#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 6.38 0.45 3.17 0.01 -1.26 -0.43 114.94 123.26 2k5p s ASN 2 Ca 0.00 0.45 0.04 0.00 -0.71 0.00 0.00 52.86 52.64 2k5p s ASN 2 Cb 0.00 -2.22 -0.04 0.00 0.41 0.00 0.00 41.25 39.39 2k5p s ASN 2 CO 0.00 -0.09 0.02 -0.76 -1.51 0.00 0.00 177.10 174.75 2k5p s LEU 3 N 1.46 2.51 -0.38 0.60 2.01 0.61 -0.67 118.68 124.83 2k5p s LEU 3 Ca 0.18 -1.52 0.01 0.00 0.01 0.00 0.00 54.13 52.81 2k5p s LEU 3 Cb -0.15 -0.75 0.12 0.00 0.01 0.00 0.00 46.19 45.42 2k5p s LEU 3 CO 0.08 -0.68 0.16 -0.89 1.01 0.00 0.00 176.35 176.03 2k5p s THR 4 N -2.85 1.34 -0.37 5.49 2.01 0.11 -0.26 115.64 121.11 2k5p s THR 4 Ca 0.21 -2.08 -0.23 0.00 0.31 0.00 0.00 61.69 59.89 2k5p s THR 4 Cb 0.06 -1.97 0.01 0.00 0.01 0.00 0.00 72.50 70.60 2k5p s THR 4 CO 0.11 -0.77 0.76 -0.69 -0.69 0.00 0.00 174.62 173.34 2k5p s VAL 5 N 0.92 4.75 -1.62 3.82 1.01 0.15 -2.88 120.40 126.54 2k5p s VAL 5 Ca 0.14 0.78 0.00 0.00 0.00 0.00 0.00 61.98 62.90 2k5p s VAL 5 Cb -0.21 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 31.97 2k5p s VAL 5 CO -0.11 -0.44 0.00 0.59 0.00 0.00 0.00 175.10 175.14 2k5p n ASN 6 N 6.38 -5.42 0.00 3.32 3.02 -1.26 -0.73 115.26 120.57 2k5p n ASN 6 Ca 0.02 0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2k5p n ASN 6 Cb 0.48 -4.54 0.00 0.00 -0.61 0.00 0.00 39.78 35.11 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 -0.95 0.71 3.28 7.41 0.00 -1.26 -5.06 105.19 109.33 2k5p n GLY 7 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.37 3.30 -0.05 1.61 -0.14 0.09 -5.08 119.74 119.10 2k5p s LYS 8 Ca 0.00 -0.68 -0.30 0.00 -1.36 0.00 0.00 55.97 53.63 2k5p s LYS 8 Cb 0.00 -2.84 -0.06 0.00 -1.68 0.00 0.00 37.83 33.25 2k5p s LYS 8 CO 0.00 -0.12 1.72 -2.14 -0.76 0.00 0.00 175.35 174.05 2k5p s PRO 9 N 1.20 4.13 -0.07 -1.68 0.02 -1.26 0.32 135.00 137.66 2k5p s PRO 9 Ca 0.02 2.22 0.01 0.00 0.02 0.00 0.00 61.00 63.28 2k5p s PRO 9 Cb -0.14 -4.03 0.02 0.00 0.02 0.00 0.00 34.50 30.37 2k5p s PRO 9 CO -0.04 -0.92 -0.10 -1.54 -0.33 0.00 0.00 177.00 174.08 2k5p s SER 10 N 3.70 1.69 -0.30 2.53 1.04 0.64 -4.92 113.70 118.08 2k5p s SER 10 Ca 0.76 -0.26 -0.10 0.00 0.48 0.00 0.00 55.95 56.83 2k5p s SER 10 Cb -0.34 -0.75 -0.02 0.00 0.10 0.00 0.00 66.02 65.00 2k5p s SER 10 CO 0.32 -0.02 0.17 -0.89 0.98 0.00 0.00 173.24 173.80 2k5p s THR 11 N 0.94 4.86 -0.07 2.02 2.01 -1.26 -0.28 115.64 123.87 2k5p s THR 11 Ca -0.10 -0.21 -0.20 0.00 0.31 0.00 0.00 61.69 61.49 2k5p s THR 11 Cb -0.15 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 2k5p s THR 11 CO 0.00 0.13 0.57 0.68 -0.69 0.00 0.00 174.62 175.32 2k5p s VAL 12 N 1.67 5.06 0.41 3.82 -7.23 0.43 -4.91 120.40 119.64 2k5p s VAL 12 Ca 0.06 1.17 -0.10 0.00 -1.81 0.00 0.00 61.98 61.30 2k5p s VAL 12 Cb -0.17 -3.91 -0.06 0.00 0.56 0.00 0.00 36.38 32.80 2k5p s VAL 12 CO 0.08 0.34 0.77 -0.62 -0.31 0.00 0.00 175.10 175.36 2k5p s ASP 13 N 0.37 6.51 0.00 4.85 2.15 -1.26 0.11 116.67 129.39 2k5p s ASP 13 Ca 0.31 1.12 0.00 0.00 0.43 0.00 0.00 52.55 54.40 2k5p s ASP 13 Cb -0.17 -2.32 0.00 0.00 -0.30 0.00 0.00 42.92 40.13 2k5p s ASP 13 CO 0.15 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 2k5p n GLY 14 N -1.34 2.04 3.95 2.66 0.00 -1.26 -4.80 105.19 106.43 2k5p n GLY 14 Ca 0.02 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.20 3.60 0.00 4.61 0.00 -1.26 -4.90 121.76 123.61 2k5p s ALA 15 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.93 2k5p s ALA 15 Cb 0.00 -2.30 0.00 0.00 0.00 0.00 0.00 23.12 20.82 2k5p s ALA 15 CO 0.00 -0.72 0.00 -0.85 0.00 0.00 0.00 175.76 174.19 2k5p n GLU 16 N -2.40 1.77 -3.78 0.00 0.28 -1.26 0.09 120.64 115.34 2k5p n GLU 16 Ca 0.05 0.00 -0.15 0.00 -0.16 0.00 0.00 57.16 56.90 2k5p n GLU 16 Cb 0.59 -0.77 -0.16 0.00 1.43 0.00 0.00 31.44 32.52 2k5p n GLU 16 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2k5p s SER 17 N -2.37 0.06 0.00 -1.84 1.04 -1.26 -2.67 113.70 106.66 2k5p s SER 17 Ca 0.00 0.04 -0.29 0.00 0.48 0.00 0.00 55.95 56.18 2k5p s SER 17 Cb 0.00 -0.06 0.10 0.00 0.10 0.00 0.00 66.02 66.16 2k5p s SER 17 CO 0.00 -0.12 1.07 -1.48 0.98 0.00 0.00 173.24 173.69 2k5p s LEU 18 N 1.01 -0.19 0.78 2.42 0.05 -0.14 -4.98 118.68 117.64 2k5p s LEU 18 Ca -0.08 -0.15 -0.14 0.00 0.05 0.00 0.00 54.13 53.81 2k5p s LEU 18 Cb -0.12 1.78 0.07 0.00 -2.05 0.00 0.00 46.19 45.86 2k5p s LEU 18 CO -0.03 -0.55 1.19 0.20 -0.55 0.00 0.00 176.35 176.62 2k5p s ASN 19 N -2.68 3.84 0.30 1.48 0.01 -1.26 0.57 114.94 117.19 2k5p s ASN 19 Ca 0.10 2.31 0.01 0.00 -0.71 0.00 0.00 52.86 54.57 2k5p s ASN 19 Cb 0.00 -2.58 0.54 0.00 0.41 0.00 0.00 41.25 39.62 2k5p s ASN 19 CO -0.04 -2.50 1.90 0.58 -1.51 0.00 0.00 177.10 175.53 2k5p h VAL 20 N -0.75 1.04 -0.82 1.60 2.07 -0.28 -1.52 116.25 117.59 2k5p h VAL 20 Ca -0.46 -0.35 0.02 0.00 0.82 0.00 0.00 66.70 66.73 2k5p h VAL 20 Cb 1.29 -0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 2k5p h VAL 20 CO 0.47 0.19 0.54 0.74 0.02 0.00 0.00 177.57 179.53 2k5p h THR 21 N 1.01 1.17 -0.11 2.57 2.02 -1.64 0.72 112.91 118.65 2k5p h THR 21 Ca 0.41 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 2k5p h THR 21 Cb 0.26 0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.67 2k5p h THR 21 CO -0.16 0.20 0.04 -0.33 0.37 0.00 0.00 175.52 175.63 2k5p h GLU 22 N 1.07 0.17 -0.45 6.66 4.39 -1.60 0.34 114.58 125.16 2k5p h GLU 22 Ca 0.32 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 60.02 2k5p h GLU 22 Cb -0.06 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.53 2k5p h GLU 22 CO -0.09 0.29 0.22 1.25 -1.16 0.00 0.00 179.01 179.53 2k5p h LEU 23 N 0.01 0.32 -0.62 1.33 5.85 -1.20 0.96 115.31 121.96 2k5p h LEU 23 Ca 0.04 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.80 2k5p h LEU 23 Cb 0.19 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 2k5p h LEU 23 CO -0.00 0.23 0.39 0.25 -0.34 0.00 0.00 178.44 178.97 2k5p h LEU 24 N 0.44 0.65 -1.29 2.25 5.85 -0.67 0.12 115.31 122.67 2k5p h LEU 24 Ca 0.20 -0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 2k5p h LEU 24 Cb 0.11 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2k5p h LEU 24 CO -0.14 0.46 -0.33 0.28 -0.34 0.00 0.00 178.44 178.37 2k5p h SER 25 N 0.78 0.04 -0.08 1.25 0.02 -0.55 -1.05 113.55 113.97 2k5p h SER 25 Ca 0.24 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 61.05 2k5p h SER 25 Cb -0.01 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2k5p h SER 25 CO -0.09 0.37 -0.36 0.00 -1.14 0.00 0.00 176.83 175.61 2k5p h ALA 26 N 1.63 0.88 -0.03 3.77 0.00 0.22 -3.11 119.26 122.63 2k5p h ALA 26 Ca 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 2k5p h ALA 26 Cb 0.60 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2k5p h ALA 26 CO 0.04 0.63 -0.75 -0.07 0.00 0.00 0.00 179.25 179.11 2k5p h LEU 27 N 0.49 0.24 -2.40 0.00 3.38 -0.55 -3.49 115.31 112.97 2k5p h LEU 27 Ca 0.05 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2k5p h LEU 27 Cb 0.85 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2k5p h LEU 27 CO 0.07 0.90 -0.58 1.17 0.09 0.00 0.00 178.44 180.09 2k5p n LYS 28 N -3.75 -2.28 -4.03 1.13 4.81 -0.44 -5.04 118.16 108.55 2k5p n LYS 28 Ca -0.03 2.01 -0.31 0.00 -0.87 0.00 0.00 58.31 59.12 2k5p n LYS 28 Cb 0.72 -4.47 -0.06 0.00 0.02 0.00 0.00 35.03 31.23 2k5p n LYS 28 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2k5p s VAL 29 N -1.67 4.67 -0.10 3.15 0.11 -1.26 -5.08 120.40 120.23 2k5p s VAL 29 Ca 0.08 -0.69 -0.30 0.00 -2.93 0.00 0.00 61.98 58.15 2k5p s VAL 29 Cb -0.02 -3.25 -0.03 0.00 -1.53 0.00 0.00 36.38 31.55 2k5p s VAL 29 CO 0.59 0.14 1.35 0.00 -3.33 0.00 0.00 175.10 173.85 2k5p s ALA 30 N -1.39 3.61 -0.38 1.54 0.00 -1.26 -4.09 121.76 119.79 2k5p s ALA 30 Ca 0.30 0.65 -0.14 0.00 0.00 0.00 0.00 51.96 52.77 2k5p s ALA 30 Cb -0.12 -3.62 0.02 0.00 0.00 0.00 0.00 23.12 19.39 2k5p s ALA 30 CO 0.22 -1.10 0.52 1.04 0.00 0.00 0.00 175.76 176.44 2k5p n GLN 31 N 6.24 -2.20 -0.20 0.00 6.02 -1.26 -4.73 117.38 121.24 2k5p n GLN 31 Ca 0.14 2.00 0.11 0.00 -0.01 0.00 0.00 57.00 59.24 2k5p n GLN 31 Cb 0.44 -5.26 0.41 0.00 1.02 0.00 0.00 30.24 26.86 2k5p n GLN 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k5p h ALA 32 N 1.85 1.88 0.00 -1.58 0.00 -1.99 -1.15 119.26 118.27 2k5p h ALA 32 Ca 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2k5p h ALA 32 Cb 0.86 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2k5p h ALA 32 CO 0.18 -0.07 -0.26 0.93 0.00 0.00 0.00 179.25 180.03 2k5p h GLU 33 N 0.62 0.00 0.00 0.00 5.08 -1.95 -3.31 114.58 115.02 2k5p h GLU 33 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 2k5p h GLU 33 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2k5p h GLU 33 CO -0.14 0.26 -0.41 0.66 -1.00 0.00 0.00 179.01 178.38 2k5p n TYR 34 N -3.18 0.24 -2.69 4.33 4.02 -0.44 -4.83 117.16 114.62 2k5p n TYR 34 Ca 0.03 0.07 -0.42 0.00 -0.01 0.00 0.00 57.90 57.57 2k5p n TYR 34 Cb 0.63 -0.47 -0.03 0.00 -0.02 0.00 0.00 39.34 39.44 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 -3.06 4.66 -0.13 -0.72 0.11 -1.20 -5.05 120.40 115.00 2k5p s VAL 35 Ca 0.10 2.01 0.01 0.00 -2.93 0.00 0.00 61.98 61.16 2k5p s VAL 35 Cb 0.16 -4.28 -0.01 0.00 -1.53 0.00 0.00 36.38 30.72 2k5p s VAL 35 CO 0.67 0.21 -0.16 -0.89 -3.33 0.00 0.00 175.10 171.60 2k5p s THR 36 N 0.64 2.75 0.00 5.04 2.01 -1.26 -4.97 115.64 119.84 2k5p s THR 36 Ca 0.51 -0.76 0.01 0.00 0.31 0.00 0.00 61.69 61.76 2k5p s THR 36 Cb -0.23 -2.14 -0.00 0.00 0.01 0.00 0.00 72.50 70.14 2k5p s THR 36 CO 0.29 0.53 -0.03 0.68 -0.69 0.00 0.00 174.62 175.39 2k5p s VAL 37 N 0.52 0.25 -0.29 3.82 -7.23 -1.26 -3.97 120.40 112.24 2k5p s VAL 37 Ca -0.10 -0.21 -0.05 0.00 -1.81 0.00 0.00 61.98 59.81 2k5p s VAL 37 Cb -0.16 -0.23 0.02 0.00 0.56 0.00 0.00 36.38 36.57 2k5p s VAL 37 CO 0.04 0.02 0.04 -1.83 -0.31 0.00 0.00 175.10 173.06 2k5p s GLU 38 N -0.20 2.84 -0.55 4.82 1.03 -1.25 -3.31 118.70 122.08 2k5p s GLU 38 Ca -0.00 -1.01 -0.28 0.00 0.03 0.00 0.00 54.97 53.71 2k5p s GLU 38 Cb -0.02 -3.27 0.01 0.00 -0.80 0.00 0.00 34.13 30.05 2k5p s GLU 38 CO -0.00 -0.50 1.48 -1.17 -1.33 0.00 0.00 175.26 173.73 2k5p s LEU 39 N 1.40 3.40 -1.84 1.83 2.96 0.23 -3.72 118.68 122.95 2k5p s LEU 39 Ca 0.00 0.36 0.00 0.00 -0.22 0.00 0.00 54.13 54.27 2k5p s LEU 39 Cb -0.18 -3.04 0.00 0.00 0.50 0.00 0.00 46.19 43.47 2k5p s LEU 39 CO 0.00 -1.77 0.00 -3.20 -1.32 0.00 0.00 176.35 170.07 2k5p n ASN 40 N 9.89 -5.79 0.00 3.68 5.15 0.29 -1.65 115.26 126.82 2k5p n ASN 40 Ca 0.14 0.08 0.00 0.00 -0.60 0.00 0.00 54.58 54.19 2k5p n ASN 40 Cb 0.49 -4.87 0.00 0.00 -0.53 0.00 0.00 39.78 34.87 2k5p n ASN 40 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k5p n GLY 41 N -0.91 2.50 3.69 8.20 0.00 -1.25 -4.97 105.19 112.45 2k5p n GLY 41 Ca -0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.23 3.45 0.00 1.61 2.56 -0.66 -5.07 118.70 120.37 2k5p s GLU 42 Ca 0.00 -0.35 -0.21 0.00 0.00 0.00 0.00 54.97 54.41 2k5p s GLU 42 Cb 0.00 -3.01 -0.05 0.00 2.00 0.00 0.00 34.13 33.07 2k5p s GLU 42 CO 0.00 0.54 0.62 0.54 -0.56 0.00 0.00 175.26 176.40 2k5p s VAL 43 N -0.39 4.88 -0.03 3.70 0.11 -1.26 0.75 120.40 128.16 2k5p s VAL 43 Ca 0.09 1.30 0.02 0.00 -2.93 0.00 0.00 61.98 60.46 2k5p s VAL 43 Cb -0.12 -3.96 -0.03 0.00 -1.53 0.00 0.00 36.38 30.74 2k5p s VAL 43 CO 0.02 0.41 -0.07 -0.76 -3.33 0.00 0.00 175.10 171.37 2k5p s LEU 44 N -0.15 3.17 0.77 2.54 1.02 -1.21 -4.93 118.68 119.88 2k5p s LEU 44 Ca 0.32 -0.08 -0.12 0.00 0.02 0.00 0.00 54.13 54.28 2k5p s LEU 44 Cb -0.19 -1.75 0.05 0.00 0.02 0.00 0.00 46.19 44.33 2k5p s LEU 44 CO 0.18 0.33 1.14 -1.61 0.02 0.00 0.00 176.35 176.41 2k5p s GLU 45 N -1.10 2.32 0.40 1.70 8.01 -1.26 -4.73 118.70 124.04 2k5p s GLU 45 Ca 0.15 0.27 0.09 0.00 0.01 0.00 0.00 54.97 55.49 2k5p s GLU 45 Cb -0.11 -1.98 0.87 0.00 -4.31 0.00 0.00 34.13 28.61 2k5p s GLU 45 CO 0.04 -1.38 1.97 0.00 0.01 0.00 0.00 175.26 175.91 2k5p h ARG 46 N -0.90 0.57 -0.01 1.61 3.08 -1.93 -0.25 114.38 116.55 2k5p h ARG 46 Ca -0.46 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2k5p h ARG 46 Cb 1.30 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.22 2k5p h ARG 46 CO 0.65 0.38 -0.41 0.39 -1.07 0.00 0.00 179.97 179.91 2k5p n GLU 47 N -4.48 1.07 0.12 0.04 1.02 -1.26 -4.25 120.64 112.90 2k5p n GLU 47 Ca 0.10 -0.81 0.13 0.00 -0.02 0.00 0.00 57.16 56.55 2k5p n GLU 47 Cb 0.28 -1.48 0.37 0.00 -0.02 0.00 0.00 31.44 30.58 2k5p n GLU 47 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k5p h ALA 48 N 3.81 0.99 -0.03 0.62 0.00 -1.39 -3.26 119.26 120.00 2k5p h ALA 48 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2k5p h ALA 48 Cb 0.67 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2k5p h ALA 48 CO 0.00 0.00 0.04 0.74 0.00 0.00 0.00 179.25 180.03 2k5p h PHE 49 N 0.00 0.00 0.00 0.00 0.04 -1.73 -0.25 116.94 115.00 2k5p h PHE 49 Ca 0.00 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.59 2k5p h PHE 49 Cb 0.78 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.90 2k5p h PHE 49 CO 0.00 0.00 -0.86 -0.44 -0.60 0.00 0.00 178.31 176.41 2k5p h ASP 50 N 0.00 0.00 -0.16 2.17 5.19 -1.88 -1.24 116.42 120.49 2k5p h ASP 50 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 2k5p h ASP 50 Cb 0.09 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.60 2k5p h ASP 50 CO -0.00 0.86 0.00 0.00 -3.12 0.00 0.00 179.24 176.98 2k5p n ALA 51 N -2.34 2.55 -3.67 3.45 0.00 -0.10 -4.71 120.51 115.69 2k5p n ALA 51 Ca 0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 53.44 52.93 2k5p n ALA 51 Cb 0.85 -1.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.14 2k5p n ALA 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2k5p s THR 52 N -1.69 -0.18 -0.49 0.00 2.01 -1.24 -5.10 115.64 108.96 2k5p s THR 52 Ca 0.12 0.39 -0.20 0.00 0.31 0.00 0.00 61.69 62.31 2k5p s THR 52 Cb 0.07 -0.22 0.05 0.00 0.01 0.00 0.00 72.50 72.40 2k5p s THR 52 CO 0.07 0.16 0.65 -0.89 -0.69 0.00 0.00 174.62 173.92 2k5p s THR 53 N 2.21 4.82 0.41 -0.82 2.01 -1.26 -1.62 115.64 121.39 2k5p s THR 53 Ca 0.04 -0.26 -0.22 0.00 0.31 0.00 0.00 61.69 61.56 2k5p s THR 53 Cb -0.12 -4.29 -0.10 0.00 0.01 0.00 0.00 72.50 68.00 2k5p s THR 53 CO -0.04 -0.76 0.98 -0.69 -0.69 0.00 0.00 174.62 173.41 2k5p s VAL 54 N 2.78 4.16 0.11 3.82 1.01 0.19 -4.79 120.40 127.69 2k5p s VAL 54 Ca 0.18 1.48 0.01 0.00 0.00 0.00 0.00 61.98 63.65 2k5p s VAL 54 Cb -0.17 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.52 2k5p s VAL 54 CO 0.14 -0.15 0.13 2.29 0.00 0.00 0.00 175.10 177.51 2k5p n LYS 55 N -0.34 0.18 -1.96 2.72 2.85 -1.26 -0.97 118.16 119.39 2k5p n LYS 55 Ca 0.06 -1.01 -0.43 0.00 -1.05 0.00 0.00 58.31 55.88 2k5p n LYS 55 Cb 0.52 0.89 -0.03 0.00 -0.65 0.00 0.00 35.03 35.77 2k5p n LYS 55 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2k5p s ASP 56 N -1.74 6.07 0.00 -5.58 -1.08 -1.09 -3.93 116.67 109.32 2k5p s ASP 56 Ca 0.11 1.62 0.00 0.00 -0.52 0.00 0.00 52.55 53.77 2k5p s ASP 56 Cb 0.00 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 2k5p s ASP 56 CO 0.08 -1.51 0.00 0.61 0.52 0.00 0.00 175.17 174.87 2k5p n GLY 57 N 5.10 0.78 3.66 2.66 0.00 0.15 -4.90 105.19 112.64 2k5p n GLY 57 Ca 0.22 -0.79 -0.09 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.53 0.04 -0.42 1.61 -1.08 -1.23 -5.06 116.67 108.99 2k5p s ASP 58 Ca 0.00 -0.98 0.03 0.00 -0.52 0.00 0.00 52.55 51.08 2k5p s ASP 58 Cb 0.00 0.67 0.12 0.00 -1.46 0.00 0.00 42.92 42.25 2k5p s ASP 58 CO 0.00 -1.29 0.17 0.00 0.52 0.00 0.00 175.17 174.56 2k5p s ALA 59 N -3.60 2.74 -0.77 3.66 0.00 -1.26 0.08 121.76 122.62 2k5p s ALA 59 Ca 0.20 -2.71 -0.21 0.00 0.00 0.00 0.00 51.96 49.24 2k5p s ALA 59 Cb -0.02 -1.98 0.10 0.00 0.00 0.00 0.00 23.12 21.21 2k5p s ALA 59 CO 0.11 -1.87 1.02 0.54 0.00 0.00 0.00 175.76 175.55 2k5p s VAL 60 N 0.46 4.51 -0.66 0.00 0.11 -1.14 0.10 120.40 123.78 2k5p s VAL 60 Ca 0.14 -0.89 -0.28 0.00 -2.93 0.00 0.00 61.98 58.02 2k5p s VAL 60 Cb -0.22 -4.72 0.03 0.00 -1.53 0.00 0.00 36.38 29.94 2k5p s VAL 60 CO -0.06 -1.47 1.24 -1.61 -3.33 0.00 0.00 175.10 169.88 2k5p s GLU 61 N 3.45 3.35 -0.45 1.54 2.02 -1.24 -4.06 118.70 123.30 2k5p s GLU 61 Ca 0.26 0.02 -0.21 0.00 0.02 0.00 0.00 54.97 55.06 2k5p s GLU 61 Cb -0.12 -4.10 0.03 0.00 0.10 0.00 0.00 34.13 30.04 2k5p s GLU 61 CO 0.02 -1.92 0.66 0.12 0.02 0.00 0.00 175.26 174.16 2k5p s PHE 62 N 5.37 3.05 0.51 1.61 5.36 -1.26 -3.77 117.98 128.84 2k5p s PHE 62 Ca 0.39 -0.09 -0.20 0.00 -0.96 0.00 0.00 56.93 56.08 2k5p s PHE 62 Cb -0.08 -3.40 -0.07 0.00 -0.34 0.00 0.00 43.02 39.13 2k5p s PHE 62 CO 0.20 -0.91 1.08 -0.51 -1.46 0.00 0.00 175.22 173.63 2k5p s LEU 63 N 2.86 3.82 -0.25 6.12 1.43 -1.25 -4.85 118.68 126.56 2k5p s LEU 63 Ca 0.23 2.04 0.14 0.00 -1.03 0.00 0.00 54.13 55.50 2k5p s LEU 63 Cb -0.14 -4.55 0.69 0.00 0.03 0.00 0.00 46.19 42.22 2k5p s LEU 63 CO 0.19 -0.95 1.64 0.00 0.23 0.00 0.00 176.35 177.46 2k5p n TYR 64 N -1.06 1.75 -1.72 0.29 0.18 -1.26 -4.95 117.16 110.39 2k5p n TYR 64 Ca 0.10 -0.96 -0.38 0.00 1.88 0.00 0.00 57.90 58.54 2k5p n TYR 64 Cb 0.52 -0.49 0.06 0.00 -0.38 0.00 0.00 39.34 39.04 2k5p n TYR 64 CO 0.00 0.00 0.00 1.97 -2.08 0.00 0.00 176.86 176.75 2k5p n PHE 65 N -0.07 1.96 -2.35 -3.48 -1.74 -1.26 -4.92 117.46 105.60 2k5p n PHE 65 Ca 0.30 0.43 -0.43 0.00 -0.56 0.00 0.00 57.45 57.18 2k5p n PHE 65 Cb 1.14 -2.29 -0.02 0.00 1.52 0.00 0.00 39.48 39.83 2k5p n PHE 65 CO 0.00 0.00 0.00 -1.64 -0.56 0.00 0.00 176.76 174.56 2k5p s MET 66 N -3.09 3.90 -0.09 3.97 -1.94 -1.26 -4.87 119.30 115.92 2k5p s MET 66 Ca 0.77 1.36 0.14 0.00 -1.71 0.00 0.00 55.69 56.25 2k5p s MET 66 Cb -0.40 -3.91 0.28 0.00 2.01 0.00 0.00 34.83 32.81 2k5p s MET 66 CO 0.45 -1.15 1.14 0.41 -0.01 0.00 0.00 175.02 175.85 2k5p n GLY 67 N 4.37 3.01 0.12 -0.03 0.00 -1.26 -4.83 105.19 106.57 2k5p n GLY 67 Ca 0.16 -0.84 -0.17 0.00 0.00 0.00 0.00 46.02 45.17 2k5p n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k5p n GLY 68 N -0.57 -0.71 3.73 -0.02 0.00 -1.26 -4.99 105.19 101.36 2k5p n GLY 68 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2k5p n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k5p n GLY 69 N 1.85 1.87 3.65 -0.02 0.00 -1.26 -4.94 105.19 106.34 2k5p n GLY 69 Ca -0.27 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 2k5p n GLY 69 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k5p s LYS 70 N 0.00 4.08 -0.31 1.61 2.20 -1.26 -5.00 119.74 121.06 2k5p s LYS 70 Ca 0.00 1.84 -0.06 0.00 -0.36 0.00 0.00 55.97 57.39 2k5p s LYS 70 Cb 0.00 -3.93 0.03 0.00 -1.51 0.00 0.00 37.83 32.42 2k5p s LYS 70 CO 0.00 -0.94 0.07 -1.17 -0.36 0.00 0.00 175.35 172.95 2k5p s LEU 71 N 4.20 3.97 -0.10 5.43 2.96 -1.26 -4.96 118.68 128.92 2k5p s LEU 71 Ca 0.66 -0.93 0.14 0.00 -0.22 0.00 0.00 54.13 53.78 2k5p s LEU 71 Cb -0.27 -1.84 0.21 0.00 0.50 0.00 0.00 46.19 44.79 2k5p s LEU 71 CO 0.24 -0.24 1.10 -1.84 -1.32 0.00 0.00 176.35 174.29 2k5p n GLU 72 N 4.81 1.38 -1.28 1.98 0.28 -1.26 -5.12 120.64 121.44 2k5p n GLU 72 Ca -0.14 -2.22 0.16 0.00 -0.16 0.00 0.00 57.16 54.80 2k5p n GLU 72 Cb 0.46 -1.31 -0.08 0.00 1.43 0.00 0.00 31.44 31.95 2k5p n GLU 72 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2k5p n HIS 73 N -1.13 -3.41 0.10 -1.84 8.25 -1.26 -5.03 115.22 110.90 2k5p n HIS 73 Ca 0.12 1.86 0.00 0.00 -0.26 0.00 0.00 57.72 59.44 2k5p n HIS 73 Cb 0.58 -3.10 0.00 0.00 1.12 0.00 0.00 29.99 28.59 2k5p n HIS 73 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k5p n HIS 74 N -4.08 -1.52 -3.53 4.41 -0.00 -1.26 -5.16 115.22 104.08 2k5p n HIS 74 Ca -0.07 0.27 -0.18 0.00 -0.00 0.00 0.00 57.72 57.74 2k5p n HIS 74 Cb 0.61 0.39 -0.06 0.00 -0.00 0.00 0.00 29.99 30.93 2k5p n HIS 74 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2k5p s HIS 75 N -2.00 -0.66 0.09 4.41 2.46 -1.26 -5.18 115.29 113.16 2k5p s HIS 75 Ca 0.00 1.15 0.04 0.00 0.47 0.00 0.00 55.06 56.72 2k5p s HIS 75 Cb 0.00 0.41 -0.04 0.00 -0.13 0.00 0.00 32.58 32.82 2k5p s HIS 75 CO 0.00 -0.60 0.05 -1.01 -2.47 0.00 0.00 174.74 170.71 2k5p s HIS 76 N -1.13 3.11 0.51 3.88 3.76 -1.26 -5.14 115.29 119.02 2k5p s HIS 76 Ca -0.10 0.03 0.05 0.00 -0.15 0.00 0.00 55.06 54.89 2k5p s HIS 76 Cb -0.00 -1.58 0.01 0.00 1.11 0.00 0.00 32.58 32.12 2k5p s HIS 76 CO 0.09 0.51 0.31 -3.38 -0.85 0.00 0.00 174.74 171.42 2k5p s HIS 77 N -1.38 1.90 0.00 1.40 -3.43 -1.26 -5.36 115.29 107.15 2k5p s HIS 77 Ca 0.28 -0.79 0.00 0.00 -0.80 0.00 0.00 55.06 53.75 2k5p s HIS 77 Cb -0.12 -1.90 0.00 0.00 -1.43 0.00 0.00 32.58 29.13 2k5p s HIS 77 CO 0.21 -0.25 0.02 -2.39 -2.00 0.00 0.00 174.74 170.33