#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 0.01 4.04 5.03 -1.26 -2.26 115.26 120.83 1p88 n ASN 26 Ca 0.00 0.00 -0.08 0.00 0.87 0.00 0.00 54.58 55.37 1p88 n ASN 26 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 38.70 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 -0.14 -0.78 3.52 3.08 -1.99 -3.15 114.38 114.92 1p88 h ARG 27 Ca 0.00 0.01 0.19 0.00 0.07 0.00 0.00 59.98 60.25 1p88 h ARG 27 Cb 0.00 0.03 -0.15 0.00 0.08 0.00 0.00 29.97 29.94 1p88 h ARG 27 CO 0.00 0.23 -0.07 0.00 -1.07 0.00 0.00 179.97 179.06 1p88 n ALA 28 N -2.67 0.31 0.06 0.04 0.00 -0.96 0.14 120.51 117.44 1p88 n ALA 28 Ca -0.06 0.84 -0.09 0.00 0.00 0.00 0.00 53.44 54.14 1p88 n ALA 28 Cb 0.22 -0.57 0.04 0.00 0.00 0.00 0.00 19.45 19.14 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 0.43 0.01 0.00 3.38 -1.73 -0.61 115.31 116.78 1p88 h LEU 29 Ca 0.43 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1p88 h LEU 29 Cb 0.81 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1p88 h LEU 29 CO -0.76 1.01 -0.00 0.25 0.09 0.00 0.00 178.44 179.03 1p88 h LEU 30 N 0.24 -0.01 -1.37 1.67 5.85 0.13 -1.70 115.31 120.13 1p88 h LEU 30 Ca -0.03 -0.42 -0.06 0.00 0.84 0.00 0.00 57.88 58.22 1p88 h LEU 30 Cb 1.29 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1p88 h LEU 30 CO 0.12 0.42 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.29 1p88 h LEU 31 N -0.43 0.00 -0.79 2.25 3.38 -0.38 0.20 115.31 119.54 1p88 h LEU 31 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1p88 h LEU 31 Cb 0.42 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1p88 h LEU 31 CO 0.00 0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.81 1p88 h ALA 32 N 1.72 0.99 0.21 1.53 0.00 -0.91 -0.87 119.26 121.92 1p88 h ALA 32 Ca -0.00 -0.29 -0.30 0.00 0.00 0.00 0.00 54.91 54.33 1p88 h ALA 32 Cb 0.62 -0.21 0.03 0.00 0.00 0.00 0.00 17.79 18.23 1p88 h ALA 32 CO 0.04 0.62 -1.34 0.00 0.00 0.00 0.00 179.25 178.57 1p88 h ALA 33 N 1.15 -0.08 0.00 0.00 0.00 -0.65 -3.19 119.26 116.49 1p88 h ALA 33 Ca 0.16 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1p88 h ALA 33 Cb 0.50 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1p88 h ALA 33 CO 0.02 0.66 0.00 1.28 0.00 0.00 0.00 179.25 181.22 1p88 n LEU 34 N -3.83 0.00 -5.04 0.00 4.77 0.65 0.00 117.00 113.56 1p88 n LEU 34 Ca -0.18 0.15 -0.20 0.00 -0.03 0.00 0.00 56.01 55.75 1p88 n LEU 34 Cb 1.01 -0.15 0.06 0.00 -2.33 0.00 0.00 43.42 42.02 1p88 n LEU 34 CO 0.55 -0.08 0.36 0.00 -1.33 0.00 0.00 177.39 176.89 1p88 s ALA 35 N -2.29 4.73 -0.28 -1.18 0.00 -0.34 -1.69 121.76 120.71 1p88 s ALA 35 Ca 0.17 -2.17 -0.04 0.00 0.00 0.00 0.00 51.96 49.92 1p88 s ALA 35 Cb 0.09 -1.44 0.03 0.00 0.00 0.00 0.00 23.12 21.80 1p88 s ALA 35 CO 0.19 -0.90 0.00 -1.01 0.00 0.00 0.00 175.76 174.04 1p88 s HIS 36 N -2.69 3.14 0.00 0.00 3.76 0.16 0.16 115.29 119.81 1p88 s HIS 36 Ca 0.62 -1.42 0.00 0.00 -0.15 0.00 0.00 55.06 54.11 1p88 s HIS 36 Cb -0.05 -2.14 0.00 0.00 1.11 0.00 0.00 32.58 31.49 1p88 s HIS 36 CO 0.39 -0.69 0.00 0.41 -0.85 0.00 0.00 174.74 174.00 1p88 n GLY 37 N 4.73 2.38 3.58 -2.22 0.00 -1.26 -1.17 105.19 111.23 1p88 n GLY 37 Ca -0.15 -2.05 -0.40 0.00 0.00 0.00 0.00 46.02 43.42 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 -2.31 3.82 0.10 1.61 2.20 -1.25 0.26 119.74 124.17 1p88 s LYS 38 Ca 0.00 -0.10 0.09 0.00 -0.36 0.00 0.00 55.97 55.60 1p88 s LYS 38 Cb 0.00 -3.73 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 1p88 s LYS 38 CO 0.00 -0.43 -0.22 0.99 -0.36 0.00 0.00 175.35 175.34 1p88 s THR 39 N 2.15 2.59 -0.07 3.43 2.01 -0.92 -4.54 115.64 120.29 1p88 s THR 39 Ca 0.15 -1.51 -0.02 0.00 0.31 0.00 0.00 61.69 60.62 1p88 s THR 39 Cb -0.16 -2.14 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 1p88 s THR 39 CO 0.11 0.16 0.04 -0.69 -0.69 0.00 0.00 174.62 173.55 1p88 s VAL 40 N -1.05 4.56 -0.24 3.82 1.01 0.49 0.06 120.40 129.06 1p88 s VAL 40 Ca 0.16 -0.23 -0.02 0.00 0.00 0.00 0.00 61.98 61.89 1p88 s VAL 40 Cb -0.10 -2.97 0.02 0.00 0.00 0.00 0.00 36.38 33.33 1p88 s VAL 40 CO 0.07 0.55 -0.06 -0.76 0.00 0.00 0.00 175.10 174.90 1p88 s LEU 41 N -1.10 3.09 0.10 3.92 2.01 0.36 0.21 118.68 127.27 1p88 s LEU 41 Ca 0.16 -0.78 0.02 0.00 0.01 0.00 0.00 54.13 53.54 1p88 s LEU 41 Cb -0.12 -1.67 -0.04 0.00 0.01 0.00 0.00 46.19 44.38 1p88 s LEU 41 CO 0.05 -0.10 0.16 0.28 1.01 0.00 0.00 176.35 177.75 1p88 s THR 42 N 1.35 4.93 -1.41 5.49 -1.32 0.30 -0.69 115.64 124.30 1p88 s THR 42 Ca 0.01 -0.69 0.00 0.00 -1.21 0.00 0.00 61.69 59.81 1p88 s THR 42 Cb -0.16 -3.44 0.00 0.00 -1.51 0.00 0.00 72.50 67.39 1p88 s THR 42 CO -0.05 0.05 0.00 -3.20 -2.21 0.00 0.00 174.62 169.22 1p88 n ASN 43 N 0.10 -4.76 -3.17 8.08 2.85 -0.76 0.55 115.26 118.16 1p88 n ASN 43 Ca -0.07 0.05 -0.09 0.00 -0.11 0.00 0.00 54.58 54.36 1p88 n ASN 43 Cb 0.52 -3.84 0.09 0.00 1.24 0.00 0.00 39.78 37.79 1p88 n ASN 43 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1p88 n LEU 44 N -2.19 0.00 -4.41 1.20 4.77 0.40 -4.68 117.00 112.09 1p88 n LEU 44 Ca -0.18 -0.26 -0.33 0.00 -0.03 0.00 0.00 56.01 55.21 1p88 n LEU 44 Cb 0.62 -0.36 -0.14 0.00 -2.33 0.00 0.00 43.42 41.21 1p88 n LEU 44 CO 0.22 -1.87 -0.43 -0.22 -1.33 0.00 0.00 177.39 173.76 1p88 s LEU 45 N 0.00 2.82 -0.97 2.23 2.96 -1.26 -4.79 118.68 119.67 1p88 s LEU 45 Ca 0.20 -0.27 -0.18 0.00 -0.22 0.00 0.00 54.13 53.65 1p88 s LEU 45 Cb -0.03 -1.63 0.13 0.00 0.50 0.00 0.00 46.19 45.15 1p88 s LEU 45 CO 0.16 0.19 1.19 -0.62 -1.32 0.00 0.00 176.35 175.95 1p88 s ASP 46 N 0.19 6.67 -0.22 3.68 2.15 -1.26 -4.48 116.67 123.40 1p88 s ASP 46 Ca -0.07 -2.12 -0.27 0.00 0.43 0.00 0.00 52.55 50.52 1p88 s ASP 46 Cb -0.15 -2.41 0.10 0.00 -0.30 0.00 0.00 42.92 40.16 1p88 s ASP 46 CO 0.05 -1.05 0.89 -0.44 -0.17 0.00 0.00 175.17 174.44 1p88 s SER 47 N 3.62 -0.55 0.44 -0.34 0.01 -1.26 -5.01 113.70 110.61 1p88 s SER 47 Ca 0.35 0.93 0.39 0.00 1.31 0.00 0.00 55.95 58.93 1p88 s SER 47 Cb -0.04 0.90 1.40 0.00 0.21 0.00 0.00 66.02 68.48 1p88 s SER 47 CO -0.08 -0.28 1.28 0.47 0.41 0.00 0.00 173.24 175.04 1p88 n ASP 48 N 1.91 0.03 -0.28 2.44 8.00 -1.26 0.20 116.55 127.58 1p88 n ASP 48 Ca -0.13 0.87 -0.01 0.00 0.71 0.00 0.00 54.79 56.22 1p88 n ASP 48 Cb 0.56 -0.43 0.11 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 0.77 0.12 -2.24 3.04 -1.84 0.19 116.42 116.45 1p88 h ASP 49 Ca 0.77 0.01 -0.24 0.00 -3.24 0.00 0.00 57.03 54.33 1p88 h ASP 49 Cb 3.00 -0.15 0.00 0.00 -1.04 0.00 0.00 39.33 41.14 1p88 h ASP 49 CO -0.07 0.51 -1.16 0.58 -2.04 0.00 0.00 179.24 177.06 1p88 h VAL 50 N 0.90 1.22 -1.00 4.15 2.07 0.21 -1.84 116.25 121.96 1p88 h VAL 50 Ca 0.33 -2.44 0.22 0.00 0.82 0.00 0.00 66.70 65.63 1p88 h VAL 50 Cb 0.10 2.88 -0.11 0.00 -1.52 0.00 0.00 31.29 32.65 1p88 h VAL 50 CO -0.15 0.69 0.61 -0.09 0.02 0.00 0.00 177.57 178.66 1p88 h ARG 51 N -0.38 0.62 0.06 1.57 2.43 -1.10 0.50 114.38 118.10 1p88 h ARG 51 Ca -0.24 -0.04 -0.24 0.00 -0.81 0.00 0.00 59.98 58.65 1p88 h ARG 51 Cb 1.68 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 31.08 1p88 h ARG 51 CO 0.08 0.41 -1.14 0.45 -1.51 0.00 0.00 179.97 178.26 1p88 h HIS 52 N 0.64 0.24 -0.75 2.20 3.86 -0.70 1.27 115.15 121.91 1p88 h HIS 52 Ca 0.59 -0.17 0.14 0.00 -1.16 0.00 0.00 60.37 59.76 1p88 h HIS 52 Cb 1.09 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 29.50 1p88 h HIS 52 CO -0.00 1.14 0.50 1.98 0.86 0.00 0.00 177.93 182.40 1p88 h MET 53 N 0.04 0.46 0.13 2.45 1.85 0.72 3.90 114.93 124.48 1p88 h MET 53 Ca -0.08 -0.03 -0.24 0.00 -0.61 0.00 0.00 59.70 58.74 1p88 h MET 53 Cb 1.88 -0.10 0.01 0.00 0.43 0.00 0.00 31.60 33.81 1p88 h MET 53 CO 0.16 0.30 -1.17 -0.07 -0.40 0.00 0.00 176.91 175.74 1p88 h LEU 54 N 0.47 0.42 -1.23 3.39 3.38 -0.34 -3.15 115.31 118.25 1p88 h LEU 54 Ca 0.36 -0.89 0.02 0.00 0.09 0.00 0.00 57.88 57.47 1p88 h LEU 54 Cb 0.75 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 1p88 h LEU 54 CO -0.12 1.53 0.53 -1.13 0.09 0.00 0.00 178.44 179.34 1p88 h ASN 55 N -0.33 0.88 -0.19 -0.43 -1.24 0.42 1.29 115.58 115.98 1p88 h ASN 55 Ca -0.24 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 56.75 1p88 h ASN 55 Cb 1.72 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 40.55 1p88 h ASN 55 CO 0.10 0.62 0.10 0.00 -1.29 0.00 0.00 177.43 176.95 1p88 h ALA 56 N 1.52 0.25 -0.83 1.57 0.00 0.72 0.70 119.26 123.19 1p88 h ALA 56 Ca 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1p88 h ALA 56 Cb -0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1p88 h ALA 56 CO -0.08 -0.20 0.47 -0.07 0.00 0.00 0.00 179.25 179.37 1p88 h LEU 57 N 0.19 1.03 -1.61 0.00 4.07 -1.28 -1.14 115.31 116.57 1p88 h LEU 57 Ca 0.07 -0.09 0.02 0.00 0.08 0.00 0.00 57.88 57.96 1p88 h LEU 57 Cb 0.10 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.56 1p88 h LEU 57 CO -0.01 0.82 0.29 0.74 -1.08 0.00 0.00 178.44 179.21 1p88 h THR 58 N 1.15 1.06 0.13 0.22 2.02 0.28 1.02 112.91 118.80 1p88 h THR 58 Ca 0.29 -0.18 -0.29 0.00 0.77 0.00 0.00 66.41 67.00 1p88 h THR 58 Cb 0.01 0.50 0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1p88 h THR 58 CO -0.05 0.09 -1.25 0.00 0.37 0.00 0.00 175.52 174.69 1p88 h ALA 59 N 1.74 0.04 0.00 6.16 0.00 0.15 -3.24 119.26 124.12 1p88 h ALA 59 Ca 0.17 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1p88 h ALA 59 Cb 0.05 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1p88 h ALA 59 CO -0.04 0.76 0.00 1.28 0.00 0.00 0.00 179.25 181.25 1p88 n LEU 60 N -3.72 0.74 -0.00 0.00 4.77 -0.63 -4.65 117.00 113.50 1p88 n LEU 60 Ca -0.12 0.57 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1p88 n LEU 60 Cb 0.99 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1p88 n LEU 60 CO 0.57 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1p88 n GLY 61 N 1.26 1.41 3.64 -0.72 0.00 -0.12 -4.40 105.19 106.26 1p88 n GLY 61 Ca 0.06 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1p88 n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p88 s VAL 62 N -2.01 5.03 0.05 1.61 1.01 0.34 -4.99 120.40 121.44 1p88 s VAL 62 Ca 0.00 1.07 -0.23 0.00 0.00 0.00 0.00 61.98 62.81 1p88 s VAL 62 Cb 0.00 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 1p88 s VAL 62 CO 0.00 0.08 0.71 -0.55 0.00 0.00 0.00 175.10 175.34 1p88 s SER 63 N 1.39 7.16 0.27 3.32 0.15 -1.26 -4.21 113.70 120.51 1p88 s SER 63 Ca 0.25 1.38 -0.21 0.00 0.70 0.00 0.00 55.95 58.08 1p88 s SER 63 Cb -0.16 -2.44 0.04 0.00 -1.71 0.00 0.00 66.02 61.76 1p88 s SER 63 CO 0.09 0.08 0.81 -0.72 1.20 0.00 0.00 173.24 174.70 1p88 s TYR 64 N -0.29 -0.10 0.03 3.44 1.13 -1.26 0.20 117.35 120.50 1p88 s TYR 64 Ca 0.36 -0.37 0.03 0.00 -1.41 0.00 0.00 57.07 55.68 1p88 s TYR 64 Cb -0.20 0.72 -0.02 0.00 -1.10 0.00 0.00 41.96 41.36 1p88 s TYR 64 CO 0.22 -1.20 -0.09 0.99 -2.51 0.00 0.00 175.55 172.96 1p88 s THR 65 N -3.35 0.65 -0.04 -3.49 2.01 0.52 -4.94 115.64 106.99 1p88 s THR 65 Ca 0.13 -0.91 0.06 0.00 0.31 0.00 0.00 61.69 61.27 1p88 s THR 65 Cb -0.05 -0.65 -0.02 0.00 0.01 0.00 0.00 72.50 71.79 1p88 s THR 65 CO 0.07 -0.21 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.36 1p88 s LEU 66 N -1.23 2.31 0.00 4.42 2.96 -1.26 0.12 118.68 126.01 1p88 s LEU 66 Ca -0.05 -0.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.47 1p88 s LEU 66 Cb -0.08 -1.43 0.00 0.00 0.50 0.00 0.00 46.19 45.18 1p88 s LEU 66 CO 0.01 0.30 0.00 -1.20 -1.32 0.00 0.00 176.35 174.14 1p88 n SER 67 N 2.58 -0.73 -0.04 3.68 7.64 0.36 -4.96 113.62 122.16 1p88 n SER 67 Ca -0.17 -0.09 -0.14 0.00 1.01 0.00 0.00 58.87 59.49 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 n ALA 68 N -3.00 1.32 1.55 -0.43 0.00 -1.26 -4.00 120.51 114.68 1p88 n ALA 68 Ca 0.00 -0.86 0.11 0.00 0.00 0.00 0.00 53.44 52.69 1p88 n ALA 68 Cb 0.00 -0.59 0.66 0.00 0.00 0.00 0.00 19.45 19.52 1p88 n ALA 68 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1p88 n ASP 69 N -3.14 0.00 -3.70 0.00 9.92 -1.26 -4.86 116.55 113.51 1p88 n ASP 69 Ca -0.28 -0.86 -0.26 0.00 -0.53 0.00 0.00 54.79 52.86 1p88 n ASP 69 Cb 1.06 0.00 0.06 0.00 -0.64 0.00 0.00 41.12 41.60 1p88 n ASP 69 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1p88 n ARG 70 N -0.95 -7.06 0.00 -1.24 5.12 -1.26 -4.83 116.66 106.45 1p88 n ARG 70 Ca 0.17 0.75 0.00 0.00 -1.93 0.00 0.00 57.85 56.84 1p88 n ARG 70 Cb 0.08 -5.75 0.00 0.00 -1.16 0.00 0.00 32.46 25.63 1p88 n ARG 70 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1p88 n THR 71 N -4.89 0.00 -3.95 0.55 -2.24 -1.26 -4.27 114.28 98.22 1p88 n THR 71 Ca 0.02 -0.02 -0.35 0.00 -2.27 0.00 0.00 64.05 61.43 1p88 n THR 71 Cb 0.55 0.95 -0.14 0.00 -2.10 0.00 0.00 70.33 69.58 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 -0.04 3.08 -0.07 -0.78 0.52 -1.25 0.15 118.95 120.56 1p88 s ARG 72 Ca 0.00 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.41 1p88 s ARG 72 Cb 0.00 -2.96 0.02 0.00 0.52 0.00 0.00 34.95 32.52 1p88 s ARG 72 CO 0.00 -0.30 -0.10 0.00 0.02 0.00 0.00 175.30 174.92 1p88 s GLU 74 N 0.82 3.49 -0.13 0.00 2.12 0.12 0.13 118.70 125.26 1p88 s GLU 74 Ca -0.12 -0.62 0.01 0.00 0.36 0.00 0.00 54.97 54.60 1p88 s GLU 74 Cb -0.15 -2.77 0.02 0.00 0.26 0.00 0.00 34.13 31.49 1p88 s GLU 74 CO 0.02 0.18 -0.16 0.42 -0.54 0.00 0.00 175.26 175.18 1p88 s ILE 75 N 0.47 1.61 -0.66 -3.70 1.01 0.11 0.19 121.20 120.22 1p88 s ILE 75 Ca -0.07 -0.69 -0.26 0.00 0.00 0.00 0.00 60.65 59.63 1p88 s ILE 75 Cb -0.15 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.81 1p88 s ILE 75 CO 0.04 0.46 1.94 0.27 0.00 0.00 0.00 174.94 177.65 1p88 s ILE 76 N 1.15 3.33 0.29 2.92 -0.00 0.53 -2.15 121.20 127.27 1p88 s ILE 76 Ca -0.02 0.07 -0.21 0.00 -0.00 0.00 0.00 60.65 60.49 1p88 s ILE 76 Cb -0.14 -3.85 -0.14 0.00 -0.00 0.00 0.00 42.46 38.32 1p88 s ILE 76 CO -0.05 -0.82 0.22 0.61 -0.00 0.00 0.00 174.94 174.90 1p88 n GLY 77 N 5.97 -2.11 0.01 6.27 0.00 0.74 -4.09 105.19 111.98 1p88 n GLY 77 Ca 0.26 0.11 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 1.97 0.54 0.00 1.61 2.85 0.19 -4.11 115.26 118.31 1p88 n ASN 78 Ca 0.12 -0.21 0.00 0.00 -0.11 0.00 0.00 54.58 54.38 1p88 n ASN 78 Cb 0.31 0.28 0.00 0.00 1.24 0.00 0.00 39.78 41.61 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 1.47 0.71 0.00 8.20 0.00 0.42 -4.91 105.19 111.08 1p88 n GLY 79 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1p88 n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p88 n GLY 80 N -2.00 -0.19 3.66 -0.02 0.00 -0.68 -4.75 105.19 101.21 1p88 n GLY 80 Ca 0.00 -0.86 -0.53 0.00 0.00 0.00 0.00 46.02 44.63 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 1.39 -2.44 1.61 -0.02 -1.26 -4.09 135.00 130.19 1p88 n PRO 81 Ca 0.00 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.57 1p88 n PRO 81 Cb 0.00 -2.21 -0.02 0.00 -0.02 0.00 0.00 33.50 31.25 1p88 n PRO 81 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1p88 s LEU 82 N 2.20 3.45 0.18 2.45 2.01 -1.26 -4.88 118.68 122.83 1p88 s LEU 82 Ca 0.90 0.33 -0.28 0.00 0.01 0.00 0.00 54.13 55.10 1p88 s LEU 82 Cb -0.94 -3.18 -0.08 0.00 0.01 0.00 0.00 46.19 42.00 1p88 s LEU 82 CO 0.54 -1.59 0.87 -1.38 1.01 0.00 0.00 176.35 175.80 1p88 s HIS 83 N 5.60 3.91 -0.22 0.29 -3.43 -1.26 -4.91 115.29 115.28 1p88 s HIS 83 Ca 0.51 1.76 -0.10 0.00 -0.80 0.00 0.00 55.06 56.43 1p88 s HIS 83 Cb -0.10 -2.90 -0.05 0.00 -1.43 0.00 0.00 32.58 28.10 1p88 s HIS 83 CO 0.27 0.43 0.14 0.00 -2.00 0.00 0.00 174.74 173.58 1p88 s ALA 84 N -0.91 3.61 -0.03 -1.38 0.00 -1.26 -4.50 121.76 117.29 1p88 s ALA 84 Ca 0.40 -0.82 -0.30 0.00 0.00 0.00 0.00 51.96 51.24 1p88 s ALA 84 Cb -0.24 -2.24 -0.05 0.00 0.00 0.00 0.00 23.12 20.59 1p88 s ALA 84 CO 0.29 -0.05 1.42 -1.21 0.00 0.00 0.00 175.76 176.20 1p88 s GLU 85 N 0.78 4.26 0.42 0.00 0.41 -1.26 -4.63 118.70 118.68 1p88 s GLU 85 Ca 0.07 1.96 0.00 0.00 -0.41 0.00 0.00 54.97 56.59 1p88 s GLU 85 Cb -0.13 -3.66 0.00 0.00 -1.78 0.00 0.00 34.13 28.56 1p88 s GLU 85 CO 0.02 -0.63 0.00 0.41 -0.49 0.00 0.00 175.26 174.57 1p88 n GLY 86 N 3.71 -2.31 3.77 -1.39 0.00 -1.26 -4.70 105.19 103.02 1p88 n GLY 86 Ca 0.14 -1.09 -0.38 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.84 3.13 0.28 4.61 0.00 -1.26 -4.62 121.76 121.06 1p88 s ALA 87 Ca 0.00 0.84 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 -0.37 -0.09 -1.17 0.00 0.00 0.00 175.76 174.13 1p88 s LEU 88 N -2.50 2.90 -0.26 0.00 2.96 0.56 -4.98 118.68 117.38 1p88 s LEU 88 Ca 0.57 -0.85 -0.04 0.00 -0.22 0.00 0.00 54.13 53.59 1p88 s LEU 88 Cb -0.27 -1.41 0.09 0.00 0.50 0.00 0.00 46.19 45.10 1p88 s LEU 88 CO 0.34 -0.00 0.11 -1.61 -1.32 0.00 0.00 176.35 173.87 1p88 s GLU 89 N -3.60 0.25 -0.27 1.98 2.02 -1.26 0.22 118.70 118.04 1p88 s GLU 89 Ca 0.31 -0.48 -0.12 0.00 0.02 0.00 0.00 54.97 54.70 1p88 s GLU 89 Cb -0.05 -1.47 -0.05 0.00 0.10 0.00 0.00 34.13 32.66 1p88 s GLU 89 CO 0.18 -0.91 0.24 -0.51 0.02 0.00 0.00 175.26 174.27 1p88 s LEU 90 N 2.04 4.04 -0.69 1.80 1.02 0.43 -4.90 118.68 122.42 1p88 s LEU 90 Ca 0.07 0.10 -0.18 0.00 0.02 0.00 0.00 54.13 54.13 1p88 s LEU 90 Cb -0.16 -2.20 0.12 0.00 0.02 0.00 0.00 46.19 43.97 1p88 s LEU 90 CO -0.27 -0.07 0.81 -0.36 0.02 0.00 0.00 176.35 176.48 1p88 s PHE 91 N 1.73 3.11 -0.88 0.29 0.08 -1.26 0.23 117.98 121.28 1p88 s PHE 91 Ca 0.09 -1.17 0.00 0.00 0.12 0.00 0.00 56.93 55.98 1p88 s PHE 91 Cb -0.16 -4.06 0.34 0.00 -0.57 0.00 0.00 43.02 38.58 1p88 s PHE 91 CO 0.10 -1.31 1.70 1.28 -0.10 0.00 0.00 175.22 176.89 1p88 n LEU 92 N 6.12 6.81 0.00 -0.37 7.99 0.40 -4.83 117.00 133.11 1p88 n LEU 92 Ca 0.01 -5.28 0.00 0.00 -0.01 0.00 0.00 56.01 50.73 1p88 n LEU 92 Cb 0.44 -1.00 0.00 0.00 -0.11 0.00 0.00 43.42 42.75 1p88 n LEU 92 CO 0.54 2.03 0.43 0.61 -1.51 0.00 0.00 177.39 179.49 1p88 n GLY 93 N -0.24 -2.17 0.42 -0.72 0.00 -1.25 -2.75 105.19 98.48 1p88 n GLY 93 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1p88 n GLY 93 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p88 n ASN 94 N -2.00 0.68 0.00 1.61 3.02 -1.26 -3.90 115.26 113.41 1p88 n ASN 94 Ca 0.00 -1.60 0.00 0.00 -0.03 0.00 0.00 54.58 52.95 1p88 n ASN 94 Cb 0.00 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 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 0.01 0.00 0.00 5.41 0.00 -1.11 -2.94 120.51 121.88 1p88 n ALA 95 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1p88 n ALA 95 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1p88 n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p88 n GLY 96 N 1.71 0.53 0.00 0.00 0.00 -1.18 -3.85 105.19 102.40 1p88 n GLY 96 Ca 0.00 -0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.10 1p88 n GLY 96 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p88 n THR 97 N 0.00 0.66 -0.11 2.61 -2.24 -1.26 -3.01 114.28 110.93 1p88 n THR 97 Ca 0.00 0.17 -0.14 0.00 -2.27 0.00 0.00 64.05 61.81 1p88 n THR 97 Cb 0.00 -0.87 -0.14 0.00 -2.10 0.00 0.00 70.33 67.22 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 -1.41 1.46 -0.11 6.98 0.00 -1.25 -4.18 120.51 122.00 1p88 n ALA 98 Ca 0.06 -1.22 -0.10 0.00 0.00 0.00 0.00 53.44 52.19 1p88 n ALA 98 Cb 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 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 0.52 0.26 0.00 -1.53 -1.84 0.95 114.93 113.30 1p88 h MET 99 Ca -0.56 -0.11 0.00 0.00 -3.44 0.00 0.00 59.70 55.60 1p88 h MET 99 Cb 2.09 -0.08 -0.03 0.00 -0.55 0.00 0.00 31.60 33.03 1p88 h MET 99 CO -0.02 0.54 -0.48 0.00 0.14 0.00 0.00 176.91 177.09 1p88 h ARG 100 N 0.40 -0.77 -0.06 0.39 -0.00 -1.76 1.02 114.38 113.60 1p88 h ARG 100 Ca 0.11 0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.64 1p88 h ARG 100 Cb 0.22 0.17 -0.00 0.00 0.00 0.00 0.00 29.97 30.36 1p88 h ARG 100 CO -0.01 -0.51 0.03 -1.00 0.00 0.00 0.00 179.97 178.49 1p88 h PRO 101 N -0.80 0.08 0.07 0.04 0.13 -1.68 -2.26 132.00 127.59 1p88 h PRO 101 Ca -0.03 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1p88 h PRO 101 Cb 0.75 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1p88 h PRO 101 CO -0.18 0.06 -0.03 -0.07 -0.23 0.00 0.00 178.00 177.55 1p88 h LEU 102 N 0.08 -0.08 -1.88 1.56 3.38 0.03 0.52 115.31 118.92 1p88 h LEU 102 Ca 0.02 -0.53 0.24 0.00 0.09 0.00 0.00 57.88 57.71 1p88 h LEU 102 Cb 0.00 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1p88 h LEU 102 CO -0.00 0.61 0.71 0.00 0.09 0.00 0.00 178.44 179.85 1p88 h ALA 103 N -0.22 2.70 0.00 1.53 0.00 0.12 0.19 119.26 123.58 1p88 h ALA 103 Ca -0.01 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1p88 h ALA 103 Cb 0.60 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1p88 h ALA 103 CO 0.02 -1.15 -0.68 0.00 0.00 0.00 0.00 179.25 177.44 1p88 h ALA 104 N 1.37 0.11 -0.12 0.00 0.00 -1.38 -3.33 119.26 115.92 1p88 h ALA 104 Ca 0.40 -0.74 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1p88 h ALA 104 Cb 1.82 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 20.07 1p88 h ALA 104 CO -0.00 0.44 0.05 0.00 0.00 0.00 0.00 179.25 179.74 1p88 h ALA 105 N -0.62 1.87 0.00 0.00 0.00 -0.10 -2.30 119.26 118.10 1p88 h ALA 105 Ca -0.15 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1p88 h ALA 105 Cb 0.87 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1p88 h ALA 105 CO -0.09 0.11 -0.15 -0.07 0.00 0.00 0.00 179.25 179.05 1p88 h LEU 106 N 0.16 0.00 -1.08 0.00 3.38 -1.18 -3.18 115.31 113.41 1p88 h LEU 106 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1p88 h LEU 106 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1p88 h LEU 106 CO -0.00 0.15 0.00 0.00 0.09 0.00 0.00 178.44 178.68 1p88 n LEU 108 N 0.00 1.97 0.00 0.00 4.77 -1.20 0.76 117.00 123.30 1p88 n LEU 108 Ca 0.03 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1p88 n LEU 108 Cb 0.30 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1p88 n LEU 108 CO 0.03 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.55 1p88 n GLY 109 N 2.34 0.68 3.06 -0.72 0.00 -1.26 -2.38 105.19 106.91 1p88 n GLY 109 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1p88 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1p88 s SER 110 N -1.29 -0.81 -0.10 1.61 0.01 -1.26 -0.91 113.70 110.95 1p88 s SER 110 Ca 0.00 -0.36 -0.08 0.00 1.31 0.00 0.00 55.95 56.81 1p88 s SER 110 Cb 0.00 1.64 0.03 0.00 0.21 0.00 0.00 66.02 67.89 1p88 s SER 110 CO 0.00 -0.28 0.25 0.54 0.41 0.00 0.00 173.24 174.16 1p88 s ASN 111 N 2.39 -0.26 -0.61 2.44 4.22 -1.25 -4.71 114.94 117.15 1p88 s ASN 111 Ca 0.12 0.51 -0.21 0.00 -2.14 0.00 0.00 52.86 51.14 1p88 s ASN 111 Cb -0.10 0.51 0.08 0.00 1.28 0.00 0.00 41.25 43.02 1p88 s ASN 111 CO -0.20 -0.09 0.84 -1.81 -2.04 0.00 0.00 177.10 173.79 1p88 s ASP 112 N 0.23 6.19 -0.04 3.54 1.11 -1.14 -1.61 116.67 124.95 1p88 s ASP 112 Ca -0.01 -1.09 0.07 0.00 0.18 0.00 0.00 52.55 51.70 1p88 s ASP 112 Cb -0.02 -2.37 -0.01 0.00 1.07 0.00 0.00 42.92 41.58 1p88 s ASP 112 CO -0.00 -1.26 -0.24 -0.63 1.18 0.00 0.00 175.17 174.21 1p88 s ILE 113 N 3.44 1.97 -0.31 0.77 -1.09 0.74 0.21 121.20 126.92 1p88 s ILE 113 Ca 0.18 -1.04 -0.06 0.00 -2.23 0.00 0.00 60.65 57.50 1p88 s ILE 113 Cb -0.19 -1.65 0.03 0.00 -1.58 0.00 0.00 42.46 39.06 1p88 s ILE 113 CO 0.10 0.55 0.07 -0.69 -1.23 0.00 0.00 174.94 173.74 1p88 s VAL 114 N -0.36 3.67 -0.43 2.92 1.01 0.60 0.19 120.40 128.01 1p88 s VAL 114 Ca 0.03 -0.99 -0.13 0.00 0.00 0.00 0.00 61.98 60.89 1p88 s VAL 114 Cb -0.12 -2.99 0.05 0.00 0.00 0.00 0.00 36.38 33.33 1p88 s VAL 114 CO 0.01 -0.04 0.31 -0.76 0.00 0.00 0.00 175.10 174.63 1p88 s LEU 115 N 1.41 5.24 0.00 3.92 1.43 0.43 0.16 118.68 131.28 1p88 s LEU 115 Ca -0.00 -1.21 0.01 0.00 -1.03 0.00 0.00 54.13 51.89 1p88 s LEU 115 Cb -0.18 -2.11 0.01 0.00 0.03 0.00 0.00 46.19 43.94 1p88 s LEU 115 CO 0.02 -0.53 0.04 0.41 0.23 0.00 0.00 176.35 176.52 1p88 n THR 116 N 5.09 0.00 -3.47 5.49 -1.04 0.14 -2.03 114.28 118.46 1p88 n THR 116 Ca -0.12 -0.95 -0.03 0.00 -2.04 0.00 0.00 64.05 60.91 1p88 n THR 116 Cb 0.45 0.06 0.01 0.00 -1.82 0.00 0.00 70.33 69.03 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 2.48 1.33 3.83 3.41 0.00 -1.26 0.15 105.19 115.12 1p88 n GLY 117 Ca -0.07 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.03 0.96 0.36 1.61 2.02 -1.26 -4.73 118.70 115.62 1p88 s GLU 118 Ca 0.08 0.05 0.15 0.00 0.02 0.00 0.00 54.97 55.27 1p88 s GLU 118 Cb -0.02 -1.84 1.03 0.00 0.10 0.00 0.00 34.13 33.40 1p88 s GLU 118 CO 0.04 -2.27 1.72 -1.35 0.02 0.00 0.00 175.26 173.43 1p88 h PRO 119 N -1.55 0.43 0.00 0.39 0.11 -2.02 0.85 132.00 130.21 1p88 h PRO 119 Ca -0.47 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1p88 h PRO 119 Cb 1.30 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1p88 h PRO 119 CO 0.54 0.28 -0.15 0.00 -0.21 0.00 0.00 178.00 178.47 1p88 h ARG 120 N 0.44 0.00 -0.18 1.05 3.08 -1.93 -2.53 114.38 114.32 1p88 h ARG 120 Ca 0.66 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.70 1p88 h ARG 120 Cb 1.49 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.53 1p88 h ARG 120 CO -0.44 0.15 0.08 1.98 -1.07 0.00 0.00 179.97 180.67 1p88 h MET 121 N 0.00 0.24 0.00 0.04 4.05 0.50 0.11 114.93 119.87 1p88 h MET 121 Ca -0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1p88 h MET 121 Cb 0.58 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.32 1p88 h MET 121 CO 0.02 0.20 0.00 0.87 0.23 0.00 0.00 176.91 178.22 1p88 h LYS 122 N 0.25 0.00 -0.00 0.39 6.56 -1.47 0.13 116.57 122.42 1p88 h LYS 122 Ca 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.65 1p88 h LYS 122 Cb 0.03 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.69 1p88 h LYS 122 CO -0.01 0.00 -0.01 0.39 -2.06 0.00 0.00 179.45 177.76 1p88 n GLU 123 N -2.59 1.11 -3.75 3.15 -0.58 0.39 -4.40 120.64 113.96 1p88 n GLU 123 Ca -0.00 -0.23 -0.29 0.00 -0.42 0.00 0.00 57.16 56.21 1p88 n GLU 123 Cb 0.14 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.39 1p88 n GLU 123 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1p88 s ARG 124 N -2.05 1.57 0.61 3.49 0.52 0.03 -5.12 118.95 118.01 1p88 s ARG 124 Ca 0.44 -2.36 -0.19 0.00 -0.52 0.00 0.00 55.73 53.09 1p88 s ARG 124 Cb 0.22 -2.60 -0.03 0.00 0.52 0.00 0.00 34.95 33.06 1p88 s ARG 124 CO 0.37 -1.20 1.29 -0.35 0.02 0.00 0.00 175.30 175.43 1p88 n PRO 125 N 3.11 1.28 0.00 3.54 -0.04 -1.26 -4.29 135.00 137.34 1p88 n PRO 125 Ca 0.12 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 1p88 n PRO 125 Cb 0.36 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.30 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 -1.63 0.59 -0.24 0.52 0.13 0.26 -4.78 119.36 114.22 1p88 n ILE 126 Ca 0.14 -0.78 -0.00 0.00 -1.10 0.00 0.00 62.75 61.01 1p88 n ILE 126 Cb 0.47 0.71 0.12 0.00 -0.84 0.00 0.00 39.64 40.10 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 1.01 0.78 4.50 0.00 -1.77 0.10 103.07 107.69 1p88 h GLY 127 Ca 0.00 -0.23 0.11 0.00 0.00 0.00 0.00 47.33 47.21 1p88 h GLY 127 CO 0.00 0.10 0.52 0.45 0.00 0.00 0.00 176.54 177.61 1p88 h HIS 128 N 0.62 0.73 -0.00 5.60 3.86 -1.88 0.16 115.15 124.24 1p88 h HIS 128 Ca 0.32 0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 59.37 1p88 h HIS 128 Cb 0.29 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 28.54 1p88 h HIS 128 CO -0.10 0.33 -0.70 1.25 0.86 0.00 0.00 177.93 179.57 1p88 h LEU 129 N 0.67 0.62 -0.36 2.43 5.85 -1.63 -2.24 115.31 120.65 1p88 h LEU 129 Ca 0.37 -0.75 0.05 0.00 0.84 0.00 0.00 57.88 58.39 1p88 h LEU 129 Cb 0.54 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1p88 h LEU 129 CO -0.15 1.29 0.11 0.58 -0.34 0.00 0.00 178.44 179.94 1p88 h VAL 130 N 0.01 0.87 -0.20 1.05 2.07 0.46 0.49 116.25 121.01 1p88 h VAL 130 Ca -0.09 -0.09 -0.16 0.00 0.82 0.00 0.00 66.70 67.19 1p88 h VAL 130 Cb 1.40 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1p88 h VAL 130 CO 0.14 0.05 -0.53 0.44 0.02 0.00 0.00 177.57 177.69 1p88 h ASP 131 N 0.25 0.62 0.02 0.57 5.19 -0.84 0.75 116.42 122.99 1p88 h ASP 131 Ca 0.17 -0.32 -0.00 0.00 -0.62 0.00 0.00 57.03 56.26 1p88 h ASP 131 Cb 0.16 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.50 1p88 h ASP 131 CO -0.19 1.03 -0.01 0.00 -3.12 0.00 0.00 179.24 176.95 1p88 h ALA 132 N 0.98 -0.03 -0.07 3.45 0.00 -0.74 0.91 119.26 123.76 1p88 h ALA 132 Ca 0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1p88 h ALA 132 Cb 1.06 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1p88 h ALA 132 CO 0.10 -0.48 -0.10 -0.07 0.00 0.00 0.00 179.25 178.70 1p88 h LEU 133 N -0.12 0.20 -2.23 0.00 3.38 0.03 -2.82 115.31 113.75 1p88 h LEU 133 Ca -0.00 -0.53 0.02 0.00 0.09 0.00 0.00 57.88 57.45 1p88 h LEU 133 Cb 0.11 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1p88 h LEU 133 CO 0.01 0.69 0.05 0.03 0.09 0.00 0.00 178.44 179.31 1p88 h ARG 134 N -0.29 0.00 -0.08 1.13 2.47 0.61 0.89 114.38 119.11 1p88 h ARG 134 Ca 0.01 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.63 1p88 h ARG 134 Cb 0.65 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.96 1p88 h ARG 134 CO 0.02 0.00 -0.39 1.25 0.56 0.00 0.00 179.97 181.41 1p88 h LEU 135 N 0.00 0.18 -0.98 3.04 5.85 0.11 -2.34 115.31 121.17 1p88 h LEU 135 Ca 0.03 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1p88 h LEU 135 Cb 0.13 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1p88 h LEU 135 CO -0.00 0.56 0.00 0.61 -0.34 0.00 0.00 178.44 179.27 1p88 n GLY 136 N -0.27 0.67 0.69 3.75 0.00 0.22 -4.79 105.19 105.45 1p88 n GLY 136 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 0.44 0.72 3.78 -0.02 0.00 -0.88 -0.17 105.19 109.07 1p88 n GLY 137 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.33 2.75 -0.51 4.61 0.00 -0.67 -3.15 121.76 122.47 1p88 s ALA 138 Ca 0.00 0.71 -0.16 0.00 0.00 0.00 0.00 51.96 52.51 1p88 s ALA 138 Cb 0.00 -3.31 0.09 0.00 0.00 0.00 0.00 23.12 19.90 1p88 s ALA 138 CO 0.00 -0.62 0.49 0.15 0.00 0.00 0.00 175.76 175.77 1p88 s LYS 139 N -3.34 3.00 -0.05 0.00 -0.14 -0.69 -4.14 119.74 114.39 1p88 s LYS 139 Ca 0.70 -1.42 0.00 0.00 -1.36 0.00 0.00 55.97 53.89 1p88 s LYS 139 Cb -0.21 -4.20 0.02 0.00 -1.68 0.00 0.00 37.83 31.77 1p88 s LYS 139 CO 0.25 -1.20 -0.03 0.42 -0.76 0.00 0.00 175.35 174.03 1p88 s ILE 140 N 1.83 0.48 -0.02 2.17 1.01 -1.26 -1.54 121.20 123.88 1p88 s ILE 140 Ca 0.06 -0.05 0.06 0.00 0.00 0.00 0.00 60.65 60.72 1p88 s ILE 140 Cb -0.26 -0.55 -0.01 0.00 0.01 0.00 0.00 42.46 41.65 1p88 s ILE 140 CO 0.06 0.23 -0.20 -0.89 0.00 0.00 0.00 174.94 174.14 1p88 s THR 141 N 1.21 1.60 0.01 2.92 2.01 -0.74 -4.95 115.64 117.70 1p88 s THR 141 Ca -0.07 -0.86 -0.30 0.00 0.31 0.00 0.00 61.69 60.77 1p88 s THR 141 Cb -0.14 -1.34 -0.03 0.00 0.01 0.00 0.00 72.50 71.00 1p88 s THR 141 CO -0.02 0.45 1.02 -0.31 -0.69 0.00 0.00 174.62 175.07 1p88 s TYR 142 N -0.42 3.62 0.00 4.92 2.02 -1.26 -0.81 117.35 125.42 1p88 s TYR 142 Ca 0.06 1.63 0.00 0.00 -0.37 0.00 0.00 57.07 58.40 1p88 s TYR 142 Cb -0.08 -3.17 0.00 0.00 -0.40 0.00 0.00 41.96 38.31 1p88 s TYR 142 CO -0.00 -0.22 0.00 1.28 -1.57 0.00 0.00 175.55 175.04 1p88 n LEU 143 N 3.90 0.12 0.00 -1.29 4.32 -1.25 -4.90 117.00 117.89 1p88 n LEU 143 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 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 0.53 0.00 0.22 -0.62 -1.22 0.00 0.00 177.39 176.30 1p88 n GLU 144 N -0.10 0.00 -4.26 3.23 -0.58 -1.26 -4.85 120.64 112.82 1p88 n GLU 144 Ca 0.00 0.01 -0.29 0.00 -0.42 0.00 0.00 57.16 56.46 1p88 n GLU 144 Cb 0.00 -0.94 -0.10 0.00 -0.57 0.00 0.00 31.44 29.83 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 -0.88 2.05 0.28 3.49 -0.21 -1.26 -5.09 119.66 118.04 1p88 s GLN 145 Ca 0.00 -1.13 -0.29 0.00 0.02 0.00 0.00 55.36 53.96 1p88 s GLN 145 Cb 0.00 -2.23 -0.10 0.00 1.00 0.00 0.00 33.01 31.68 1p88 s GLN 145 CO 0.00 0.48 1.34 -1.21 -2.12 0.00 0.00 175.29 173.78 1p88 s GLU 146 N -2.41 4.35 -1.47 2.91 2.02 -1.26 -2.08 118.70 120.75 1p88 s GLU 146 Ca 0.22 2.19 0.00 0.00 0.02 0.00 0.00 54.97 57.40 1p88 s GLU 146 Cb -0.10 -3.11 0.00 0.00 0.10 0.00 0.00 34.13 31.02 1p88 s GLU 146 CO 0.14 -0.25 0.00 0.09 0.02 0.00 0.00 175.26 175.26 1p88 n ASN 147 N 1.59 -4.86 -4.80 -0.19 3.02 -1.26 -4.87 115.26 103.90 1p88 n ASN 147 Ca 0.03 0.34 -0.23 0.00 -0.03 0.00 0.00 54.58 54.70 1p88 n ASN 147 Cb 0.42 -3.58 -0.05 0.00 -0.61 0.00 0.00 39.78 35.96 1p88 n ASN 147 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1p88 s TYR 148 N -2.45 2.69 0.08 3.10 1.51 -0.88 0.93 117.35 122.31 1p88 s TYR 148 Ca 0.00 -0.50 -0.15 0.00 -1.01 0.00 0.00 57.07 55.41 1p88 s TYR 148 Cb 0.00 -1.99 -0.03 0.00 -0.11 0.00 0.00 41.96 39.83 1p88 s TYR 148 CO 0.00 0.08 0.88 -2.30 -1.11 0.00 0.00 175.55 173.11 1p88 n PRO 149 N -1.36 -0.21 -1.64 -1.71 -0.02 -1.26 -4.33 135.00 124.47 1p88 n PRO 149 Ca 0.00 0.87 -0.40 0.00 -2.02 0.00 0.00 63.50 61.96 1p88 n PRO 149 Cb 0.63 -1.28 0.03 0.00 -0.02 0.00 0.00 33.50 32.85 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 -4.29 1.39 -3.67 0.52 -0.02 -1.05 -4.34 135.00 123.54 1p88 n PRO 150 Ca 0.01 0.51 -0.11 0.00 -2.02 0.00 0.00 63.50 61.89 1p88 n PRO 150 Cb 0.13 -2.20 -0.09 0.00 -0.02 0.00 0.00 33.50 31.32 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 -1.42 -0.43 -0.45 2.45 1.43 -0.86 -3.97 118.68 115.43 1p88 s LEU 151 Ca 0.67 1.21 -0.10 0.00 -1.03 0.00 0.00 54.13 54.88 1p88 s LEU 151 Cb -0.49 1.95 0.10 0.00 0.03 0.00 0.00 46.19 47.77 1p88 s LEU 151 CO 0.54 -0.21 0.32 -0.13 0.23 0.00 0.00 176.35 177.10 1p88 s ARG 152 N 1.05 2.61 0.18 1.70 0.52 0.01 -0.43 118.95 124.58 1p88 s ARG 152 Ca -0.06 -1.59 -0.10 0.00 -0.52 0.00 0.00 55.73 53.46 1p88 s ARG 152 Cb -0.06 -3.90 -0.07 0.00 0.52 0.00 0.00 34.95 31.45 1p88 s ARG 152 CO -0.10 -1.08 0.51 -0.51 0.02 0.00 0.00 175.30 174.14 1p88 s LEU 153 N 1.43 4.25 0.00 2.53 1.43 0.51 -1.80 118.68 127.04 1p88 s LEU 153 Ca 0.04 0.90 0.11 0.00 -1.03 0.00 0.00 54.13 54.15 1p88 s LEU 153 Cb -0.25 -3.43 0.18 0.00 0.03 0.00 0.00 46.19 42.72 1p88 s LEU 153 CO 0.01 0.02 1.02 0.00 0.23 0.00 0.00 176.35 177.63 1p88 n GLN 154 N 0.28 0.00 -0.48 1.70 6.02 -0.59 -0.19 117.38 124.13 1p88 n GLN 154 Ca -0.03 -1.31 0.07 0.00 -0.01 0.00 0.00 57.00 55.72 1p88 n GLN 154 Cb 0.52 0.09 -0.02 0.00 1.02 0.00 0.00 30.24 31.86 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 0.21 -0.86 0.00 1.08 0.00 -1.22 -3.96 105.19 100.44 1p88 n GLY 155 Ca -0.07 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.53 1.55 3.68 -0.02 0.00 -0.09 -1.70 105.19 107.09 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 0.33 0.00 0.00 0.00 173.32 173.65 1p88 n PHE 157 N 0.00 2.59 -0.01 1.61 7.35 0.23 -3.84 117.46 125.39 1p88 n PHE 157 Ca 0.00 -0.24 -0.01 0.00 -0.76 0.00 0.00 57.45 56.44 1p88 n PHE 157 Cb 0.00 -2.76 -0.01 0.00 0.35 0.00 0.00 39.48 37.05 1p88 n PHE 157 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1p88 n THR 158 N 5.05 0.09 0.00 -2.13 -2.24 0.76 -4.55 114.28 111.26 1p88 n THR 158 Ca 0.19 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1p88 n THR 158 Cb 0.39 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 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 2.82 0.84 0.00 3.38 0.00 0.70 0.16 105.19 113.10 1p88 n GLY 159 Ca -0.02 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.00 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 2.50 3.70 -0.02 0.00 -0.82 -4.10 105.19 106.45 1p88 n GLY 160 Ca 0.00 -1.80 -0.58 0.00 0.00 0.00 0.00 46.02 43.63 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 2.23 -4.50 1.61 4.13 -1.26 -3.68 115.26 113.79 1p88 n ASN 161 Ca 0.00 1.05 -0.33 0.00 1.68 0.00 0.00 54.58 56.98 1p88 n ASN 161 Cb 0.00 -1.11 -0.12 0.00 -1.54 0.00 0.00 39.78 37.00 1p88 n ASN 161 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1p88 s VAL 162 N 3.73 3.54 -0.26 2.41 1.01 0.49 -4.75 120.40 126.56 1p88 s VAL 162 Ca 1.00 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 62.38 1p88 s VAL 162 Cb -1.12 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 1p88 s VAL 162 CO 0.67 0.55 0.11 -1.81 0.00 0.00 0.00 175.10 174.62 1p88 s ASP 163 N -0.22 5.39 -0.10 3.32 1.11 -1.26 -0.34 116.67 124.57 1p88 s ASP 163 Ca 0.02 -0.18 -0.01 0.00 0.18 0.00 0.00 52.55 52.57 1p88 s ASP 163 Cb -0.13 -1.98 0.03 0.00 1.07 0.00 0.00 42.92 41.91 1p88 s ASP 163 CO 0.03 -0.05 -0.06 -0.69 1.18 0.00 0.00 175.17 175.58 1p88 s VAL 164 N 1.65 0.85 0.26 -1.27 1.01 -0.56 -4.47 120.40 117.87 1p88 s VAL 164 Ca 0.06 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 1p88 s VAL 164 Cb -0.15 -0.91 -0.14 0.00 0.00 0.00 0.00 36.38 35.18 1p88 s VAL 164 CO 0.06 0.34 1.21 0.47 0.00 0.00 0.00 175.10 177.17 1p88 n ASP 165 N 4.98 2.01 -0.03 3.32 8.00 -1.26 -2.65 116.55 130.93 1p88 n ASP 165 Ca -0.11 1.17 -0.11 0.00 0.71 0.00 0.00 54.79 56.45 1p88 n ASP 165 Cb 0.50 -1.35 -0.05 0.00 -0.02 0.00 0.00 41.12 40.20 1p88 n ASP 165 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1p88 h GLY 166 N 3.00 0.21 -7.48 0.44 0.00 -1.27 -3.34 103.07 94.62 1p88 h GLY 166 Ca -0.43 -0.10 -0.69 0.00 0.00 0.00 0.00 47.33 46.11 1p88 h GLY 166 CO 0.67 0.09 1.01 -0.56 0.00 0.00 0.00 176.54 177.75 1p88 s SER 167 N -5.43 6.71 0.00 0.19 0.01 -1.22 0.70 113.70 114.66 1p88 s SER 167 Ca -0.13 -2.19 0.00 0.00 1.31 0.00 0.00 55.95 54.94 1p88 s SER 167 Cb 0.07 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.88 1p88 s SER 167 CO 0.69 -1.04 0.00 0.52 0.41 0.00 0.00 173.24 173.82 1p88 n VAL 168 N 5.45 0.00 -3.74 3.43 0.31 -1.25 -4.98 118.33 117.54 1p88 n VAL 168 Ca 0.28 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.46 1p88 n VAL 168 Cb 0.48 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.26 1p88 n VAL 168 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1p88 s SER 169 N 1.37 0.12 0.61 4.52 0.01 -1.26 -4.92 113.70 114.15 1p88 s SER 169 Ca 0.00 0.19 0.32 0.00 1.31 0.00 0.00 55.95 57.77 1p88 s SER 169 Cb 0.00 0.08 1.75 0.00 0.21 0.00 0.00 66.02 68.06 1p88 s SER 169 CO 0.00 -0.16 1.98 0.77 0.41 0.00 0.00 173.24 176.24 1p88 h SER 170 N 7.45 0.00 0.68 2.44 4.64 -1.90 0.32 113.55 127.18 1p88 h SER 170 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1p88 h SER 170 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1p88 h SER 170 CO 0.40 0.00 -0.33 0.00 -0.87 0.00 0.00 176.83 176.03 1p88 n GLN 171 N -2.83 0.01 -0.00 4.77 3.00 -1.26 -2.53 117.38 118.54 1p88 n GLN 171 Ca -0.02 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.86 1p88 n GLN 171 Cb 0.27 -1.51 -0.09 0.00 0.00 0.00 0.00 30.24 28.91 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 -0.09 -0.63 1.08 -1.00 -0.72 -0.82 116.94 114.76 1p88 h PHE 172 Ca 0.00 -0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.68 1p88 h PHE 172 Cb 0.51 0.03 -0.02 0.00 3.61 0.00 0.00 35.95 40.08 1p88 h PHE 172 CO 0.00 0.47 0.03 -0.07 -1.61 0.00 0.00 178.31 177.13 1p88 h LEU 173 N -0.85 1.07 -1.76 1.54 3.38 -1.68 -1.82 115.31 115.18 1p88 h LEU 173 Ca -0.01 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1p88 h LEU 173 Cb 0.60 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1p88 h LEU 173 CO 0.02 1.10 0.14 0.74 0.09 0.00 0.00 178.44 180.52 1p88 h THR 174 N 1.01 1.06 -0.49 0.22 2.02 -1.55 0.20 112.91 115.37 1p88 h THR 174 Ca 0.18 -0.13 -0.09 0.00 0.77 0.00 0.00 66.41 67.14 1p88 h THR 174 Cb 0.53 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1p88 h THR 174 CO 0.03 0.06 -0.06 0.00 0.37 0.00 0.00 175.52 175.92 1p88 h ALA 175 N 1.85 0.67 0.01 6.16 0.00 -0.29 -2.52 119.26 125.15 1p88 h ALA 175 Ca 0.08 -0.31 -0.23 0.00 0.00 0.00 0.00 54.91 54.45 1p88 h ALA 175 Cb -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1p88 h ALA 175 CO -0.02 0.53 -0.96 -0.07 0.00 0.00 0.00 179.25 178.73 1p88 h LEU 176 N 0.76 0.50 -1.32 0.00 3.38 -0.96 -2.06 115.31 115.60 1p88 h LEU 176 Ca 0.13 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.71 1p88 h LEU 176 Cb 0.59 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1p88 h LEU 176 CO 0.04 1.22 0.46 -0.07 0.09 0.00 0.00 178.44 180.18 1p88 h LEU 177 N 0.20 0.78 0.11 1.67 4.07 -0.56 0.79 115.31 122.37 1p88 h LEU 177 Ca -0.08 -0.02 -0.18 0.00 0.08 0.00 0.00 57.88 57.68 1p88 h LEU 177 Cb 1.61 -0.19 0.01 0.00 1.08 0.00 0.00 40.66 43.17 1p88 h LEU 177 CO 0.16 0.55 -0.86 0.24 -1.08 0.00 0.00 178.44 177.45 1p88 h MET 178 N 0.91 0.23 -0.25 1.13 2.86 -1.44 -3.34 114.93 115.04 1p88 h MET 178 Ca 0.27 -0.40 -0.14 0.00 -2.06 0.00 0.00 59.70 57.37 1p88 h MET 178 Cb -0.05 0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 1p88 h MET 178 CO -0.06 1.19 -0.40 1.15 1.06 0.00 0.00 176.91 179.84 1p88 h THR 179 N -0.47 1.30 -0.85 2.22 2.02 -1.22 -3.33 112.91 112.59 1p88 h THR 179 Ca -0.17 -1.60 0.01 0.00 0.77 0.00 0.00 66.41 65.42 1p88 h THR 179 Cb 1.57 1.71 -0.04 0.00 -1.74 0.00 0.00 68.15 69.64 1p88 h THR 179 CO 0.09 0.51 0.56 0.00 0.37 0.00 0.00 175.52 177.05 1p88 h ALA 180 N 0.65 1.08 -0.01 6.16 0.00 0.43 -2.49 119.26 125.10 1p88 h ALA 180 Ca 0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1p88 h ALA 180 Cb 1.00 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1p88 h ALA 180 CO 0.09 0.47 -0.19 -1.00 0.00 0.00 0.00 179.25 178.62 1p88 h PRO 181 N 1.14 0.01 -0.05 0.00 0.13 -1.68 0.20 132.00 131.75 1p88 h PRO 181 Ca 0.31 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 1p88 h PRO 181 Cb -0.12 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.01 1p88 h PRO 181 CO -0.07 0.20 0.00 1.28 -0.23 0.00 0.00 178.00 179.18 1p88 n LEU 182 N -4.31 0.74 -4.75 1.56 4.77 -0.97 0.23 117.00 114.27 1p88 n LEU 182 Ca -0.02 -0.29 -0.40 0.00 -0.03 0.00 0.00 56.01 55.27 1p88 n LEU 182 Cb 0.25 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 1p88 n LEU 182 CO 0.37 0.15 0.46 0.00 -1.33 0.00 0.00 177.39 177.03 1p88 s ALA 183 N -1.93 3.39 0.54 -1.18 0.00 0.72 -4.43 121.76 118.87 1p88 s ALA 183 Ca 0.34 0.29 0.29 0.00 0.00 0.00 0.00 51.96 52.88 1p88 s ALA 183 Cb 0.17 -2.98 1.45 0.00 0.00 0.00 0.00 23.12 21.77 1p88 s ALA 183 CO 0.27 0.13 1.93 -1.00 0.00 0.00 0.00 175.76 177.09 1p88 h PRO 184 N 5.33 0.00 -6.18 0.00 0.13 -1.69 1.39 132.00 130.98 1p88 h PRO 184 Ca -0.45 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.00 1p88 h PRO 184 Cb 1.21 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.09 1p88 h PRO 184 CO 0.70 0.00 -0.78 -2.00 -0.23 0.00 0.00 178.00 175.69 1p88 s GLU 185 N -4.96 2.62 0.42 0.86 2.12 0.43 -4.24 118.70 115.95 1p88 s GLU 185 Ca -0.05 -0.71 -0.25 0.00 0.36 0.00 0.00 54.97 54.32 1p88 s GLU 185 Cb 0.20 -2.40 -0.10 0.00 0.26 0.00 0.00 34.13 32.10 1p88 s GLU 185 CO 0.74 0.55 1.22 -3.47 -0.54 0.00 0.00 175.26 173.76 1p88 n ASP 186 N 2.51 2.27 -4.35 -1.70 -0.08 -1.26 -3.91 116.55 110.03 1p88 n ASP 186 Ca -0.17 1.09 -0.29 0.00 -1.51 0.00 0.00 54.79 53.91 1p88 n ASP 186 Cb 0.52 -1.47 -0.14 0.00 2.34 0.00 0.00 41.12 42.38 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 -1.21 2.11 -0.14 5.18 2.01 0.09 -1.94 115.64 121.73 1p88 s THR 187 Ca 0.62 -1.55 -0.00 0.00 0.31 0.00 0.00 61.69 61.06 1p88 s THR 187 Cb -0.52 -1.85 0.03 0.00 0.01 0.00 0.00 72.50 70.18 1p88 s THR 187 CO 0.57 0.19 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.92 1p88 s VAL 188 N -0.95 1.18 -0.31 3.82 1.01 -1.24 -0.71 120.40 123.20 1p88 s VAL 188 Ca 0.12 -0.52 -0.12 0.00 0.00 0.00 0.00 61.98 61.46 1p88 s VAL 188 Cb -0.10 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 1p88 s VAL 188 CO 0.04 0.28 0.22 -0.63 0.00 0.00 0.00 175.10 175.01 1p88 s ILE 189 N 1.63 5.29 -0.25 2.22 1.09 0.14 0.19 121.20 131.51 1p88 s ILE 189 Ca 0.03 -0.00 -0.10 0.00 -1.10 0.00 0.00 60.65 59.47 1p88 s ILE 189 Cb -0.14 -3.63 -0.05 0.00 -1.06 0.00 0.00 42.46 37.58 1p88 s ILE 189 CO -0.08 0.12 0.16 -0.60 -0.10 0.00 0.00 174.94 174.43 1p88 s ARG 190 N 1.76 4.00 -0.25 2.79 3.52 0.54 0.22 118.95 131.54 1p88 s ARG 190 Ca 0.07 -0.30 -0.17 0.00 -0.13 0.00 0.00 55.73 55.20 1p88 s ARG 190 Cb -0.17 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.65 1p88 s ARG 190 CO 0.11 -0.01 0.45 0.42 -0.81 0.00 0.00 175.30 175.46 1p88 s ILE 191 N 1.24 5.13 -0.81 4.11 1.09 -1.25 -1.50 121.20 129.20 1p88 s ILE 191 Ca 0.07 0.75 -0.26 0.00 -1.10 0.00 0.00 60.65 60.11 1p88 s ILE 191 Cb -0.14 -3.77 0.03 0.00 -1.06 0.00 0.00 42.46 37.52 1p88 s ILE 191 CO 0.06 0.14 1.38 -0.54 -0.10 0.00 0.00 174.94 175.88 1p88 s LYS 192 N 2.02 3.25 0.00 2.79 1.02 -1.08 -4.58 119.74 123.15 1p88 s LYS 192 Ca 0.19 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1p88 s LYS 192 Cb -0.16 -4.55 0.00 0.00 -0.52 0.00 0.00 37.83 32.61 1p88 s LYS 192 CO 0.09 -2.24 0.00 0.41 -0.92 0.00 0.00 175.35 172.70 1p88 n GLY 193 N 5.86 1.02 3.34 -3.33 0.00 -1.26 -0.91 105.19 109.91 1p88 n GLY 193 Ca 0.13 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.36 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 4.01 0.38 1.61 1.11 -1.26 -4.80 116.67 113.71 1p88 s ASP 194 Ca 0.00 -0.36 -0.23 0.00 0.18 0.00 0.00 52.55 52.14 1p88 s ASP 194 Cb 0.00 -1.63 -0.15 0.00 1.07 0.00 0.00 42.92 42.22 1p88 s ASP 194 CO 0.00 0.12 0.33 0.18 1.18 0.00 0.00 175.17 176.98 1p88 n LEU 195 N 3.82 -1.57 0.14 1.23 4.77 -1.26 -3.39 117.00 120.75 1p88 n LEU 195 Ca -0.18 0.90 -0.01 0.00 -0.03 0.00 0.00 56.01 56.69 1p88 n LEU 195 Cb 0.52 -0.98 0.20 0.00 -2.33 0.00 0.00 43.42 40.84 1p88 n LEU 195 CO 0.30 -3.52 0.53 1.62 -1.33 0.00 0.00 177.39 175.00 1p88 h VAL 196 N 0.62 1.41 0.00 4.08 3.04 -0.05 -3.40 116.25 121.95 1p88 h VAL 196 Ca -0.37 -1.98 -0.20 0.00 -1.01 0.00 0.00 66.70 63.15 1p88 h VAL 196 Cb 1.43 2.07 -0.14 0.00 -2.01 0.00 0.00 31.29 32.64 1p88 h VAL 196 CO 0.50 0.56 -0.30 -0.24 -1.01 0.00 0.00 177.57 177.08 1p88 n SER 197 N -3.84 -2.11 -0.29 3.17 2.88 -1.26 -4.90 113.62 107.27 1p88 n SER 197 Ca -0.01 -3.10 0.07 0.00 -1.33 0.00 0.00 58.87 54.50 1p88 n SER 197 Cb 0.58 1.67 0.15 0.00 -0.75 0.00 0.00 64.21 65.86 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 0.66 -0.07 -0.34 -1.46 3.00 -1.26 0.13 118.16 118.81 1p88 n LYS 198 Ca 0.03 1.27 0.28 0.00 -0.00 0.00 0.00 58.31 59.89 1p88 n LYS 198 Cb 0.70 -1.93 0.59 0.00 0.00 0.00 0.00 35.03 34.39 1p88 n LYS 198 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 1p88 h PRO 199 N 0.00 0.25 -0.25 1.64 0.13 -1.98 0.59 132.00 132.38 1p88 h PRO 199 Ca 0.42 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 65.47 1p88 h PRO 199 Cb 0.72 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 1p88 h PRO 199 CO -0.83 0.17 -0.12 1.88 -0.23 0.00 0.00 178.00 178.87 1p88 h TYR 200 N 0.26 0.60 -0.58 1.56 -1.99 0.63 -2.53 116.97 114.92 1p88 h TYR 200 Ca 0.61 -0.15 0.01 0.00 2.00 0.00 0.00 58.73 61.20 1p88 h TYR 200 Cb 1.82 -0.14 -0.03 0.00 2.00 0.00 0.00 36.73 40.38 1p88 h TYR 200 CO -0.00 0.78 0.38 0.82 -0.00 0.00 0.00 178.16 180.14 1p88 h ILE 201 N 0.25 1.14 -0.77 -2.88 1.08 0.16 -0.86 117.51 115.63 1p88 h ILE 201 Ca 0.06 -0.26 -0.02 0.00 -0.39 0.00 0.00 64.86 64.25 1p88 h ILE 201 Cb 0.62 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.64 1p88 h ILE 201 CO 0.04 0.14 0.42 -0.78 -0.69 0.00 0.00 178.15 177.28 1p88 h ASP 202 N 0.77 0.96 -0.06 1.72 3.58 -0.36 -0.76 116.42 122.28 1p88 h ASP 202 Ca 0.22 -0.10 -0.00 0.00 0.42 0.00 0.00 57.03 57.56 1p88 h ASP 202 Cb -0.07 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 40.74 1p88 h ASP 202 CO -0.05 0.78 0.02 0.40 -2.88 0.00 0.00 179.24 177.51 1p88 h ILE 203 N 1.07 1.17 -0.24 2.25 2.04 -0.88 -1.58 117.51 121.33 1p88 h ILE 203 Ca 0.27 -0.50 0.06 0.00 1.00 0.00 0.00 64.86 65.69 1p88 h ILE 203 Cb 0.04 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 1p88 h ILE 203 CO -0.04 0.14 -0.13 0.74 0.00 0.00 0.00 178.15 178.85 1p88 h THR 204 N -0.10 0.60 -0.18 -0.27 2.02 -0.80 2.54 112.91 116.71 1p88 h THR 204 Ca 0.02 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.14 1p88 h THR 204 Cb 0.21 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 1p88 h THR 204 CO -0.00 0.00 -0.16 -0.07 0.37 0.00 0.00 175.52 175.66 1p88 h LEU 205 N -0.11 0.29 0.02 2.58 3.38 -1.11 1.65 115.31 122.01 1p88 h LEU 205 Ca 0.13 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 1p88 h LEU 205 Cb 0.31 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.99 1p88 h LEU 205 CO -0.31 0.48 -0.46 -1.13 0.09 0.00 0.00 178.44 177.11 1p88 h ASN 206 N 0.28 0.36 0.07 -0.43 -1.24 -0.21 0.72 115.58 115.13 1p88 h ASN 206 Ca 0.05 -0.82 -0.09 0.00 0.71 0.00 0.00 56.30 56.15 1p88 h ASN 206 Cb 0.46 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.39 1p88 h ASN 206 CO 0.03 1.14 -0.29 0.25 -1.29 0.00 0.00 177.43 177.26 1p88 h LEU 207 N -0.38 0.34 -0.33 0.34 5.85 0.46 -1.50 115.31 120.09 1p88 h LEU 207 Ca -0.06 -0.12 -0.19 0.00 0.84 0.00 0.00 57.88 58.34 1p88 h LEU 207 Cb 1.23 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1p88 h LEU 207 CO 0.09 0.63 -0.83 0.24 -0.34 0.00 0.00 178.44 178.23 1p88 h MET 208 N 0.30 0.29 -0.84 1.25 2.86 0.24 -3.11 114.93 115.93 1p88 h MET 208 Ca 0.04 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 1p88 h MET 208 Cb 0.67 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.37 1p88 h MET 208 CO 0.05 0.97 0.47 0.87 1.06 0.00 0.00 176.91 180.32 1p88 h LYS 209 N 0.18 1.16 0.00 1.72 1.57 -0.20 0.08 116.57 121.07 1p88 h LYS 209 Ca -0.04 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1p88 h LYS 209 Cb 1.43 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.51 1p88 h LYS 209 CO 0.13 0.84 -0.07 0.00 -0.57 0.00 0.00 179.45 179.78 1p88 h THR 210 N 1.17 0.77 -0.00 -0.16 1.03 -1.23 0.79 112.91 115.28 1p88 h THR 210 Ca 0.30 -0.26 0.00 0.00 -0.01 0.00 0.00 66.41 66.43 1p88 h THR 210 Cb 0.01 1.16 0.00 0.00 -1.07 0.00 0.00 68.15 68.24 1p88 h THR 210 CO -0.05 0.07 -0.14 0.49 -0.01 0.00 0.00 175.52 175.88 1p88 n PHE 211 N -4.05 0.00 0.00 0.00 3.72 -0.02 -4.07 117.46 113.04 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 0.16 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.43 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 1.36 1.12 3.31 1.37 0.00 0.27 0.14 105.19 112.76 1p88 n GLY 212 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 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 1.89 0.00 1.61 -7.23 -1.03 -4.68 120.40 108.96 1p88 s VAL 213 Ca 0.00 -1.52 0.04 0.00 -1.81 0.00 0.00 61.98 58.70 1p88 s VAL 213 Cb 0.00 -1.68 -0.01 0.00 0.56 0.00 0.00 36.38 35.25 1p88 s VAL 213 CO 0.00 0.07 -0.13 -1.61 -0.31 0.00 0.00 175.10 173.12 1p88 s GLU 214 N -1.73 1.02 0.09 4.82 2.02 -1.26 -2.34 118.70 121.31 1p88 s GLU 214 Ca 0.09 -0.55 0.09 0.00 0.02 0.00 0.00 54.97 54.62 1p88 s GLU 214 Cb -0.10 -0.99 -0.03 0.00 0.10 0.00 0.00 34.13 33.11 1p88 s GLU 214 CO 0.04 0.26 -0.22 0.42 0.02 0.00 0.00 175.26 175.78 1p88 s ILE 215 N -0.47 1.83 -0.28 -1.63 -1.09 -1.26 -4.49 121.20 113.81 1p88 s ILE 215 Ca 0.04 -1.49 -0.10 0.00 -2.23 0.00 0.00 60.65 56.88 1p88 s ILE 215 Cb -0.06 -1.63 -0.03 0.00 -1.58 0.00 0.00 42.46 39.16 1p88 s ILE 215 CO 0.00 0.06 0.15 -0.70 -1.23 0.00 0.00 174.94 173.22 1p88 s GLU 216 N -1.71 3.67 0.39 2.79 2.12 0.21 -4.93 118.70 121.24 1p88 s GLU 216 Ca 0.08 -0.49 -0.17 0.00 0.36 0.00 0.00 54.97 54.75 1p88 s GLU 216 Cb -0.10 -3.55 -0.09 0.00 0.26 0.00 0.00 34.13 30.65 1p88 s GLU 216 CO 0.04 -0.26 0.85 1.21 -0.54 0.00 0.00 175.26 176.55 1p88 s ASN 217 N 1.68 6.80 0.00 -1.70 2.47 -1.26 0.12 114.94 123.05 1p88 s ASN 217 Ca 0.06 1.46 0.00 0.00 0.42 0.00 0.00 52.86 54.80 1p88 s ASN 217 Cb -0.16 -2.45 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 1p88 s ASN 217 CO 0.08 -0.32 0.00 0.00 -3.72 0.00 0.00 177.10 173.14 1p88 n GLN 218 N -0.66 3.24 -1.24 0.43 1.13 0.18 -4.89 117.38 115.56 1p88 n GLN 218 Ca 0.05 0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.74 1p88 n GLN 218 Cb 0.54 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.86 1p88 n GLN 218 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1p88 n HIS 219 N 0.00 2.31 -3.47 1.08 8.25 -1.26 -4.29 115.22 117.84 1p88 n HIS 219 Ca 0.00 -2.40 -0.25 0.00 -0.26 0.00 0.00 57.72 54.81 1p88 n HIS 219 Cb 0.00 -2.08 0.03 0.00 1.12 0.00 0.00 29.99 29.07 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 5.64 -2.19 0.00 4.41 9.36 -1.26 -4.76 117.16 128.35 1p88 n TYR 220 Ca 0.54 0.71 0.00 0.00 3.32 0.00 0.00 57.90 62.48 1p88 n TYR 220 Cb 0.31 -4.09 0.00 0.00 -0.63 0.00 0.00 39.34 34.92 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 -4.34 0.00 0.00 2.98 10.64 -1.26 -4.05 117.38 121.35 1p88 n GLN 221 Ca -0.02 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.15 1p88 n GLN 221 Cb 0.56 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.94 1p88 n GLN 221 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 1p88 n GLN 222 N 0.00 0.00 -4.95 2.61 6.02 -1.18 -3.78 117.38 116.11 1p88 n GLN 222 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.72 1p88 n GLN 222 Cb 0.00 0.00 -0.16 0.00 1.02 0.00 0.00 30.24 31.10 1p88 n GLN 222 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1p88 s PHE 223 N 0.00 1.79 -0.23 1.08 0.40 0.61 0.50 117.98 122.12 1p88 s PHE 223 Ca 0.00 -0.40 0.02 0.00 -0.60 0.00 0.00 56.93 55.95 1p88 s PHE 223 Cb 0.00 -1.17 0.04 0.00 0.51 0.00 0.00 43.02 42.40 1p88 s PHE 223 CO 0.00 -0.08 -0.13 0.08 0.70 0.00 0.00 175.22 175.79 1p88 s VAL 224 N -0.32 2.21 -0.16 -0.44 1.01 0.31 -0.68 120.40 122.33 1p88 s VAL 224 Ca 0.04 -1.34 0.01 0.00 0.00 0.00 0.00 61.98 60.69 1p88 s VAL 224 Cb -0.09 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.15 1p88 s VAL 224 CO 0.00 0.18 -0.19 0.54 0.00 0.00 0.00 175.10 175.63 1p88 s VAL 225 N 1.19 1.96 -0.20 2.92 0.11 0.11 0.63 120.40 127.13 1p88 s VAL 225 Ca -0.03 -0.89 -0.29 0.00 -2.93 0.00 0.00 61.98 57.84 1p88 s VAL 225 Cb -0.17 -1.77 -0.01 0.00 -1.53 0.00 0.00 36.38 32.90 1p88 s VAL 225 CO -0.08 0.52 1.26 -0.54 -3.33 0.00 0.00 175.10 172.94 1p88 s LYS 226 N 1.22 4.17 0.58 1.54 3.01 -1.26 -0.74 119.74 128.27 1p88 s LYS 226 Ca 0.02 1.56 -0.10 0.00 -1.01 0.00 0.00 55.97 56.45 1p88 s LYS 226 Cb -0.13 -3.78 0.15 0.00 -1.01 0.00 0.00 37.83 33.05 1p88 s LYS 226 CO -0.10 -0.79 0.50 0.41 0.51 0.00 0.00 175.35 175.88 1p88 n GLY 227 N 3.74 -2.69 2.51 -3.33 0.00 -1.25 -4.13 105.19 100.04 1p88 n GLY 227 Ca 0.14 -1.45 -0.19 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.05 1.52 0.00 -0.02 0.00 0.48 -4.84 105.19 101.28 1p88 n GLY 228 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.36 -3.59 1.61 1.13 0.62 -4.96 117.38 109.33 1p88 n GLN 229 Ca -0.19 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.71 1p88 n GLN 229 Cb 0.62 0.00 -0.07 0.00 0.11 0.00 0.00 30.24 30.90 1p88 n GLN 229 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1p88 s SER 230 N -1.59 -0.60 -0.16 1.08 0.01 -1.26 -4.75 113.70 106.42 1p88 s SER 230 Ca 0.00 0.79 -0.03 0.00 1.31 0.00 0.00 55.95 58.03 1p88 s SER 230 Cb 0.00 0.72 -0.02 0.00 0.21 0.00 0.00 66.02 66.93 1p88 s SER 230 CO 0.00 -0.48 -0.07 -0.31 0.41 0.00 0.00 173.24 172.79 1p88 s TYR 231 N -0.79 2.95 0.13 2.43 2.02 -1.26 -4.29 117.35 118.54 1p88 s TYR 231 Ca -0.08 -0.52 0.10 0.00 -0.37 0.00 0.00 57.07 56.19 1p88 s TYR 231 Cb -0.02 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.55 1p88 s TYR 231 CO 0.07 -0.19 -0.24 -0.65 -1.57 0.00 0.00 175.55 172.97 1p88 s GLN 232 N 0.58 1.31 -0.41 -0.62 -0.21 0.36 0.35 119.66 121.03 1p88 s GLN 232 Ca -0.04 -1.31 -0.29 0.00 0.02 0.00 0.00 55.36 53.74 1p88 s GLN 232 Cb -0.15 -1.69 0.01 0.00 1.00 0.00 0.00 33.01 32.18 1p88 s GLN 232 CO 0.03 0.39 1.33 -1.54 -2.12 0.00 0.00 175.29 173.38 1p88 s SER 233 N -2.11 6.46 0.00 5.90 1.04 -0.32 -4.41 113.70 120.27 1p88 s SER 233 Ca 0.12 0.80 0.09 0.00 0.48 0.00 0.00 55.95 57.45 1p88 s SER 233 Cb -0.10 -2.54 0.51 0.00 0.10 0.00 0.00 66.02 64.00 1p88 s SER 233 CO 0.06 -1.33 1.09 -0.81 0.98 0.00 0.00 173.24 173.22 1p88 n PRO 234 N 7.89 0.22 0.00 4.02 -0.04 -1.26 -4.89 135.00 140.94 1p88 n PRO 234 Ca 0.15 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1p88 n PRO 234 Cb 0.48 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1p88 n PRO 234 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p88 n GLY 235 N -0.46 0.92 3.38 0.55 0.00 -1.26 -4.88 105.19 103.43 1p88 n GLY 235 Ca 0.06 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 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 2.83 -0.06 2.61 2.01 -1.26 0.19 115.64 121.95 1p88 s THR 236 Ca 0.00 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.24 1p88 s THR 236 Cb 0.00 -2.13 0.02 0.00 0.01 0.00 0.00 72.50 70.40 1p88 s THR 236 CO 0.00 0.55 -0.06 -0.47 -0.69 0.00 0.00 174.62 173.96 1p88 s TYR 237 N -0.07 0.99 -0.43 4.92 6.14 0.57 -4.88 117.35 124.60 1p88 s TYR 237 Ca -0.03 -0.35 -0.21 0.00 0.64 0.00 0.00 57.07 57.11 1p88 s TYR 237 Cb -0.14 -0.85 0.02 0.00 0.42 0.00 0.00 41.96 41.41 1p88 s TYR 237 CO 0.04 -0.27 0.68 -1.17 0.64 0.00 0.00 175.55 175.47 1p88 s LEU 238 N 1.12 4.41 -0.40 6.97 1.98 -1.26 0.11 118.68 131.61 1p88 s LEU 238 Ca -0.07 -0.23 -0.26 0.00 -2.89 0.00 0.00 54.13 50.68 1p88 s LEU 238 Cb -0.14 -2.80 0.02 0.00 0.66 0.00 0.00 46.19 43.93 1p88 s LEU 238 CO -0.01 -0.80 0.96 -0.69 -1.89 0.00 0.00 176.35 173.92 1p88 s VAL 239 N 2.93 4.51 -2.15 1.68 1.01 0.19 -4.88 120.40 123.70 1p88 s VAL 239 Ca 0.25 1.12 0.31 0.00 0.00 0.00 0.00 61.98 63.66 1p88 s VAL 239 Cb -0.14 -4.39 0.80 0.00 0.00 0.00 0.00 36.38 32.65 1p88 s VAL 239 CO 0.19 -0.65 2.08 -0.62 0.00 0.00 0.00 175.10 176.11