#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 6.19 -0.01 3.17 -0.87 -1.26 -0.14 114.94 122.01 2k5p s ASN 2 Ca 0.00 0.20 0.08 0.00 -1.57 0.00 0.00 52.86 51.57 2k5p s ASN 2 Cb 0.00 -2.11 -0.02 0.00 -0.02 0.00 0.00 41.25 39.10 2k5p s ASN 2 CO 0.00 0.12 -0.25 -0.76 -2.57 0.00 0.00 177.10 173.64 2k5p s LEU 3 N 0.68 2.13 -1.22 0.60 2.01 0.84 -0.95 118.68 122.77 2k5p s LEU 3 Ca 0.09 -0.47 -0.11 0.00 0.01 0.00 0.00 54.13 53.64 2k5p s LEU 3 Cb -0.12 -1.35 0.19 0.00 0.01 0.00 0.00 46.19 44.92 2k5p s LEU 3 CO 0.01 0.31 1.53 0.41 1.01 0.00 0.00 176.35 179.62 2k5p n THR 4 N 2.30 4.37 -2.30 5.49 -1.04 0.26 -0.50 114.28 122.86 2k5p n THR 4 Ca -0.16 -4.77 -0.43 0.00 -2.04 0.00 0.00 64.05 56.65 2k5p n THR 4 Cb 0.51 -2.43 -0.02 0.00 -1.82 0.00 0.00 70.33 66.57 2k5p n THR 4 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2k5p s VAL 5 N 0.70 3.84 -1.87 12.58 1.01 0.13 -2.84 120.40 133.95 2k5p s VAL 5 Ca 0.40 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.24 2k5p s VAL 5 Cb 0.00 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2k5p s VAL 5 CO 0.00 -0.71 0.00 0.59 0.00 0.00 0.00 175.10 174.98 2k5p n ASN 6 N 9.04 -5.52 0.00 3.32 3.02 -0.37 -0.86 115.26 123.89 2k5p n ASN 6 Ca 0.17 0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.92 2k5p n ASN 6 Cb 0.48 -4.71 0.00 0.00 -0.61 0.00 0.00 39.78 34.94 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 -0.74 0.83 3.83 7.41 0.00 -1.13 -5.06 105.19 110.33 2k5p n GLY 7 Ca -0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.66 3.42 -0.12 1.61 3.01 -0.03 -5.02 119.74 121.94 2k5p s LYS 8 Ca 0.00 -0.19 -0.30 0.00 -1.01 0.00 0.00 55.97 54.48 2k5p s LYS 8 Cb 0.00 -3.14 -0.02 0.00 -1.01 0.00 0.00 37.83 33.66 2k5p s LYS 8 CO 0.00 0.73 1.27 -1.25 0.51 0.00 0.00 175.35 176.61 2k5p s PRO 9 N -0.89 4.27 0.10 -1.68 0.04 -1.26 0.19 135.00 135.77 2k5p s PRO 9 Ca 0.14 1.71 0.03 0.00 0.04 0.00 0.00 61.00 62.92 2k5p s PRO 9 Cb -0.12 -3.70 -0.04 0.00 0.04 0.00 0.00 34.50 30.69 2k5p s PRO 9 CO 0.03 -0.62 -0.09 0.45 0.04 0.00 0.00 177.00 176.81 2k5p s SER 10 N 1.87 1.39 -0.14 6.66 0.15 0.34 -4.93 113.70 119.04 2k5p s SER 10 Ca 0.56 -0.86 -0.03 0.00 0.70 0.00 0.00 55.95 56.33 2k5p s SER 10 Cb -0.24 0.03 0.05 0.00 -1.71 0.00 0.00 66.02 64.15 2k5p s SER 10 CO 0.18 -0.31 0.03 -0.89 1.20 0.00 0.00 173.24 173.45 2k5p s THR 11 N -2.73 0.36 -0.47 6.45 2.01 -1.26 -0.11 115.64 119.89 2k5p s THR 11 Ca 0.07 -0.23 -0.21 0.00 0.31 0.00 0.00 61.69 61.63 2k5p s THR 11 Cb -0.01 -0.76 0.03 0.00 0.01 0.00 0.00 72.50 71.77 2k5p s THR 11 CO -0.01 -0.04 0.68 0.68 -0.69 0.00 0.00 174.62 175.24 2k5p s VAL 12 N 1.95 4.78 0.25 3.82 -7.23 0.80 -4.93 120.40 119.83 2k5p s VAL 12 Ca 0.02 0.01 -0.24 0.00 -1.81 0.00 0.00 61.98 59.96 2k5p s VAL 12 Cb -0.15 -4.27 -0.09 0.00 0.56 0.00 0.00 36.38 32.43 2k5p s VAL 12 CO -0.07 -0.71 0.83 -0.62 -0.31 0.00 0.00 175.10 174.22 2k5p s ASP 13 N 2.25 7.27 0.00 4.85 2.15 -1.26 0.13 116.67 132.07 2k5p s ASP 13 Ca 0.22 1.65 0.00 0.00 0.43 0.00 0.00 52.55 54.86 2k5p s ASP 13 Cb -0.15 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 2k5p s ASP 13 CO 0.18 0.04 0.00 0.61 -0.17 0.00 0.00 175.17 175.83 2k5p n GLY 14 N 0.90 0.87 3.64 2.66 0.00 -1.26 -4.96 105.19 107.03 2k5p n GLY 14 Ca -0.01 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.00 -1.97 -0.26 4.61 0.00 -1.26 -5.04 121.76 115.84 2k5p s ALA 15 Ca 0.00 2.07 0.00 0.00 0.00 0.00 0.00 51.96 54.03 2k5p s ALA 15 Cb 0.00 -1.43 -0.16 0.00 0.00 0.00 0.00 23.12 21.53 2k5p s ALA 15 CO 0.00 -0.31 -0.24 0.39 0.00 0.00 0.00 175.76 175.60 2k5p n GLU 16 N 2.96 0.64 -3.24 0.00 1.02 -1.26 0.94 120.64 121.70 2k5p n GLU 16 Ca -0.15 0.16 0.03 0.00 -0.02 0.00 0.00 57.16 57.18 2k5p n GLU 16 Cb 0.56 -1.52 -0.02 0.00 -0.02 0.00 0.00 31.44 30.45 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 -6.61 -1.05 0.18 1.62 1.04 -1.26 -4.16 113.70 103.47 2k5p s SER 17 Ca -0.35 0.82 0.06 0.00 0.48 0.00 0.00 55.95 56.96 2k5p s SER 17 Cb 0.10 1.94 -0.05 0.00 0.10 0.00 0.00 66.02 68.11 2k5p s SER 17 CO 0.59 -0.20 -0.12 -0.76 0.98 0.00 0.00 173.24 173.73 2k5p s LEU 18 N 2.85 2.53 0.78 2.42 1.43 -0.85 -4.89 118.68 122.95 2k5p s LEU 18 Ca 0.10 -1.03 -0.11 0.00 -1.03 0.00 0.00 54.13 52.06 2k5p s LEU 18 Cb -0.13 -0.52 0.06 0.00 0.03 0.00 0.00 46.19 45.63 2k5p s LEU 18 CO -0.18 -0.25 1.08 0.54 0.23 0.00 0.00 176.35 177.77 2k5p s ASN 19 N -3.26 4.53 0.39 2.29 2.20 -1.26 0.43 114.94 120.26 2k5p s ASN 19 Ca 0.20 1.53 0.06 0.00 -0.94 0.00 0.00 52.86 53.72 2k5p s ASN 19 Cb 0.01 -2.29 0.81 0.00 -2.00 0.00 0.00 41.25 37.78 2k5p s ASN 19 CO 0.04 -1.98 2.03 0.58 -2.94 0.00 0.00 177.10 174.84 2k5p h VAL 20 N -1.09 1.09 0.37 3.54 2.07 -0.70 -1.23 116.25 120.30 2k5p h VAL 20 Ca -0.46 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 2k5p h VAL 20 Cb 1.25 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 2k5p h VAL 20 CO 0.56 0.12 -0.18 0.74 0.02 0.00 0.00 177.57 178.83 2k5p h THR 21 N 0.64 0.64 -0.24 2.57 2.02 -1.89 0.12 112.91 116.76 2k5p h THR 21 Ca 0.20 -0.03 -0.05 0.00 0.77 0.00 0.00 66.41 67.31 2k5p h THR 21 Cb 0.03 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2k5p h THR 21 CO -0.05 0.01 -0.05 -0.33 0.37 0.00 0.00 175.52 175.47 2k5p h GLU 22 N -0.52 0.37 -0.40 6.66 4.39 -1.85 -1.85 114.58 121.39 2k5p h GLU 22 Ca -0.05 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.57 2k5p h GLU 22 Cb 0.39 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2k5p h GLU 22 CO 0.08 0.44 0.25 1.25 -1.16 0.00 0.00 179.01 179.87 2k5p h LEU 23 N 0.36 0.47 -1.04 1.33 6.46 -0.79 0.18 115.31 122.28 2k5p h LEU 23 Ca 0.08 -0.04 0.02 0.00 -0.12 0.00 0.00 57.88 57.83 2k5p h LEU 23 Cb 0.32 -0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 40.08 2k5p h LEU 23 CO 0.01 0.36 0.65 -0.07 -0.62 0.00 0.00 178.44 178.78 2k5p h LEU 24 N 0.53 1.10 -0.87 2.25 3.38 -0.27 -0.08 115.31 121.35 2k5p h LEU 24 Ca 0.14 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 2k5p h LEU 24 Cb -0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2k5p h LEU 24 CO -0.03 0.77 -0.48 -1.28 0.09 0.00 0.00 178.44 177.52 2k5p h SER 25 N 1.29 0.22 -0.08 -0.43 0.87 -0.86 0.30 113.55 114.85 2k5p h SER 25 Ca 0.38 -0.10 -0.05 0.00 -1.23 0.00 0.00 61.79 60.79 2k5p h SER 25 Cb -0.07 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 2k5p h SER 25 CO -0.10 0.67 -0.14 0.00 -0.53 0.00 0.00 176.83 176.73 2k5p h ALA 26 N 1.34 0.13 0.00 6.23 0.00 0.09 -3.23 119.26 123.82 2k5p h ALA 26 Ca 0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2k5p h ALA 26 Cb 0.91 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2k5p h ALA 26 CO 0.07 0.02 -0.04 1.25 0.00 0.00 0.00 179.25 180.55 2k5p h LEU 27 N -0.22 0.00 -2.51 0.00 5.85 -1.05 -3.49 115.31 113.89 2k5p h LEU 27 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2k5p h LEU 27 Cb 0.71 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2k5p h LEU 27 CO 0.03 0.04 -0.23 0.29 -0.34 0.00 0.00 178.44 178.23 2k5p n LYS 28 N -3.11 -1.43 -3.72 1.25 5.02 0.99 -4.23 118.16 112.93 2k5p n LYS 28 Ca 0.03 1.50 -0.34 0.00 -2.02 0.00 0.00 58.31 57.49 2k5p n LYS 28 Cb 0.51 -4.50 -0.05 0.00 -0.02 0.00 0.00 35.03 30.97 2k5p n LYS 28 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2k5p s VAL 29 N -2.45 5.24 -0.01 -0.18 1.01 -0.88 -0.20 120.40 122.93 2k5p s VAL 29 Ca 0.12 0.15 -0.21 0.00 0.00 0.00 0.00 61.98 62.04 2k5p s VAL 29 Cb -0.03 -3.60 -0.12 0.00 0.00 0.00 0.00 36.38 32.63 2k5p s VAL 29 CO 0.54 0.27 0.88 0.00 0.00 0.00 0.00 175.10 176.79 2k5p h ALA 30 N 3.63 -0.67 -2.06 5.51 0.00 -1.43 -3.41 119.26 120.83 2k5p h ALA 30 Ca -0.49 -0.17 -0.73 0.00 0.00 0.00 0.00 54.91 53.52 2k5p h ALA 30 Cb 1.19 0.26 -0.22 0.00 0.00 0.00 0.00 17.79 19.02 2k5p h ALA 30 CO 0.68 -0.65 -0.02 -0.65 0.00 0.00 0.00 179.25 178.62 2k5p s GLN 31 N -3.96 3.08 0.03 0.00 -0.21 -1.26 -4.87 119.66 112.46 2k5p s GLN 31 Ca -0.11 -1.60 0.11 0.00 0.02 0.00 0.00 55.36 53.78 2k5p s GLN 31 Cb 0.01 -4.31 -0.21 0.00 1.00 0.00 0.00 33.01 29.50 2k5p s GLN 31 CO 0.35 -1.43 0.90 0.00 -2.12 0.00 0.00 175.29 172.99 2k5p h ALA 32 N 8.94 0.63 0.00 6.09 0.00 -1.98 -3.08 119.26 129.86 2k5p h ALA 32 Ca -0.25 -1.21 -0.07 0.00 0.00 0.00 0.00 54.91 53.38 2k5p h ALA 32 Cb 1.09 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2k5p h ALA 32 CO 1.05 1.40 -0.34 1.49 0.00 0.00 0.00 179.25 182.84 2k5p h GLU 33 N 0.00 0.00 -0.27 0.00 4.57 -1.98 -3.32 114.58 113.58 2k5p h GLU 33 Ca -0.18 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 2k5p h GLU 33 Cb 1.88 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.47 2k5p h GLU 33 CO 0.09 0.34 0.00 0.66 -1.18 0.00 0.00 179.01 178.93 2k5p n TYR 34 N -3.20 0.44 -2.35 0.92 4.02 -1.25 -4.94 117.16 110.80 2k5p n TYR 34 Ca 0.02 -0.56 -0.35 0.00 -0.01 0.00 0.00 57.90 57.00 2k5p n TYR 34 Cb 0.66 -0.07 -0.04 0.00 -0.02 0.00 0.00 39.34 39.87 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 -1.29 3.74 -0.81 -0.72 0.11 -1.16 -4.93 120.40 115.34 2k5p s VAL 35 Ca 0.22 -0.70 -0.25 0.00 -2.93 0.00 0.00 61.98 58.32 2k5p s VAL 35 Cb 0.14 -4.65 0.01 0.00 -1.53 0.00 0.00 36.38 30.34 2k5p s VAL 35 CO 0.12 -1.53 1.53 -0.89 -3.33 0.00 0.00 175.10 171.00 2k5p s THR 36 N 7.11 3.66 0.25 5.04 2.01 -1.26 -4.98 115.64 127.47 2k5p s THR 36 Ca 0.56 -0.05 0.12 0.00 0.31 0.00 0.00 61.69 62.63 2k5p s THR 36 Cb -0.02 -4.63 -0.05 0.00 0.01 0.00 0.00 72.50 67.80 2k5p s THR 36 CO -0.04 -1.56 -0.21 0.68 -0.69 0.00 0.00 174.62 172.79 2k5p s VAL 37 N 6.81 2.41 -0.03 3.82 -7.23 -1.26 -4.46 120.40 120.46 2k5p s VAL 37 Ca 0.49 -2.30 0.02 0.00 -1.81 0.00 0.00 61.98 58.38 2k5p s VAL 37 Cb -0.07 -2.24 0.01 0.00 0.56 0.00 0.00 36.38 34.64 2k5p s VAL 37 CO 0.07 -0.33 -0.07 -1.83 -0.31 0.00 0.00 175.10 172.63 2k5p s GLU 38 N -3.28 0.83 -0.63 4.82 -1.05 -1.17 -3.24 118.70 114.96 2k5p s GLU 38 Ca 0.27 -0.22 -0.28 0.00 -0.15 0.00 0.00 54.97 54.60 2k5p s GLU 38 Cb -0.06 -0.79 0.02 0.00 -0.44 0.00 0.00 34.13 32.86 2k5p s GLU 38 CO 0.13 0.05 1.33 -1.17 0.95 0.00 0.00 175.26 176.55 2k5p s LEU 39 N 0.38 3.32 -1.85 1.83 1.98 0.96 -1.93 118.68 123.38 2k5p s LEU 39 Ca -0.05 -0.02 0.00 0.00 -2.89 0.00 0.00 54.13 51.16 2k5p s LEU 39 Cb -0.10 -2.87 0.00 0.00 0.66 0.00 0.00 46.19 43.88 2k5p s LEU 39 CO 0.00 -1.74 0.00 0.59 -1.89 0.00 0.00 176.35 173.32 2k5p n ASN 40 N 9.39 -5.23 -0.14 3.68 5.03 0.14 -1.93 115.26 126.21 2k5p n ASN 40 Ca 0.08 0.28 0.00 0.00 0.87 0.00 0.00 54.58 55.81 2k5p n ASN 40 Cb 0.49 -4.52 0.00 0.00 -1.02 0.00 0.00 39.78 34.73 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 -0.63 0.96 2.90 7.41 0.00 -1.25 -5.06 105.19 109.53 2k5p n GLY 41 Ca -0.21 -0.17 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.23 0.37 0.33 1.61 2.12 -0.81 -5.10 118.70 115.99 2k5p s GLU 42 Ca 0.00 0.34 -0.29 0.00 0.36 0.00 0.00 54.97 55.38 2k5p s GLU 42 Cb 0.00 -0.43 -0.11 0.00 0.26 0.00 0.00 34.13 33.86 2k5p s GLU 42 CO 0.00 -0.81 1.46 0.54 -0.54 0.00 0.00 175.26 175.91 2k5p s VAL 43 N 2.53 2.29 0.32 3.70 0.11 -1.26 -0.03 120.40 128.07 2k5p s VAL 43 Ca 0.11 0.28 -0.08 0.00 -2.93 0.00 0.00 61.98 59.36 2k5p s VAL 43 Cb -0.14 -3.18 -0.06 0.00 -1.53 0.00 0.00 36.38 31.47 2k5p s VAL 43 CO -0.22 0.06 0.63 -0.76 -3.33 0.00 0.00 175.10 171.47 2k5p s LEU 44 N -1.47 4.00 0.64 2.54 2.01 -1.20 -4.88 118.68 120.33 2k5p s LEU 44 Ca 0.55 0.90 -0.11 0.00 0.01 0.00 0.00 54.13 55.48 2k5p s LEU 44 Cb -0.45 -3.73 -0.03 0.00 0.01 0.00 0.00 46.19 42.00 2k5p s LEU 44 CO 0.55 -0.24 1.04 -0.70 1.01 0.00 0.00 176.35 178.01 2k5p s GLU 45 N -3.51 3.41 0.25 1.70 2.12 -1.26 -4.93 118.70 116.49 2k5p s GLU 45 Ca 0.47 0.75 -0.02 0.00 0.36 0.00 0.00 54.97 56.53 2k5p s GLU 45 Cb -0.11 -2.06 0.54 0.00 0.26 0.00 0.00 34.13 32.77 2k5p s GLU 45 CO 0.28 -0.71 1.33 2.89 -0.54 0.00 0.00 175.26 178.52 2k5p n ARG 46 N -2.84 -0.07 -0.01 4.30 1.85 -1.26 -0.56 116.66 118.07 2k5p n ARG 46 Ca 0.06 1.30 0.08 0.00 -1.00 0.00 0.00 57.85 58.29 2k5p n ARG 46 Cb 0.54 -2.01 0.07 0.00 -1.05 0.00 0.00 32.46 30.01 2k5p n ARG 46 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 2k5p n GLU 47 N -5.30 1.19 0.27 2.89 0.28 -1.26 -4.41 120.64 114.29 2k5p n GLU 47 Ca 0.17 -1.44 0.18 0.00 -0.16 0.00 0.00 57.16 55.91 2k5p n GLU 47 Cb 0.56 -1.29 0.87 0.00 1.43 0.00 0.00 31.44 33.01 2k5p n GLU 47 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k5p h ALA 48 N 2.95 1.00 -0.89 -1.84 0.00 -1.19 -2.53 119.26 116.77 2k5p h ALA 48 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2k5p h ALA 48 Cb 0.64 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 2k5p h ALA 48 CO 0.00 0.00 0.58 0.74 0.00 0.00 0.00 179.25 180.57 2k5p h PHE 49 N 0.00 1.09 0.05 0.00 -1.00 -1.77 0.19 116.94 115.50 2k5p h PHE 49 Ca 0.00 0.03 -0.25 0.00 2.81 0.00 0.00 57.97 60.56 2k5p h PHE 49 Cb 0.22 -0.36 -0.02 0.00 3.61 0.00 0.00 35.95 39.40 2k5p h PHE 49 CO 0.00 0.63 -1.24 0.22 -1.61 0.00 0.00 178.31 176.31 2k5p h ASP 50 N 1.13 0.17 1.80 2.17 1.82 -1.79 0.13 116.42 121.85 2k5p h ASP 50 Ca 0.35 -0.20 0.00 0.00 -0.39 0.00 0.00 57.03 56.79 2k5p h ASP 50 Cb -0.01 -0.05 0.00 0.00 0.68 0.00 0.00 39.33 39.94 2k5p h ASP 50 CO -0.11 1.16 -0.08 0.00 -1.61 0.00 0.00 179.24 178.60 2k5p h ALA 51 N 0.81 0.96 -2.84 -0.78 0.00 -1.38 -3.44 119.26 112.59 2k5p h ALA 51 Ca -0.11 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.18 2k5p h ALA 51 Cb 1.89 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 19.54 2k5p h ALA 51 CO 0.15 0.00 -0.30 0.99 0.00 0.00 0.00 179.25 180.09 2k5p s THR 52 N -3.20 5.22 -0.50 0.00 2.01 0.66 -5.05 115.64 114.78 2k5p s THR 52 Ca 0.07 0.50 -0.21 0.00 0.31 0.00 0.00 61.69 62.37 2k5p s THR 52 Cb 0.07 -3.66 0.04 0.00 0.01 0.00 0.00 72.50 68.97 2k5p s THR 52 CO 0.66 0.22 0.70 -0.89 -0.69 0.00 0.00 174.62 174.63 2k5p s THR 53 N 1.67 4.75 -0.27 -0.82 2.01 -1.26 -3.24 115.64 118.48 2k5p s THR 53 Ca 0.14 -0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.72 2k5p s THR 53 Cb -0.15 -4.33 -0.01 0.00 0.01 0.00 0.00 72.50 68.02 2k5p s THR 53 CO 0.09 -0.81 1.37 -0.69 -0.69 0.00 0.00 174.62 173.88 2k5p s VAL 54 N 2.99 4.06 0.00 3.82 1.01 0.17 -4.88 120.40 127.57 2k5p s VAL 54 Ca 0.21 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.39 2k5p s VAL 54 Cb -0.16 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.18 2k5p s VAL 54 CO 0.16 -0.40 0.00 0.29 0.00 0.00 0.00 175.10 175.15 2k5p n LYS 55 N 7.31 2.11 -2.65 2.72 5.02 -1.26 -2.01 118.16 129.41 2k5p n LYS 55 Ca 0.15 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 56.03 2k5p n LYS 55 Cb 0.46 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.43 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 -0.69 7.39 0.00 4.39 -1.08 -1.26 -4.11 116.67 121.31 2k5p s ASP 56 Ca 0.00 1.87 0.00 0.00 -0.52 0.00 0.00 52.55 53.90 2k5p s ASP 56 Cb 0.00 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.87 2k5p s ASP 56 CO 0.00 -0.17 0.00 0.61 0.52 0.00 0.00 175.17 176.13 2k5p n GLY 57 N 2.38 0.78 3.43 2.66 0.00 -0.13 -4.98 105.19 109.32 2k5p n GLY 57 Ca 0.04 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.86 3.72 -1.14 1.61 -1.08 -1.26 -4.94 116.67 110.71 2k5p s ASP 58 Ca 0.00 -0.30 -0.08 0.00 -0.52 0.00 0.00 52.55 51.65 2k5p s ASP 58 Cb 0.00 -0.67 0.26 0.00 -1.46 0.00 0.00 42.92 41.05 2k5p s ASP 58 CO 0.00 0.33 1.45 0.00 0.52 0.00 0.00 175.17 177.46 2k5p n ALA 59 N 2.24 4.79 -2.68 3.66 0.00 -1.26 -0.57 120.51 126.68 2k5p n ALA 59 Ca -0.17 -4.61 -0.42 0.00 0.00 0.00 0.00 53.44 48.24 2k5p n ALA 59 Cb 0.52 -2.58 -0.03 0.00 0.00 0.00 0.00 19.45 17.36 2k5p n ALA 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2k5p s VAL 60 N -1.28 4.85 -0.59 0.00 -7.23 -1.19 -0.68 120.40 114.27 2k5p s VAL 60 Ca 0.34 1.82 -0.20 0.00 -1.81 0.00 0.00 61.98 62.13 2k5p s VAL 60 Cb 0.01 -4.22 0.08 0.00 0.56 0.00 0.00 36.38 32.81 2k5p s VAL 60 CO 0.02 0.05 0.79 -1.61 -0.31 0.00 0.00 175.10 174.03 2k5p s GLU 61 N 1.90 3.10 -0.50 4.82 2.02 -0.81 -1.24 118.70 127.99 2k5p s GLU 61 Ca 0.43 -1.02 -0.12 0.00 0.02 0.00 0.00 54.97 54.28 2k5p s GLU 61 Cb -0.18 -4.21 0.12 0.00 0.10 0.00 0.00 34.13 29.97 2k5p s GLU 61 CO 0.16 -1.56 0.41 0.12 0.02 0.00 0.00 175.26 174.41 2k5p s PHE 62 N 3.18 3.35 -0.04 1.61 2.19 -1.26 -3.06 117.98 123.96 2k5p s PHE 62 Ca 0.17 -1.63 0.05 0.00 0.33 0.00 0.00 56.93 55.84 2k5p s PHE 62 Cb -0.20 -3.63 -0.01 0.00 -1.31 0.00 0.00 43.02 37.87 2k5p s PHE 62 CO 0.09 -1.01 -0.18 -0.48 1.83 0.00 0.00 175.22 175.48 2k5p s LEU 63 N 1.45 1.95 -0.21 6.12 2.34 -1.26 -4.74 118.68 124.33 2k5p s LEU 63 Ca 0.05 -0.36 0.00 0.00 0.06 0.00 0.00 54.13 53.88 2k5p s LEU 63 Cb -0.28 -0.99 0.00 0.00 -0.56 0.00 0.00 46.19 44.37 2k5p s LEU 63 CO 0.01 0.17 0.00 -1.22 -1.06 0.00 0.00 176.35 174.25 2k5p n TYR 64 N 3.02 0.00 -4.25 3.48 4.01 -1.26 -4.86 117.16 117.30 2k5p n TYR 64 Ca -0.17 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.38 2k5p n TYR 64 Cb 0.53 -1.27 -0.13 0.00 -0.31 0.00 0.00 39.34 38.17 2k5p n TYR 64 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2k5p s PHE 65 N -1.62 1.16 0.01 -0.72 0.08 -1.26 -5.12 117.98 110.51 2k5p s PHE 65 Ca 0.00 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 56.64 2k5p s PHE 65 Cb 0.00 -0.67 0.00 0.00 -0.57 0.00 0.00 43.02 41.78 2k5p s PHE 65 CO 0.00 0.03 0.04 0.00 -0.10 0.00 0.00 175.22 175.20 2k5p n MET 66 N 1.66 0.04 0.00 0.44 0.00 -1.26 -5.07 117.12 112.93 2k5p n MET 66 Ca -0.19 -0.09 0.00 0.00 0.00 0.00 0.00 57.70 57.42 2k5p n MET 66 Cb 0.55 0.11 0.00 0.00 0.00 0.00 0.00 33.22 33.88 2k5p n MET 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2k5p n GLY 67 N -0.03 -1.99 2.11 3.17 0.00 -1.25 -1.12 105.19 106.07 2k5p n GLY 67 Ca -0.00 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.60 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 -1.35 2.19 3.68 -0.02 0.00 0.72 -4.65 105.19 105.77 2k5p n GLY 68 Ca 0.00 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 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 0.00 -0.50 3.50 -0.02 0.00 -1.25 -4.87 105.19 102.04 2k5p n GLY 69 Ca 0.00 0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2k5p n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5p s LYS 70 N -6.29 1.92 0.00 1.61 1.02 -1.26 -5.12 119.74 111.62 2k5p s LYS 70 Ca 0.52 -1.10 0.00 0.00 0.02 0.00 0.00 55.97 55.41 2k5p s LYS 70 Cb -0.24 -2.17 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 2k5p s LYS 70 CO 0.76 0.50 0.00 1.47 -0.92 0.00 0.00 175.35 177.17 2k5p n LEU 71 N 0.99 0.00 -4.65 3.17 -0.00 -1.26 -5.13 117.00 110.13 2k5p n LEU 71 Ca -0.15 0.00 -0.46 0.00 -0.00 0.00 0.00 56.01 55.39 2k5p n LEU 71 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.91 2k5p n LEU 71 CO 0.29 0.00 0.98 -0.62 -0.00 0.00 0.00 177.39 178.03 2k5p n GLU 72 N 0.00 1.83 -1.71 1.47 4.71 -1.26 -4.89 120.64 120.79 2k5p n GLU 72 Ca 0.00 0.65 -0.43 0.00 -0.01 0.00 0.00 57.16 57.37 2k5p n GLU 72 Cb 0.00 -2.30 -0.02 0.00 -1.01 0.00 0.00 31.44 28.11 2k5p n GLU 72 CO 0.00 0.00 0.00 -2.39 0.09 0.00 0.00 177.13 174.83 2k5p n HIS 73 N 2.10 2.50 -1.55 -0.32 1.44 -1.26 -4.76 115.22 113.37 2k5p n HIS 73 Ca 0.13 0.35 -0.23 0.00 -2.01 0.00 0.00 57.72 55.96 2k5p n HIS 73 Cb 0.29 -2.53 -0.08 0.00 0.12 0.00 0.00 29.99 27.79 2k5p n HIS 73 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2k5p n HIS 74 N 1.99 1.06 -0.74 -1.40 8.25 -1.26 -4.92 115.22 118.21 2k5p n HIS 74 Ca 0.10 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 2k5p n HIS 74 Cb 0.34 -2.36 0.00 0.00 1.12 0.00 0.00 29.99 29.09 2k5p n HIS 74 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k5p n HIS 75 N 15.79 -3.23 -1.76 4.41 1.44 -1.26 -4.99 115.22 125.63 2k5p n HIS 75 Ca 0.48 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.77 2k5p n HIS 75 Cb 0.40 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.50 2k5p n HIS 75 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k5p s HIS 76 N -0.87 2.76 -0.04 -1.40 3.76 -1.26 -5.00 115.29 113.23 2k5p s HIS 76 Ca 0.00 0.72 -0.06 0.00 -0.15 0.00 0.00 55.06 55.57 2k5p s HIS 76 Cb 0.00 -4.09 0.01 0.00 1.11 0.00 0.00 32.58 29.61 2k5p s HIS 76 CO 0.00 -3.72 0.15 -1.58 -0.85 0.00 0.00 174.74 168.74 2k5p s HIS 77 N 0.13 -0.10 -2.00 1.40 2.46 -1.26 -5.27 115.29 110.65 2k5p s HIS 77 Ca 0.65 0.23 0.26 0.00 0.47 0.00 0.00 55.06 56.67 2k5p s HIS 77 Cb -0.48 0.02 1.56 0.00 -0.13 0.00 0.00 32.58 33.55 2k5p s HIS 77 CO 0.46 -0.15 1.91 -2.39 -2.47 0.00 0.00 174.74 172.11