 -1.12 -2.12 0.00 0.00 175.29 172.99 1p88 s SER 233 N -3.59 6.39 0.00 5.90 0.01 -1.26 -4.38 113.70 116.77 1p88 s SER 233 Ca 0.31 0.01 0.12 0.00 1.31 0.00 0.00 55.95 57.70 1p88 s SER 233 Cb -0.04 -2.32 0.74 0.00 0.21 0.00 0.00 66.02 64.61 1p88 s SER 233 CO 0.17 -0.65 1.17 -0.81 0.41 0.00 0.00 173.24 173.53 1p88 n PRO 234 N 6.11 0.48 0.00 12.44 -0.04 -1.26 -4.88 135.00 147.85 1p88 n PRO 234 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1p88 n PRO 234 Cb 0.48 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 1p88 n PRO 234 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p88 n GLY 235 N -0.03 0.97 3.27 0.55 0.00 -1.26 -4.87 105.19 103.81 1p88 n GLY 235 Ca 0.09 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 1p88 n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p88 s THR 236 N 0.00 2.17 -0.04 2.61 2.01 -1.26 0.17 115.64 121.29 1p88 s THR 236 Ca 0.00 -1.01 0.03 0.00 0.31 0.00 0.00 61.69 61.02 1p88 s THR 236 Cb 0.00 -1.81 0.01 0.00 0.01 0.00 0.00 72.50 70.71 1p88 s THR 236 CO 0.00 0.56 -0.12 -0.47 -0.69 0.00 0.00 174.62 173.91 1p88 s TYR 237 N 0.04 1.29 -0.41 4.92 6.14 0.59 -4.88 117.35 125.03 1p88 s TYR 237 Ca -0.09 -0.40 -0.17 0.00 0.64 0.00 0.00 57.07 57.05 1p88 s TYR 237 Cb -0.15 -0.92 0.02 0.00 0.42 0.00 0.00 41.96 41.32 1p88 s TYR 237 CO 0.06 -0.18 0.41 -1.17 0.64 0.00 0.00 175.55 175.31 1p88 s LEU 238 N 0.37 4.86 -0.38 6.97 1.98 -1.26 0.13 118.68 131.35 1p88 s LEU 238 Ca -0.08 -0.66 -0.29 0.00 -2.89 0.00 0.00 54.13 50.21 1p88 s LEU 238 Cb -0.12 -2.35 0.02 0.00 0.66 0.00 0.00 46.19 44.39 1p88 s LEU 238 CO 0.02 -0.54 1.15 -0.69 -1.89 0.00 0.00 176.35 174.40 1p88 s VAL 239 N 2.07 4.30 -2.24 1.68 1.01 0.15 -4.88 120.40 122.50 1p88 s VAL 239 Ca 0.11 1.43 0.30 0.00 0.00 0.00 0.00 61.98 63.83 1p88 s VAL 239 Cb -0.17 -4.43 0.74 0.00 0.00 0.00 0.00 36.38 32.51 1p88 s VAL 239 CO 0.13 -0.69 2.00 -0.62 0.00 0.00 0.00 175.10 175.92