#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q27 s GLY 2 N 0.00 2.39 0.00 3.03 0.00 -1.26 -5.03 107.32 106.45 1q27 s GLY 2 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.45 1q27 s GLY 2 CO 0.00 0.42 0.00 0.61 0.00 0.00 0.00 173.10 174.13 1q27 n GLY 3 N 2.68 0.48 3.04 0.20 0.00 -1.26 -5.15 105.19 105.17 1q27 n GLY 3 Ca -0.11 0.65 -0.31 0.00 0.00 0.00 0.00 46.02 46.25 1q27 n GLY 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q27 s VAL 4 N 0.00 1.67 0.31 1.61 1.01 -1.26 -5.13 120.40 118.60 1q27 s VAL 4 Ca 0.00 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.34 1q27 s VAL 4 Cb 0.00 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 1q27 s VAL 4 CO 0.00 0.46 0.42 -0.94 0.00 0.00 0.00 175.10 175.05 1q27 s SER 5 N 1.45 6.03 -0.30 3.32 1.04 -1.26 -5.10 113.70 118.87 1q27 s SER 5 Ca 0.05 -0.13 -0.09 0.00 0.48 0.00 0.00 55.95 56.26 1q27 s SER 5 Cb -0.13 -1.40 0.19 0.00 0.10 0.00 0.00 66.02 64.77 1q27 s SER 5 CO -0.11 -0.32 0.98 -0.62 0.98 0.00 0.00 173.24 174.15 1q27 s ASP 6 N -4.10 -0.60 -0.80 7.02 2.15 -1.26 -5.10 116.67 113.98 1q27 s ASP 6 Ca 0.41 0.10 -0.09 0.00 0.43 0.00 0.00 52.55 53.41 1q27 s ASP 6 Cb -0.09 1.39 0.21 0.00 -0.30 0.00 0.00 42.92 44.13 1q27 s ASP 6 CO 0.30 -0.11 0.70 -0.70 -0.17 0.00 0.00 175.17 175.19 1q27 s GLU 7 N 2.94 3.31 0.26 4.34 2.12 -1.26 -5.03 118.70 125.37 1q27 s GLU 7 Ca 0.22 -2.65 0.08 0.00 0.36 0.00 0.00 54.97 52.99 1q27 s GLU 7 Cb -0.04 -4.18 -0.04 0.00 0.26 0.00 0.00 34.13 30.13 1q27 s GLU 7 CO -0.22 -1.25 0.08 -0.98 -0.54 0.00 0.00 175.26 172.36 1q27 s ARG 8 N -0.21 2.58 -0.10 4.30 1.70 -1.26 -4.21 118.95 121.75 1q27 s ARG 8 Ca 0.20 -1.24 0.02 0.00 -0.47 0.00 0.00 55.73 54.24 1q27 s ARG 8 Cb -0.13 -2.35 0.01 0.00 -0.57 0.00 0.00 34.95 31.91 1q27 s ARG 8 CO -0.07 0.38 -0.16 -1.17 -1.08 0.00 0.00 175.30 173.20 1q27 s LEU 9 N -3.72 1.76 0.07 -1.89 0.20 -0.30 -0.76 118.68 114.04 1q27 s LEU 9 Ca 0.32 -0.42 0.02 0.00 0.69 0.00 0.00 54.13 54.74 1q27 s LEU 9 Cb -0.07 -1.08 -0.04 0.00 -0.43 0.00 0.00 46.19 44.57 1q27 s LEU 9 CO 0.22 0.04 0.11 -0.62 -0.29 0.00 0.00 176.35 175.81 1q27 s ASP 10 N 0.82 5.75 -0.29 3.68 -1.08 -1.26 -1.40 116.67 122.89 1q27 s ASP 10 Ca -0.10 0.07 0.03 0.00 -0.52 0.00 0.00 52.55 52.03 1q27 s ASP 10 Cb -0.16 -1.61 0.07 0.00 -1.46 0.00 0.00 42.92 39.76 1q27 s ASP 10 CO 0.01 0.18 -0.05 -0.22 0.52 0.00 0.00 175.17 175.61 1q27 s LEU 11 N -2.38 3.93 0.04 -1.34 2.96 -0.81 -4.93 118.68 116.14 1q27 s LEU 11 Ca 0.30 -1.65 0.05 0.00 -0.22 0.00 0.00 54.13 52.61 1q27 s LEU 11 Cb -0.12 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 1q27 s LEU 11 CO 0.23 -0.26 -0.12 0.54 -1.32 0.00 0.00 176.35 175.42 1q27 s VAL 12 N 1.04 3.28 -0.15 1.68 0.11 -1.26 0.10 120.40 125.19 1q27 s VAL 12 Ca -0.02 -1.03 -0.26 0.00 -2.93 0.00 0.00 61.98 57.74 1q27 s VAL 12 Cb -0.20 -2.43 -0.23 0.00 -1.53 0.00 0.00 36.38 31.99 1q27 s VAL 12 CO -0.06 0.31 0.60 -0.55 -3.33 0.00 0.00 175.10 172.08 1q27 h ASN 13 N 4.34 0.00 0.00 3.54 7.08 -1.83 -3.43 115.58 125.28 1q27 h ASN 13 Ca -0.48 -0.83 -0.09 0.00 -3.08 0.00 0.00 56.30 51.82 1q27 h ASN 13 Cb 1.16 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 37.39 1q27 h ASN 13 CO 0.51 1.07 -0.90 1.21 -2.08 0.00 0.00 177.43 177.25 1q27 n GLU 14 N -4.58 0.50 0.00 4.14 4.07 -1.26 -5.02 120.64 118.48 1q27 n GLU 14 Ca -0.14 0.48 0.00 0.00 -0.06 0.00 0.00 57.16 57.44 1q27 n GLU 14 Cb 0.49 -1.66 0.00 0.00 -0.06 0.00 0.00 31.44 30.22 1q27 n GLU 14 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 1q27 n ARG 15 N -4.53 0.00 0.00 5.31 1.85 -1.26 -4.96 116.66 113.07 1q27 n ARG 15 Ca -0.17 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.68 1q27 n ARG 15 Cb 0.44 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.85 1q27 n ARG 15 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1q27 n ASP 16 N 0.00 0.10 -4.38 2.89 -0.08 -1.26 -4.90 116.55 108.92 1q27 n ASP 16 Ca 0.00 -0.38 -0.45 0.00 -1.51 0.00 0.00 54.79 52.45 1q27 n ASP 16 Cb 0.00 0.77 -0.01 0.00 2.34 0.00 0.00 41.12 44.23 1q27 n ASP 16 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1q27 s GLU 17 N -0.79 4.03 0.37 -0.67 2.02 -1.26 -5.03 118.70 117.37 1q27 s GLU 17 Ca 0.00 -2.83 -0.27 0.00 0.02 0.00 0.00 54.97 51.90 1q27 s GLU 17 Cb 0.00 -4.69 -0.11 0.00 0.10 0.00 0.00 34.13 29.43 1q27 s GLU 17 CO 0.00 -1.42 1.25 0.28 0.02 0.00 0.00 175.26 175.39 1q27 n VAL 18 N 3.60 2.22 -0.08 2.63 0.31 -1.26 -2.60 118.33 123.15 1q27 n VAL 18 Ca 0.25 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.98 1q27 n VAL 18 Cb 0.42 -1.52 -0.09 0.00 -0.91 0.00 0.00 33.84 31.75 1q27 n VAL 18 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1q27 n VAL 19 N 0.09 0.98 -3.72 2.52 0.24 0.28 -4.85 118.33 113.86 1q27 n VAL 19 Ca 0.06 -0.45 -0.14 0.00 -2.04 0.00 0.00 64.34 61.77 1q27 n VAL 19 Cb 0.37 -0.96 -0.08 0.00 -1.47 0.00 0.00 33.84 31.70 1q27 n VAL 19 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1q27 s GLY 20 N -5.35 -0.24 -0.15 7.63 0.00 -1.04 -5.06 107.32 103.11 1q27 s GLY 20 Ca -0.18 0.55 -0.10 0.00 0.00 0.00 0.00 44.72 45.00 1q27 s GLY 20 CO 0.45 0.32 0.17 1.20 0.00 0.00 0.00 173.10 175.25 1q27 s GLN 21 N -1.21 3.90 -0.07 2.90 1.11 -1.26 -1.93 119.66 123.09 1q27 s GLN 21 Ca -0.12 -0.10 0.03 0.00 0.01 0.00 0.00 55.36 55.17 1q27 s GLN 21 Cb -0.04 -3.32 0.01 0.00 -1.01 0.00 0.00 33.01 28.65 1q27 s GLN 21 CO 0.05 0.50 -0.15 0.42 0.01 0.00 0.00 175.29 176.12 1q27 s ILE 22 N -0.24 1.36 -0.01 1.08 -1.09 -0.49 -4.99 121.20 116.82 1q27 s ILE 22 Ca 0.13 -0.61 0.04 0.00 -2.23 0.00 0.00 60.65 57.98 1q27 s ILE 22 Cb -0.12 -1.22 -0.01 0.00 -1.58 0.00 0.00 42.46 39.53 1q27 s ILE 22 CO 0.02 0.40 -0.14 -0.76 -1.23 0.00 0.00 174.94 173.23 1q27 s LEU 23 N 0.58 2.04 0.35 2.97 1.43 -1.26 -1.14 118.68 123.63 1q27 s LEU 23 Ca -0.15 -0.27 0.04 0.00 -1.03 0.00 0.00 54.13 52.72 1q27 s LEU 23 Cb -0.16 -0.73 0.63 0.00 0.03 0.00 0.00 46.19 45.96 1q27 s LEU 23 CO 0.05 0.17 1.91 0.08 0.23 0.00 0.00 176.35 178.79 1q27 h ARG 24 N 5.74 0.56 -0.00 1.70 0.11 -1.96 -1.91 114.38 118.62 1q27 h ARG 24 Ca -0.35 -0.10 -0.03 0.00 0.10 0.00 0.00 59.98 59.60 1q27 h ARG 24 Cb 1.16 -0.09 -0.00 0.00 1.11 0.00 0.00 29.97 32.14 1q27 h ARG 24 CO 0.49 0.53 -0.16 1.79 0.10 0.00 0.00 179.97 182.72 1q27 h THR 25 N 0.55 1.11 -3.67 0.08 1.35 -1.96 -3.40 112.91 106.98 1q27 h THR 25 Ca 0.13 -0.54 -0.64 0.00 -0.55 0.00 0.00 66.41 64.81 1q27 h THR 25 Cb 0.24 1.29 -0.15 0.00 -1.73 0.00 0.00 68.15 67.80 1q27 h THR 25 CO -0.00 0.16 -0.19 -1.81 -0.25 0.00 0.00 175.52 173.43 1q27 s ASP 26 N -7.01 6.27 0.00 5.36 1.01 -0.72 -4.95 116.67 116.63 1q27 s ASP 26 Ca -0.04 0.11 0.00 0.00 0.71 0.00 0.00 52.55 53.33 1q27 s ASP 26 Cb 0.16 -2.23 0.00 0.00 1.01 0.00 0.00 42.92 41.86 1q27 s ASP 26 CO 0.69 -0.30 0.72 -2.65 0.21 0.00 0.00 175.17 173.84 1q27 n PRO 27 N 5.46 0.91 -0.98 8.23 -0.02 -1.26 -3.98 135.00 143.36 1q27 n PRO 27 Ca -0.07 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.20 1q27 n PRO 27 Cb 0.50 -1.20 0.10 0.00 -0.02 0.00 0.00 33.50 32.88 1q27 n PRO 27 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1q27 n ALA 28 N -0.27 5.17 -0.49 3.55 0.00 -1.26 -4.13 120.51 123.08 1q27 n ALA 28 Ca 0.00 -2.27 0.06 0.00 0.00 0.00 0.00 53.44 51.24 1q27 n ALA 28 Cb 0.10 -1.43 0.18 0.00 0.00 0.00 0.00 19.45 18.29 1q27 n ALA 28 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1q27 n LEU 29 N -0.47 3.15 -4.11 0.00 -0.00 -1.26 -4.99 117.00 109.32 1q27 n LEU 29 Ca 0.44 -2.41 -0.30 0.00 -0.00 0.00 0.00 56.01 53.74 1q27 n LEU 29 Cb 1.00 -0.33 -0.05 0.00 -0.00 0.00 0.00 43.42 44.04 1q27 n LEU 29 CO 0.50 0.69 -0.33 -1.14 -0.00 0.00 0.00 177.39 177.11 1q27 n ARG 30 N -0.04 -1.87 -2.46 1.47 3.00 -1.26 -4.85 116.66 110.65 1q27 n ARG 30 Ca 0.14 0.24 -0.43 0.00 -0.00 0.00 0.00 57.85 57.80 1q27 n ARG 30 Cb 0.58 -3.91 -0.02 0.00 0.00 0.00 0.00 32.46 29.11 1q27 n ARG 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1q27 s TRP 31 N -4.09 2.80 0.00 -0.14 0.52 -1.26 -4.67 118.94 112.09 1q27 s TRP 31 Ca 0.07 0.95 0.00 0.00 0.02 0.00 0.00 56.10 57.14 1q27 s TRP 31 Cb -0.03 -3.80 0.00 0.00 -1.15 0.00 0.00 33.47 28.48 1q27 s TRP 31 CO 0.94 -1.53 0.00 -0.85 0.02 0.00 0.00 176.95 175.53 1q27 n GLU 32 N 7.12 0.00 -0.88 4.98 0.28 -1.26 -4.92 120.64 125.96 1q27 n GLU 32 Ca 0.14 0.00 0.04 0.00 -0.16 0.00 0.00 57.16 57.18 1q27 n GLU 32 Cb 0.46 -0.06 0.16 0.00 1.43 0.00 0.00 31.44 33.44 1q27 n GLU 32 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1q27 n ARG 33 N -2.28 1.48 -0.99 3.44 1.74 -1.26 -3.96 116.66 114.83 1q27 n ARG 33 Ca 0.00 -3.16 -0.30 0.00 -0.77 0.00 0.00 57.85 53.61 1q27 n ARG 33 Cb 0.00 -1.41 0.26 0.00 -1.02 0.00 0.00 32.46 30.29 1q27 n ARG 33 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1q27 n VAL 34 N -0.82 0.00 -4.17 1.55 0.24 -1.26 -4.44 118.33 109.42 1q27 n VAL 34 Ca 0.18 -0.45 -0.35 0.00 -2.04 0.00 0.00 64.34 61.68 1q27 n VAL 34 Cb 0.78 -1.22 -0.09 0.00 -1.47 0.00 0.00 33.84 31.84 1q27 n VAL 34 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1q27 s ARG 35 N -5.47 3.39 0.20 7.34 0.52 -1.26 -1.33 118.95 122.33 1q27 s ARG 35 Ca 0.71 -0.34 -0.11 0.00 -0.52 0.00 0.00 55.73 55.48 1q27 s ARG 35 Cb -0.07 -3.00 -0.00 0.00 0.52 0.00 0.00 34.95 32.40 1q27 s ARG 35 CO 0.55 0.58 0.37 0.08 0.02 0.00 0.00 175.30 176.90 1q27 s VAL 36 N -0.51 0.03 0.00 3.52 1.01 -0.79 -4.33 120.40 119.33 1q27 s VAL 36 Ca 0.10 -1.35 0.07 0.00 0.00 0.00 0.00 61.98 60.79 1q27 s VAL 36 Cb -0.12 -1.98 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 1q27 s VAL 36 CO 0.02 -0.15 -0.21 0.68 0.00 0.00 0.00 175.10 175.44 1q27 s VAL 37 N -3.99 1.64 0.02 2.92 -7.23 -0.77 -1.78 120.40 111.22 1q27 s VAL 37 Ca 0.19 -0.97 -0.16 0.00 -1.81 0.00 0.00 61.98 59.23 1q27 s VAL 37 Cb 0.02 -1.38 0.03 0.00 0.56 0.00 0.00 36.38 35.60 1q27 s VAL 37 CO 0.04 0.39 0.34 0.54 -0.31 0.00 0.00 175.10 176.10 1q27 s ASN 38 N -0.69 -0.20 0.28 4.85 2.20 -0.34 -1.13 114.94 119.92 1q27 s ASN 38 Ca 0.08 -0.02 -0.20 0.00 -0.94 0.00 0.00 52.86 51.77 1q27 s ASN 38 Cb -0.08 0.36 0.03 0.00 -2.00 0.00 0.00 41.25 39.57 1q27 s ASN 38 CO -0.00 -0.57 0.78 0.00 -2.94 0.00 0.00 177.10 174.37 1q27 s ALA 39 N -2.07 -1.19 -0.17 3.54 0.00 -0.02 -1.41 121.76 120.43 1q27 s ALA 39 Ca -0.08 -0.34 -0.06 0.00 0.00 0.00 0.00 51.96 51.47 1q27 s ALA 39 Cb -0.02 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 1q27 s ALA 39 CO -0.00 -1.03 0.03 -0.06 0.00 0.00 0.00 175.76 174.70 1q27 s PHE 40 N -3.45 3.18 -0.19 0.00 0.08 -0.79 -1.84 117.98 114.97 1q27 s PHE 40 Ca 0.12 -0.05 -0.11 0.00 0.12 0.00 0.00 56.93 57.01 1q27 s PHE 40 Cb -0.05 -2.04 -0.05 0.00 -0.57 0.00 0.00 43.02 40.31 1q27 s PHE 40 CO 0.07 0.09 0.19 -1.17 -0.10 0.00 0.00 175.22 174.30 1q27 s LEU 41 N 0.37 4.21 0.00 -0.37 2.96 -1.26 -2.34 118.68 122.25 1q27 s LEU 41 Ca 0.01 0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 54.20 1q27 s LEU 41 Cb -0.13 -2.18 -0.01 0.00 0.50 0.00 0.00 46.19 44.37 1q27 s LEU 41 CO 0.01 0.15 0.06 -0.60 -1.32 0.00 0.00 176.35 174.64 1q27 s ARG 42 N 0.44 0.31 0.29 1.98 3.52 -1.00 -2.11 118.95 122.39 1q27 s ARG 42 Ca 0.11 -0.35 -0.19 0.00 -0.13 0.00 0.00 55.73 55.16 1q27 s ARG 42 Cb -0.12 0.12 0.02 0.00 -1.56 0.00 0.00 34.95 33.42 1q27 s ARG 42 CO 0.00 -0.06 0.71 0.54 -0.81 0.00 0.00 175.30 175.68 1q27 s ASN 43 N -1.04 -0.20 0.00 -2.12 2.20 -0.91 -1.75 114.94 111.12 1q27 s ASN 43 Ca -0.11 -0.71 0.00 0.00 -0.94 0.00 0.00 52.86 51.09 1q27 s ASN 43 Cb -0.07 0.73 0.00 0.00 -2.00 0.00 0.00 41.25 39.92 1q27 s ASN 43 CO 0.00 -1.38 0.00 -1.20 -2.94 0.00 0.00 177.10 171.59 1q27 n SER 44 N -0.58 0.00 0.00 3.54 7.64 -1.26 -1.67 113.62 121.29 1q27 n SER 44 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1q27 n SER 44 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1q27 n SER 44 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1q27 n GLN 45 N 0.00 0.00 -0.75 1.43 7.27 -1.26 -4.97 117.38 119.10 1q27 n GLN 45 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.08 1q27 n GLN 45 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1q27 n GLN 45 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1q27 n GLY 46 N 0.00 0.65 3.47 1.69 0.00 -1.20 -5.00 105.19 104.80 1q27 n GLY 46 Ca 0.00 -0.20 -0.44 0.00 0.00 0.00 0.00 46.02 45.38 1q27 n GLY 46 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q27 s GLN 47 N 0.00 3.88 -0.32 1.61 -1.52 -0.67 -3.89 119.66 118.76 1q27 s GLN 47 Ca 0.08 -2.20 -0.13 0.00 -1.95 0.00 0.00 55.36 51.16 1q27 s GLN 47 Cb 0.09 -5.04 -0.03 0.00 -0.22 0.00 0.00 33.01 27.82 1q27 s GLN 47 CO -0.04 -1.81 0.27 -0.51 -0.25 0.00 0.00 175.29 172.95 1q27 s LEU 48 N 2.23 4.30 -0.27 2.90 1.43 0.41 -2.15 118.68 127.54 1q27 s LEU 48 Ca 0.40 -0.18 -0.13 0.00 -1.03 0.00 0.00 54.13 53.19 1q27 s LEU 48 Cb -0.03 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 1q27 s LEU 48 CO -0.04 -0.20 0.26 0.86 0.23 0.00 0.00 176.35 177.47 1q27 s TRP 49 N 1.84 3.25 -0.16 0.29 -0.00 -0.90 -0.42 118.94 122.84 1q27 s TRP 49 Ca 0.09 0.27 -0.14 0.00 -0.00 0.00 0.00 56.10 56.31 1q27 s TRP 49 Cb -0.17 -2.44 0.04 0.00 -0.00 0.00 0.00 33.47 30.91 1q27 s TRP 49 CO 0.11 -0.14 0.43 0.42 -0.00 0.00 0.00 176.95 177.76 1q27 s ILE 50 N 1.75 -0.00 0.61 5.86 -1.09 0.41 -4.33 121.20 124.41 1q27 s ILE 50 Ca 0.11 0.01 -0.13 0.00 -2.23 0.00 0.00 60.65 58.41 1q27 s ILE 50 Cb -0.16 -0.60 -0.04 0.00 -1.58 0.00 0.00 42.46 40.09 1q27 s ILE 50 CO 0.10 0.00 1.03 -2.16 -1.23 0.00 0.00 174.94 172.68 1q27 s PRO 51 N 0.34 3.50 -0.09 2.79 0.04 -1.26 -2.54 135.00 137.79 1q27 s PRO 51 Ca -0.01 0.89 0.08 0.00 0.04 0.00 0.00 61.00 62.00 1q27 s PRO 51 Cb -0.03 -2.07 -0.11 0.00 0.04 0.00 0.00 34.50 32.33 1q27 s PRO 51 CO -0.01 -0.64 0.03 2.89 0.04 0.00 0.00 177.00 179.31 1q27 n ARG 52 N -2.49 2.55 -2.63 4.56 1.85 -1.26 -4.03 116.66 115.21 1q27 n ARG 52 Ca 0.07 -0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.76 1q27 n ARG 52 Cb 0.54 -1.22 0.04 0.00 -1.05 0.00 0.00 32.46 30.76 1q27 n ARG 52 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 1q27 n ARG 53 N -2.33 0.75 -3.64 2.89 1.85 -1.26 -4.87 116.66 110.05 1q27 n ARG 53 Ca -0.14 -2.35 -0.07 0.00 -1.00 0.00 0.00 57.85 54.29 1q27 n ARG 53 Cb 0.78 -0.07 -0.02 0.00 -1.05 0.00 0.00 32.46 32.10 1q27 n ARG 53 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1q27 s SER 54 N -3.58 -0.33 -0.24 2.89 0.01 -1.26 -4.68 113.70 106.51 1q27 s SER 54 Ca 0.40 -0.25 -0.28 0.00 1.31 0.00 0.00 55.95 57.12 1q27 s SER 54 Cb -0.03 0.54 -0.05 0.00 0.21 0.00 0.00 66.02 66.69 1q27 s SER 54 CO 0.25 -0.94 2.24 -0.81 0.41 0.00 0.00 173.24 174.39 1q27 n PRO 55 N -0.39 1.89 -1.05 12.44 -0.04 -1.26 -4.84 135.00 141.75 1q27 n PRO 55 Ca -0.09 0.49 -0.21 0.00 -0.04 0.00 0.00 63.50 63.66 1q27 n PRO 55 Cb 0.62 -3.26 0.15 0.00 -0.04 0.00 0.00 33.50 30.97 1q27 n PRO 55 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1q27 n SER 56 N 12.06 3.79 -0.02 3.54 3.41 -1.26 -4.22 113.62 130.91 1q27 n SER 56 Ca 0.31 -3.37 -0.07 0.00 -0.26 0.00 0.00 58.87 55.47 1q27 n SER 56 Cb 0.46 -0.80 -0.13 0.00 -0.26 0.00 0.00 64.21 63.47 1q27 n SER 56 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1q27 n LYS 57 N -0.89 0.64 -3.53 4.33 4.81 -1.26 -4.98 118.16 117.28 1q27 n LYS 57 Ca 0.51 0.25 -0.18 0.00 -0.87 0.00 0.00 58.31 58.02 1q27 n LYS 57 Cb 1.47 -1.76 -0.06 0.00 0.02 0.00 0.00 35.03 34.69 1q27 n LYS 57 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1q27 s SER 58 N -5.96 -0.65 0.62 3.14 0.01 -1.26 -5.14 113.70 104.46 1q27 s SER 58 Ca -0.05 0.74 0.00 0.00 1.31 0.00 0.00 55.95 57.95 1q27 s SER 58 Cb 0.08 0.58 0.00 0.00 0.21 0.00 0.00 66.02 66.89 1q27 s SER 58 CO 0.82 -0.59 0.00 0.18 0.41 0.00 0.00 173.24 174.07 1q27 n LEU 59 N 1.01 -1.16 -4.48 2.44 4.32 -1.26 -4.75 117.00 113.12 1q27 n LEU 59 Ca -0.19 2.51 -0.43 0.00 -0.02 0.00 0.00 56.01 57.88 1q27 n LEU 59 Cb 0.57 -3.05 -0.09 0.00 -1.62 0.00 0.00 43.42 39.23 1q27 n LEU 59 CO 0.23 -1.88 0.13 -0.36 -1.22 0.00 0.00 177.39 174.28 1q27 s PHE 60 N -4.53 3.16 0.03 -1.77 0.40 -1.26 -4.86 117.98 109.16 1q27 s PHE 60 Ca 0.00 -0.37 -0.23 0.00 -0.60 0.00 0.00 56.93 55.73 1q27 s PHE 60 Cb 0.00 -2.93 -0.13 0.00 0.51 0.00 0.00 43.02 40.47 1q27 s PHE 60 CO 0.00 -0.72 1.25 -1.00 0.70 0.00 0.00 175.22 175.46 1q27 h PRO 61 N 8.74 -0.80 -3.53 0.24 0.13 -1.85 -3.46 132.00 131.46 1q27 h PRO 61 Ca -0.26 0.05 0.09 0.00 -0.87 0.00 0.00 66.00 65.01 1q27 h PRO 61 Cb 1.11 0.18 -0.05 0.00 0.13 0.00 0.00 31.00 32.37 1q27 h PRO 61 CO 0.80 -0.54 -1.02 0.09 -0.23 0.00 0.00 178.00 177.11 1q27 n ASN 62 N -4.42 -7.97 0.00 1.44 3.02 -1.26 -4.31 115.26 101.77 1q27 n ASN 62 Ca -0.10 1.70 0.00 0.00 -0.03 0.00 0.00 54.58 56.15 1q27 n ASN 62 Cb 0.33 -4.83 0.00 0.00 -0.61 0.00 0.00 39.78 34.67 1q27 n ASN 62 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q27 n ALA 63 N -3.03 0.00 -2.62 5.41 0.00 -0.94 -4.77 120.51 114.56 1q27 n ALA 63 Ca -0.03 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.15 1q27 n ALA 63 Cb 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.88 1q27 n ALA 63 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1q27 s LEU 64 N 0.00 3.14 0.00 0.00 -0.00 -1.26 -4.91 118.68 115.65 1q27 s LEU 64 Ca 0.00 -0.49 -0.00 0.00 -0.00 0.00 0.00 54.13 53.64 1q27 s LEU 64 Cb 0.00 -1.81 0.11 0.00 -0.00 0.00 0.00 46.19 44.49 1q27 s LEU 64 CO 0.00 0.10 0.77 -0.67 -0.00 0.00 0.00 176.35 176.55 1q27 n ASP 65 N -0.04 1.05 -4.17 1.48 2.03 -1.26 -5.03 116.55 110.61 1q27 n ASP 65 Ca -0.10 -1.88 -0.21 0.00 0.52 0.00 0.00 54.79 53.11 1q27 n ASP 65 Cb 0.55 -0.50 0.12 0.00 -0.72 0.00 0.00 41.12 40.57 1q27 n ASP 65 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1q27 n VAL 66 N -2.53 0.00 -0.09 5.18 0.24 -1.26 -4.25 118.33 115.63 1q27 n VAL 66 Ca 0.13 -1.32 -0.14 0.00 -2.04 0.00 0.00 64.34 60.96 1q27 n VAL 66 Cb 0.46 -1.04 -0.05 0.00 -1.47 0.00 0.00 33.84 31.74 1q27 n VAL 66 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1q27 n SER 67 N -3.04 1.75 -4.26 -1.34 3.41 -0.77 -4.47 113.62 104.91 1q27 n SER 67 Ca 0.15 0.30 -0.38 0.00 -0.26 0.00 0.00 58.87 58.67 1q27 n SER 67 Cb 0.52 -0.68 -0.12 0.00 -0.26 0.00 0.00 64.21 63.67 1q27 n SER 67 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1q27 s VAL 68 N -2.64 3.86 -0.02 -3.33 1.01 -1.02 -4.93 120.40 113.33 1q27 s VAL 68 Ca -0.28 -1.27 0.00 0.00 0.00 0.00 0.00 61.98 60.44 1q27 s VAL 68 Cb 0.07 -3.26 0.02 0.00 0.00 0.00 0.00 36.38 33.21 1q27 s VAL 68 CO 0.38 -0.30 0.02 -0.83 0.00 0.00 0.00 175.10 174.37 1q27 s GLY 69 N 1.61 0.11 0.15 4.51 0.00 -1.26 -0.84 107.32 111.60 1q27 s GLY 69 Ca 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 44.72 44.90 1q27 s GLY 69 CO 0.02 0.54 0.16 -0.32 0.00 0.00 0.00 173.10 173.49 1q27 s GLY 70 N 0.85 0.76 0.10 0.20 0.00 -0.28 -4.86 107.32 104.09 1q27 s GLY 70 Ca -0.07 -1.21 0.02 0.00 0.00 0.00 0.00 44.72 43.45 1q27 s GLY 70 CO -0.02 -1.13 0.20 0.00 0.00 0.00 0.00 173.10 172.15 1q27 s ALA 71 N -4.01 3.87 0.14 3.20 0.00 -1.26 -1.85 121.76 121.85 1q27 s ALA 71 Ca 0.21 -0.96 -0.31 0.00 0.00 0.00 0.00 51.96 50.89 1q27 s ALA 71 Cb 0.06 -1.70 -0.09 0.00 0.00 0.00 0.00 23.12 21.39 1q27 s ALA 71 CO 0.01 0.70 1.47 0.08 0.00 0.00 0.00 175.76 178.02 1q27 s VAL 72 N -1.58 2.99 0.26 0.00 1.01 -1.26 -4.81 120.40 117.01 1q27 s VAL 72 Ca 0.33 0.71 0.06 0.00 0.00 0.00 0.00 61.98 63.08 1q27 s VAL 72 Cb -0.12 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 1q27 s VAL 72 CO 0.27 0.06 0.37 -1.58 0.00 0.00 0.00 175.10 174.21 1q27 s GLN 73 N 1.08 3.33 -0.60 2.72 0.74 -1.26 -4.62 119.66 121.05 1q27 s GLN 73 Ca 0.67 -0.84 -0.26 0.00 0.05 0.00 0.00 55.36 54.98 1q27 s GLN 73 Cb -0.40 -2.85 -0.06 0.00 1.10 0.00 0.00 33.01 30.80 1q27 s GLN 73 CO 0.31 0.34 2.21 -1.54 -0.55 0.00 0.00 175.29 176.07 1q27 s SER 74 N -4.01 4.66 0.00 6.67 1.04 0.06 -3.81 113.70 118.30 1q27 s SER 74 Ca 0.36 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.39 1q27 s SER 74 Cb -0.09 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1q27 s SER 74 CO 0.29 -2.86 0.00 0.61 0.98 0.00 0.00 173.24 172.26 1q27 n GLY 75 N 6.09 -1.65 0.02 7.32 0.00 -1.26 -4.94 105.19 110.76 1q27 n GLY 75 Ca 0.33 0.58 -0.00 0.00 0.00 0.00 0.00 46.02 46.93 1q27 n GLY 75 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q27 n GLU 76 N 0.00 0.81 -0.01 1.61 1.02 -1.25 -5.11 120.64 117.71 1q27 n GLU 76 Ca 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1q27 n GLU 76 Cb 0.00 0.01 0.00 0.00 -0.02 0.00 0.00 31.44 31.43 1q27 n GLU 76 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1q27 n THR 77 N -0.01 0.00 -0.26 2.62 -1.04 -1.26 -4.58 114.28 109.75 1q27 n THR 77 Ca -0.00 0.00 0.33 0.00 -2.04 0.00 0.00 64.05 62.34 1q27 n THR 77 Cb 0.00 -1.79 0.72 0.00 -1.82 0.00 0.00 70.33 67.44 1q27 n THR 77 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1q27 h TYR 78 N -0.03 0.00 0.14 -1.42 0.05 -1.98 -1.76 116.97 111.97 1q27 h TYR 78 Ca 0.00 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.79 1q27 h TYR 78 Cb 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.71 1q27 h TYR 78 CO 0.00 0.00 -0.41 1.49 -1.05 0.00 0.00 178.16 178.19 1q27 h GLU 79 N 0.00 -0.60 -0.15 4.88 4.81 -2.00 0.14 114.58 121.66 1q27 h GLU 79 Ca 0.52 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.73 1q27 h GLU 79 Cb 2.27 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 31.77 1q27 h GLU 79 CO -0.01 -0.40 -0.16 1.49 -0.73 0.00 0.00 179.01 179.20 1q27 h GLU 80 N -0.62 0.25 -0.62 1.92 4.81 -1.63 -1.99 114.58 116.71 1q27 h GLU 80 Ca -0.01 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1q27 h GLU 80 Cb 0.61 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 1q27 h GLU 80 CO -0.20 0.41 0.32 0.00 -0.73 0.00 0.00 179.01 178.81 1q27 h ALA 81 N 1.61 1.39 0.06 2.92 0.00 -1.07 -1.59 119.26 122.58 1q27 h ALA 81 Ca 0.05 -0.11 -0.23 0.00 0.00 0.00 0.00 54.91 54.61 1q27 h ALA 81 Cb 0.43 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 17.99 1q27 h ALA 81 CO 0.03 0.49 -0.94 0.74 0.00 0.00 0.00 179.25 179.57 1q27 h PHE 82 N 0.87 0.83 -0.77 0.00 0.04 -0.26 -2.77 116.94 114.87 1q27 h PHE 82 Ca 0.22 -0.49 0.04 0.00 2.80 0.00 0.00 57.97 60.54 1q27 h PHE 82 Cb 0.06 -0.08 -0.05 0.00 2.20 0.00 0.00 35.95 38.09 1q27 h PHE 82 CO 0.01 1.34 0.51 -0.09 -0.60 0.00 0.00 178.31 179.47 1q27 h ARG 83 N 0.09 0.88 0.26 1.51 2.43 -1.11 0.11 114.38 118.55 1q27 h ARG 83 Ca -0.13 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 1q27 h ARG 83 Cb 1.64 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1q27 h ARG 83 CO 0.18 0.58 -0.13 -0.09 -1.51 0.00 0.00 179.97 179.01 1q27 h ARG 84 N 0.91 -0.34 -0.54 0.20 1.12 -1.35 -1.16 114.38 113.22 1q27 h ARG 84 Ca 0.32 0.02 0.10 0.00 -1.11 0.00 0.00 59.98 59.31 1q27 h ARG 84 Cb 0.11 0.08 -0.03 0.00 -0.01 0.00 0.00 29.97 30.11 1q27 h ARG 84 CO -0.10 -0.00 0.36 0.93 -3.11 0.00 0.00 179.97 178.05 1q27 h GLU 85 N -0.94 0.30 -0.04 0.20 3.07 -1.33 -1.25 114.58 114.59 1q27 h GLU 85 Ca -0.04 -0.02 -0.25 0.00 -0.50 0.00 0.00 59.36 58.55 1q27 h GLU 85 Cb 0.49 -0.07 0.02 0.00 -0.84 0.00 0.00 28.75 28.35 1q27 h GLU 85 CO 0.06 0.20 -0.97 0.00 -1.40 0.00 0.00 179.01 176.90 1q27 h ALA 86 N 1.73 0.17 -0.13 3.43 0.00 -0.80 -3.12 119.26 120.54 1q27 h ALA 86 Ca 0.25 -0.67 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1q27 h ALA 86 Cb 0.57 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1q27 h ALA 86 CO -0.06 0.67 0.07 -0.09 0.00 0.00 0.00 179.25 179.84 1q27 h ARG 87 N 0.42 0.19 -0.22 0.00 2.43 0.14 -1.83 114.38 115.51 1q27 h ARG 87 Ca -0.11 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.10 1q27 h ARG 87 Cb 1.62 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.12 1q27 h ARG 87 CO 0.19 0.23 0.16 0.93 -1.51 0.00 0.00 179.97 179.97 1q27 h GLU 88 N 0.10 0.00 0.17 0.20 5.08 -1.36 0.61 114.58 119.37 1q27 h GLU 88 Ca 0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1q27 h GLU 88 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1q27 h GLU 88 CO -0.01 0.00 -0.08 1.49 -1.00 0.00 0.00 179.01 179.41 1q27 h GLU 89 N 0.00 -0.22 -0.28 2.33 4.81 -1.36 -3.41 114.58 116.46 1q27 h GLU 89 Ca 0.11 0.01 -0.24 0.00 -0.13 0.00 0.00 59.36 59.11 1q27 h GLU 89 Cb 0.43 0.05 -0.25 0.00 0.63 0.00 0.00 28.75 29.61 1q27 h GLU 89 CO -0.00 -0.14 -0.64 -0.11 -0.73 0.00 0.00 179.01 177.39 1q27 n LEU 90 N -2.70 -0.46 -1.91 1.64 -0.00 -1.13 -4.67 117.00 107.78 1q27 n LEU 90 Ca -0.03 -3.35 -0.16 0.00 -0.00 0.00 0.00 56.01 52.47 1q27 n LEU 90 Cb 0.09 0.21 0.00 0.00 -0.00 0.00 0.00 43.42 43.72 1q27 n LEU 90 CO 0.07 1.61 -0.13 -3.20 -0.00 0.00 0.00 177.39 175.74 1q27 n ASN 91 N -0.78 -4.69 -4.72 1.96 2.85 0.21 -4.97 115.26 105.12 1q27 n ASN 91 Ca -0.03 -0.08 -0.41 0.00 -0.11 0.00 0.00 54.58 53.95 1q27 n ASN 91 Cb 0.84 -3.73 -0.04 0.00 1.24 0.00 0.00 39.78 38.09 1q27 n ASN 91 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1q27 s VAL 92 N -2.84 4.91 -0.23 3.44 1.01 -0.74 -4.80 120.40 121.16 1q27 s VAL 92 Ca 0.07 1.71 0.13 0.00 0.00 0.00 0.00 61.98 63.90 1q27 s VAL 92 Cb -0.03 -4.16 0.51 0.00 0.00 0.00 0.00 36.38 32.69 1q27 s VAL 92 CO 0.09 0.24 1.43 -1.84 0.00 0.00 0.00 175.10 175.02 1q27 n GLU 93 N 3.61 2.33 -2.13 2.72 0.28 -1.26 0.53 120.64 126.72 1q27 n GLU 93 Ca 0.01 -2.98 -0.04 0.00 -0.16 0.00 0.00 57.16 53.99 1q27 n GLU 93 Cb 0.51 -1.82 -0.01 0.00 1.43 0.00 0.00 31.44 31.56 1q27 n GLU 93 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 1q27 n ILE 94 N -0.85 -0.15 -1.16 3.84 -5.35 -1.26 -4.64 119.36 109.79 1q27 n ILE 94 Ca 0.27 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.75 1q27 n ILE 94 Cb 0.95 -0.57 0.00 0.00 -1.74 0.00 0.00 39.64 38.28 1q27 n ILE 94 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1q27 n ASP 95 N -1.07 0.09 -0.02 7.28 2.03 -1.26 -4.75 116.55 118.86 1q27 n ASP 95 Ca -0.05 -1.25 -0.02 0.00 0.52 0.00 0.00 54.79 54.00 1q27 n ASP 95 Cb 0.44 -0.04 -0.02 0.00 -0.72 0.00 0.00 41.12 40.78 1q27 n ASP 95 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1q27 n ALA 96 N -0.03 1.93 -1.44 -1.67 0.00 -1.26 -4.96 120.51 113.08 1q27 n ALA 96 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1q27 n ALA 96 Cb 0.53 0.29 0.00 0.00 0.00 0.00 0.00 19.45 20.27 1q27 n ALA 96 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1q27 n LEU 97 N -2.33 0.32 0.00 0.00 4.77 -1.26 -5.12 117.00 113.38 1q27 n LEU 97 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1q27 n LEU 97 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1q27 n LEU 97 CO 0.05 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 174.91 1q27 n SER 98 N -0.31 0.00 -4.02 -1.43 7.64 -1.26 -5.02 113.62 109.22 1q27 n SER 98 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 1q27 n SER 98 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 1q27 n SER 98 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 1q27 s TRP 99 N 0.00 0.36 -0.28 1.43 1.48 -1.26 -2.12 118.94 118.56 1q27 s TRP 99 Ca 0.00 -0.69 -0.20 0.00 -1.06 0.00 0.00 56.10 54.15 1q27 s TRP 99 Cb 0.00 -0.26 0.10 0.00 -1.16 0.00 0.00 33.47 32.15 1q27 s TRP 99 CO 0.00 -0.24 0.85 -0.98 -4.06 0.00 0.00 176.95 172.52 1q27 s ARG 100 N -2.21 0.61 0.09 3.25 1.70 -0.86 -4.95 118.95 116.58 1q27 s ARG 100 Ca -0.09 0.88 -0.31 0.00 -0.47 0.00 0.00 55.73 55.75 1q27 s ARG 100 Cb -0.05 0.21 -0.07 0.00 -0.57 0.00 0.00 34.95 34.47 1q27 s ARG 100 CO -0.04 -0.10 1.31 -1.25 -1.08 0.00 0.00 175.30 174.15 1q27 s PRO 101 N 0.94 4.36 0.00 3.89 0.04 -1.26 -0.28 135.00 142.70 1q27 s PRO 101 Ca -0.04 1.95 0.00 0.00 0.04 0.00 0.00 61.00 62.95 1q27 s PRO 101 Cb -0.05 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.20 1q27 s PRO 101 CO -0.11 -0.37 0.00 1.28 0.04 0.00 0.00 177.00 177.84 1q27 n LEU 102 N 3.96 0.00 0.00 -3.56 4.77 -0.45 -4.92 117.00 116.79 1q27 n LEU 102 Ca 0.10 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 1q27 n LEU 102 Cb 0.44 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1q27 n LEU 102 CO 0.57 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.63 1q27 n ALA 103 N -1.07 0.00 -3.51 -1.18 0.00 -0.74 -5.03 120.51 108.99 1q27 n ALA 103 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1q27 n ALA 103 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1q27 n ALA 103 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1q27 s SER 104 N -0.37 -0.19 -0.10 0.00 1.04 -1.26 -0.41 113.70 112.42 1q27 s SER 104 Ca 0.00 0.29 -0.08 0.00 0.48 0.00 0.00 55.95 56.63 1q27 s SER 104 Cb 0.00 1.13 -0.04 0.00 0.10 0.00 0.00 66.02 67.21 1q27 s SER 104 CO 0.00 -0.04 0.19 -0.36 0.98 0.00 0.00 173.24 174.00 1q27 s PHE 105 N 1.48 3.62 0.15 5.02 0.08 0.56 -4.86 117.98 124.03 1q27 s PHE 105 Ca -0.06 0.61 0.09 0.00 0.12 0.00 0.00 56.93 57.69 1q27 s PHE 105 Cb -0.02 -2.00 -0.04 0.00 -0.57 0.00 0.00 43.02 40.39 1q27 s PHE 105 CO -0.13 0.72 -0.20 0.45 -0.10 0.00 0.00 175.22 175.96 1q27 s SER 106 N -1.05 2.77 -0.20 1.36 0.15 -1.26 -0.80 113.70 114.67 1q27 s SER 106 Ca 0.17 -0.80 -0.29 0.00 0.70 0.00 0.00 55.95 55.73 1q27 s SER 106 Cb -0.13 -0.17 -0.04 0.00 -1.71 0.00 0.00 66.02 63.98 1q27 s SER 106 CO 0.06 0.03 1.77 -2.16 1.20 0.00 0.00 173.24 174.14 1q27 s PRO 107 N -2.45 3.69 0.00 5.44 0.04 -1.26 -4.29 135.00 136.17 1q27 s PRO 107 Ca 0.13 1.81 0.00 0.00 0.04 0.00 0.00 61.00 62.98 1q27 s PRO 107 Cb -0.08 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.34 1q27 s PRO 107 CO 0.06 -1.43 0.00 0.34 0.04 0.00 0.00 177.00 176.01 1q27 n PHE 108 N 9.01 0.00 -2.63 0.56 7.35 -1.26 -5.00 117.46 125.49 1q27 n PHE 108 Ca 0.21 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.87 1q27 n PHE 108 Cb 0.45 0.00 0.05 0.00 0.35 0.00 0.00 39.48 40.33 1q27 n PHE 108 CO 0.00 0.00 0.00 0.94 -0.76 0.00 0.00 176.76 176.94 1q27 n GLN 109 N -0.54 0.63 -4.36 -4.13 7.27 -1.26 -5.16 117.38 109.84 1q27 n GLN 109 Ca 0.00 -0.86 -0.18 0.00 0.07 0.00 0.00 57.00 56.03 1q27 n GLN 109 Cb 0.00 0.10 -0.10 0.00 2.41 0.00 0.00 30.24 32.65 1q27 n GLN 109 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1q27 s THR 110 N 0.08 1.19 0.41 1.69 -4.23 -1.26 -5.03 115.64 108.49 1q27 s THR 110 Ca 0.07 -2.05 0.30 0.00 -1.18 0.00 0.00 61.69 58.83 1q27 s THR 110 Cb 0.21 -2.37 0.32 0.00 1.34 0.00 0.00 72.50 72.00 1q27 s THR 110 CO -0.05 -0.32 2.10 0.00 -0.54 0.00 0.00 174.62 175.80 1q27 h THR 111 N 2.42 0.45 -3.45 3.99 1.03 -1.86 -3.42 112.91 112.07 1q27 h THR 111 Ca -0.39 -0.47 -0.54 0.00 -0.01 0.00 0.00 66.41 65.01 1q27 h THR 111 Cb 1.22 1.32 -0.04 0.00 -1.07 0.00 0.00 68.15 69.59 1q27 h THR 111 CO 0.65 0.09 0.19 -0.76 -0.01 0.00 0.00 175.52 175.69 1q27 s LEU 112 N -7.07 4.46 -0.19 0.00 1.02 -1.26 -4.78 118.68 110.86 1q27 s LEU 112 Ca -0.03 1.50 0.11 0.00 0.02 0.00 0.00 54.13 55.73 1q27 s LEU 112 Cb 0.13 -3.29 0.63 0.00 0.02 0.00 0.00 46.19 43.68 1q27 s LEU 112 CO 0.56 0.00 1.47 -1.54 0.02 0.00 0.00 176.35 176.86 1q27 n SER 113 N 2.82 4.63 -3.69 2.29 3.41 -1.26 -4.62 113.62 117.19 1q27 n SER 113 Ca -0.02 -2.73 -0.12 0.00 -0.26 0.00 0.00 58.87 55.75 1q27 n SER 113 Cb 0.50 -0.65 -0.06 0.00 -0.26 0.00 0.00 64.21 63.74 1q27 n SER 113 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1q27 s SER 114 N -0.60 -0.22 -1.00 4.04 0.01 -1.25 -4.45 113.70 110.23 1q27 s SER 114 Ca 0.42 -0.11 -0.24 0.00 1.31 0.00 0.00 55.95 57.33 1q27 s SER 114 Cb 0.32 0.41 -0.08 0.00 0.21 0.00 0.00 66.02 66.88 1q27 s SER 114 CO 0.12 -0.67 1.99 0.12 0.41 0.00 0.00 173.24 175.21 1q27 s PHE 115 N -2.67 1.78 0.28 2.43 5.36 -0.44 -4.34 117.98 120.37 1q27 s PHE 115 Ca -0.04 0.76 0.05 0.00 -0.96 0.00 0.00 56.93 56.74 1q27 s PHE 115 Cb -0.00 -3.95 -0.03 0.00 -0.34 0.00 0.00 43.02 38.70 1q27 s PHE 115 CO -0.04 -1.50 0.41 -1.64 -1.46 0.00 0.00 175.22 171.00 1q27 s MET 116 N 7.04 3.38 0.24 10.12 -1.94 0.02 -1.88 119.30 136.29 1q27 s MET 116 Ca 0.72 -0.74 0.09 0.00 -1.71 0.00 0.00 55.69 54.05 1q27 s MET 116 Cb -0.05 -2.84 -0.04 0.00 2.01 0.00 0.00 34.83 33.91 1q27 s MET 116 CO 0.05 0.31 0.02 0.00 -0.01 0.00 0.00 175.02 175.39 1q27 s VAL 118 N -2.15 2.86 0.34 0.00 1.01 0.46 -1.19 120.40 121.72 1q27 s VAL 118 Ca 0.30 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.69 1q27 s VAL 118 Cb -0.07 -2.27 -0.07 0.00 0.00 0.00 0.00 36.38 33.98 1q27 s VAL 118 CO 0.20 0.47 -0.06 -0.31 0.00 0.00 0.00 175.10 175.41 1q27 s TYR 119 N 1.33 2.29 -0.33 5.22 1.51 -0.50 -1.34 117.35 125.53 1q27 s TYR 119 Ca 0.04 -0.61 0.02 0.00 -1.01 0.00 0.00 57.07 55.51 1q27 s TYR 119 Cb -0.14 -1.39 0.08 0.00 -0.11 0.00 0.00 41.96 40.41 1q27 s TYR 119 CO -0.06 0.45 0.03 -1.21 -1.11 0.00 0.00 175.55 173.64 1q27 s GLU 120 N -3.68 1.89 -0.22 -0.62 2.02 0.62 -1.89 118.70 116.82 1q27 s GLU 120 Ca 0.33 -1.65 -0.05 0.00 0.02 0.00 0.00 54.97 53.62 1q27 s GLU 120 Cb 0.05 -3.18 -0.02 0.00 0.10 0.00 0.00 34.13 31.08 1q27 s GLU 120 CO 0.16 -0.82 -0.01 -0.51 0.02 0.00 0.00 175.26 174.10 1q27 s LEU 121 N 1.04 3.11 -0.38 1.80 1.02 -0.99 -2.03 118.68 122.25 1q27 s LEU 121 Ca 0.03 -0.30 -0.15 0.00 0.02 0.00 0.00 54.13 53.73 1q27 s LEU 121 Cb -0.20 -1.80 0.00 0.00 0.02 0.00 0.00 46.19 44.21 1q27 s LEU 121 CO -0.06 -0.00 0.35 0.00 0.02 0.00 0.00 176.35 176.66 1q27 s ARG 122 N 1.40 3.31 -0.17 1.70 3.03 -0.90 -2.37 118.95 124.95 1q27 s ARG 122 Ca 0.05 -0.66 -0.28 0.00 2.03 0.00 0.00 55.73 56.86 1q27 s ARG 122 Cb -0.15 -3.88 0.08 0.00 -1.03 0.00 0.00 34.95 29.98 1q27 s ARG 122 CO -0.00 -0.65 0.78 0.45 -1.13 0.00 0.00 175.30 174.76 1q27 s SER 123 N 1.74 -0.62 -0.92 -2.89 0.15 -0.72 -4.30 113.70 106.15 1q27 s SER 123 Ca 0.10 0.95 -0.00 0.00 0.70 0.00 0.00 55.95 57.69 1q27 s SER 123 Cb -0.17 0.87 0.30 0.00 -1.71 0.00 0.00 66.02 65.31 1q27 s SER 123 CO 0.12 -0.39 1.36 -0.90 1.20 0.00 0.00 173.24 174.63 1q27 n ASP 124 N 1.67 5.90 -3.59 5.45 5.68 -1.26 -4.24 116.55 126.16 1q27 n ASP 124 Ca -0.15 -3.53 -0.15 0.00 -0.50 0.00 0.00 54.79 50.46 1q27 n ASP 124 Cb 0.56 -1.04 -0.07 0.00 -1.14 0.00 0.00 41.12 39.44 1q27 n ASP 124 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1q27 s ALA 125 N -3.22 -1.79 0.10 2.12 0.00 -1.26 -5.13 121.76 112.57 1q27 s ALA 125 Ca 0.37 1.76 -0.06 0.00 0.00 0.00 0.00 51.96 54.04 1q27 s ALA 125 Cb 0.13 -0.77 -0.05 0.00 0.00 0.00 0.00 23.12 22.43 1q27 s ALA 125 CO -0.01 -0.34 0.35 0.99 0.00 0.00 0.00 175.76 176.75 1q27 s THR 126 N -0.22 5.19 0.00 0.00 2.01 -1.26 -5.00 115.64 116.36 1q27 s THR 126 Ca -0.04 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.07 1q27 s THR 126 Cb -0.03 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.86 1q27 s THR 126 CO 0.04 0.15 0.00 -2.65 -0.69 0.00 0.00 174.62 171.47 1q27 n PRO 127 N 0.44 1.36 -2.95 4.92 -0.02 -1.26 -4.68 135.00 132.80 1q27 n PRO 127 Ca -0.05 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.24 1q27 n PRO 127 Cb 0.52 0.00 0.05 0.00 -0.02 0.00 0.00 33.50 34.05 1q27 n PRO 127 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1q27 n ILE 128 N -0.43 0.00 -2.63 4.25 -5.35 -1.26 -4.93 119.36 109.01 1q27 n ILE 128 Ca 0.00 -1.78 -0.43 0.00 -0.27 0.00 0.00 62.75 60.27 1q27 n ILE 128 Cb 0.00 -0.45 -0.02 0.00 -1.74 0.00 0.00 39.64 37.43 1q27 n ILE 128 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 1q27 s PHE 129 N -2.26 3.03 -0.36 4.28 5.36 -1.26 -4.96 117.98 121.81 1q27 s PHE 129 Ca 0.48 1.02 0.02 0.00 -0.96 0.00 0.00 56.93 57.50 1q27 s PHE 129 Cb -0.04 -3.96 0.15 0.00 -0.34 0.00 0.00 43.02 38.83 1q27 s PHE 129 CO 0.31 -0.95 0.34 1.21 -1.46 0.00 0.00 175.22 174.67 1q27 s ASN 130 N 1.94 1.49 -0.15 6.13 3.84 -1.26 -5.01 114.94 121.93 1q27 s ASN 130 Ca 0.46 -1.55 0.02 0.00 0.21 0.00 0.00 52.86 52.00 1q27 s ASN 130 Cb -0.10 0.42 0.23 0.00 -0.55 0.00 0.00 41.25 41.25 1q27 s ASN 130 CO 0.21 -0.28 1.29 -0.81 -2.79 0.00 0.00 177.10 174.71 1q27 n PRO 131 N 4.36 1.49 0.00 0.43 -0.04 -1.26 -2.31 135.00 137.67 1q27 n PRO 131 Ca 0.09 -1.03 0.00 0.00 -0.04 0.00 0.00 63.50 62.52 1q27 n PRO 131 Cb 0.44 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 1q27 n PRO 131 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1q27 n ASN 132 N -0.04 1.36 -0.08 3.54 2.85 -1.26 -4.86 115.26 116.76 1q27 n ASN 132 Ca 0.20 0.00 -0.08 0.00 -0.11 0.00 0.00 54.58 54.59 1q27 n ASN 132 Cb 0.88 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.87 1q27 n ASN 132 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1q27 n ASP 133 N -2.62 1.86 -3.51 1.20 9.92 -1.25 -4.92 116.55 117.24 1q27 n ASP 133 Ca 0.00 0.50 -0.27 0.00 -0.53 0.00 0.00 54.79 54.49 1q27 n ASP 133 Cb 0.39 -0.82 -0.14 0.00 -0.64 0.00 0.00 41.12 39.90 1q27 n ASP 133 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1q27 s ILE 134 N -2.51 -0.11 0.56 0.53 1.09 -1.18 -4.99 121.20 114.59 1q27 s ILE 134 Ca -0.21 -0.79 0.29 0.00 -1.10 0.00 0.00 60.65 58.84 1q27 s ILE 134 Cb 0.03 -0.99 0.42 0.00 -1.06 0.00 0.00 42.46 40.87 1q27 s ILE 134 CO 0.32 -0.71 1.91 0.28 -0.10 0.00 0.00 174.94 176.65 1q27 h SER 135 N 8.27 0.00 -1.02 3.58 0.02 -1.79 -3.39 113.55 119.21 1q27 h SER 135 Ca -0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1q27 h SER 135 Cb 1.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1q27 h SER 135 CO 0.41 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.71 1q27 n GLY 136 N -1.60 -0.73 0.00 -3.77 0.00 -1.26 -4.70 105.19 93.12 1q27 n GLY 136 Ca 0.12 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1q27 n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q27 n GLY 137 N 1.04 -3.49 3.30 -0.02 0.00 -1.26 -4.94 105.19 99.82 1q27 n GLY 137 Ca 0.00 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 45.04 1q27 n GLY 137 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1q27 s GLU 138 N 0.00 1.27 -0.53 1.61 2.12 -1.05 -4.82 118.70 117.30 1q27 s GLU 138 Ca 0.00 -1.64 -0.16 0.00 0.36 0.00 0.00 54.97 53.52 1q27 s GLU 138 Cb 0.00 -0.45 0.11 0.00 0.26 0.00 0.00 34.13 34.05 1q27 s GLU 138 CO 0.00 -0.14 0.51 -1.58 -0.54 0.00 0.00 175.26 173.52 1q27 s TRP 139 N -3.54 3.20 0.49 5.30 0.52 -1.26 -0.44 118.94 123.20 1q27 s TRP 139 Ca 0.28 -1.12 0.03 0.00 0.02 0.00 0.00 56.10 55.31 1q27 s TRP 139 Cb 0.06 -3.67 -0.03 0.00 -1.15 0.00 0.00 33.47 28.68 1q27 s TRP 139 CO 0.08 -1.01 0.02 -0.48 0.02 0.00 0.00 176.95 175.58 1q27 s LEU 140 N 1.82 2.47 0.06 2.99 2.34 0.44 -4.92 118.68 123.88 1q27 s LEU 140 Ca 0.05 -1.56 -0.03 0.00 0.06 0.00 0.00 54.13 52.65 1q27 s LEU 140 Cb -0.27 -0.80 -0.05 0.00 -0.56 0.00 0.00 46.19 44.51 1q27 s LEU 140 CO 0.05 -0.76 0.26 0.28 -1.06 0.00 0.00 176.35 175.12 1q27 s THR 141 N -2.83 5.32 0.47 5.48 -1.32 -1.26 -0.44 115.64 121.06 1q27 s THR 141 Ca 0.14 -0.12 0.34 0.00 -1.21 0.00 0.00 61.69 60.85 1q27 s THR 141 Cb 0.04 -3.60 0.54 0.00 -1.51 0.00 0.00 72.50 67.97 1q27 s THR 141 CO 0.08 0.19 1.63 -0.65 -2.21 0.00 0.00 174.62 173.66 1q27 h PRO 142 N 3.33 0.07 -0.83 7.08 0.11 -1.89 0.86 132.00 140.73 1q27 h PRO 142 Ca -0.47 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1q27 h PRO 142 Cb 1.17 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 1q27 h PRO 142 CO 0.72 0.05 0.45 0.93 -0.21 0.00 0.00 178.00 179.94 1q27 h GLU 143 N 0.07 1.16 -0.13 1.05 5.08 -1.93 0.31 114.58 120.18 1q27 h GLU 143 Ca 0.82 -0.14 -0.22 0.00 -1.00 0.00 0.00 59.36 58.82 1q27 h GLU 143 Cb 2.76 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 31.79 1q27 h GLU 143 CO -0.29 0.85 -0.78 0.45 -1.00 0.00 0.00 179.01 178.24 1q27 h HIS 144 N 1.16 0.96 0.05 4.33 3.86 0.34 -1.67 115.15 124.17 1q27 h HIS 144 Ca 0.29 -0.43 -0.00 0.00 -1.16 0.00 0.00 60.37 59.07 1q27 h HIS 144 Cb 0.03 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.35 1q27 h HIS 144 CO 0.01 1.24 -0.02 1.25 0.86 0.00 0.00 177.93 181.27 1q27 h LEU 145 N 0.48 -0.05 -1.04 2.43 7.12 -0.98 -1.91 115.31 121.36 1q27 h LEU 145 Ca -0.05 -0.10 -0.07 0.00 0.13 0.00 0.00 57.88 57.79 1q27 h LEU 145 Cb 1.40 0.01 -0.02 0.00 -0.53 0.00 0.00 40.66 41.52 1q27 h LEU 145 CO 0.15 0.07 -0.07 -0.07 -0.13 0.00 0.00 178.44 178.39 1q27 h LEU 146 N -0.17 0.58 -1.56 2.25 -0.00 -1.00 -2.02 115.31 113.39 1q27 h LEU 146 Ca -0.01 -0.14 -0.02 0.00 -0.00 0.00 0.00 57.88 57.71 1q27 h LEU 146 Cb 0.15 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 40.64 1q27 h LEU 146 CO 0.01 0.70 0.10 0.00 -0.00 0.00 0.00 178.44 179.25 1q27 h ALA 147 N 1.36 1.66 0.05 1.53 0.00 -1.02 0.13 119.26 122.97 1q27 h ALA 147 Ca 0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1q27 h ALA 147 Cb 0.46 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1q27 h ALA 147 CO 0.02 0.27 -0.02 0.00 0.00 0.00 0.00 179.25 179.52 1q27 h ARG 148 N 0.39 -0.06 -0.16 0.00 3.08 -0.88 -1.51 114.38 115.24 1q27 h ARG 148 Ca 0.10 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.20 1q27 h ARG 148 Cb 0.10 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1q27 h ARG 148 CO -0.01 0.11 0.13 -0.84 -1.07 0.00 0.00 179.97 178.30 1q27 h ILE 149 N -1.01 0.73 0.14 2.04 3.07 -1.37 -1.75 117.51 119.36 1q27 h ILE 149 Ca -0.01 0.00 -0.23 0.00 1.55 0.00 0.00 64.86 66.17 1q27 h ILE 149 Cb 0.20 0.90 0.01 0.00 -0.27 0.00 0.00 36.82 37.67 1q27 h ILE 149 CO 0.01 0.00 -1.07 0.00 -1.05 0.00 0.00 178.15 176.04 1q27 h ALA 150 N 1.88 -0.01 0.34 0.16 0.00 -0.84 -3.39 119.26 117.40 1q27 h ALA 150 Ca 0.08 -0.84 -0.02 0.00 0.00 0.00 0.00 54.91 54.13 1q27 h ALA 150 Cb 0.35 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1q27 h ALA 150 CO -0.00 0.55 -0.19 0.00 0.00 0.00 0.00 179.25 179.61 1q27 h ALA 151 N 0.04 -1.08 0.00 0.00 0.00 -0.66 -3.47 119.26 114.10 1q27 h ALA 151 Ca -0.21 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1q27 h ALA 151 Cb 1.72 0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1q27 h ALA 151 CO 0.13 -1.05 0.00 0.41 0.00 0.00 0.00 179.25 178.74 1q27 n GLY 152 N -1.25 -1.80 2.14 0.00 0.00 -0.72 -5.03 105.19 98.53 1q27 n GLY 152 Ca -0.06 0.70 -0.16 0.00 0.00 0.00 0.00 46.02 46.49 1q27 n GLY 152 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1q27 n GLU 153 N 0.00 2.90 -2.25 1.61 2.13 -1.01 -4.88 120.64 119.14 1q27 n GLU 153 Ca 0.00 -3.02 -0.19 0.00 0.66 0.00 0.00 57.16 54.61 1q27 n GLU 153 Cb 0.00 -2.19 -0.02 0.00 0.27 0.00 0.00 31.44 29.49 1q27 n GLU 153 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1q27 n ALA 154 N -0.70 -0.59 -0.64 4.31 0.00 -1.26 -3.04 120.51 118.59 1q27 n ALA 154 Ca 0.52 0.18 -0.09 0.00 0.00 0.00 0.00 53.44 54.04 1q27 n ALA 154 Cb 1.55 -2.01 0.21 0.00 0.00 0.00 0.00 19.45 19.20 1q27 n ALA 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q27 n ALA 155 N -1.47 4.42 -2.07 0.00 0.00 -1.26 -2.21 120.51 117.92 1q27 n ALA 155 Ca -0.22 -1.97 0.00 0.00 0.00 0.00 0.00 53.44 51.25 1q27 n ALA 155 Cb 0.66 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1q27 n ALA 155 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1q27 n LYS 156 N -0.30 -5.29 -0.27 0.00 5.02 -1.26 -4.14 118.16 111.91 1q27 n LYS 156 Ca 0.37 3.79 -0.05 0.00 -2.02 0.00 0.00 58.31 60.40 1q27 n LYS 156 Cb 1.26 -4.20 0.06 0.00 -0.02 0.00 0.00 35.03 32.13 1q27 n LYS 156 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1q27 h GLY 157 N 4.13 1.09 1.33 0.72 0.00 -1.94 -2.13 103.07 106.27 1q27 h GLY 157 Ca 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 1q27 h GLY 157 CO 0.00 0.44 0.41 1.29 0.00 0.00 0.00 176.54 178.68 1q27 h ASP 158 N 1.03 0.78 0.31 0.19 2.03 -1.97 0.24 116.42 119.02 1q27 h ASP 158 Ca 0.27 -0.04 -0.01 0.00 -0.73 0.00 0.00 57.03 56.52 1q27 h ASP 158 Cb -0.03 -0.20 0.00 0.00 -0.83 0.00 0.00 39.33 38.28 1q27 h ASP 158 CO -0.05 0.60 -0.15 0.25 -1.03 0.00 0.00 179.24 178.86 1q27 h LEU 159 N 0.91 -0.35 -1.04 0.15 5.85 -1.66 -2.11 115.31 117.06 1q27 h LEU 159 Ca 0.24 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1q27 h LEU 159 Cb -0.05 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 1q27 h LEU 159 CO -0.05 0.01 0.65 0.00 -0.34 0.00 0.00 178.44 178.71 1q27 h ALA 160 N -0.19 1.32 -0.54 1.25 0.00 -1.23 0.30 119.26 120.17 1q27 h ALA 160 Ca -0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1q27 h ALA 160 Cb 0.50 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1q27 h ALA 160 CO 0.07 0.62 0.19 1.49 0.00 0.00 0.00 179.25 181.62 1q27 h GLU 161 N 1.30 0.80 0.07 0.00 4.81 -0.94 0.14 114.58 120.76 1q27 h GLU 161 Ca 0.36 -0.13 -0.26 0.00 -0.13 0.00 0.00 59.36 59.20 1q27 h GLU 161 Cb -0.12 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.14 1q27 h GLU 161 CO -0.09 0.68 -1.11 1.25 -0.73 0.00 0.00 179.01 179.01 1q27 h LEU 162 N 0.78 0.62 -0.48 1.64 6.46 -0.67 -2.27 115.31 121.39 1q27 h LEU 162 Ca 0.18 -0.56 -0.16 0.00 -0.12 0.00 0.00 57.88 57.22 1q27 h LEU 162 Cb 0.20 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1q27 h LEU 162 CO -0.01 1.39 -0.53 0.58 -0.62 0.00 0.00 178.44 179.24 1q27 h VAL 163 N 0.21 1.31 -0.03 1.05 2.07 -0.68 -2.11 116.25 118.07 1q27 h VAL 163 Ca -0.13 -1.76 -0.19 0.00 0.82 0.00 0.00 66.70 65.45 1q27 h VAL 163 Cb 1.78 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 33.26 1q27 h VAL 163 CO 0.20 0.55 -0.79 -0.09 0.02 0.00 0.00 177.57 177.46 1q27 h ARG 164 N 0.49 0.27 -0.08 1.57 2.43 -0.80 -0.82 114.38 117.44 1q27 h ARG 164 Ca 0.01 -0.25 -0.15 0.00 -0.81 0.00 0.00 59.98 58.79 1q27 h ARG 164 Cb 1.09 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1q27 h ARG 164 CO 0.10 0.93 -0.61 0.00 -1.51 0.00 0.00 179.97 178.89 1q27 h ARG 165 N 0.17 0.29 0.13 0.20 3.08 -1.36 -0.63 114.38 116.26 1q27 h ARG 165 Ca -0.04 -0.20 -0.29 0.00 0.07 0.00 0.00 59.98 59.52 1q27 h ARG 165 Cb 1.38 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.46 1q27 h ARG 165 CO 0.13 0.81 -1.39 0.00 -1.07 0.00 0.00 179.97 178.44 1q27 h TYR 167 N 0.07 -0.05 0.44 0.00 -1.99 -1.14 -3.41 116.97 110.90 1q27 h TYR 167 Ca -0.19 -0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.52 1q27 h TYR 167 Cb 2.00 0.02 0.00 0.00 2.00 0.00 0.00 36.73 40.75 1q27 h TYR 167 CO 0.07 -0.03 -0.21 -0.09 -0.00 0.00 0.00 178.16 177.89 1q27 h ARG 168 N -0.18 -0.57 -6.45 4.88 9.65 -1.31 -3.42 114.38 116.99 1q27 h ARG 168 Ca -0.01 0.04 -0.54 0.00 -1.10 0.00 0.00 59.98 58.38 1q27 h ARG 168 Cb 0.04 0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 1q27 h ARG 168 CO 0.01 -0.38 0.63 -1.21 2.80 0.00 0.00 179.97 181.82 1q27 s GLU 169 N -4.24 4.39 -0.05 0.20 2.02 -1.07 -4.85 118.70 115.10 1q27 s GLU 169 Ca -0.09 1.80 0.02 0.00 0.02 0.00 0.00 54.97 56.73 1q27 s GLU 169 Cb 0.01 -3.40 0.06 0.00 0.10 0.00 0.00 34.13 30.90 1q27 s GLU 169 CO 0.26 -0.34 0.87 0.39 0.02 0.00 0.00 175.26 176.45 1q27 n GLU 170 N 4.31 0.19 0.00 1.61 1.02 -1.26 -4.03 120.64 122.48 1q27 n GLU 170 Ca 0.10 -0.80 0.11 0.00 -0.02 0.00 0.00 57.16 56.55 1q27 n GLU 170 Cb 0.46 0.47 0.09 0.00 -0.02 0.00 0.00 31.44 32.43 1q27 n GLU 170 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46