#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d1p s LEU 2 N 0.00 4.10 -0.12 -0.89 2.96 -0.51 -2.78 118.68 121.45 2d1p s LEU 2 Ca 0.00 0.43 -0.11 0.00 -0.22 0.00 0.00 54.13 54.23 2d1p s LEU 2 Cb 0.00 -2.66 -0.05 0.00 0.50 0.00 0.00 46.19 43.98 2d1p s LEU 2 CO 0.00 -0.33 0.24 -1.00 -1.32 0.00 0.00 176.35 173.95 2d1p s HIS 3 N 2.34 3.56 -0.06 5.38 3.76 0.10 -0.89 115.29 129.49 2d1p s HIS 3 Ca 0.21 0.62 0.05 0.00 -0.15 0.00 0.00 55.06 55.79 2d1p s HIS 3 Cb -0.16 -2.17 -0.00 0.00 1.11 0.00 0.00 32.58 31.37 2d1p s HIS 3 CO 0.10 0.51 -0.20 0.99 -0.85 0.00 0.00 174.74 175.29 2d1p s THR 4 N -0.41 1.66 -0.23 1.30 2.01 -0.15 -0.04 115.64 119.79 2d1p s THR 4 Ca 0.16 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.34 2d1p s THR 4 Cb -0.13 -1.43 0.06 0.00 0.01 0.00 0.00 72.50 71.01 2d1p s THR 4 CO 0.05 0.47 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.19 2d1p s LEU 5 N 0.10 2.46 0.00 4.42 2.96 -0.62 0.92 118.68 128.92 2d1p s LEU 5 Ca -0.07 -1.15 0.20 0.00 -0.22 0.00 0.00 54.13 52.88 2d1p s LEU 5 Cb -0.14 -1.13 -0.10 0.00 0.50 0.00 0.00 46.19 45.32 2d1p s LEU 5 CO 0.04 -0.24 0.92 0.00 -1.32 0.00 0.00 176.35 175.75 2d1p n HIS 6 N 4.70 0.00 -3.97 5.38 1.44 -1.26 -1.85 115.22 119.66 2d1p n HIS 6 Ca -0.12 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.38 2d1p n HIS 6 Cb 0.44 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.51 2d1p n HIS 6 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2d1p s ARG 7 N -2.53 2.82 0.27 -1.40 0.52 -1.26 -2.00 118.95 115.36 2d1p s ARG 7 Ca 0.12 -1.18 -0.30 0.00 -0.52 0.00 0.00 55.73 53.86 2d1p s ARG 7 Cb 0.16 -2.52 -0.11 0.00 0.52 0.00 0.00 34.95 33.00 2d1p s ARG 7 CO 0.64 0.25 1.53 0.45 0.02 0.00 0.00 175.30 178.20 2d1p s SER 8 N -3.91 6.50 0.55 0.23 0.15 -1.25 -3.39 113.70 112.57 2d1p s SER 8 Ca 0.37 2.82 0.25 0.00 0.70 0.00 0.00 55.95 60.08 2d1p s SER 8 Cb -0.07 -2.63 1.47 0.00 -1.71 0.00 0.00 66.02 63.09 2d1p s SER 8 CO 0.26 -0.82 2.06 1.55 1.20 0.00 0.00 173.24 177.48 2d1p h PRO 9 N 5.09 0.00 0.00 5.44 0.13 -1.87 0.97 132.00 141.75 2d1p h PRO 9 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2d1p h PRO 9 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2d1p h PRO 9 CO 0.80 0.00 -0.02 -1.49 -0.23 0.00 0.00 178.00 177.05 2d1p h TRP 10 N 0.00 0.00 -0.18 1.56 6.55 -1.98 -2.77 115.95 119.14 2d1p h TRP 10 Ca 0.14 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.97 2d1p h TRP 10 Cb 0.62 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.92 2d1p h TRP 10 CO 0.00 0.02 -0.01 1.28 -1.05 0.00 0.00 178.44 178.68 2d1p n LEU 11 N -3.14 3.39 -4.36 -4.49 4.77 0.31 -5.00 117.00 108.48 2d1p n LEU 11 Ca -0.00 -3.10 -0.29 0.00 -0.03 0.00 0.00 56.01 52.59 2d1p n LEU 11 Cb 0.28 -0.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.72 2d1p n LEU 11 CO 0.27 0.73 -0.56 -0.89 -1.33 0.00 0.00 177.39 175.60 2d1p s THR 12 N -2.88 2.16 -1.28 -5.08 2.01 -1.05 -4.88 115.64 104.64 2d1p s THR 12 Ca 0.39 -1.59 -0.18 0.00 0.31 0.00 0.00 61.69 60.61 2d1p s THR 12 Cb 0.33 -1.89 0.03 0.00 0.01 0.00 0.00 72.50 70.98 2d1p s THR 12 CO 0.06 0.18 1.86 -0.67 -0.69 0.00 0.00 174.62 175.36 2d1p n ASP 13 N 1.26 4.35 -0.36 3.53 -0.08 -1.26 -4.75 116.55 119.23 2d1p n ASP 13 Ca -0.18 -2.86 0.03 0.00 -1.51 0.00 0.00 54.79 50.27 2d1p n ASP 13 Cb 0.53 -1.71 0.18 0.00 2.34 0.00 0.00 41.12 42.46 2d1p n ASP 13 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2d1p h PHE 14 N 7.71 1.18 -0.61 -0.67 3.57 -1.96 -1.86 116.94 124.30 2d1p h PHE 14 Ca 0.43 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.98 2d1p h PHE 14 Cb 0.84 -0.39 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 2d1p h PHE 14 CO 1.39 0.60 0.38 0.00 -2.23 0.00 0.00 178.31 178.45 2d1p h ALA 15 N 1.46 0.79 -0.66 2.41 0.00 -1.98 -0.62 119.26 120.67 2d1p h ALA 15 Ca 0.43 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.29 2d1p h ALA 15 Cb 0.19 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2d1p h ALA 15 CO -0.18 0.13 0.28 0.00 0.00 0.00 0.00 179.25 179.48 2d1p h ALA 16 N 1.26 1.26 -0.27 0.00 0.00 -1.76 -2.23 119.26 117.52 2d1p h ALA 16 Ca 0.24 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2d1p h ALA 16 Cb 0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2d1p h ALA 16 CO -0.10 0.55 0.02 1.25 0.00 0.00 0.00 179.25 180.98 2d1p h LEU 17 N 0.94 0.45 -0.82 0.00 6.46 -0.70 -3.12 115.31 118.53 2d1p h LEU 17 Ca 0.22 -0.29 0.01 0.00 -0.12 0.00 0.00 57.88 57.71 2d1p h LEU 17 Cb 0.15 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 39.92 2d1p h LEU 17 CO -0.02 0.63 0.54 -0.07 -0.62 0.00 0.00 178.44 178.89 2d1p h LEU 18 N 0.26 0.93 -2.53 2.25 3.38 -0.88 -2.24 115.31 116.49 2d1p h LEU 18 Ca 0.08 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2d1p h LEU 18 Cb 0.38 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2d1p h LEU 18 CO 0.01 0.67 0.04 0.03 0.09 0.00 0.00 178.44 179.28 2d1p h ARG 19 N 1.10 0.00 -0.01 1.13 3.08 -1.34 -1.87 114.38 116.46 2d1p h ARG 19 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 2d1p h ARG 19 Cb -0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.94 2d1p h ARG 19 CO -0.07 0.00 -0.60 1.28 -1.07 0.00 0.00 179.97 179.51 2d1p n LEU 20 N -2.87 1.15 -4.71 3.04 4.32 -0.84 -4.92 117.00 112.18 2d1p n LEU 20 Ca -0.03 -0.40 -0.42 0.00 -0.02 0.00 0.00 56.01 55.14 2d1p n LEU 20 Cb 0.10 -0.08 -0.03 0.00 -1.62 0.00 0.00 43.42 41.79 2d1p n LEU 20 CO 0.17 0.24 0.75 -0.76 -1.22 0.00 0.00 177.39 176.57 2d1p s LEU 21 N -2.76 4.36 0.10 2.23 1.43 -0.71 -5.04 118.68 118.29 2d1p s LEU 21 Ca 0.15 1.75 0.08 0.00 -1.03 0.00 0.00 54.13 55.08 2d1p s LEU 21 Cb 0.18 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 2d1p s LEU 21 CO 0.68 -0.33 -0.20 -0.94 0.23 0.00 0.00 176.35 175.79 2d1p s SER 22 N 1.04 2.49 0.14 2.29 1.04 -1.26 -4.97 113.70 114.46 2d1p s SER 22 Ca 0.54 -0.69 -0.34 0.00 0.48 0.00 0.00 55.95 55.94 2d1p s SER 22 Cb -0.23 -0.13 -0.16 0.00 0.10 0.00 0.00 66.02 65.59 2d1p s SER 22 CO 0.28 0.04 1.14 1.21 0.98 0.00 0.00 173.24 176.89 2d1p n GLU 23 N 1.06 0.94 0.00 4.02 2.13 -1.26 -0.73 120.64 126.80 2d1p n GLU 23 Ca -0.19 0.34 0.00 0.00 0.66 0.00 0.00 57.16 57.96 2d1p n GLU 23 Cb 0.54 -1.82 0.00 0.00 0.27 0.00 0.00 31.44 30.42 2d1p n GLU 23 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2d1p n GLY 24 N 2.03 2.21 3.84 8.31 0.00 -1.22 -5.04 105.19 115.32 2d1p n GLY 24 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2d1p n GLY 24 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2d1p s ASP 25 N -1.61 4.19 0.01 1.61 1.01 0.09 -4.68 116.67 117.29 2d1p s ASP 25 Ca 0.00 0.96 0.00 0.00 0.71 0.00 0.00 52.55 54.22 2d1p s ASP 25 Cb 0.00 -1.55 -0.01 0.00 1.01 0.00 0.00 42.92 42.37 2d1p s ASP 25 CO 0.00 -2.12 -0.02 -1.61 0.21 0.00 0.00 175.17 171.63 2d1p s GLU 26 N -5.38 0.16 -0.16 8.23 2.02 -1.12 -3.65 118.70 118.80 2d1p s GLU 26 Ca 0.62 -0.28 0.00 0.00 0.02 0.00 0.00 54.97 55.34 2d1p s GLU 26 Cb -0.13 0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.12 2d1p s GLU 26 CO 0.52 -0.01 -0.15 -1.17 0.02 0.00 0.00 175.26 174.46 2d1p s LEU 27 N -0.64 2.45 -0.19 1.80 2.96 -0.59 0.02 118.68 124.50 2d1p s LEU 27 Ca -0.07 -0.49 -0.04 0.00 -0.22 0.00 0.00 54.13 53.31 2d1p s LEU 27 Cb -0.04 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 2d1p s LEU 27 CO -0.00 0.06 -0.02 -0.22 -1.32 0.00 0.00 176.35 174.85 2d1p s LEU 28 N 0.95 3.22 -0.18 -0.68 2.96 0.95 0.08 118.68 125.98 2d1p s LEU 28 Ca -0.03 -0.20 -0.15 0.00 -0.22 0.00 0.00 54.13 53.53 2d1p s LEU 28 Cb -0.15 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2d1p s LEU 28 CO -0.02 0.09 0.36 -0.76 -1.32 0.00 0.00 176.35 174.70 2d1p s LEU 29 N 0.84 4.20 0.15 -0.68 1.43 0.46 -1.59 118.68 123.49 2d1p s LEU 29 Ca 0.00 0.53 -0.05 0.00 -1.03 0.00 0.00 54.13 53.58 2d1p s LEU 29 Cb -0.14 -2.47 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 2d1p s LEU 29 CO 0.02 -0.00 0.18 -1.48 0.23 0.00 0.00 176.35 175.30 2d1p s LEU 30 N 0.93 1.30 0.00 1.79 2.34 -0.77 -0.88 118.68 123.40 2d1p s LEU 30 Ca 0.18 -1.04 0.00 0.00 0.06 0.00 0.00 54.13 53.33 2d1p s LEU 30 Cb -0.14 0.78 0.00 0.00 -0.56 0.00 0.00 46.19 46.27 2d1p s LEU 30 CO 0.07 -0.83 0.00 0.00 -1.06 0.00 0.00 176.35 174.53 2d1p n GLN 31 N -0.17 0.00 0.01 1.48 6.02 -1.26 -0.39 117.38 123.07 2d1p n GLN 31 Ca -0.06 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 56.98 2d1p n GLN 31 Cb 0.63 0.00 0.23 0.00 1.02 0.00 0.00 30.24 32.12 2d1p n GLN 31 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2d1p n ASP 32 N 2.05 0.04 0.23 1.08 8.00 -0.85 -2.66 116.55 124.44 2d1p n ASP 32 Ca 0.00 0.51 0.10 0.00 0.71 0.00 0.00 54.79 56.11 2d1p n ASP 32 Cb 0.00 -0.52 0.54 0.00 -0.02 0.00 0.00 41.12 41.13 2d1p n ASP 32 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2d1p h GLY 33 N 1.68 0.00 2.00 0.44 0.00 -0.64 -3.08 103.07 103.46 2d1p h GLY 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2d1p h GLY 33 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 2d1p n VAL 34 N -3.61 1.66 0.26 4.60 0.24 -1.09 -1.59 118.33 118.81 2d1p n VAL 34 Ca -0.01 0.49 0.14 0.00 -2.04 0.00 0.00 64.34 62.92 2d1p n VAL 34 Cb 0.36 -1.45 0.66 0.00 -1.47 0.00 0.00 33.84 31.94 2d1p n VAL 34 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 2d1p h THR 35 N 0.00 0.30 0.00 3.34 1.35 -1.80 -2.08 112.91 114.02 2d1p h THR 35 Ca 0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 2d1p h THR 35 Cb 0.05 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2d1p h THR 35 CO 0.00 0.10 0.00 0.00 -0.25 0.00 0.00 175.52 175.37 2d1p n ALA 36 N -2.17 2.10 1.14 6.62 0.00 -0.62 -2.56 120.51 125.02 2d1p n ALA 36 Ca -0.00 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.46 2d1p n ALA 36 Cb 0.32 -1.35 0.21 0.00 0.00 0.00 0.00 19.45 18.63 2d1p n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d1p n ALA 37 N -1.29 2.68 -2.36 0.00 0.00 -0.78 -4.32 120.51 114.44 2d1p n ALA 37 Ca 0.10 -0.60 -0.42 0.00 0.00 0.00 0.00 53.44 52.51 2d1p n ALA 37 Cb 0.17 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 2d1p n ALA 37 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2d1p s VAL 38 N -2.10 3.98 -0.05 0.00 1.01 -1.06 -1.59 120.40 120.59 2d1p s VAL 38 Ca 0.29 1.36 -0.37 0.00 0.00 0.00 0.00 61.98 63.26 2d1p s VAL 38 Cb 0.20 -3.87 -0.15 0.00 0.00 0.00 0.00 36.38 32.56 2d1p s VAL 38 CO 0.36 0.02 1.64 -0.67 0.00 0.00 0.00 175.10 176.46 2d1p n ASP 39 N 4.98 2.60 0.00 3.32 -0.08 0.54 -1.71 116.55 126.20 2d1p n ASP 39 Ca 0.11 1.06 0.00 0.00 -1.51 0.00 0.00 54.79 54.46 2d1p n ASP 39 Cb 0.45 -1.27 0.00 0.00 2.34 0.00 0.00 41.12 42.64 2d1p n ASP 39 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2d1p n GLY 40 N 3.67 1.10 3.80 0.27 0.00 -1.26 -5.00 105.19 107.77 2d1p n GLY 40 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 2d1p n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d1p s ASN 41 N -3.02 5.82 0.00 1.61 4.22 -0.70 -4.92 114.94 117.95 2d1p s ASN 41 Ca 0.00 1.89 0.09 0.00 -2.14 0.00 0.00 52.86 52.70 2d1p s ASN 41 Cb 0.00 -2.54 0.42 0.00 1.28 0.00 0.00 41.25 40.41 2d1p s ASN 41 CO 0.00 -1.14 1.24 -2.11 -2.04 0.00 0.00 177.10 173.05 2d1p n ARG 42 N -1.80 0.06 0.00 3.55 1.85 -1.26 -2.48 116.66 116.58 2d1p n ARG 42 Ca 0.09 0.28 0.11 0.00 -1.00 0.00 0.00 57.85 57.33 2d1p n ARG 42 Cb 0.53 -1.50 -0.10 0.00 -1.05 0.00 0.00 32.46 30.33 2d1p n ARG 42 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2d1p n TYR 43 N -1.41 0.04 -0.25 2.89 4.02 -1.26 -4.48 117.16 116.71 2d1p n TYR 43 Ca 0.03 0.01 -0.04 0.00 -0.01 0.00 0.00 57.90 57.89 2d1p n TYR 43 Cb 0.09 -0.21 0.07 0.00 -0.02 0.00 0.00 39.34 39.27 2d1p n TYR 43 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 2d1p h LEU 44 N 0.00 0.76 -0.38 7.72 5.85 -1.68 -2.98 115.31 124.60 2d1p h LEU 44 Ca 0.00 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2d1p h LEU 44 Cb 0.67 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 2d1p h LEU 44 CO 0.00 0.54 0.23 -0.08 -0.34 0.00 0.00 178.44 178.78 2d1p h GLU 45 N 0.90 0.52 -0.77 1.25 4.57 -1.78 -1.18 114.58 118.09 2d1p h GLU 45 Ca 0.28 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.45 2d1p h GLU 45 Cb -0.03 -0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 28.41 2d1p h GLU 45 CO -0.09 0.40 0.51 0.66 -1.18 0.00 0.00 179.01 179.31 2d1p h SER 46 N 0.50 0.79 -0.40 1.04 4.64 -1.81 -0.52 113.55 117.79 2d1p h SER 46 Ca 0.14 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.36 2d1p h SER 46 Cb 0.01 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2d1p h SER 46 CO -0.02 0.53 -0.11 -0.07 -0.87 0.00 0.00 176.83 176.29 2d1p h LEU 47 N 0.91 0.80 -1.12 5.97 3.38 -1.29 -2.69 115.31 121.26 2d1p h LEU 47 Ca 0.31 -0.37 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 2d1p h LEU 47 Cb 0.10 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2d1p h LEU 47 CO -0.10 0.98 -0.09 -0.09 0.09 0.00 0.00 178.44 179.24 2d1p h ARG 48 N 0.60 0.52 -0.00 1.13 2.43 -0.42 -2.07 114.38 116.56 2d1p h ARG 48 Ca 0.10 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2d1p h ARG 48 Cb 0.64 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 2d1p h ARG 48 CO 0.04 0.61 -0.02 0.09 -1.51 0.00 0.00 179.97 179.18 2d1p n ASN 49 N -4.22 0.22 -4.79 -3.80 3.02 -0.28 -4.81 115.26 100.61 2d1p n ASN 49 Ca 0.01 -0.76 -0.38 0.00 -0.03 0.00 0.00 54.58 53.42 2d1p n ASN 49 Cb 0.30 -0.08 -0.06 0.00 -0.61 0.00 0.00 39.78 39.33 2d1p n ASN 49 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2d1p s ALA 50 N -2.22 3.38 0.00 5.41 0.00 -0.78 -4.94 121.76 122.61 2d1p s ALA 50 Ca 0.39 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.70 2d1p s ALA 50 Cb 0.21 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 20.35 2d1p s ALA 50 CO 0.41 0.27 1.03 -2.30 0.00 0.00 0.00 175.76 175.17 2d1p n PRO 51 N 1.13 0.54 -4.15 0.00 -0.02 -1.26 -4.81 135.00 126.42 2d1p n PRO 51 Ca -0.03 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.33 2d1p n PRO 51 Cb 0.49 -1.23 -0.08 0.00 -0.02 0.00 0.00 33.50 32.66 2d1p n PRO 51 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2d1p s ILE 52 N 0.89 0.00 -0.10 4.25 -4.36 -1.26 -3.41 121.20 117.20 2d1p s ILE 52 Ca 0.00 -1.83 -0.11 0.00 -0.26 0.00 0.00 60.65 58.45 2d1p s ILE 52 Cb 0.00 -2.43 -0.05 0.00 1.25 0.00 0.00 42.46 41.24 2d1p s ILE 52 CO 0.00 0.00 0.24 -0.54 0.24 0.00 0.00 174.94 174.88 2d1p s LYS 53 N -4.06 3.79 -0.13 0.37 1.02 -1.24 -4.98 119.74 114.52 2d1p s LYS 53 Ca 0.34 0.05 -0.01 0.00 0.02 0.00 0.00 55.97 56.37 2d1p s LYS 53 Cb 0.05 -3.26 -0.02 0.00 -0.52 0.00 0.00 37.83 34.07 2d1p s LYS 53 CO 0.12 0.61 -0.10 0.08 -0.92 0.00 0.00 175.35 175.14 2d1p s VAL 54 N -0.62 3.36 0.29 3.17 1.01 -1.26 -1.54 120.40 124.81 2d1p s VAL 54 Ca 0.17 -0.56 0.10 0.00 0.00 0.00 0.00 61.98 61.69 2d1p s VAL 54 Cb -0.13 -2.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.77 2d1p s VAL 54 CO 0.06 0.52 -0.07 -0.31 0.00 0.00 0.00 175.10 175.30 2d1p s TYR 55 N 0.19 2.50 -0.03 5.22 2.02 0.11 -1.24 117.35 126.12 2d1p s TYR 55 Ca -0.06 -0.33 -0.01 0.00 -0.37 0.00 0.00 57.07 56.30 2d1p s TYR 55 Cb -0.15 -1.21 0.03 0.00 -0.40 0.00 0.00 41.96 40.23 2d1p s TYR 55 CO 0.04 0.62 0.07 0.00 -1.57 0.00 0.00 175.55 174.71 2d1p s ALA 56 N -2.46 -0.08 -0.26 3.71 0.00 -0.23 -0.41 121.76 122.05 2d1p s ALA 56 Ca 0.32 0.40 -0.29 0.00 0.00 0.00 0.00 51.96 52.38 2d1p s ALA 56 Cb -0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 2d1p s ALA 56 CO 0.18 -0.11 1.41 -1.17 0.00 0.00 0.00 175.76 176.07 2d1p s LEU 57 N 0.89 3.92 0.26 0.00 2.96 -0.05 -2.16 118.68 124.50 2d1p s LEU 57 Ca -0.07 1.41 -0.02 0.00 -0.22 0.00 0.00 54.13 55.23 2d1p s LEU 57 Cb -0.10 -3.54 0.45 0.00 0.50 0.00 0.00 46.19 43.51 2d1p s LEU 57 CO -0.03 -1.11 1.84 -1.13 -1.32 0.00 0.00 176.35 174.60 2d1p h ASN 58 N 9.67 0.88 -0.91 3.68 -1.24 -0.90 -2.13 115.58 124.63 2d1p h ASN 58 Ca -0.29 0.04 0.12 0.00 0.71 0.00 0.00 56.30 56.88 2d1p h ASN 58 Cb 1.12 -0.14 -0.08 0.00 0.73 0.00 0.00 38.32 39.94 2d1p h ASN 58 CO 1.02 0.51 0.53 -0.33 -1.29 0.00 0.00 177.43 177.87 2d1p h GLU 59 N 0.98 0.80 0.00 6.67 3.07 -1.91 -0.13 114.58 124.07 2d1p h GLU 59 Ca 0.44 -0.05 -0.10 0.00 -0.50 0.00 0.00 59.36 59.16 2d1p h GLU 59 Cb 0.35 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 2d1p h GLU 59 CO -0.23 0.53 -0.47 -0.44 -1.40 0.00 0.00 179.01 177.00 2d1p h ASP 60 N 0.83 0.00 -0.11 1.42 3.32 -1.75 -1.71 116.42 118.41 2d1p h ASP 60 Ca 0.46 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.29 2d1p h ASP 60 Cb 0.51 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.07 2d1p h ASP 60 CO -0.29 0.47 -0.78 -0.07 -1.72 0.00 0.00 179.24 176.85 2d1p h LEU 61 N 0.00 0.90 -0.71 1.55 3.38 -1.03 -2.61 115.31 116.80 2d1p h LEU 61 Ca -0.00 -0.60 -0.03 0.00 0.09 0.00 0.00 57.88 57.34 2d1p h LEU 61 Cb 1.07 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 2d1p h LEU 61 CO 0.06 1.39 0.31 0.40 0.09 0.00 0.00 178.44 180.70 2d1p h ILE 62 N 0.52 1.24 -0.22 1.22 2.04 -0.94 -0.02 117.51 121.34 2d1p h ILE 62 Ca -0.05 -0.72 -0.04 0.00 1.00 0.00 0.00 64.86 65.05 2d1p h ILE 62 Cb 1.41 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 2d1p h ILE 62 CO 0.16 0.29 -0.06 0.00 0.00 0.00 0.00 178.15 178.54 2d1p h ALA 63 N 1.15 1.50 -0.49 1.87 0.00 -1.26 -2.86 119.26 119.16 2d1p h ALA 63 Ca 0.24 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2d1p h ALA 63 Cb 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2d1p h ALA 63 CO -0.03 0.36 0.00 0.54 0.00 0.00 0.00 179.25 180.12 2d1p n ARG 64 N -4.30 2.55 -3.52 0.00 1.74 -0.96 -4.98 116.66 107.19 2d1p n ARG 64 Ca 0.00 -2.37 -0.20 0.00 -0.77 0.00 0.00 57.85 54.51 2d1p n ARG 64 Cb 0.24 -1.51 0.08 0.00 -1.02 0.00 0.00 32.46 30.26 2d1p n ARG 64 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2d1p n GLY 65 N 1.45 -0.43 0.00 -0.13 0.00 -0.18 -4.93 105.19 100.96 2d1p n GLY 65 Ca 0.20 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.39 2d1p n GLY 65 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d1p n LEU 66 N -4.49 1.48 -0.01 0.99 4.77 -0.27 -4.80 117.00 114.67 2d1p n LEU 66 Ca -0.17 -1.48 0.22 0.00 -0.03 0.00 0.00 56.01 54.56 2d1p n LEU 66 Cb 0.62 0.00 0.72 0.00 -2.33 0.00 0.00 43.42 42.44 2d1p n LEU 66 CO 0.63 0.37 1.20 0.71 -1.33 0.00 0.00 177.39 178.98 2d1p h THR 67 N 0.17 0.54 -0.67 -5.08 1.35 -1.92 -1.53 112.91 105.77 2d1p h THR 67 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2d1p h THR 67 Cb 0.34 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 67.41 2d1p h THR 67 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2d1p n GLY 68 N -1.60 2.71 0.41 5.82 0.00 -1.26 -4.35 105.19 106.93 2d1p n GLY 68 Ca 0.11 -0.84 0.06 0.00 0.00 0.00 0.00 46.02 45.35 2d1p n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2d1p n GLN 69 N 1.24 0.90 -3.19 1.61 6.02 -0.58 -5.06 117.38 118.32 2d1p n GLN 69 Ca 0.25 -2.27 -0.38 0.00 -0.01 0.00 0.00 57.00 54.60 2d1p n GLN 69 Cb 0.82 -1.13 -0.06 0.00 1.02 0.00 0.00 30.24 30.89 2d1p n GLN 69 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2d1p s ILE 70 N -1.96 4.64 0.50 5.09 -1.09 -1.25 -0.34 121.20 126.80 2d1p s ILE 70 Ca 0.25 1.28 -0.23 0.00 -2.23 0.00 0.00 60.65 59.73 2d1p s ILE 70 Cb 0.24 -3.92 -0.06 0.00 -1.58 0.00 0.00 42.46 37.14 2d1p s ILE 70 CO -0.01 0.45 1.29 -0.55 -1.23 0.00 0.00 174.94 174.89 2d1p s SER 71 N -1.29 5.67 0.54 3.58 0.15 -0.62 -4.70 113.70 117.02 2d1p s SER 71 Ca 0.34 2.61 0.30 0.00 0.70 0.00 0.00 55.95 59.90 2d1p s SER 71 Cb -0.19 -2.63 1.51 0.00 -1.71 0.00 0.00 66.02 63.01 2d1p s SER 71 CO 0.21 -1.29 2.08 0.78 1.20 0.00 0.00 173.24 176.22 2d1p h ASN 72 N 1.78 0.00 1.14 5.45 2.35 -1.96 -2.50 115.58 121.83 2d1p h ASN 72 Ca -0.50 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.24 2d1p h ASN 72 Cb 1.28 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.65 2d1p h ASN 72 CO 0.59 0.10 -0.01 0.44 -1.65 0.00 0.00 177.43 176.89 2d1p h ASP 73 N 0.00 0.00 -3.23 5.81 3.32 -1.97 -3.44 116.42 116.91 2d1p h ASP 73 Ca -0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 2d1p h ASP 73 Cb 0.35 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.82 2d1p h ASP 73 CO 0.01 0.01 -0.20 -0.63 -1.72 0.00 0.00 179.24 176.72 2d1p s ILE 74 N -3.61 5.17 -0.19 0.35 1.01 -0.94 -4.65 121.20 118.33 2d1p s ILE 74 Ca 0.02 0.83 -0.20 0.00 0.00 0.00 0.00 60.65 61.30 2d1p s ILE 74 Cb 0.08 -3.75 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 2d1p s ILE 74 CO 0.56 0.41 0.58 -0.63 0.00 0.00 0.00 174.94 175.87 2d1p s ILE 75 N 0.11 5.06 -0.10 2.92 1.01 -0.37 -4.89 121.20 124.93 2d1p s ILE 75 Ca 0.23 1.09 -0.25 0.00 0.00 0.00 0.00 60.65 61.73 2d1p s ILE 75 Cb -0.15 -3.90 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 2d1p s ILE 75 CO 0.10 0.14 0.77 -0.76 0.00 0.00 0.00 174.94 175.19 2d1p s LEU 76 N 1.75 4.26 0.19 2.97 1.02 -1.26 -1.07 118.68 126.54 2d1p s LEU 76 Ca 0.27 1.21 0.01 0.00 0.02 0.00 0.00 54.13 55.64 2d1p s LEU 76 Cb -0.16 -3.17 -0.05 0.00 0.02 0.00 0.00 46.19 42.84 2d1p s LEU 76 CO 0.10 -0.23 0.05 0.27 0.02 0.00 0.00 176.35 176.56 2d1p s ILE 77 N 1.33 0.46 0.12 -0.59 -4.36 -0.92 -4.96 121.20 112.29 2d1p s ILE 77 Ca 0.39 -1.97 0.01 0.00 -0.26 0.00 0.00 60.65 58.82 2d1p s ILE 77 Cb -0.18 -2.27 0.01 0.00 1.25 0.00 0.00 42.46 41.28 2d1p s ILE 77 CO 0.17 -0.31 0.09 -0.90 0.24 0.00 0.00 174.94 174.23 2d1p n ASP 78 N -0.27 1.36 -0.25 4.36 5.68 -1.26 -0.15 116.55 126.02 2d1p n ASP 78 Ca -0.04 -1.41 -0.04 0.00 -0.50 0.00 0.00 54.79 52.80 2d1p n ASP 78 Cb 0.64 -0.01 0.11 0.00 -1.14 0.00 0.00 41.12 40.73 2d1p n ASP 78 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 2d1p h TYR 79 N 0.53 1.11 -0.92 2.11 0.05 -1.99 -1.49 116.97 116.36 2d1p h TYR 79 Ca -0.08 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 2d1p h TYR 79 Cb 0.28 -0.34 -0.04 0.00 1.01 0.00 0.00 36.73 37.63 2d1p h TYR 79 CO 0.00 0.84 0.54 1.15 -1.05 0.00 0.00 178.16 179.64 2d1p h THR 80 N 1.08 1.26 -0.39 -2.88 2.02 -2.00 -0.20 112.91 111.80 2d1p h THR 80 Ca 0.25 -0.59 -0.12 0.00 0.77 0.00 0.00 66.41 66.73 2d1p h THR 80 Cb 0.19 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 2d1p h THR 80 CO -0.02 0.28 -0.24 0.44 0.37 0.00 0.00 175.52 176.34 2d1p h ASP 81 N 1.28 0.82 -0.25 4.18 3.32 -1.87 -2.10 116.42 121.80 2d1p h ASP 81 Ca 0.33 -0.30 0.04 0.00 0.02 0.00 0.00 57.03 57.11 2d1p h ASP 81 Cb -0.03 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 2d1p h ASP 81 CO -0.06 1.02 0.04 0.15 -1.72 0.00 0.00 179.24 178.67 2d1p h PHE 82 N 0.69 0.06 -0.09 4.55 3.04 -0.44 0.13 116.94 124.88 2d1p h PHE 82 Ca 0.09 0.02 0.03 0.00 3.98 0.00 0.00 57.97 62.09 2d1p h PHE 82 Cb 0.77 0.01 -0.04 0.00 2.56 0.00 0.00 35.95 39.25 2d1p h PHE 82 CO 0.04 0.01 -0.13 0.28 -2.02 0.00 0.00 178.31 176.49 2d1p h VAL 83 N 0.13 0.66 0.00 1.41 2.07 -0.80 -1.36 116.25 118.36 2d1p h VAL 83 Ca 0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.62 2d1p h VAL 83 Cb 0.12 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 2d1p h VAL 83 CO -0.16 0.00 -0.06 0.03 0.02 0.00 0.00 177.57 177.39 2d1p h ARG 84 N -0.17 0.00 -0.33 1.57 3.08 -0.84 -0.03 114.38 117.66 2d1p h ARG 84 Ca 0.08 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 2d1p h ARG 84 Cb 0.28 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 2d1p h ARG 84 CO -0.19 0.06 -0.28 1.25 -1.07 0.00 0.00 179.97 179.74 2d1p h LEU 85 N 0.00 0.69 -0.49 3.04 5.85 0.29 0.70 115.31 125.38 2d1p h LEU 85 Ca -0.00 -0.26 -0.09 0.00 0.84 0.00 0.00 57.88 58.37 2d1p h LEU 85 Cb 0.12 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2d1p h LEU 85 CO 0.01 0.93 -0.43 0.71 -0.34 0.00 0.00 178.44 179.31 2d1p h THR 86 N 0.58 0.85 -0.08 1.05 1.35 -0.11 -2.40 112.91 114.14 2d1p h THR 86 Ca 0.07 -1.85 -0.23 0.00 -0.55 0.00 0.00 66.41 63.85 2d1p h THR 86 Cb 0.77 2.17 0.01 0.00 -1.73 0.00 0.00 68.15 69.37 2d1p h THR 86 CO 0.06 0.42 -0.88 0.58 -0.25 0.00 0.00 175.52 175.46 2d1p h VAL 87 N 0.00 1.30 -0.54 6.82 2.07 -0.68 -3.28 116.25 121.94 2d1p h VAL 87 Ca -0.00 -2.13 -0.02 0.00 0.82 0.00 0.00 66.70 65.36 2d1p h VAL 87 Cb 1.13 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 33.05 2d1p h VAL 87 CO 0.06 0.66 0.24 0.50 0.02 0.00 0.00 177.57 179.05 2d1p h LYS 88 N 0.43 0.79 -5.45 1.57 3.64 -0.71 -3.42 116.57 113.42 2d1p h LYS 88 Ca -0.08 -0.13 -0.59 0.00 -1.27 0.00 0.00 60.65 58.58 2d1p h LYS 88 Cb 1.51 -0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 33.09 2d1p h LYS 88 CO 0.17 0.67 -0.36 -1.01 -2.27 0.00 0.00 179.45 176.65 2d1p s HIS 89 N -5.64 3.45 0.36 1.91 3.76 -0.92 -4.98 115.29 113.23 2d1p s HIS 89 Ca -0.13 0.54 0.26 0.00 -0.15 0.00 0.00 55.06 55.58 2d1p s HIS 89 Cb 0.12 -2.31 1.32 0.00 1.11 0.00 0.00 32.58 32.82 2d1p s HIS 89 CO 0.78 0.25 2.01 -1.35 -0.85 0.00 0.00 174.74 175.58 2d1p h PRO 90 N 6.67 0.00 -5.22 8.40 0.11 -1.82 -3.45 132.00 136.69 2d1p h PRO 90 Ca -0.41 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.33 2d1p h PRO 90 Cb 1.16 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.12 2d1p h PRO 90 CO 0.76 0.15 -0.72 0.45 -0.21 0.00 0.00 178.00 178.42 2d1p s SER 91 N -6.19 2.00 -0.04 -2.05 0.15 -1.26 -5.08 113.70 101.23 2d1p s SER 91 Ca -0.02 -0.99 -0.01 0.00 0.70 0.00 0.00 55.95 55.63 2d1p s SER 91 Cb 0.13 -0.05 0.03 0.00 -1.71 0.00 0.00 66.02 64.42 2d1p s SER 91 CO 0.60 -0.27 0.02 -1.58 1.20 0.00 0.00 173.24 173.21 2d1p s GLN 92 N -3.62 0.18 -0.34 5.44 0.74 -1.26 -1.42 119.66 119.38 2d1p s GLN 92 Ca 0.17 0.19 -0.08 0.00 0.05 0.00 0.00 55.36 55.69 2d1p s GLN 92 Cb 0.01 -0.53 0.02 0.00 1.10 0.00 0.00 33.01 33.61 2d1p s GLN 92 CO 0.02 -0.23 0.14 1.41 -0.55 0.00 0.00 175.29 176.09 2d1p s MET 93 N 1.53 2.88 -0.24 1.67 1.75 -0.07 -4.96 119.30 121.85 2d1p s MET 93 Ca -0.03 -1.02 -0.13 0.00 -1.25 0.00 0.00 55.69 53.26 2d1p s MET 93 Cb -0.13 -3.55 -0.04 0.00 2.84 0.00 0.00 34.83 33.95 2d1p s MET 93 CO -0.03 -0.60 0.29 0.00 -0.65 0.00 0.00 175.02 174.04 2d1p s ALA 94 N 1.50 3.57 -1.21 4.11 0.00 -1.26 -0.98 121.76 127.49 2d1p s ALA 94 Ca 0.01 -0.79 0.10 0.00 0.00 0.00 0.00 51.96 51.28 2d1p s ALA 94 Cb -0.19 -2.54 0.08 0.00 0.00 0.00 0.00 23.12 20.47 2d1p s ALA 94 CO 0.04 -0.40 0.81 0.91 0.00 0.00 0.00 175.76 177.12