#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5p s ASN 2 N 0.00 6.55 -0.04 3.17 0.01 -1.26 -1.12 114.94 122.24 2k5p s ASN 2 Ca 0.00 0.65 0.04 0.00 -0.71 0.00 0.00 52.86 52.85 2k5p s ASN 2 Cb 0.00 -2.27 -0.00 0.00 0.41 0.00 0.00 41.25 39.39 2k5p s ASN 2 CO 0.00 -0.08 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.58 2k5p s LEU 3 N 1.20 1.90 -0.61 0.60 1.43 -0.74 0.23 118.68 122.68 2k5p s LEU 3 Ca 0.23 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 52.79 2k5p s LEU 3 Cb -0.15 -0.95 0.11 0.00 0.03 0.00 0.00 46.19 45.23 2k5p s LEU 3 CO 0.09 0.14 0.73 -0.89 0.23 0.00 0.00 176.35 176.65 2k5p s THR 4 N 0.09 4.83 -0.25 5.49 2.01 0.08 -0.40 115.64 127.49 2k5p s THR 4 Ca -0.05 -1.05 -0.10 0.00 0.31 0.00 0.00 61.69 60.80 2k5p s THR 4 Cb -0.12 -4.51 -0.05 0.00 0.01 0.00 0.00 72.50 67.84 2k5p s THR 4 CO 0.02 -1.15 0.16 0.68 -0.69 0.00 0.00 174.62 173.65 2k5p s VAL 5 N 2.64 5.32 -1.43 3.82 -7.23 0.98 -3.03 120.40 121.47 2k5p s VAL 5 Ca 0.13 0.17 -0.09 0.00 -1.81 0.00 0.00 61.98 60.38 2k5p s VAL 5 Cb -0.23 -3.49 0.05 0.00 0.56 0.00 0.00 36.38 33.27 2k5p s VAL 5 CO 0.05 0.33 0.94 0.59 -0.31 0.00 0.00 175.10 176.71 2k5p n ASN 6 N 4.41 -3.96 -0.28 4.85 3.02 -1.26 -0.83 115.26 121.21 2k5p n ASN 6 Ca -0.15 -0.74 -0.04 0.00 -0.03 0.00 0.00 54.58 53.62 2k5p n ASN 6 Cb 0.52 -4.18 -0.02 0.00 -0.61 0.00 0.00 39.78 35.50 2k5p n ASN 6 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k5p n GLY 7 N -1.69 0.53 3.02 7.41 0.00 -1.26 -4.99 105.19 108.20 2k5p n GLY 7 Ca -0.07 -0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 2k5p n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5p s LYS 8 N -1.76 1.96 0.30 1.61 1.02 -0.01 -5.10 119.74 117.75 2k5p s LYS 8 Ca 0.00 -0.47 -0.28 0.00 0.02 0.00 0.00 55.97 55.25 2k5p s LYS 8 Cb 0.00 -1.72 -0.09 0.00 -0.52 0.00 0.00 37.83 35.50 2k5p s LYS 8 CO 0.00 -0.09 0.99 -1.25 -0.92 0.00 0.00 175.35 174.09 2k5p s PRO 9 N 1.06 4.63 -0.04 -1.68 0.04 -1.26 -0.01 135.00 137.73 2k5p s PRO 9 Ca -0.06 1.52 -0.00 0.00 0.04 0.00 0.00 61.00 62.49 2k5p s PRO 9 Cb -0.15 -3.01 0.03 0.00 0.04 0.00 0.00 34.50 31.41 2k5p s PRO 9 CO -0.02 0.28 0.01 0.45 0.04 0.00 0.00 177.00 177.77 2k5p s SER 10 N -1.30 0.79 -0.83 6.66 0.15 0.46 -4.91 113.70 114.72 2k5p s SER 10 Ca 0.47 -0.01 -0.21 0.00 0.70 0.00 0.00 55.95 56.90 2k5p s SER 10 Cb -0.25 -0.24 0.09 0.00 -1.71 0.00 0.00 66.02 63.92 2k5p s SER 10 CO 0.31 -0.15 1.11 -0.89 1.20 0.00 0.00 173.24 174.82 2k5p s THR 11 N 1.44 4.42 -0.71 6.45 2.01 -1.26 -1.80 115.64 126.20 2k5p s THR 11 Ca -0.04 -0.92 -0.18 0.00 0.31 0.00 0.00 61.69 60.86 2k5p s THR 11 Cb -0.13 -4.79 0.13 0.00 0.01 0.00 0.00 72.50 67.73 2k5p s THR 11 CO -0.03 -1.56 0.81 0.68 -0.69 0.00 0.00 174.62 173.83 2k5p s VAL 12 N 3.64 4.97 0.68 3.82 -7.23 -0.28 -4.92 120.40 121.09 2k5p s VAL 12 Ca 0.30 -1.44 -0.11 0.00 -1.81 0.00 0.00 61.98 58.93 2k5p s VAL 12 Cb -0.09 -4.55 -0.00 0.00 0.56 0.00 0.00 36.38 32.30 2k5p s VAL 12 CO -0.01 -1.19 1.05 -0.62 -0.31 0.00 0.00 175.10 174.03 2k5p s ASP 13 N 3.32 5.54 0.00 4.85 2.15 -1.26 0.86 116.67 132.13 2k5p s ASP 13 Ca 0.17 1.60 0.00 0.00 0.43 0.00 0.00 52.55 54.75 2k5p s ASP 13 Cb -0.17 -2.49 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 2k5p s ASP 13 CO -0.00 -1.34 0.00 0.61 -0.17 0.00 0.00 175.17 174.27 2k5p n GLY 14 N -2.05 2.36 3.68 2.66 0.00 -1.26 -4.77 105.19 105.82 2k5p n GLY 14 Ca 0.07 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 2k5p n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5p s ALA 15 N 0.00 3.57 -0.11 4.61 0.00 -1.25 -4.91 121.76 123.68 2k5p s ALA 15 Ca 0.00 0.66 -0.04 0.00 0.00 0.00 0.00 51.96 52.58 2k5p s ALA 15 Cb 0.00 -3.58 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 2k5p s ALA 15 CO 0.00 -0.96 -0.13 0.39 0.00 0.00 0.00 175.76 175.06 2k5p n GLU 16 N 5.78 0.24 -3.20 0.00 1.02 -1.26 -0.42 120.64 122.80 2k5p n GLU 16 Ca 0.13 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 2k5p n GLU 16 Cb 0.45 -0.96 -0.03 0.00 -0.02 0.00 0.00 31.44 30.89 2k5p n GLU 16 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2k5p s SER 17 N -5.80 -0.98 0.05 1.62 1.04 -1.26 -4.06 113.70 104.31 2k5p s SER 17 Ca -0.15 0.47 0.02 0.00 0.48 0.00 0.00 55.95 56.77 2k5p s SER 17 Cb 0.05 1.84 -0.03 0.00 0.10 0.00 0.00 66.02 67.99 2k5p s SER 17 CO 0.20 -0.29 -0.08 -0.76 0.98 0.00 0.00 173.24 173.30 2k5p s LEU 18 N 2.76 2.30 0.64 2.42 1.43 -1.02 -4.97 118.68 122.25 2k5p s LEU 18 Ca 0.16 -0.63 -0.13 0.00 -1.03 0.00 0.00 54.13 52.49 2k5p s LEU 18 Cb -0.14 -0.14 -0.01 0.00 0.03 0.00 0.00 46.19 45.93 2k5p s LEU 18 CO -0.22 -0.25 1.06 0.54 0.23 0.00 0.00 176.35 177.70 2k5p s ASN 19 N -1.84 5.57 0.36 2.29 4.22 -1.26 -0.18 114.94 124.10 2k5p s ASN 19 Ca -0.06 1.72 0.13 0.00 -2.14 0.00 0.00 52.86 52.51 2k5p s ASN 19 Cb -0.07 -2.52 0.94 0.00 1.28 0.00 0.00 41.25 40.88 2k5p s ASN 19 CO -0.01 -1.31 1.80 0.58 -2.04 0.00 0.00 177.10 176.13 2k5p h VAL 20 N -0.12 0.66 -0.20 3.54 2.07 -0.06 0.82 116.25 122.96 2k5p h VAL 20 Ca -0.45 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 66.93 2k5p h VAL 20 Cb 1.22 0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 2k5p h VAL 20 CO 0.57 0.10 -0.16 0.74 0.02 0.00 0.00 177.57 178.84 2k5p h THR 21 N 0.56 0.56 0.00 2.57 2.02 -1.55 0.71 112.91 117.78 2k5p h THR 21 Ca 0.55 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.62 2k5p h THR 21 Cb 1.13 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 2k5p h THR 21 CO -0.29 0.00 -0.51 -0.33 0.37 0.00 0.00 175.52 174.75 2k5p h GLU 22 N -0.16 0.00 -0.46 6.66 4.39 -1.25 -0.33 114.58 123.43 2k5p h GLU 22 Ca 0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2k5p h GLU 22 Cb 0.34 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2k5p h GLU 22 CO -0.30 0.51 0.29 1.25 -1.16 0.00 0.00 179.01 179.61 2k5p h LEU 23 N 0.00 0.54 -0.69 1.33 6.46 -0.32 0.21 115.31 122.84 2k5p h LEU 23 Ca -0.01 -0.03 -0.05 0.00 -0.12 0.00 0.00 57.88 57.67 2k5p h LEU 23 Cb 0.96 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 40.72 2k5p h LEU 23 CO 0.07 0.41 0.23 -0.07 -0.62 0.00 0.00 178.44 178.46 2k5p h LEU 24 N 0.62 0.99 -2.17 2.25 3.38 -0.64 -2.63 115.31 117.12 2k5p h LEU 24 Ca 0.17 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2k5p h LEU 24 Cb -0.04 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 2k5p h LEU 24 CO -0.03 0.93 -0.02 -1.28 0.09 0.00 0.00 178.44 178.13 2k5p h SER 25 N 1.00 0.00 -0.78 -0.43 0.87 -0.34 0.59 113.55 114.46 2k5p h SER 25 Ca 0.22 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.79 2k5p h SER 25 Cb 0.28 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.21 2k5p h SER 25 CO -0.01 0.02 0.51 0.00 -0.53 0.00 0.00 176.83 176.82 2k5p h ALA 26 N 1.98 0.99 -0.01 6.23 0.00 -0.22 -0.60 119.26 127.63 2k5p h ALA 26 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2k5p h ALA 26 Cb 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2k5p h ALA 26 CO 0.00 0.40 -0.03 1.28 0.00 0.00 0.00 179.25 180.89 2k5p n LEU 27 N -4.55 1.24 -3.55 0.00 4.32 -0.78 -4.95 117.00 108.73 2k5p n LEU 27 Ca 0.08 -0.40 -0.19 0.00 -0.02 0.00 0.00 56.01 55.48 2k5p n LEU 27 Cb 0.02 -0.02 0.07 0.00 -1.62 0.00 0.00 43.42 41.86 2k5p n LEU 27 CO 0.36 0.21 0.06 1.17 -1.22 0.00 0.00 177.39 177.97 2k5p n LYS 28 N -0.09 -6.11 -2.62 3.23 4.81 -0.23 -4.92 118.16 112.22 2k5p n LYS 28 Ca 0.19 0.76 -0.42 0.00 -0.87 0.00 0.00 58.31 57.97 2k5p n LYS 28 Cb 0.32 -5.62 -0.02 0.00 0.02 0.00 0.00 35.03 29.73 2k5p n LYS 28 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2k5p s VAL 29 N -3.46 4.08 0.56 3.15 1.01 0.03 -4.84 120.40 120.94 2k5p s VAL 29 Ca 0.07 -1.06 0.28 0.00 0.00 0.00 0.00 61.98 61.26 2k5p s VAL 29 Cb -0.03 -5.04 0.39 0.00 0.00 0.00 0.00 36.38 31.71 2k5p s VAL 29 CO 0.76 -1.88 1.97 0.00 0.00 0.00 0.00 175.10 175.95 2k5p h ALA 30 N 9.32 2.32 -0.20 5.51 0.00 -1.91 -2.99 119.26 131.31 2k5p h ALA 30 Ca 0.23 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.89 2k5p h ALA 30 Cb 0.99 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.73 2k5p h ALA 30 CO 1.38 -0.66 0.02 1.04 0.00 0.00 0.00 179.25 181.03 2k5p n GLN 31 N -4.06 1.80 -0.21 0.00 1.13 -1.26 -4.58 117.38 110.20 2k5p n GLN 31 Ca 0.09 -1.13 0.04 0.00 -1.94 0.00 0.00 57.00 54.06 2k5p n GLN 31 Cb 0.61 -1.71 0.30 0.00 0.11 0.00 0.00 30.24 29.56 2k5p n GLN 31 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k5p h ALA 32 N 2.22 1.60 0.00 -1.58 0.00 -1.88 0.32 119.26 119.94 2k5p h ALA 32 Ca 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2k5p h ALA 32 Cb 1.11 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2k5p h ALA 32 CO 0.40 0.31 0.00 -1.91 0.00 0.00 0.00 179.25 178.05 2k5p n GLU 33 N -4.46 0.21 -0.11 0.00 4.07 -1.26 -3.96 120.64 115.13 2k5p n GLU 33 Ca 0.10 0.05 -0.22 0.00 -0.06 0.00 0.00 57.16 57.03 2k5p n GLU 33 Cb 0.16 -1.50 -0.07 0.00 -0.06 0.00 0.00 31.44 29.96 2k5p n GLU 33 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2k5p n TYR 34 N -1.38 0.00 -2.27 4.31 4.02 -0.09 -5.00 117.16 116.75 2k5p n TYR 34 Ca 0.10 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.58 2k5p n TYR 34 Cb 0.25 -0.76 -0.03 0.00 -0.02 0.00 0.00 39.34 38.78 2k5p n TYR 34 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2k5p s VAL 35 N -2.42 3.22 -0.05 -0.72 0.11 -0.12 -5.04 120.40 115.38 2k5p s VAL 35 Ca -0.30 1.09 0.02 0.00 -2.93 0.00 0.00 61.98 59.86 2k5p s VAL 35 Cb 0.11 -3.69 -0.03 0.00 -1.53 0.00 0.00 36.38 31.24 2k5p s VAL 35 CO 0.38 0.21 -0.10 -0.89 -3.33 0.00 0.00 175.10 171.36 2k5p s THR 36 N -0.44 3.43 0.06 5.04 2.01 -1.26 -4.92 115.64 119.56 2k5p s THR 36 Ca 0.52 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.94 2k5p s THR 36 Cb -0.36 -2.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 2k5p s THR 36 CO 0.42 0.58 -0.10 0.68 -0.69 0.00 0.00 174.62 175.50 2k5p s VAL 37 N -0.80 0.80 -0.14 3.82 -7.23 -1.26 -3.53 120.40 112.06 2k5p s VAL 37 Ca 0.12 -1.29 0.02 0.00 -1.81 0.00 0.00 61.98 59.03 2k5p s VAL 37 Cb -0.11 -0.93 0.00 0.00 0.56 0.00 0.00 36.38 35.90 2k5p s VAL 37 CO 0.02 -0.39 -0.20 -1.83 -0.31 0.00 0.00 175.10 172.39 2k5p s GLU 38 N -1.94 3.10 -0.25 4.82 -1.05 -1.07 -2.98 118.70 119.33 2k5p s GLU 38 Ca -0.04 -0.82 -0.17 0.00 -0.15 0.00 0.00 54.97 53.80 2k5p s GLU 38 Cb -0.08 -2.48 -0.03 0.00 -0.44 0.00 0.00 34.13 31.09 2k5p s GLU 38 CO 0.01 0.03 0.46 -1.17 0.95 0.00 0.00 175.26 175.54 2k5p s LEU 39 N 0.72 4.06 -1.62 1.83 1.98 0.11 -0.93 118.68 124.84 2k5p s LEU 39 Ca -0.08 0.46 0.00 0.00 -2.89 0.00 0.00 54.13 51.62 2k5p s LEU 39 Cb -0.16 -2.58 0.00 0.00 0.66 0.00 0.00 46.19 44.11 2k5p s LEU 39 CO 0.01 -0.23 0.00 0.59 -1.89 0.00 0.00 176.35 174.82 2k5p n ASN 40 N 5.34 -4.90 0.00 3.68 5.03 0.62 -0.79 115.26 124.24 2k5p n ASN 40 Ca -0.06 0.20 0.00 0.00 0.87 0.00 0.00 54.58 55.59 2k5p n ASN 40 Cb 0.50 -4.21 0.00 0.00 -1.02 0.00 0.00 39.78 35.05 2k5p n ASN 40 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2k5p n GLY 41 N -0.71 0.64 3.35 7.41 0.00 -1.26 -5.06 105.19 109.57 2k5p n GLY 41 Ca -0.19 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 2k5p n GLY 41 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k5p s GLU 42 N -0.63 3.40 -0.02 1.61 2.12 0.03 -5.05 118.70 120.16 2k5p s GLU 42 Ca 0.00 -0.64 -0.30 0.00 0.36 0.00 0.00 54.97 54.39 2k5p s GLU 42 Cb 0.00 -2.84 -0.03 0.00 0.26 0.00 0.00 34.13 31.52 2k5p s GLU 42 CO 0.00 0.01 1.07 0.54 -0.54 0.00 0.00 175.26 176.33 2k5p s VAL 43 N 0.92 4.57 -0.12 3.70 0.11 -1.26 0.09 120.40 128.41 2k5p s VAL 43 Ca -0.02 1.85 -0.07 0.00 -2.93 0.00 0.00 61.98 60.82 2k5p s VAL 43 Cb -0.15 -4.19 -0.04 0.00 -1.53 0.00 0.00 36.38 30.48 2k5p s VAL 43 CO 0.00 0.09 0.14 -0.76 -3.33 0.00 0.00 175.10 171.24 2k5p s LEU 44 N 1.40 4.37 0.80 2.54 2.01 -1.16 -4.96 118.68 123.70 2k5p s LEU 44 Ca 0.53 0.46 -0.11 0.00 0.01 0.00 0.00 54.13 55.03 2k5p s LEU 44 Cb -0.23 -2.06 0.08 0.00 0.01 0.00 0.00 46.19 43.98 2k5p s LEU 44 CO 0.25 0.41 1.10 -1.61 1.01 0.00 0.00 176.35 177.51 2k5p s GLU 45 N -1.03 1.99 0.38 1.70 8.01 -1.26 -4.69 118.70 123.80 2k5p s GLU 45 Ca 0.15 1.15 0.10 0.00 0.01 0.00 0.00 54.97 56.38 2k5p s GLU 45 Cb -0.12 -1.87 0.86 0.00 -4.31 0.00 0.00 34.13 28.69 2k5p s GLU 45 CO 0.04 -1.83 1.91 0.00 0.01 0.00 0.00 175.26 175.39 2k5p h ARG 46 N -1.26 0.62 -0.42 1.61 3.08 -1.94 0.64 114.38 116.71 2k5p h ARG 46 Ca -0.44 -0.04 -0.14 0.00 0.07 0.00 0.00 59.98 59.43 2k5p h ARG 46 Cb 1.24 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 2k5p h ARG 46 CO 0.51 0.41 -0.29 0.93 -1.07 0.00 0.00 179.97 180.46 2k5p h GLU 47 N 0.64 0.91 0.00 0.04 5.08 -1.97 -3.19 114.58 116.08 2k5p h GLU 47 Ca 0.39 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2k5p h GLU 47 Cb 0.63 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2k5p h GLU 47 CO -0.15 1.08 0.00 0.00 -1.00 0.00 0.00 179.01 178.93 2k5p h ALA 48 N 0.89 1.00 -0.28 3.43 0.00 -1.22 -2.36 119.26 120.73 2k5p h ALA 48 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2k5p h ALA 48 Cb 0.86 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2k5p h ALA 48 CO 0.08 0.00 -0.01 0.74 0.00 0.00 0.00 179.25 180.06 2k5p h PHE 49 N 0.00 0.43 -0.00 0.00 0.04 -1.49 0.02 116.94 115.93 2k5p h PHE 49 Ca 0.00 -0.03 -0.19 0.00 2.80 0.00 0.00 57.97 60.55 2k5p h PHE 49 Cb 0.20 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 2k5p h PHE 49 CO 0.00 0.44 -0.85 0.22 -0.60 0.00 0.00 178.31 177.52 2k5p h ASP 50 N 0.40 0.21 0.00 2.17 3.58 -1.63 -1.14 116.42 120.02 2k5p h ASP 50 Ca 0.09 -0.17 -0.12 0.00 0.42 0.00 0.00 57.03 57.26 2k5p h ASP 50 Cb 0.28 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.25 2k5p h ASP 50 CO 0.01 0.96 -0.66 0.00 -2.88 0.00 0.00 179.24 176.67 2k5p h ALA 51 N 1.03 0.13 -2.00 -0.78 0.00 -1.60 -3.45 119.26 112.60 2k5p h ALA 51 Ca -0.03 -0.84 -0.59 0.00 0.00 0.00 0.00 54.91 53.45 2k5p h ALA 51 Cb 1.46 0.40 0.01 0.00 0.00 0.00 0.00 17.79 19.66 2k5p h ALA 51 CO 0.13 0.38 1.31 2.41 0.00 0.00 0.00 179.25 183.47 2k5p n THR 52 N -4.53 0.52 -3.56 0.00 -1.04 -0.03 -4.89 114.28 100.75 2k5p n THR 52 Ca -0.21 -0.25 -0.38 0.00 -2.04 0.00 0.00 64.05 61.17 2k5p n THR 52 Cb 0.55 -2.21 -0.11 0.00 -1.82 0.00 0.00 70.33 66.75 2k5p n THR 52 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2k5p s THR 53 N 5.96 5.29 -0.04 12.58 -4.23 -1.26 -1.06 115.64 132.88 2k5p s THR 53 Ca 0.96 0.20 -0.11 0.00 -1.18 0.00 0.00 61.69 61.56 2k5p s THR 53 Cb -0.52 -3.57 -0.05 0.00 1.34 0.00 0.00 72.50 69.70 2k5p s THR 53 CO 0.43 0.22 0.29 -0.69 -0.54 0.00 0.00 174.62 174.33 2k5p s VAL 54 N 1.80 5.24 0.10 2.29 1.01 0.75 -4.92 120.40 126.66 2k5p s VAL 54 Ca 0.08 0.53 0.01 0.00 0.00 0.00 0.00 61.98 62.61 2k5p s VAL 54 Cb -0.16 -3.58 -0.00 0.00 0.00 0.00 0.00 36.38 32.64 2k5p s VAL 54 CO 0.11 0.57 0.04 0.29 0.00 0.00 0.00 175.10 176.11 2k5p n LYS 55 N 1.79 0.80 -1.89 2.72 5.02 -1.26 -2.45 118.16 122.90 2k5p n LYS 55 Ca -0.16 -0.84 -0.42 0.00 -2.02 0.00 0.00 58.31 54.87 2k5p n LYS 55 Cb 0.53 0.48 -0.03 0.00 -0.02 0.00 0.00 35.03 35.99 2k5p n LYS 55 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2k5p s ASP 56 N -1.61 6.53 -0.17 4.39 2.15 -1.26 -2.98 116.67 123.72 2k5p s ASP 56 Ca 0.05 2.73 -0.00 0.00 0.43 0.00 0.00 52.55 55.76 2k5p s ASP 56 Cb 0.00 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 2k5p s ASP 56 CO 0.04 -0.84 0.04 0.61 -0.17 0.00 0.00 175.17 174.84 2k5p n GLY 57 N 3.16 0.44 3.41 2.66 0.00 0.14 -4.89 105.19 110.11 2k5p n GLY 57 Ca 0.12 -0.74 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 2k5p n GLY 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k5p s ASP 58 N -2.94 3.45 -0.93 1.61 -1.08 -1.16 -4.95 116.67 110.66 2k5p s ASP 58 Ca 0.02 -0.71 -0.08 0.00 -0.52 0.00 0.00 52.55 51.26 2k5p s ASP 58 Cb -0.01 -0.29 0.24 0.00 -1.46 0.00 0.00 42.92 41.39 2k5p s ASP 58 CO 0.02 0.18 0.86 0.00 0.52 0.00 0.00 175.17 176.76 2k5p s ALA 59 N -1.09 4.32 -0.89 3.66 0.00 -1.26 -0.74 121.76 125.76 2k5p s ALA 59 Ca 0.15 -3.66 -0.20 0.00 0.00 0.00 0.00 51.96 48.25 2k5p s ALA 59 Cb -0.10 -3.25 0.11 0.00 0.00 0.00 0.00 23.12 19.88 2k5p s ALA 59 CO 0.07 -2.20 1.13 0.54 0.00 0.00 0.00 175.76 175.31 2k5p s VAL 60 N -0.82 4.58 -0.85 0.00 0.11 -1.17 -0.28 120.40 121.97 2k5p s VAL 60 Ca 0.25 -1.29 -0.25 0.00 -2.93 0.00 0.00 61.98 57.77 2k5p s VAL 60 Cb -0.10 -4.79 -0.03 0.00 -1.53 0.00 0.00 36.38 29.93 2k5p s VAL 60 CO -0.09 -1.54 1.84 -0.70 -3.33 0.00 0.00 175.10 171.28 2k5p s GLU 61 N 3.15 2.71 -0.39 1.54 2.12 -0.11 -4.37 118.70 123.36 2k5p s GLU 61 Ca 0.32 -0.19 -0.29 0.00 0.36 0.00 0.00 54.97 55.17 2k5p s GLU 61 Cb -0.06 -4.92 0.00 0.00 0.26 0.00 0.00 34.13 29.41 2k5p s GLU 61 CO -0.06 -3.06 1.50 0.12 -0.54 0.00 0.00 175.26 173.23 2k5p s PHE 62 N 9.11 2.26 0.55 5.30 5.36 -1.26 -2.59 117.98 136.70 2k5p s PHE 62 Ca 0.65 0.66 -0.17 0.00 -0.96 0.00 0.00 56.93 57.11 2k5p s PHE 62 Cb -0.07 -4.26 -0.05 0.00 -0.34 0.00 0.00 43.02 38.29 2k5p s PHE 62 CO 0.03 -2.23 1.05 -0.51 -1.46 0.00 0.00 175.22 172.11 2k5p s LEU 63 N 5.75 3.63 -0.16 6.12 1.43 -1.23 -4.78 118.68 129.44 2k5p s LEU 63 Ca 0.66 1.87 -0.04 0.00 -1.03 0.00 0.00 54.13 55.59 2k5p s LEU 63 Cb -0.16 -4.54 -0.07 0.00 0.03 0.00 0.00 46.19 41.45 2k5p s LEU 63 CO 0.33 -1.03 2.89 -1.22 0.23 0.00 0.00 176.35 177.55 2k5p n TYR 64 N -1.62 0.61 0.07 0.29 4.02 -1.26 -4.44 117.16 114.83 2k5p n TYR 64 Ca 0.09 -1.58 0.01 0.00 -0.01 0.00 0.00 57.90 56.41 2k5p n TYR 64 Cb 0.53 -1.25 0.04 0.00 -0.02 0.00 0.00 39.34 38.63 2k5p n TYR 64 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2k5p n PHE 65 N 1.61 0.00 -2.60 -0.72 3.01 -1.26 -4.44 117.46 113.05 2k5p n PHE 65 Ca 0.35 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.39 2k5p n PHE 65 Cb 0.70 -0.45 -0.03 0.00 -0.01 0.00 0.00 39.48 39.69 2k5p n PHE 65 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 2k5p s MET 66 N -2.91 3.26 0.00 -1.08 -1.94 -1.26 -4.79 119.30 110.58 2k5p s MET 66 Ca 0.01 -0.20 0.11 0.00 -1.71 0.00 0.00 55.69 53.90 2k5p s MET 66 Cb 0.01 -4.14 -0.03 0.00 2.01 0.00 0.00 34.83 32.67 2k5p s MET 66 CO 0.03 -1.99 0.62 0.41 -0.01 0.00 0.00 175.02 174.09 2k5p n GLY 67 N 5.30 -0.10 3.77 -0.03 0.00 -1.26 -5.01 105.19 107.85 2k5p n GLY 67 Ca 0.03 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 2k5p n GLY 67 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k5p s GLY 68 N -1.63 2.93 0.08 -0.02 0.00 -1.26 -4.96 107.32 102.45 2k5p s GLY 68 Ca 0.08 1.26 -0.16 0.00 0.00 0.00 0.00 44.72 45.90 2k5p s GLY 68 CO 0.33 1.86 1.33 -1.33 0.00 0.00 0.00 173.10 175.28 2k5p h GLY 69 N 2.70 0.69 -3.36 0.20 0.00 -2.04 -3.50 103.07 97.76 2k5p h GLY 69 Ca -0.50 -0.84 0.00 0.00 0.00 0.00 0.00 47.33 46.00 2k5p h GLY 69 CO 0.63 0.75 -0.65 1.17 0.00 0.00 0.00 176.54 178.43 2k5p n LYS 70 N -4.22 -3.79 -0.00 4.80 4.81 -1.26 -4.27 118.16 114.23 2k5p n LYS 70 Ca -0.06 2.85 0.23 0.00 -0.87 0.00 0.00 58.31 60.46 2k5p n LYS 70 Cb 0.55 -2.98 0.65 0.00 0.02 0.00 0.00 35.03 33.27 2k5p n LYS 70 CO 0.00 0.00 0.00 1.37 1.17 0.00 0.00 177.40 179.94 2k5p h LEU 71 N 2.95 0.00 0.08 3.14 -0.00 -2.06 -1.47 115.31 117.94 2k5p h LEU 71 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.65 2k5p h LEU 71 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.65 2k5p h LEU 71 CO 0.00 0.00 -1.17 -0.08 -0.00 0.00 0.00 178.44 177.19 2k5p h GLU 72 N 0.00 0.18 0.00 0.17 4.81 -2.03 -3.51 114.58 114.20 2k5p h GLU 72 Ca 0.29 -0.30 0.14 0.00 -0.13 0.00 0.00 59.36 59.35 2k5p h GLU 72 Cb 1.68 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 31.13 2k5p h GLU 72 CO -0.00 1.15 -0.18 0.72 -0.73 0.00 0.00 179.01 179.96 2k5p n HIS 73 N -4.11 -2.49 -1.07 0.92 8.25 -0.56 -4.50 115.22 111.67 2k5p n HIS 73 Ca -0.23 0.63 0.08 0.00 -0.26 0.00 0.00 57.72 57.94 2k5p n HIS 73 Cb 0.81 -1.02 0.22 0.00 1.12 0.00 0.00 29.99 31.11 2k5p n HIS 73 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k5p n HIS 74 N -2.55 0.67 -1.86 4.41 -0.00 -1.26 -5.03 115.22 109.59 2k5p n HIS 74 Ca 0.00 -0.98 -0.42 0.00 0.46 0.00 0.00 57.72 56.78 2k5p n HIS 74 Cb 0.23 -0.28 -0.03 0.00 -0.12 0.00 0.00 29.99 29.79 2k5p n HIS 74 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k5p s HIS 75 N -2.89 3.00 0.26 1.57 5.65 -1.26 -5.00 115.29 116.62 2k5p s HIS 75 Ca 0.39 0.55 0.01 0.00 0.25 0.00 0.00 55.06 56.27 2k5p s HIS 75 Cb 0.33 -4.00 -0.05 0.00 -1.18 0.00 0.00 32.58 27.68 2k5p s HIS 75 CO 0.06 -3.69 0.10 -3.38 -0.65 0.00 0.00 174.74 167.17 2k5p s HIS 76 N 1.07 1.56 0.12 3.88 -3.43 -1.26 -5.17 115.29 112.06 2k5p s HIS 76 Ca 0.71 -1.17 0.08 0.00 -0.80 0.00 0.00 55.06 53.87 2k5p s HIS 76 Cb -0.46 -0.92 -0.04 0.00 -1.43 0.00 0.00 32.58 29.74 2k5p s HIS 76 CO 0.33 -0.32 -0.19 -1.01 -2.00 0.00 0.00 174.74 171.54 2k5p s HIS 77 N -3.73 1.74 -2.00 0.38 3.76 -1.26 -5.33 115.29 108.85 2k5p s HIS 77 Ca 0.38 -0.45 0.26 0.00 -0.15 0.00 0.00 55.06 55.10 2k5p s HIS 77 Cb 0.08 -0.92 1.54 0.00 1.11 0.00 0.00 32.58 34.39 2k5p s HIS 77 CO 0.14 0.24 1.90 0.72 -0.85 0.00 0.00 174.74 176.88