#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q27 n GLY 2 N 0.00 0.24 0.00 3.03 0.00 -1.26 -5.14 105.19 102.06 1q27 n GLY 2 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1q27 n GLY 2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q27 n GLY 3 N 0.00 -0.58 3.15 -0.02 0.00 -1.26 -5.15 105.19 101.33 1q27 n GLY 3 Ca 0.00 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 45.06 1q27 n GLY 3 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1q27 n VAL 4 N 5.32 0.00 -3.95 1.61 0.24 -1.26 -5.04 118.33 115.25 1q27 n VAL 4 Ca 0.00 -0.16 0.02 0.00 -2.04 0.00 0.00 64.34 62.15 1q27 n VAL 4 Cb 0.00 -0.56 0.01 0.00 -1.47 0.00 0.00 33.84 31.81 1q27 n VAL 4 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1q27 n SER 5 N -1.62 -0.55 -3.56 -1.34 2.88 -1.26 -5.03 113.62 103.14 1q27 n SER 5 Ca 0.03 -1.09 -0.41 0.00 -1.33 0.00 0.00 58.87 56.08 1q27 n SER 5 Cb 0.51 0.84 -0.05 0.00 -0.75 0.00 0.00 64.21 64.76 1q27 n SER 5 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1q27 n ASP 6 N -0.56 2.67 -1.82 -3.46 8.00 -1.26 -4.64 116.55 115.48 1q27 n ASP 6 Ca 0.02 -2.63 0.00 0.00 0.71 0.00 0.00 54.79 52.90 1q27 n ASP 6 Cb 0.28 -1.08 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 1q27 n ASP 6 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1q27 n GLU 7 N 6.73 -4.89 -3.98 -1.24 1.02 -1.26 -4.92 120.64 112.09 1q27 n GLU 7 Ca 0.48 3.52 -0.09 0.00 -0.02 0.00 0.00 57.16 61.05 1q27 n GLU 7 Cb 0.37 -3.77 -0.11 0.00 -0.02 0.00 0.00 31.44 27.91 1q27 n GLU 7 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1q27 s ARG 8 N -1.39 0.35 -0.34 3.49 3.52 -1.26 -4.48 118.95 118.83 1q27 s ARG 8 Ca 0.00 -0.64 -0.06 0.00 -0.13 0.00 0.00 55.73 54.90 1q27 s ARG 8 Cb 0.00 0.12 0.04 0.00 -1.56 0.00 0.00 34.95 33.55 1q27 s ARG 8 CO 0.00 -0.06 0.10 -0.51 -0.81 0.00 0.00 175.30 174.02 1q27 s LEU 9 N -1.57 4.29 -0.23 -0.88 1.02 -0.79 -1.90 118.68 118.62 1q27 s LEU 9 Ca -0.14 -1.14 -0.07 0.00 0.02 0.00 0.00 54.13 52.80 1q27 s LEU 9 Cb -0.08 -1.86 -0.03 0.00 0.02 0.00 0.00 46.19 44.23 1q27 s LEU 9 CO -0.02 -0.32 0.06 -1.81 0.02 0.00 0.00 176.35 174.28 1q27 s ASP 10 N 1.40 5.21 -0.36 2.29 1.11 -1.26 -1.58 116.67 123.47 1q27 s ASP 10 Ca -0.02 -0.14 -0.13 0.00 0.18 0.00 0.00 52.55 52.44 1q27 s ASP 10 Cb -0.19 -1.92 -0.00 0.00 1.07 0.00 0.00 42.92 41.87 1q27 s ASP 10 CO 0.03 0.03 0.26 -0.76 1.18 0.00 0.00 175.17 175.90 1q27 s LEU 11 N 1.24 4.70 0.04 1.23 1.02 -0.18 -4.80 118.68 121.92 1q27 s LEU 11 Ca 0.04 -0.59 0.07 0.00 0.02 0.00 0.00 54.13 53.68 1q27 s LEU 11 Cb -0.14 -2.14 -0.03 0.00 0.02 0.00 0.00 46.19 43.90 1q27 s LEU 11 CO 0.03 -0.30 -0.18 0.54 0.02 0.00 0.00 176.35 176.45 1q27 s VAL 12 N 1.70 2.76 0.02 -1.59 0.11 -1.26 0.10 120.40 122.25 1q27 s VAL 12 Ca 0.06 -1.20 -0.07 0.00 -2.93 0.00 0.00 61.98 57.83 1q27 s VAL 12 Cb -0.18 -2.16 -0.03 0.00 -1.53 0.00 0.00 36.38 32.49 1q27 s VAL 12 CO 0.10 0.33 1.11 0.78 -3.33 0.00 0.00 175.10 174.10 1q27 h ASN 13 N 4.53 -0.35 0.00 3.54 4.21 -1.50 -3.46 115.58 122.55 1q27 h ASN 13 Ca -0.48 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.07 1q27 h ASN 13 Cb 1.15 0.14 0.00 0.00 -1.12 0.00 0.00 38.32 38.49 1q27 h ASN 13 CO 0.47 -0.10 0.00 1.21 -1.29 0.00 0.00 177.43 177.72 1q27 n GLU 14 N -3.15 0.00 0.00 0.81 2.13 -1.26 -5.04 120.64 114.14 1q27 n GLU 14 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1q27 n GLU 14 Cb 0.08 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.79 1q27 n GLU 14 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1q27 n ARG 15 N -1.76 0.00 -1.59 5.31 0.63 -1.26 -4.95 116.66 113.04 1q27 n ARG 15 Ca 0.00 0.08 -0.05 0.00 -0.92 0.00 0.00 57.85 56.96 1q27 n ARG 15 Cb 0.00 -0.43 -0.00 0.00 0.45 0.00 0.00 32.46 32.48 1q27 n ARG 15 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1q27 n ASP 16 N -1.27 -1.01 -4.22 6.15 8.00 -1.26 -5.05 116.55 117.89 1q27 n ASP 16 Ca 0.00 -2.07 -0.41 0.00 0.71 0.00 0.00 54.79 53.02 1q27 n ASP 16 Cb 0.00 0.38 -0.04 0.00 -0.02 0.00 0.00 41.12 41.44 1q27 n ASP 16 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1q27 s GLU 17 N -0.04 3.49 -0.25 -1.24 2.02 -1.26 -4.98 118.70 116.43 1q27 s GLU 17 Ca 0.05 -2.96 -0.31 0.00 0.02 0.00 0.00 54.97 51.77 1q27 s GLU 17 Cb 0.16 -4.19 -0.08 0.00 0.10 0.00 0.00 34.13 30.13 1q27 s GLU 17 CO -0.05 -1.25 2.19 0.28 0.02 0.00 0.00 175.26 176.45 1q27 n VAL 18 N 2.98 0.31 0.03 2.63 0.31 -1.26 -1.18 118.33 122.15 1q27 n VAL 18 Ca 0.18 -0.36 -0.19 0.00 -0.01 0.00 0.00 64.34 63.96 1q27 n VAL 18 Cb 0.40 -2.18 -0.11 0.00 -0.91 0.00 0.00 33.84 31.04 1q27 n VAL 18 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1q27 h VAL 19 N 7.01 1.35 -2.76 2.52 -1.51 0.39 -3.47 116.25 119.77 1q27 h VAL 19 Ca -0.36 -2.20 -0.11 0.00 -1.23 0.00 0.00 66.70 62.80 1q27 h VAL 19 Cb 1.27 2.52 -0.21 0.00 -2.13 0.00 0.00 31.29 32.74 1q27 h VAL 19 CO 0.98 0.66 -0.19 -0.83 -1.23 0.00 0.00 177.57 176.97 1q27 s GLY 20 N -4.22 -0.28 -0.40 5.19 0.00 -1.03 -5.05 107.32 101.54 1q27 s GLY 20 Ca -0.11 0.80 -0.02 0.00 0.00 0.00 0.00 44.72 45.39 1q27 s GLY 20 CO 0.88 0.59 0.18 1.20 0.00 0.00 0.00 173.10 175.95 1q27 s GLN 21 N -0.72 1.91 -0.13 2.90 -0.21 -1.26 -1.02 119.66 121.14 1q27 s GLN 21 Ca -0.08 -1.83 -0.09 0.00 0.02 0.00 0.00 55.36 53.38 1q27 s GLN 21 Cb -0.04 -3.52 -0.04 0.00 1.00 0.00 0.00 33.01 30.41 1q27 s GLN 21 CO 0.04 -1.05 0.17 -1.50 -2.12 0.00 0.00 175.29 170.83 1q27 s ILE 22 N 1.09 5.44 0.06 1.08 1.10 -0.61 -5.03 121.20 124.33 1q27 s ILE 22 Ca 0.09 0.28 0.03 0.00 -0.51 0.00 0.00 60.65 60.54 1q27 s ILE 22 Cb -0.22 -3.45 -0.04 0.00 0.15 0.00 0.00 42.46 38.89 1q27 s ILE 22 CO -0.05 0.57 0.07 -0.76 -2.11 0.00 0.00 174.94 172.66 1q27 s LEU 23 N -0.69 3.77 0.33 8.50 1.43 -1.26 -1.89 118.68 128.86 1q27 s LEU 23 Ca 0.15 0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 1q27 s LEU 23 Cb -0.12 -2.40 0.56 0.00 0.03 0.00 0.00 46.19 44.26 1q27 s LEU 23 CO 0.04 0.20 1.91 0.08 0.23 0.00 0.00 176.35 178.80 1q27 h ARG 24 N 3.51 0.72 0.00 1.70 0.11 -1.92 -2.34 114.38 116.16 1q27 h ARG 24 Ca -0.47 -0.11 -0.19 0.00 0.10 0.00 0.00 59.98 59.31 1q27 h ARG 24 Cb 1.17 -0.13 -0.03 0.00 1.11 0.00 0.00 29.97 32.09 1q27 h ARG 24 CO 0.64 0.61 -0.88 1.79 0.10 0.00 0.00 179.97 182.23 1q27 h THR 25 N 0.72 1.56 -2.62 0.08 1.35 -1.94 -3.44 112.91 108.62 1q27 h THR 25 Ca 0.17 -3.09 -0.54 0.00 -0.55 0.00 0.00 66.41 62.40 1q27 h THR 25 Cb 0.16 2.70 -0.00 0.00 -1.73 0.00 0.00 68.15 69.28 1q27 h THR 25 CO -0.01 0.86 1.07 -1.81 -0.25 0.00 0.00 175.52 175.38 1q27 s ASP 26 N -6.69 6.65 0.00 5.36 1.01 -0.88 -4.88 116.67 117.24 1q27 s ASP 26 Ca 0.01 2.31 0.29 0.00 0.71 0.00 0.00 52.55 55.87 1q27 s ASP 26 Cb 0.10 -2.54 1.71 0.00 1.01 0.00 0.00 42.92 43.20 1q27 s ASP 26 CO 0.80 -0.92 2.05 -0.81 0.21 0.00 0.00 175.17 176.50 1q27 n PRO 27 N 6.82 0.89 -0.27 8.23 -0.04 -1.26 -3.92 135.00 145.46 1q27 n PRO 27 Ca 0.17 0.00 0.30 0.00 -0.04 0.00 0.00 63.50 63.93 1q27 n PRO 27 Cb 0.42 -1.50 0.69 0.00 -0.04 0.00 0.00 33.50 33.07 1q27 n PRO 27 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1q27 h ALA 28 N 3.79 2.83 -2.23 0.55 0.00 -1.90 -3.41 119.26 118.90 1q27 h ALA 28 Ca 0.00 -0.02 -0.48 0.00 0.00 0.00 0.00 54.91 54.42 1q27 h ALA 28 Cb 0.00 0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.88 1q27 h ALA 28 CO 0.00 -1.15 -0.08 -0.48 0.00 0.00 0.00 179.25 177.54 1q27 s LEU 29 N -8.68 3.83 -0.57 0.00 0.05 -1.25 -5.06 118.68 106.99 1q27 s LEU 29 Ca -0.06 0.56 -0.10 0.00 0.05 0.00 0.00 54.13 54.58 1q27 s LEU 29 Cb 0.23 -3.45 0.14 0.00 -2.05 0.00 0.00 46.19 41.06 1q27 s LEU 29 CO 0.79 -0.46 0.46 -0.13 -0.55 0.00 0.00 176.35 176.46 1q27 s ARG 30 N -4.49 2.78 -0.31 1.48 0.52 -1.26 -5.04 118.95 112.63 1q27 s ARG 30 Ca 0.44 -1.98 -0.29 0.00 -0.52 0.00 0.00 55.73 53.38 1q27 s ARG 30 Cb -0.10 -4.06 -0.01 0.00 0.52 0.00 0.00 34.95 31.30 1q27 s ARG 30 CO 0.39 -1.24 1.64 -1.58 0.02 0.00 0.00 175.30 174.54 1q27 s TRP 31 N 1.01 2.05 0.00 -0.53 0.52 -1.26 -4.36 118.94 116.37 1q27 s TRP 31 Ca 0.09 0.61 0.00 0.00 0.02 0.00 0.00 56.10 56.82 1q27 s TRP 31 Cb -0.23 -4.12 0.00 0.00 -1.15 0.00 0.00 33.47 27.96 1q27 s TRP 31 CO -0.02 -2.70 0.00 0.39 0.02 0.00 0.00 176.95 174.64 1q27 n GLU 32 N 8.09 0.00 -0.60 4.98 1.02 -1.26 -4.95 120.64 127.92 1q27 n GLU 32 Ca 0.20 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.40 1q27 n GLU 32 Cb 0.47 0.00 0.20 0.00 -0.02 0.00 0.00 31.44 32.09 1q27 n GLU 32 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1q27 n ARG 33 N -1.88 1.55 -1.91 3.49 1.85 -1.26 -4.09 116.66 114.40 1q27 n ARG 33 Ca 0.00 -3.26 -0.30 0.00 -1.00 0.00 0.00 57.85 53.30 1q27 n ARG 33 Cb 0.00 -1.58 0.16 0.00 -1.05 0.00 0.00 32.46 29.98 1q27 n ARG 33 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1q27 s VAL 34 N -3.16 2.00 -0.14 8.89 1.01 -1.26 -4.66 120.40 123.07 1q27 s VAL 34 Ca 0.38 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 62.25 1q27 s VAL 34 Cb 0.37 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.71 1q27 s VAL 34 CO -0.07 0.00 0.20 -0.13 0.00 0.00 0.00 175.10 175.10 1q27 s ARG 35 N -5.79 3.92 0.04 2.72 0.52 -1.26 -1.55 118.95 117.56 1q27 s ARG 35 Ca 0.70 -0.06 -0.03 0.00 -0.52 0.00 0.00 55.73 55.82 1q27 s ARG 35 Cb -0.06 -3.32 -0.02 0.00 0.52 0.00 0.00 34.95 32.06 1q27 s ARG 35 CO 0.52 0.49 0.03 0.08 0.02 0.00 0.00 175.30 176.44 1q27 s VAL 36 N -0.24 0.17 -0.23 3.52 1.01 0.47 -4.31 120.40 120.78 1q27 s VAL 36 Ca 0.14 -1.37 -0.05 0.00 0.00 0.00 0.00 61.98 60.69 1q27 s VAL 36 Cb -0.12 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 1q27 s VAL 36 CO 0.03 -0.76 0.01 0.68 0.00 0.00 0.00 175.10 175.06 1q27 s VAL 37 N -3.09 3.84 0.07 2.92 -7.23 -0.20 -2.29 120.40 114.43 1q27 s VAL 37 Ca -0.01 -0.33 0.07 0.00 -1.81 0.00 0.00 61.98 59.89 1q27 s VAL 37 Cb 0.02 -2.77 -0.03 0.00 0.56 0.00 0.00 36.38 34.16 1q27 s VAL 37 CO -0.07 0.39 -0.18 0.20 -0.31 0.00 0.00 175.10 175.13 1q27 s ASN 38 N 1.50 2.14 0.07 4.85 0.02 -0.24 -0.65 114.94 122.64 1q27 s ASN 38 Ca 0.06 -0.59 -0.26 0.00 -1.02 0.00 0.00 52.86 51.05 1q27 s ASN 38 Cb -0.15 -0.12 0.08 0.00 0.02 0.00 0.00 41.25 41.08 1q27 s ASN 38 CO 0.00 0.04 0.67 0.00 0.02 0.00 0.00 177.10 177.84 1q27 s ALA 39 N -1.06 -1.68 -0.18 0.60 0.00 -0.37 -1.69 121.76 117.38 1q27 s ALA 39 Ca 0.04 0.81 -0.06 0.00 0.00 0.00 0.00 51.96 52.74 1q27 s ALA 39 Cb -0.09 0.55 -0.03 0.00 0.00 0.00 0.00 23.12 23.54 1q27 s ALA 39 CO 0.03 -0.64 0.03 -0.06 0.00 0.00 0.00 175.76 175.11 1q27 s PHE 40 N -2.94 3.14 -0.28 0.00 0.40 0.42 -0.44 117.98 118.29 1q27 s PHE 40 Ca -0.02 -0.15 -0.12 0.00 -0.60 0.00 0.00 56.93 56.05 1q27 s PHE 40 Cb -0.01 -2.06 -0.04 0.00 0.51 0.00 0.00 43.02 41.42 1q27 s PHE 40 CO -0.06 -0.00 0.24 -0.51 0.70 0.00 0.00 175.22 175.58 1q27 s LEU 41 N 0.58 4.06 -0.03 -0.37 2.01 -1.26 -2.17 118.68 121.50 1q27 s LEU 41 Ca 0.01 0.03 -0.07 0.00 0.01 0.00 0.00 54.13 54.11 1q27 s LEU 41 Cb -0.13 -2.20 0.01 0.00 0.01 0.00 0.00 46.19 43.88 1q27 s LEU 41 CO 0.02 -0.10 0.16 -0.60 1.01 0.00 0.00 176.35 176.84 1q27 s ARG 42 N 1.83 0.37 0.34 1.70 3.52 -1.05 -2.52 118.95 123.15 1q27 s ARG 42 Ca 0.09 -0.13 -0.17 0.00 -0.13 0.00 0.00 55.73 55.38 1q27 s ARG 42 Cb -0.16 0.16 0.06 0.00 -1.56 0.00 0.00 34.95 33.45 1q27 s ARG 42 CO 0.11 -0.08 0.84 0.54 -0.81 0.00 0.00 175.30 175.90 1q27 s ASN 43 N -0.78 -0.01 -1.63 -2.12 6.03 -0.95 -2.00 114.94 113.47 1q27 s ASN 43 Ca -0.09 -1.02 0.00 0.00 -1.03 0.00 0.00 52.86 50.73 1q27 s ASN 43 Cb -0.05 0.77 0.00 0.00 -3.03 0.00 0.00 41.25 38.94 1q27 s ASN 43 CO 0.01 -1.52 0.00 -1.20 -2.03 0.00 0.00 177.10 172.36 1q27 n SER 44 N -1.32 -5.06 -3.76 3.54 7.64 -1.26 -1.19 113.62 112.21 1q27 n SER 44 Ca -0.07 0.38 -0.33 0.00 1.01 0.00 0.00 58.87 59.86 1q27 n SER 44 Cb 0.60 -4.21 0.03 0.00 -1.01 0.00 0.00 64.21 59.62 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 -1.66 -0.99 0.00 1.43 7.27 -1.26 -4.45 117.38 117.72 1q27 n GLN 45 Ca -0.15 0.44 0.00 0.00 0.07 0.00 0.00 57.00 57.36 1q27 n GLN 45 Cb 0.59 -3.58 0.00 0.00 2.41 0.00 0.00 30.24 29.66 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 -1.79 0.19 3.46 1.69 0.00 -1.15 -5.06 105.19 102.52 1q27 n GLY 46 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 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 3.46 -0.34 1.61 -0.21 -0.33 -3.61 119.66 120.24 1q27 s GLN 47 Ca 0.00 -1.47 -0.10 0.00 0.02 0.00 0.00 55.36 53.81 1q27 s GLN 47 Cb 0.00 -4.75 0.00 0.00 1.00 0.00 0.00 33.01 29.27 1q27 s GLN 47 CO 0.00 -1.81 0.18 -0.51 -2.12 0.00 0.00 175.29 171.04 1q27 s LEU 48 N 3.19 4.36 -0.27 2.90 1.43 -0.88 -2.24 118.68 127.17 1q27 s LEU 48 Ca 0.30 -0.66 -0.12 0.00 -1.03 0.00 0.00 54.13 52.62 1q27 s LEU 48 Cb -0.08 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 1q27 s LEU 48 CO -0.04 -0.26 0.25 0.86 0.23 0.00 0.00 176.35 177.38 1q27 s TRP 49 N 1.61 3.24 -0.23 0.29 -0.00 -1.05 -1.15 118.94 121.65 1q27 s TRP 49 Ca 0.04 0.23 -0.26 0.00 -0.00 0.00 0.00 56.10 56.11 1q27 s TRP 49 Cb -0.18 -2.43 0.08 0.00 -0.00 0.00 0.00 33.47 30.95 1q27 s TRP 49 CO 0.07 -0.15 0.78 0.42 -0.00 0.00 0.00 176.95 178.07 1q27 s ILE 50 N 1.75 0.00 0.28 5.86 1.09 0.53 -4.40 121.20 126.31 1q27 s ILE 50 Ca 0.10 0.00 -0.29 0.00 -1.10 0.00 0.00 60.65 59.35 1q27 s ILE 50 Cb -0.16 -1.00 -0.13 0.00 -1.06 0.00 0.00 42.46 40.11 1q27 s ILE 50 CO 0.10 0.00 1.24 -2.65 -0.10 0.00 0.00 174.94 173.53 1q27 n PRO 51 N 2.25 1.79 0.00 2.79 -0.02 -1.26 -2.57 135.00 137.99 1q27 n PRO 51 Ca -0.14 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1q27 n PRO 51 Cb 0.56 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1q27 n PRO 51 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1q27 n ARG 52 N 1.17 2.92 -1.69 -0.52 -4.01 -1.26 -4.75 116.66 108.52 1q27 n ARG 52 Ca 0.09 0.00 -0.39 0.00 -1.04 0.00 0.00 57.85 56.51 1q27 n ARG 52 Cb 0.32 -0.90 0.03 0.00 -3.04 0.00 0.00 32.46 28.88 1q27 n ARG 52 CO 0.00 0.00 0.00 2.89 -3.04 0.00 0.00 177.63 177.48 1q27 n ARG 53 N -1.75 1.54 -3.63 2.89 0.00 -1.26 -4.99 116.66 109.45 1q27 n ARG 53 Ca 0.00 0.56 -0.37 0.00 -0.00 0.00 0.00 57.85 58.04 1q27 n ARG 53 Cb 0.40 -2.37 -0.06 0.00 -0.00 0.00 0.00 32.46 30.43 1q27 n ARG 53 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1q27 s SER 54 N -0.86 6.65 -0.68 2.89 0.01 -1.26 -5.03 113.70 115.41 1q27 s SER 54 Ca 0.69 0.77 -0.27 0.00 1.31 0.00 0.00 55.95 58.45 1q27 s SER 54 Cb -0.46 -2.18 0.01 0.00 0.21 0.00 0.00 66.02 63.61 1q27 s SER 54 CO 0.52 0.32 1.49 -2.16 0.41 0.00 0.00 173.24 173.81 1q27 s PRO 55 N -1.27 3.01 0.13 12.44 0.04 -1.26 -4.84 135.00 143.25 1q27 s PRO 55 Ca 0.23 0.11 0.04 0.00 0.04 0.00 0.00 61.00 61.43 1q27 s PRO 55 Cb -0.15 -4.25 -0.16 0.00 0.04 0.00 0.00 34.50 29.98 1q27 s PRO 55 CO 0.12 -2.33 1.29 0.77 0.04 0.00 0.00 177.00 176.89 1q27 h SER 56 N 11.79 0.11 0.22 6.66 0.02 -2.01 -3.37 113.55 126.98 1q27 h SER 56 Ca -0.27 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.55 1q27 h SER 56 Cb 1.09 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1q27 h SER 56 CO 1.25 1.04 -0.11 0.50 -1.14 0.00 0.00 176.83 178.38 1q27 h LYS 57 N 0.03 -0.29 -7.22 3.45 3.64 -2.04 -3.45 116.57 110.68 1q27 h LYS 57 Ca -0.04 0.02 -0.44 0.00 -1.27 0.00 0.00 60.65 58.92 1q27 h LYS 57 Cb 1.73 0.07 0.19 0.00 -0.41 0.00 0.00 32.23 33.81 1q27 h LYS 57 CO 0.14 -0.19 0.06 -1.54 -2.27 0.00 0.00 179.45 175.65 1q27 s SER 58 N -3.17 1.38 -0.51 4.20 1.04 -1.26 -5.01 113.70 110.36 1q27 s SER 58 Ca -0.04 1.35 0.07 0.00 0.48 0.00 0.00 55.95 57.80 1q27 s SER 58 Cb 0.00 -2.10 0.23 0.00 0.10 0.00 0.00 66.02 64.26 1q27 s SER 58 CO 0.13 -3.93 0.58 -0.11 0.98 0.00 0.00 173.24 170.89 1q27 n LEU 59 N -4.72 1.64 -3.25 2.42 0.00 -1.26 -4.94 117.00 106.89 1q27 n LEU 59 Ca 0.03 -4.97 0.03 0.00 0.00 0.00 0.00 56.01 51.10 1q27 n LEU 59 Cb 0.56 0.04 -0.02 0.00 0.00 0.00 0.00 43.42 43.99 1q27 n LEU 59 CO 0.58 2.02 0.43 0.12 0.00 0.00 0.00 177.39 180.53 1q27 s PHE 60 N -1.54 -0.98 0.99 1.96 5.36 -1.26 -5.17 117.98 117.33 1q27 s PHE 60 Ca 0.36 1.24 -0.12 0.00 -0.96 0.00 0.00 56.93 57.45 1q27 s PHE 60 Cb 0.13 0.42 0.19 0.00 -0.34 0.00 0.00 43.02 43.41 1q27 s PHE 60 CO -0.09 -0.52 1.09 -1.25 -1.46 0.00 0.00 175.22 172.98 1q27 s PRO 61 N 2.80 0.47 0.22 10.12 0.04 -1.26 -5.00 135.00 142.39 1q27 s PRO 61 Ca 0.05 0.64 -0.18 0.00 0.04 0.00 0.00 61.00 61.56 1q27 s PRO 61 Cb -0.11 -1.73 0.02 0.00 0.04 0.00 0.00 34.50 32.72 1q27 s PRO 61 CO -0.16 -2.74 0.56 -0.80 0.04 0.00 0.00 177.00 173.90 1q27 s ASN 62 N -3.32 -0.24 -0.03 6.66 0.01 -1.26 -5.10 114.94 111.65 1q27 s ASN 62 Ca 0.65 -0.57 -0.00 0.00 -0.71 0.00 0.00 52.86 52.23 1q27 s ASN 62 Cb -0.19 0.62 -0.00 0.00 0.41 0.00 0.00 41.25 42.08 1q27 s ASN 62 CO 0.58 -1.13 -0.01 0.00 -1.51 0.00 0.00 177.10 175.03 1q27 h ALA 63 N 2.15 0.00 -2.55 0.60 0.00 -1.67 -3.33 119.26 114.47 1q27 h ALA 63 Ca -0.26 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1q27 h ALA 63 Cb 1.26 0.01 -0.15 0.00 0.00 0.00 0.00 17.79 18.91 1q27 h ALA 63 CO 0.34 0.01 0.16 -1.17 0.00 0.00 0.00 179.25 178.59 1q27 s LEU 64 N -5.21 -0.49 -0.03 0.00 2.96 -1.26 -4.12 118.68 110.53 1q27 s LEU 64 Ca -0.00 0.28 0.07 0.00 -0.22 0.00 0.00 54.13 54.26 1q27 s LEU 64 Cb 0.00 2.47 -0.02 0.00 0.50 0.00 0.00 46.19 49.14 1q27 s LEU 64 CO 0.01 -0.79 -0.24 -1.81 -1.32 0.00 0.00 176.35 172.20 1q27 s ASP 65 N -2.05 3.22 1.04 3.68 1.11 -1.26 -5.08 116.67 117.32 1q27 s ASP 65 Ca -0.04 -0.43 -0.05 0.00 0.18 0.00 0.00 52.55 52.20 1q27 s ASP 65 Cb -0.01 -0.50 0.08 0.00 1.07 0.00 0.00 42.92 43.57 1q27 s ASP 65 CO -0.03 0.31 0.19 1.33 1.18 0.00 0.00 175.17 178.16 1q27 n VAL 66 N 2.49 0.00 -0.08 -1.27 0.24 -1.26 -4.22 118.33 114.23 1q27 n VAL 66 Ca -0.16 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.03 1q27 n VAL 66 Cb 0.51 -0.21 -0.04 0.00 -1.47 0.00 0.00 33.84 32.63 1q27 n VAL 66 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1q27 n SER 67 N -3.32 1.82 -4.32 -1.34 7.64 0.42 -4.45 113.62 110.06 1q27 n SER 67 Ca 0.03 0.31 -0.38 0.00 1.01 0.00 0.00 58.87 59.84 1q27 n SER 67 Cb 0.13 -0.70 -0.12 0.00 -1.01 0.00 0.00 64.21 62.51 1q27 n SER 67 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1q27 s VAL 68 N -2.74 4.01 -0.07 0.44 1.01 -0.51 -4.80 120.40 117.74 1q27 s VAL 68 Ca -0.27 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 60.83 1q27 s VAL 68 Cb 0.05 -3.17 0.02 0.00 0.00 0.00 0.00 36.38 33.28 1q27 s VAL 68 CO 0.39 -0.07 -0.04 -0.83 0.00 0.00 0.00 175.10 174.54 1q27 s GLY 69 N 1.47 0.57 0.16 4.51 0.00 -1.26 -1.23 107.32 111.54 1q27 s GLY 69 Ca 0.01 -0.21 0.02 0.00 0.00 0.00 0.00 44.72 44.54 1q27 s GLY 69 CO 0.03 0.70 0.18 0.61 0.00 0.00 0.00 173.10 174.62 1q27 n GLY 70 N 4.54 3.13 3.97 0.20 0.00 0.18 -4.78 105.19 112.43 1q27 n GLY 70 Ca -0.17 -1.65 -0.21 0.00 0.00 0.00 0.00 46.02 44.00 1q27 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q27 s ALA 71 N -2.43 4.01 -0.26 4.61 0.00 -1.26 -1.03 121.76 125.39 1q27 s ALA 71 Ca 0.17 -1.28 -0.10 0.00 0.00 0.00 0.00 51.96 50.75 1q27 s ALA 71 Cb 0.00 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 1q27 s ALA 71 CO 0.12 0.15 0.14 0.08 0.00 0.00 0.00 175.76 176.25 1q27 s VAL 72 N -2.05 5.03 0.09 0.00 1.01 -1.26 -4.81 120.40 118.41 1q27 s VAL 72 Ca 0.37 0.07 -0.31 0.00 0.00 0.00 0.00 61.98 62.12 1q27 s VAL 72 Cb -0.09 -3.37 -0.10 0.00 0.00 0.00 0.00 36.38 32.82 1q27 s VAL 72 CO 0.30 0.31 1.85 -1.10 0.00 0.00 0.00 175.10 176.46 1q27 s GLN 73 N 1.48 4.14 0.00 2.72 -0.21 -1.26 -3.77 119.66 122.76 1q27 s GLN 73 Ca 0.07 2.58 0.00 0.00 0.02 0.00 0.00 55.36 58.02 1q27 s GLN 73 Cb -0.15 -3.75 0.00 0.00 1.00 0.00 0.00 33.01 30.11 1q27 s GLN 73 CO 0.07 -0.87 0.00 0.43 -2.12 0.00 0.00 175.29 172.80 1q27 n SER 74 N 6.20 0.00 0.00 5.90 7.64 -0.80 -4.52 113.62 128.04 1q27 n SER 74 Ca 0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1q27 n SER 74 Cb 0.39 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 1q27 n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1q27 n GLY 75 N 0.00 1.51 0.00 0.23 0.00 -1.25 -4.49 105.19 101.19 1q27 n GLY 75 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 0.31 0.00 -3.90 1.61 1.02 -1.26 -5.09 120.64 113.33 1q27 n GLU 76 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.84 1q27 n GLU 76 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.27 1q27 n GLU 76 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1q27 s THR 77 N -0.75 1.60 0.41 2.62 -4.23 -1.26 -4.97 115.64 109.06 1q27 s THR 77 Ca 0.00 -1.72 0.10 0.00 -1.18 0.00 0.00 61.69 58.88 1q27 s THR 77 Cb 0.00 -2.10 0.19 0.00 1.34 0.00 0.00 72.50 71.93 1q27 s THR 77 CO 0.00 -0.49 1.96 1.88 -0.54 0.00 0.00 174.62 177.43 1q27 h TYR 78 N 7.86 0.26 -0.01 3.99 -1.99 -1.98 -2.66 116.97 122.44 1q27 h TYR 78 Ca -0.11 -0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.60 1q27 h TYR 78 Cb 1.03 -0.08 -0.00 0.00 2.00 0.00 0.00 36.73 39.68 1q27 h TYR 78 CO 0.44 0.32 0.00 1.49 -0.00 0.00 0.00 178.16 180.41 1q27 h GLU 79 N 0.25 0.02 -0.90 4.88 4.81 -1.99 -1.04 114.58 120.62 1q27 h GLU 79 Ca 0.06 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1q27 h GLU 79 Cb 0.26 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 1q27 h GLU 79 CO 0.01 0.19 0.59 1.49 -0.73 0.00 0.00 179.01 180.55 1q27 h GLU 80 N -0.15 1.12 0.79 1.92 4.57 -1.94 0.14 114.58 121.02 1q27 h GLU 80 Ca 0.00 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.08 1q27 h GLU 80 Cb 0.17 -0.25 0.01 0.00 -0.16 0.00 0.00 28.75 28.52 1q27 h GLU 80 CO -0.00 0.74 -0.38 0.00 -1.18 0.00 0.00 179.01 178.19 1q27 h ALA 81 N 1.37 -1.05 -0.78 2.92 0.00 -1.33 -2.34 119.26 118.04 1q27 h ALA 81 Ca 0.35 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1q27 h ALA 81 Cb -0.02 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1q27 h ALA 81 CO -0.11 -0.99 0.51 0.35 0.00 0.00 0.00 179.25 179.01 1q27 h PHE 82 N -1.26 0.80 0.04 0.00 3.57 -1.10 -2.26 116.94 116.73 1q27 h PHE 82 Ca -0.11 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.42 1q27 h PHE 82 Cb 0.81 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 1q27 h PHE 82 CO -0.00 0.40 -0.08 -0.09 -2.23 0.00 0.00 178.31 176.31 1q27 h ARG 83 N 0.77 -0.15 -0.55 1.11 2.43 -0.66 0.23 114.38 117.56 1q27 h ARG 83 Ca 0.35 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.57 1q27 h ARG 83 Cb 0.35 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 1q27 h ARG 83 CO -0.13 -0.10 0.36 -0.09 -1.51 0.00 0.00 179.97 178.51 1q27 h ARG 84 N -0.16 0.58 -0.14 0.20 2.43 -0.86 0.13 114.38 116.56 1q27 h ARG 84 Ca 0.02 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 1q27 h ARG 84 Cb 0.17 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1q27 h ARG 84 CO -0.05 0.38 -0.14 0.93 -1.51 0.00 0.00 179.97 179.58 1q27 h GLU 85 N 0.59 0.35 0.00 0.20 5.08 -0.95 -1.80 114.58 118.05 1q27 h GLU 85 Ca 0.23 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1q27 h GLU 85 Cb 0.15 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1q27 h GLU 85 CO -0.06 0.73 -0.13 0.00 -1.00 0.00 0.00 179.01 178.55 1q27 h ALA 86 N 0.61 1.02 0.01 3.43 0.00 -0.44 -2.48 119.26 121.42 1q27 h ALA 86 Ca 0.02 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.58 1q27 h ALA 86 Cb 0.66 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1q27 h ALA 86 CO 0.03 0.16 -1.17 -0.09 0.00 0.00 0.00 179.25 178.18 1q27 h ARG 87 N 0.00 0.03 0.00 0.00 2.43 -0.65 -1.43 114.38 114.77 1q27 h ARG 87 Ca -0.00 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1q27 h ARG 87 Cb 0.64 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1q27 h ARG 87 CO 0.02 0.92 -0.34 1.05 -1.51 0.00 0.00 179.97 180.11 1q27 h GLU 88 N 0.01 0.00 0.10 0.20 4.11 -1.13 0.19 114.58 118.06 1q27 h GLU 88 Ca -0.08 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.14 1q27 h GLU 88 Cb 1.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.09 1q27 h GLU 88 CO 0.13 0.12 -1.01 1.05 0.07 0.00 0.00 179.01 179.37 1q27 h GLU 89 N 0.00 0.21 0.00 1.06 4.11 -1.52 -3.43 114.58 115.01 1q27 h GLU 89 Ca -0.01 -0.37 -0.04 0.00 0.07 0.00 0.00 59.36 59.02 1q27 h GLU 89 Cb 1.11 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 30.44 1q27 h GLU 89 CO 0.02 1.17 -0.30 -0.11 0.07 0.00 0.00 179.01 179.86 1q27 n LEU 90 N -4.12 -0.04 -3.30 3.06 0.00 -1.13 -4.78 117.00 106.68 1q27 n LEU 90 Ca -0.20 -1.24 -0.23 0.00 0.00 0.00 0.00 56.01 54.35 1q27 n LEU 90 Cb 0.80 0.00 0.01 0.00 0.00 0.00 0.00 43.42 44.23 1q27 n LEU 90 CO 0.41 0.79 -0.02 -3.20 0.00 0.00 0.00 177.39 175.36 1q27 n ASN 91 N 0.05 -4.32 -0.11 1.96 2.85 0.67 -4.86 115.26 111.50 1q27 n ASN 91 Ca -0.03 -0.38 -0.13 0.00 -0.11 0.00 0.00 54.58 53.93 1q27 n ASN 91 Cb 0.65 -3.54 -0.03 0.00 1.24 0.00 0.00 39.78 38.10 1q27 n ASN 91 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1q27 h VAL 92 N -1.11 1.29 -0.26 3.44 2.07 -1.47 -3.46 116.25 116.75 1q27 h VAL 92 Ca -0.46 -1.48 -0.11 0.00 0.82 0.00 0.00 66.70 65.47 1q27 h VAL 92 Cb 1.31 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 32.49 1q27 h VAL 92 CO 0.55 0.49 -0.10 -0.62 0.02 0.00 0.00 177.57 177.90 1q27 n GLU 93 N -4.18 -1.13 -2.20 1.57 1.02 -1.25 -3.32 120.64 111.14 1q27 n GLU 93 Ca -0.03 0.58 -0.03 0.00 -0.02 0.00 0.00 57.16 57.66 1q27 n GLU 93 Cb 0.49 -4.58 -0.00 0.00 -0.02 0.00 0.00 31.44 27.33 1q27 n GLU 93 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1q27 n ILE 94 N -2.46 -0.11 -2.03 -3.67 -5.35 -1.26 -4.62 119.36 99.85 1q27 n ILE 94 Ca -0.05 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1q27 n ILE 94 Cb 0.37 -0.37 -0.00 0.00 -1.74 0.00 0.00 39.64 37.90 1q27 n ILE 94 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1q27 n ASP 95 N -1.11 0.05 0.00 7.28 9.92 -1.21 -4.75 116.55 126.72 1q27 n ASP 95 Ca -0.03 -1.80 0.00 0.00 -0.53 0.00 0.00 54.79 52.43 1q27 n ASP 95 Cb 0.44 -0.16 0.00 0.00 -0.64 0.00 0.00 41.12 40.76 1q27 n ASP 95 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1q27 n ALA 96 N 0.03 2.00 -1.73 2.24 0.00 -1.23 -4.99 120.51 116.83 1q27 n ALA 96 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1q27 n ALA 96 Cb 0.69 0.45 0.00 0.00 0.00 0.00 0.00 19.45 20.59 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 -2.40 0.02 0.00 0.00 4.77 -1.26 -5.13 117.00 113.00 1q27 n LEU 97 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1q27 n LEU 97 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1q27 n LEU 97 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.39 175.82 1q27 n SER 98 N -0.37 0.00 -4.04 -1.43 2.88 -1.26 -5.02 113.62 104.37 1q27 n SER 98 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1q27 n SER 98 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 1q27 n SER 98 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1q27 s TRP 99 N 0.00 0.58 -0.21 0.66 1.48 -1.26 -1.66 118.94 118.53 1q27 s TRP 99 Ca 0.00 -0.50 -0.15 0.00 -1.06 0.00 0.00 56.10 54.39 1q27 s TRP 99 Cb 0.00 -0.35 0.06 0.00 -1.16 0.00 0.00 33.47 32.02 1q27 s TRP 99 CO 0.00 -0.10 0.54 1.03 -4.06 0.00 0.00 176.95 174.35 1q27 s ARG 100 N -1.52 0.58 -0.43 3.25 1.81 -0.91 -4.97 118.95 116.77 1q27 s ARG 100 Ca -0.11 0.88 -0.27 0.00 -1.72 0.00 0.00 55.73 54.51 1q27 s ARG 100 Cb -0.10 0.16 -0.05 0.00 -0.45 0.00 0.00 34.95 34.51 1q27 s ARG 100 CO 0.00 -0.12 2.24 -1.25 -0.68 0.00 0.00 175.30 175.49 1q27 s PRO 101 N 0.95 2.52 0.29 3.54 0.04 -1.26 -0.39 135.00 140.70 1q27 s PRO 101 Ca -0.05 1.45 0.05 0.00 0.04 0.00 0.00 61.00 62.49 1q27 s PRO 101 Cb -0.06 -4.48 0.44 0.00 0.04 0.00 0.00 34.50 30.45 1q27 s PRO 101 CO -0.08 -2.81 1.71 1.25 0.04 0.00 0.00 177.00 177.11 1q27 h LEU 102 N 17.60 0.35 0.00 -3.56 7.12 -0.97 -3.47 115.31 132.38 1q27 h LEU 102 Ca -0.29 -0.13 0.00 0.00 0.13 0.00 0.00 57.88 57.58 1q27 h LEU 102 Cb 1.24 -0.10 0.00 0.00 -0.53 0.00 0.00 40.66 41.27 1q27 h LEU 102 CO 1.11 0.68 0.00 0.00 -0.13 0.00 0.00 178.44 180.10 1q27 n ALA 103 N -2.48 0.00 -3.74 1.25 0.00 -0.58 -5.04 120.51 109.91 1q27 n ALA 103 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.20 1q27 n ALA 103 Cb 0.45 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.73 1q27 n ALA 103 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1q27 s SER 104 N -4.00 1.47 -0.27 0.00 0.15 -1.26 -0.36 113.70 109.43 1q27 s SER 104 Ca 0.00 -0.12 -0.11 0.00 0.70 0.00 0.00 55.95 56.42 1q27 s SER 104 Cb 0.00 -0.49 -0.05 0.00 -1.71 0.00 0.00 66.02 63.77 1q27 s SER 104 CO 0.00 -0.14 0.17 -0.36 1.20 0.00 0.00 173.24 174.11 1q27 s PHE 105 N 1.63 3.23 0.00 3.44 0.40 -0.51 -4.73 117.98 121.44 1q27 s PHE 105 Ca 0.00 0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.43 1q27 s PHE 105 Cb -0.13 -2.35 0.00 0.00 0.51 0.00 0.00 43.02 41.05 1q27 s PHE 105 CO -0.04 -0.13 0.00 0.45 0.70 0.00 0.00 175.22 176.20 1q27 n SER 106 N 4.89 0.00 0.00 1.36 2.88 -1.26 -1.94 113.62 119.55 1q27 n SER 106 Ca -0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 1q27 n SER 106 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1q27 n SER 106 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1q27 n PRO 107 N 0.00 0.00 0.00 -1.46 -0.01 -1.26 -4.58 135.00 127.69 1q27 n PRO 107 Ca 0.00 0.41 0.00 0.00 -0.01 0.00 0.00 63.50 63.90 1q27 n PRO 107 Cb 0.00 -0.64 0.00 0.00 -0.01 0.00 0.00 33.50 32.85 1q27 n PRO 107 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 175.50 175.83 1q27 n PHE 108 N -2.06 0.00 0.02 6.00 -0.00 -1.26 -4.91 117.46 115.25 1q27 n PHE 108 Ca 0.00 0.00 0.22 0.00 -0.00 0.00 0.00 57.45 57.67 1q27 n PHE 108 Cb 0.00 0.00 0.72 0.00 -0.00 0.00 0.00 39.48 40.20 1q27 n PHE 108 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.76 177.13 1q27 h GLN 109 N 0.00 0.00 0.01 -4.13 -0.00 -1.99 -2.35 115.11 106.64 1q27 h GLN 109 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 58.65 58.24 1q27 h GLN 109 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 27.48 27.42 1q27 h GLN 109 CO 0.00 0.00 -2.28 0.25 0.00 0.00 0.00 178.83 176.80 1q27 n THR 110 N -3.78 1.54 -2.39 2.39 -2.24 -1.26 -5.02 114.28 103.51 1q27 n THR 110 Ca 0.11 -0.36 -0.05 0.00 -2.27 0.00 0.00 64.05 61.48 1q27 n THR 110 Cb 0.75 -1.83 -0.04 0.00 -2.10 0.00 0.00 70.33 67.11 1q27 n THR 110 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1q27 n THR 111 N -4.09-11.08 -3.36 4.28 -1.04 -0.89 -4.65 114.28 93.45 1q27 n THR 111 Ca -0.48 2.24 0.00 0.00 -2.04 0.00 0.00 64.05 63.77 1q27 n THR 111 Cb 0.88 -6.03 0.00 0.00 -1.82 0.00 0.00 70.33 63.35 1q27 n THR 111 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1q27 n LEU 112 N 1.34 0.00 0.07 -4.42 4.32 -1.26 -4.90 117.00 112.15 1q27 n LEU 112 Ca -0.33 0.00 -0.01 0.00 -0.02 0.00 0.00 56.01 55.65 1q27 n LEU 112 Cb 0.51 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.26 1q27 n LEU 112 CO 0.33 0.00 0.00 0.77 -1.22 0.00 0.00 177.39 177.27 1q27 h SER 113 N 0.00 0.00 -1.81 -1.43 4.64 -1.98 -3.49 113.55 109.48 1q27 h SER 113 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1q27 h SER 113 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1q27 h SER 113 CO 0.00 0.63 0.13 -0.24 -0.87 0.00 0.00 176.83 176.47 1q27 n SER 114 N -3.06 -0.96 -4.57 4.97 2.88 -1.26 -4.19 113.62 107.43 1q27 n SER 114 Ca -0.05 -1.65 -0.41 0.00 -1.33 0.00 0.00 58.87 55.42 1q27 n SER 114 Cb 0.83 1.59 -0.03 0.00 -0.75 0.00 0.00 64.21 65.86 1q27 n SER 114 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1q27 s PHE 115 N -5.99 2.37 0.15 0.66 2.19 -0.59 -4.70 117.98 112.06 1q27 s PHE 115 Ca 0.07 0.26 0.09 0.00 0.33 0.00 0.00 56.93 57.68 1q27 s PHE 115 Cb -0.02 -4.52 -0.04 0.00 -1.31 0.00 0.00 43.02 37.13 1q27 s PHE 115 CO 0.05 -1.89 -0.21 -1.64 1.83 0.00 0.00 175.22 173.36 1q27 s MET 116 N 5.46 1.29 0.32 10.12 -1.94 -0.82 -0.40 119.30 133.34 1q27 s MET 116 Ca 0.43 -1.37 0.05 0.00 -1.71 0.00 0.00 55.69 53.09 1q27 s MET 116 Cb -0.09 -1.48 -0.02 0.00 2.01 0.00 0.00 34.83 35.26 1q27 s MET 116 CO 0.21 0.32 0.47 0.00 -0.01 0.00 0.00 175.02 176.01 1q27 s VAL 118 N -2.18 1.69 0.03 0.00 1.01 0.51 -1.08 120.40 120.38 1q27 s VAL 118 Ca 0.42 -1.13 0.08 0.00 0.00 0.00 0.00 61.98 61.35 1q27 s VAL 118 Cb -0.09 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1q27 s VAL 118 CO 0.32 0.09 -0.22 -0.31 0.00 0.00 0.00 175.10 174.98 1q27 s TYR 119 N 1.36 2.45 -0.45 5.22 2.02 -0.68 -0.30 117.35 126.96 1q27 s TYR 119 Ca -0.03 -0.33 -0.14 0.00 -0.37 0.00 0.00 57.07 56.20 1q27 s TYR 119 Cb -0.17 -1.46 0.07 0.00 -0.40 0.00 0.00 41.96 40.00 1q27 s TYR 119 CO -0.07 0.16 0.35 -1.21 -1.57 0.00 0.00 175.55 173.20 1q27 s GLU 120 N -1.18 2.89 -0.17 -0.62 2.02 0.48 -0.44 118.70 121.69 1q27 s GLU 120 Ca 0.13 -1.33 -0.07 0.00 0.02 0.00 0.00 54.97 53.71 1q27 s GLU 120 Cb -0.10 -4.02 -0.04 0.00 0.10 0.00 0.00 34.13 30.07 1q27 s GLU 120 CO 0.03 -0.97 0.08 -1.17 0.02 0.00 0.00 175.26 173.25 1q27 s LEU 121 N 1.59 3.95 -0.63 1.80 2.96 -0.92 -2.14 118.68 125.29 1q27 s LEU 121 Ca 0.04 0.17 -0.23 0.00 -0.22 0.00 0.00 54.13 53.89 1q27 s LEU 121 Cb -0.23 -1.99 0.06 0.00 0.50 0.00 0.00 46.19 44.53 1q27 s LEU 121 CO 0.06 0.23 0.98 -0.13 -1.32 0.00 0.00 176.35 176.17 1q27 s ARG 122 N 0.04 3.18 -0.09 1.98 0.52 -0.66 -2.52 118.95 121.40 1q27 s ARG 122 Ca 0.07 -0.61 -0.31 0.00 -0.52 0.00 0.00 55.73 54.35 1q27 s ARG 122 Cb -0.12 -4.17 0.11 0.00 0.52 0.00 0.00 34.95 31.29 1q27 s ARG 122 CO 0.00 -1.74 1.38 -1.54 0.02 0.00 0.00 175.30 173.42 1q27 s SER 123 N 3.43 -0.00 -0.42 0.23 1.04 -0.85 -4.57 113.70 112.56 1q27 s SER 123 Ca 0.26 -0.03 0.06 0.00 0.48 0.00 0.00 55.95 56.71 1q27 s SER 123 Cb -0.15 0.02 0.20 0.00 0.10 0.00 0.00 66.02 66.19 1q27 s SER 123 CO 0.13 -0.04 0.45 -0.67 0.98 0.00 0.00 173.24 174.09 1q27 n ASP 124 N -0.93 -0.66 -4.22 7.02 2.03 -1.26 -3.46 116.55 115.08 1q27 n ASP 124 Ca 0.04 -2.55 -0.25 0.00 0.52 0.00 0.00 54.79 52.55 1q27 n ASP 124 Cb 0.59 -0.28 -0.14 0.00 -0.72 0.00 0.00 41.12 40.57 1q27 n ASP 124 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1q27 s ALA 125 N -0.21 1.61 0.54 -1.67 0.00 -1.26 -5.13 121.76 115.64 1q27 s ALA 125 Ca 0.33 -0.95 -0.16 0.00 0.00 0.00 0.00 51.96 51.18 1q27 s ALA 125 Cb 0.08 -0.33 -0.06 0.00 0.00 0.00 0.00 23.12 22.81 1q27 s ALA 125 CO -0.16 0.36 1.02 0.99 0.00 0.00 0.00 175.76 177.97 1q27 s THR 126 N -0.70 4.20 0.00 0.00 2.01 -1.26 -5.05 115.64 114.84 1q27 s THR 126 Ca 0.06 1.07 0.00 0.00 0.31 0.00 0.00 61.69 63.14 1q27 s THR 126 Cb -0.08 -3.57 0.00 0.00 0.01 0.00 0.00 72.50 68.86 1q27 s THR 126 CO 0.01 -0.59 0.00 -0.81 -0.69 0.00 0.00 174.62 172.54 1q27 n PRO 127 N -1.72 -0.17 -3.67 4.92 -0.04 -1.26 -4.87 135.00 128.20 1q27 n PRO 127 Ca 0.08 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.35 1q27 n PRO 127 Cb 0.53 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.95 1q27 n PRO 127 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1q27 n ILE 128 N -1.89 0.00 -1.54 0.52 -6.64 -1.26 -5.04 119.36 103.50 1q27 n ILE 128 Ca 0.00 -1.57 -0.33 0.00 -1.77 0.00 0.00 62.75 59.09 1q27 n ILE 128 Cb 0.00 0.44 -0.06 0.00 -1.44 0.00 0.00 39.64 38.57 1q27 n ILE 128 CO 0.00 0.00 0.00 0.49 -1.77 0.00 0.00 176.55 175.27 1q27 n PHE 129 N -0.72 1.19 -2.80 4.28 3.72 -1.26 -4.76 117.46 117.11 1q27 n PHE 129 Ca -0.09 0.14 -0.08 0.00 -0.05 0.00 0.00 57.45 57.37 1q27 n PHE 129 Cb 0.41 -2.51 0.02 0.00 -0.94 0.00 0.00 39.48 36.47 1q27 n PHE 129 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1q27 n ASN 130 N 15.12 -2.94 -0.73 4.37 2.85 -1.26 -4.99 115.26 127.67 1q27 n ASN 130 Ca 0.45 -3.08 0.03 0.00 -0.11 0.00 0.00 54.58 51.87 1q27 n ASN 130 Cb 0.43 1.61 0.12 0.00 1.24 0.00 0.00 39.78 43.18 1q27 n ASN 130 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1q27 n PRO 131 N 2.26 1.94 -0.13 1.20 -0.04 -1.26 -0.95 135.00 138.02 1q27 n PRO 131 Ca 0.14 -0.93 -0.23 0.00 -0.04 0.00 0.00 63.50 62.44 1q27 n PRO 131 Cb 0.59 -1.51 -0.11 0.00 -0.04 0.00 0.00 33.50 32.43 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 0.19 1.98 -0.13 3.54 5.15 -1.26 -4.73 115.26 120.00 1q27 n ASN 132 Ca 0.08 0.09 -0.23 0.00 -0.60 0.00 0.00 54.58 53.92 1q27 n ASN 132 Cb 0.40 -0.62 -0.11 0.00 -0.53 0.00 0.00 39.78 38.92 1q27 n ASN 132 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1q27 n ASP 133 N -3.70 1.97 -3.14 1.20 2.03 -1.25 -4.99 116.55 108.67 1q27 n ASP 133 Ca -0.48 0.09 0.05 0.00 0.52 0.00 0.00 54.79 54.97 1q27 n ASP 133 Cb 0.94 -0.61 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 1q27 n ASP 133 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1q27 s ILE 134 N -2.51 -0.20 0.59 5.18 -1.16 -1.08 -5.01 121.20 117.00 1q27 s ILE 134 Ca -0.36 0.00 0.29 0.00 -0.51 0.00 0.00 60.65 60.07 1q27 s ILE 134 Cb 0.11 -0.20 0.36 0.00 0.61 0.00 0.00 42.46 43.35 1q27 s ILE 134 CO 0.56 0.00 2.05 0.28 -2.81 0.00 0.00 174.94 175.02 1q27 h SER 135 N 7.16 0.00 0.00 4.50 0.02 -1.33 -3.44 113.55 120.46 1q27 h SER 135 Ca -0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1q27 h SER 135 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1q27 h SER 135 CO -0.11 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.19 1q27 n GLY 136 N -1.43 2.96 0.00 -3.77 0.00 -1.26 -4.69 105.19 97.00 1q27 n GLY 136 Ca 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 -1.45 3.34 -0.02 0.00 -1.26 -4.88 105.19 100.92 1q27 n GLY 137 Ca 0.00 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.72 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 1.39 -0.56 1.61 2.12 -1.06 -4.77 118.70 117.42 1q27 s GLU 138 Ca 0.00 -1.72 -0.17 0.00 0.36 0.00 0.00 54.97 53.44 1q27 s GLU 138 Cb 0.00 -0.53 0.13 0.00 0.26 0.00 0.00 34.13 33.99 1q27 s GLU 138 CO 0.00 -0.17 0.55 -1.58 -0.54 0.00 0.00 175.26 173.53 1q27 s TRP 139 N -3.51 3.22 0.58 5.30 0.51 -1.26 -0.35 118.94 123.42 1q27 s TRP 139 Ca 0.32 -1.25 0.08 0.00 -2.12 0.00 0.00 56.10 53.13 1q27 s TRP 139 Cb 0.07 -3.85 0.08 0.00 -0.81 0.00 0.00 33.47 28.96 1q27 s TRP 139 CO 0.11 -1.08 0.63 1.28 -0.51 0.00 0.00 176.95 177.38 1q27 n LEU 140 N 5.43 0.00 -4.97 2.99 4.77 -0.30 -4.94 117.00 119.98 1q27 n LEU 140 Ca -0.12 -2.73 -0.20 0.00 -0.03 0.00 0.00 56.01 52.93 1q27 n LEU 140 Cb 0.41 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1q27 n LEU 140 CO 0.54 -0.66 0.16 0.42 -1.33 0.00 0.00 177.39 176.52 1q27 s THR 141 N -2.73 2.49 0.32 -5.08 -4.23 -1.26 -2.07 115.64 103.08 1q27 s THR 141 Ca 0.48 -1.15 0.04 0.00 -1.18 0.00 0.00 61.69 59.88 1q27 s THR 141 Cb -0.04 -2.63 0.12 0.00 1.34 0.00 0.00 72.50 71.29 1q27 s THR 141 CO 0.30 0.00 1.81 -0.65 -0.54 0.00 0.00 174.62 175.55 1q27 h PRO 142 N 0.61 0.48 -0.06 3.99 0.11 -1.94 0.10 132.00 135.29 1q27 h PRO 142 Ca -0.37 -0.14 -0.20 0.00 0.11 0.00 0.00 66.00 65.41 1q27 h PRO 142 Cb 1.28 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1q27 h PRO 142 CO 0.48 0.60 -0.79 1.49 -0.21 0.00 0.00 178.00 179.57 1q27 h GLU 143 N 0.45 0.42 0.04 1.05 4.81 -1.95 -2.76 114.58 116.63 1q27 h GLU 143 Ca 0.08 -0.37 -0.24 0.00 -0.13 0.00 0.00 59.36 58.69 1q27 h GLU 143 Cb 0.48 0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.95 1q27 h GLU 143 CO 0.03 1.02 -1.03 0.45 -0.73 0.00 0.00 179.01 178.75 1q27 h HIS 144 N 0.27 0.66 0.82 0.92 3.86 -1.89 -1.94 115.15 117.84 1q27 h HIS 144 Ca -0.05 -0.38 -0.04 0.00 -1.16 0.00 0.00 60.37 58.74 1q27 h HIS 144 Cb 1.39 -0.06 0.01 0.00 1.06 0.00 0.00 27.41 29.80 1q27 h HIS 144 CO 0.05 1.22 -0.39 1.25 0.86 0.00 0.00 177.93 180.92 1q27 h LEU 145 N 0.22 -0.93 -1.42 2.43 5.85 -0.81 0.10 115.31 120.74 1q27 h LEU 145 Ca -0.10 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.59 1q27 h LEU 145 Cb 1.69 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.95 1q27 h LEU 145 CO 0.18 -0.62 -0.14 -0.07 -0.34 0.00 0.00 178.44 177.46 1q27 h LEU 146 N -1.18 0.20 -1.05 2.25 -0.00 -1.61 -1.95 115.31 111.97 1q27 h LEU 146 Ca -0.11 -0.04 -0.09 0.00 -0.00 0.00 0.00 57.88 57.64 1q27 h LEU 146 Cb 0.85 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.44 1q27 h LEU 146 CO 0.18 0.36 -0.44 0.00 -0.00 0.00 0.00 178.44 178.55 1q27 h ALA 147 N 1.66 1.13 0.09 1.53 0.00 -1.18 -2.22 119.26 120.28 1q27 h ALA 147 Ca 0.04 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1q27 h ALA 147 Cb 0.37 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1q27 h ALA 147 CO 0.02 0.55 -0.04 -0.09 0.00 0.00 0.00 179.25 179.69 1q27 h ARG 148 N 0.00 -0.11 -0.25 0.00 2.43 -0.07 -1.90 114.38 114.48 1q27 h ARG 148 Ca -0.00 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.25 1q27 h ARG 148 Cb 0.85 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.41 1q27 h ARG 148 CO 0.06 0.28 0.18 -0.84 -1.51 0.00 0.00 179.97 178.14 1q27 h ILE 149 N -0.97 0.87 0.10 1.20 -0.00 -1.47 -1.00 117.51 116.25 1q27 h ILE 149 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 64.86 64.59 1q27 h ILE 149 Cb 0.44 0.87 -0.00 0.00 -0.00 0.00 0.00 36.82 38.13 1q27 h ILE 149 CO 0.02 0.00 -1.19 0.00 -0.00 0.00 0.00 178.15 176.98 1q27 h ALA 150 N 1.87 0.16 0.06 0.16 0.00 -1.48 -3.25 119.26 116.79 1q27 h ALA 150 Ca 0.12 -0.90 -0.00 0.00 0.00 0.00 0.00 54.91 54.13 1q27 h ALA 150 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1q27 h ALA 150 CO -0.00 1.04 -0.03 0.00 0.00 0.00 0.00 179.25 180.26 1q27 h ALA 151 N 0.67 -1.00 0.00 0.00 0.00 -0.33 -3.46 119.26 115.15 1q27 h ALA 151 Ca -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1q27 h ALA 151 Cb 1.93 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1q27 h ALA 151 CO 0.19 -0.99 0.00 0.41 0.00 0.00 0.00 179.25 178.86 1q27 n GLY 152 N -1.04 -1.92 0.59 0.00 0.00 -1.06 -5.02 105.19 96.74 1q27 n GLY 152 Ca -0.01 0.94 0.06 0.00 0.00 0.00 0.00 46.02 47.02 1q27 n GLY 152 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q27 n GLU 153 N 0.00 1.32 -1.77 1.61 -0.58 -1.25 -4.95 120.64 115.03 1q27 n GLU 153 Ca 0.00 -2.97 -0.17 0.00 -0.42 0.00 0.00 57.16 53.60 1q27 n GLU 153 Cb 0.00 -1.40 -0.05 0.00 -0.57 0.00 0.00 31.44 29.42 1q27 n GLU 153 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1q27 n ALA 154 N -0.98 -0.39 -1.69 0.62 0.00 -1.25 -3.88 120.51 112.94 1q27 n ALA 154 Ca 0.17 0.23 0.03 0.00 0.00 0.00 0.00 53.44 53.86 1q27 n ALA 154 Cb 0.73 -1.75 0.18 0.00 0.00 0.00 0.00 19.45 18.61 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 -0.02 3.77 -2.09 0.00 0.00 -1.26 -3.55 120.51 117.37 1q27 n ALA 155 Ca -0.18 -3.32 0.00 0.00 0.00 0.00 0.00 53.44 49.94 1q27 n ALA 155 Cb 0.58 -0.36 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1q27 n ALA 155 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1q27 n LYS 156 N -1.01 3.26 0.00 0.00 4.81 -1.22 -2.61 118.16 121.38 1q27 n LYS 156 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 1q27 n LYS 156 Cb 0.74 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.79 1q27 n LYS 156 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1q27 n GLY 157 N 5.00 1.77 0.36 3.14 0.00 -1.26 -2.35 105.19 111.85 1q27 n GLY 157 Ca 0.00 -0.52 0.14 0.00 0.00 0.00 0.00 46.02 45.64 1q27 n GLY 157 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1q27 h ASP 158 N 9.37 0.23 0.56 1.61 3.58 -1.98 -1.63 116.42 128.16 1q27 h ASP 158 Ca 0.00 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.43 1q27 h ASP 158 Cb 0.00 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.01 1q27 h ASP 158 CO 0.00 0.14 -0.27 0.25 -2.88 0.00 0.00 179.24 176.48 1q27 h LEU 159 N 0.26 -0.63 -0.41 2.28 6.46 -1.77 0.13 115.31 121.62 1q27 h LEU 159 Ca 0.25 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 58.02 1q27 h LEU 159 Cb 0.66 0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.73 1q27 h LEU 159 CO -0.05 -0.43 0.26 0.00 -0.62 0.00 0.00 178.44 177.60 1q27 h ALA 160 N -0.35 0.52 -0.81 1.25 0.00 -1.12 -2.38 119.26 116.37 1q27 h ALA 160 Ca -0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1q27 h ALA 160 Cb 0.59 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1q27 h ALA 160 CO 0.13 -0.00 0.47 0.93 0.00 0.00 0.00 179.25 180.77 1q27 h GLU 161 N 0.55 1.12 -0.76 0.00 5.08 -1.24 0.16 114.58 119.49 1q27 h GLU 161 Ca 0.15 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1q27 h GLU 161 Cb -0.04 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 28.95 1q27 h GLU 161 CO -0.03 0.80 0.35 1.25 -1.00 0.00 0.00 179.01 180.37 1q27 h LEU 162 N 1.13 1.01 -0.03 1.33 6.46 -0.36 -0.80 115.31 124.06 1q27 h LEU 162 Ca 0.29 -0.15 -0.25 0.00 -0.12 0.00 0.00 57.88 57.65 1q27 h LEU 162 Cb -0.01 -0.26 0.01 0.00 -0.73 0.00 0.00 40.66 39.66 1q27 h LEU 162 CO -0.05 0.88 -1.09 0.58 -0.62 0.00 0.00 178.44 178.14 1q27 h VAL 163 N 1.08 1.41 -0.40 1.05 2.07 -1.00 -2.03 116.25 118.43 1q27 h VAL 163 Ca 0.26 -2.65 -0.08 0.00 0.82 0.00 0.00 66.70 65.06 1q27 h VAL 163 Cb 0.15 2.63 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 1q27 h VAL 163 CO -0.03 0.79 -0.06 -0.09 0.02 0.00 0.00 177.57 178.20 1q27 h ARG 164 N 0.19 0.68 0.00 1.57 2.43 -0.50 0.14 114.38 118.88 1q27 h ARG 164 Ca -0.12 -0.19 -0.20 0.00 -0.81 0.00 0.00 59.98 58.67 1q27 h ARG 164 Cb 1.76 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 31.20 1q27 h ARG 164 CO 0.19 0.74 -1.02 0.07 -1.51 0.00 0.00 179.97 178.44 1q27 h ARG 165 N 0.63 0.00 0.02 0.20 0.11 -1.19 -2.26 114.38 111.89 1q27 h ARG 165 Ca 0.12 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.07 1q27 h ARG 165 Cb 0.48 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.57 1q27 h ARG 165 CO 0.03 0.78 -0.50 0.00 0.10 0.00 0.00 179.97 180.37 1q27 h TYR 167 N -0.29 -0.13 0.00 0.00 0.05 -0.86 -3.41 116.97 112.32 1q27 h TYR 167 Ca -0.07 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.71 1q27 h TYR 167 Cb 1.25 0.04 0.00 0.00 1.01 0.00 0.00 36.73 39.04 1q27 h TYR 167 CO 0.17 -0.08 0.00 -2.13 -1.05 0.00 0.00 178.16 175.07 1q27 n ARG 168 N -3.19 0.00 -1.42 4.88 0.00 -0.86 -4.81 116.66 111.26 1q27 n ARG 168 Ca -0.02 0.47 -0.29 0.00 -0.00 0.00 0.00 57.85 58.01 1q27 n ARG 168 Cb 0.06 -1.41 0.15 0.00 0.00 0.00 0.00 32.46 31.25 1q27 n ARG 168 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 1q27 s GLU 169 N -2.65 0.92 -0.53 -0.14 2.56 -1.01 -5.00 118.70 112.86 1q27 s GLU 169 Ca 0.00 0.36 0.04 0.00 0.00 0.00 0.00 54.97 55.37 1q27 s GLU 169 Cb 0.00 -1.81 0.40 0.00 2.00 0.00 0.00 34.13 34.72 1q27 s GLU 169 CO 0.00 -2.37 1.23 -0.85 -0.56 0.00 0.00 175.26 172.71 1q27 n GLU 170 N -3.90 3.37 0.00 4.30 0.28 -1.22 -4.09 120.64 119.38 1q27 n GLU 170 Ca 0.06 -4.43 0.00 0.00 -0.16 0.00 0.00 57.16 52.63 1q27 n GLU 170 Cb 0.59 -2.26 0.00 0.00 1.43 0.00 0.00 31.44 31.20 1q27 n GLU 170 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12