#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 6.93 0.35 3.17 0.01 -1.26 -1.38 114.94 122.76 2k5p s ASN 2 Ca 0.00 1.13 0.04 0.00 -0.71 0.00 0.00 52.86 53.32 2k5p s ASN 2 Cb 0.00 -2.41 -0.03 0.00 0.41 0.00 0.00 41.25 39.21 2k5p s ASN 2 CO 0.00 -0.22 0.15 -0.76 -1.51 0.00 0.00 177.10 174.76 2k5p s LEU 3 N 1.35 1.85 -0.03 0.60 1.43 -0.89 0.66 118.68 123.64 2k5p s LEU 3 Ca 0.36 -1.61 -0.01 0.00 -1.03 0.00 0.00 54.13 51.84 2k5p s LEU 3 Cb -0.17 0.07 0.03 0.00 0.03 0.00 0.00 46.19 46.14 2k5p s LEU 3 CO 0.15 -0.90 0.06 -0.89 0.23 0.00 0.00 176.35 175.00 2k5p s THR 4 N -3.41 -0.04 -0.17 5.49 2.01 -0.55 -0.69 115.64 118.28 2k5p s THR 4 Ca 0.31 0.16 0.01 0.00 0.31 0.00 0.00 61.69 62.49 2k5p s THR 4 Cb 0.04 -0.11 0.02 0.00 0.01 0.00 0.00 72.50 72.45 2k5p s THR 4 CO 0.17 0.07 -0.20 0.54 -0.69 0.00 0.00 174.62 174.51 2k5p s VAL 5 N 0.87 2.00 -0.69 3.82 0.11 -0.32 -0.55 120.40 125.63 2k5p s VAL 5 Ca -0.07 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.07 2k5p s VAL 5 Cb -0.10 -1.81 0.00 0.00 -1.53 0.00 0.00 36.38 32.95 2k5p s VAL 5 CO -0.03 0.53 0.00 0.59 -3.33 0.00 0.00 175.10 172.86 2k5p n ASN 6 N 4.52 -5.00 0.00 3.54 5.03 -1.24 -0.15 115.26 121.95 2k5p n ASN 6 Ca -0.20 0.16 0.00 0.00 0.87 0.00 0.00 54.58 55.41 2k5p n ASN 6 Cb 0.50 -3.07 0.00 0.00 -1.02 0.00 0.00 39.78 36.19 2k5p n ASN 6 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2k5p n GLY 7 N -0.58 0.78 3.49 7.41 0.00 -1.26 -4.99 105.19 110.03 2k5p n GLY 7 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.64 3.13 0.03 1.61 1.02 0.78 -5.04 119.74 120.63 2k5p s LYS 8 Ca 0.00 -0.78 -0.33 0.00 0.02 0.00 0.00 55.97 54.88 2k5p s LYS 8 Cb 0.00 -3.95 -0.12 0.00 -0.52 0.00 0.00 37.83 33.25 2k5p s LYS 8 CO 0.00 -0.78 1.81 -2.30 -0.92 0.00 0.00 175.35 173.17 2k5p n PRO 9 N 5.45 2.40 -3.63 -1.68 -0.02 -1.26 -1.18 135.00 135.08 2k5p n PRO 9 Ca -0.09 0.88 -0.29 0.00 -2.02 0.00 0.00 63.50 61.98 2k5p n PRO 9 Cb 0.48 -2.73 -0.15 0.00 -0.02 0.00 0.00 33.50 31.07 2k5p n PRO 9 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2k5p s SER 10 N 3.09 3.66 -0.86 2.55 0.01 0.14 -4.91 113.70 117.39 2k5p s SER 10 Ca 0.87 -1.38 -0.25 0.00 1.31 0.00 0.00 55.95 56.49 2k5p s SER 10 Cb -0.61 -0.56 0.04 0.00 0.21 0.00 0.00 66.02 65.10 2k5p s SER 10 CO 0.44 -0.42 1.33 -0.89 0.41 0.00 0.00 173.24 174.11 2k5p s THR 11 N 1.90 3.86 -1.29 1.44 2.01 -1.26 -2.11 115.64 120.19 2k5p s THR 11 Ca 0.09 -0.17 -0.17 0.00 0.31 0.00 0.00 61.69 61.75 2k5p s THR 11 Cb -0.17 -4.96 0.09 0.00 0.01 0.00 0.00 72.50 67.47 2k5p s THR 11 CO -0.30 -1.86 1.70 1.33 -0.69 0.00 0.00 174.62 174.79 2k5p n VAL 12 N 6.54 4.00 -2.04 3.82 0.24 -0.48 -4.92 118.33 125.49 2k5p n VAL 12 Ca 0.16 -4.20 -0.28 0.00 -2.04 0.00 0.00 64.34 57.98 2k5p n VAL 12 Cb 0.50 -2.38 0.09 0.00 -1.47 0.00 0.00 33.84 30.57 2k5p n VAL 12 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2k5p s ASP 13 N 3.89 4.54 -0.45 -1.34 -1.08 -1.24 0.27 116.67 121.25 2k5p s ASP 13 Ca 0.51 0.58 0.00 0.00 -0.52 0.00 0.00 52.55 53.13 2k5p s ASP 13 Cb 0.03 -1.11 0.00 0.00 -1.46 0.00 0.00 42.92 40.38 2k5p s ASP 13 CO 0.06 -1.83 0.00 0.61 0.52 0.00 0.00 175.17 174.53 2k5p n GLY 14 N -3.17 0.44 3.05 2.66 0.00 -1.26 -4.65 105.19 102.26 2k5p n GLY 14 Ca 0.09 -0.76 -0.13 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 -2.21 -0.61 -0.01 4.61 0.00 -1.26 -4.93 121.76 117.35 2k5p s ALA 15 Ca 0.00 1.01 -0.01 0.00 0.00 0.00 0.00 51.96 52.96 2k5p s ALA 15 Cb 0.00 -0.93 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 2k5p s ALA 15 CO 0.00 -0.51 0.29 0.93 0.00 0.00 0.00 175.76 176.47 2k5p h GLU 16 N 7.93 -0.05 -1.64 0.00 4.39 -1.96 0.02 114.58 123.28 2k5p h GLU 16 Ca -0.23 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.56 2k5p h GLU 16 Cb 1.13 0.01 -0.26 0.00 -0.10 0.00 0.00 28.75 29.53 2k5p h GLU 16 CO 0.21 -0.03 0.34 -1.54 -1.16 0.00 0.00 179.01 176.82 2k5p s SER 17 N -3.03 -0.57 0.15 1.42 1.04 -1.26 -4.59 113.70 106.85 2k5p s SER 17 Ca -0.01 0.95 -0.12 0.00 0.48 0.00 0.00 55.95 57.26 2k5p s SER 17 Cb 0.00 1.16 0.01 0.00 0.10 0.00 0.00 66.02 67.28 2k5p s SER 17 CO 0.02 -0.15 0.33 -1.48 0.98 0.00 0.00 173.24 172.93 2k5p s LEU 18 N 1.06 0.80 0.84 2.42 0.05 -0.82 -4.96 118.68 118.07 2k5p s LEU 18 Ca -0.06 -0.65 -0.11 0.00 0.05 0.00 0.00 54.13 53.36 2k5p s LEU 18 Cb -0.04 1.45 0.10 0.00 -2.05 0.00 0.00 46.19 45.64 2k5p s LEU 18 CO -0.13 -0.88 1.13 0.20 -0.55 0.00 0.00 176.35 176.13 2k5p s ASN 19 N -2.90 3.65 0.21 1.48 -0.87 -1.26 0.65 114.94 115.90 2k5p s ASN 19 Ca 0.10 2.08 -0.09 0.00 -1.57 0.00 0.00 52.86 53.38 2k5p s ASN 19 Cb 0.03 -2.55 0.23 0.00 -0.02 0.00 0.00 41.25 38.93 2k5p s ASN 19 CO -0.05 -2.61 1.82 0.58 -2.57 0.00 0.00 177.10 174.27 2k5p h VAL 20 N -1.39 1.01 -0.43 1.60 2.07 -0.27 0.81 116.25 119.65 2k5p h VAL 20 Ca -0.44 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2k5p h VAL 20 Cb 1.26 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 2k5p h VAL 20 CO 0.46 0.14 0.28 0.74 0.02 0.00 0.00 177.57 179.20 2k5p h THR 21 N 0.74 1.12 -0.71 2.57 2.02 -1.74 -0.27 112.91 116.65 2k5p h THR 21 Ca 0.30 -0.24 0.01 0.00 0.77 0.00 0.00 66.41 67.25 2k5p h THR 21 Cb 0.14 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.02 2k5p h THR 21 CO -0.16 0.12 0.47 -0.08 0.37 0.00 0.00 175.52 176.24 2k5p h GLU 22 N 0.58 0.92 -0.52 6.66 4.22 -1.70 0.89 114.58 125.62 2k5p h GLU 22 Ca 0.16 -0.06 -0.01 0.00 0.08 0.00 0.00 59.36 59.53 2k5p h GLU 22 Cb -0.04 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 28.98 2k5p h GLU 22 CO -0.03 0.61 0.27 1.25 -2.18 0.00 0.00 179.01 178.92 2k5p h LEU 23 N 0.94 0.66 -1.53 1.64 5.85 -0.28 0.90 115.31 123.48 2k5p h LEU 23 Ca 0.27 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.92 2k5p h LEU 23 Cb -0.07 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.76 2k5p h LEU 23 CO -0.06 0.58 0.36 -0.07 -0.34 0.00 0.00 178.44 178.91 2k5p h LEU 24 N 0.69 0.52 -0.34 2.25 3.38 0.04 -2.08 115.31 119.77 2k5p h LEU 24 Ca 0.18 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 2k5p h LEU 24 Cb 0.08 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2k5p h LEU 24 CO -0.03 0.35 -0.15 -1.28 0.09 0.00 0.00 178.44 177.43 2k5p h SER 25 N 0.60 0.72 -0.52 -0.43 0.87 -0.05 0.18 113.55 114.93 2k5p h SER 25 Ca 0.22 -0.40 0.07 0.00 -1.23 0.00 0.00 61.79 60.45 2k5p h SER 25 Cb 0.14 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 61.84 2k5p h SER 25 CO -0.06 0.96 0.20 0.00 -0.53 0.00 0.00 176.83 177.40 2k5p h ALA 26 N 0.79 0.65 -0.01 6.23 0.00 -0.15 -1.94 119.26 124.83 2k5p h ALA 26 Ca 0.08 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2k5p h ALA 26 Cb 0.68 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2k5p h ALA 26 CO 0.05 -0.19 -0.49 1.28 0.00 0.00 0.00 179.25 179.90 2k5p n LEU 27 N -4.98 1.14 -2.79 0.00 7.99 -1.05 -5.03 117.00 112.27 2k5p n LEU 27 Ca 0.06 -0.36 -0.01 0.00 -0.01 0.00 0.00 56.01 55.68 2k5p n LEU 27 Cb 0.20 -0.10 0.00 0.00 -0.11 0.00 0.00 43.42 43.41 2k5p n LEU 27 CO 0.25 0.23 -0.45 1.17 -1.51 0.00 0.00 177.39 177.08 2k5p n LYS 28 N -0.83 -3.05 -1.70 3.23 4.81 0.45 -5.01 118.16 116.06 2k5p n LYS 28 Ca 0.09 2.51 -0.31 0.00 -0.87 0.00 0.00 58.31 59.73 2k5p n LYS 28 Cb 0.37 -4.90 0.04 0.00 0.02 0.00 0.00 35.03 30.57 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 -1.65 4.00 -0.08 3.15 0.11 -0.03 -5.00 120.40 120.90 2k5p s VAL 29 Ca 0.03 0.65 -0.27 0.00 -2.93 0.00 0.00 61.98 59.46 2k5p s VAL 29 Cb -0.01 -3.50 -0.24 0.00 -1.53 0.00 0.00 36.38 31.11 2k5p s VAL 29 CO 0.70 -0.85 0.99 0.00 -3.33 0.00 0.00 175.10 172.61 2k5p h ALA 30 N -0.66 0.01 -4.30 1.54 0.00 -1.95 -3.47 119.26 110.44 2k5p h ALA 30 Ca -0.45 -0.42 -0.62 0.00 0.00 0.00 0.00 54.91 53.42 2k5p h ALA 30 Cb 1.22 0.01 -0.28 0.00 0.00 0.00 0.00 17.79 18.74 2k5p h ALA 30 CO 0.60 -0.04 -0.86 -0.65 0.00 0.00 0.00 179.25 178.30 2k5p s GLN 31 N -3.07 1.65 -0.12 0.00 -0.21 -1.26 -5.05 119.66 111.60 2k5p s GLN 31 Ca -0.17 -0.89 0.01 0.00 0.02 0.00 0.00 55.36 54.33 2k5p s GLN 31 Cb -0.00 -1.69 -0.08 0.00 1.00 0.00 0.00 33.01 32.24 2k5p s GLN 31 CO 0.70 0.45 -0.11 0.00 -2.12 0.00 0.00 175.29 174.21 2k5p n ALA 32 N 2.18 1.75 0.06 6.09 0.00 -1.26 -3.86 120.51 125.47 2k5p n ALA 32 Ca -0.16 -0.52 -0.08 0.00 0.00 0.00 0.00 53.44 52.68 2k5p n ALA 32 Cb 0.53 0.22 -0.12 0.00 0.00 0.00 0.00 19.45 20.08 2k5p n ALA 32 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2k5p h GLU 33 N -0.01 0.02 -0.00 0.00 9.09 -1.96 -3.31 114.58 118.40 2k5p h GLU 33 Ca -0.27 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.10 2k5p h GLU 33 Cb 1.42 0.01 0.00 0.00 -1.65 0.00 0.00 28.75 28.53 2k5p h GLU 33 CO -0.04 0.99 -0.40 0.66 0.05 0.00 0.00 179.01 180.26 2k5p n TYR 34 N -3.35 0.00 -1.55 2.06 4.01 -1.26 -4.88 117.16 112.19 2k5p n TYR 34 Ca -0.02 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.49 2k5p n TYR 34 Cb 0.95 -0.16 -0.06 0.00 -0.31 0.00 0.00 39.34 39.76 2k5p n TYR 34 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 2k5p n VAL 35 N -0.98 -0.04 -2.73 -0.72 3.14 -1.25 -4.87 118.33 110.88 2k5p n VAL 35 Ca 0.09 -0.61 -0.42 0.00 -2.96 0.00 0.00 64.34 60.44 2k5p n VAL 35 Cb 0.35 -2.21 -0.03 0.00 -1.06 0.00 0.00 33.84 30.89 2k5p n VAL 35 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2k5p s THR 36 N 13.17 4.25 0.01 1.55 2.01 -1.26 -4.99 115.64 130.39 2k5p s THR 36 Ca 0.98 -0.90 0.06 0.00 0.31 0.00 0.00 61.69 62.14 2k5p s THR 36 Cb -0.20 -4.90 -0.02 0.00 0.01 0.00 0.00 72.50 67.39 2k5p s THR 36 CO 0.18 -1.71 -0.20 0.68 -0.69 0.00 0.00 174.62 172.88 2k5p s VAL 37 N 4.09 1.57 -0.17 3.82 -7.23 -1.26 -3.27 120.40 117.95 2k5p s VAL 37 Ca 0.37 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.57 2k5p s VAL 37 Cb -0.05 -1.33 0.01 0.00 0.56 0.00 0.00 36.38 35.57 2k5p s VAL 37 CO -0.05 0.34 -0.18 -1.83 -0.31 0.00 0.00 175.10 173.07 2k5p s GLU 38 N -0.74 3.09 -0.55 4.82 -1.05 -0.73 -3.69 118.70 119.85 2k5p s GLU 38 Ca 0.07 -0.79 -0.28 0.00 -0.15 0.00 0.00 54.97 53.82 2k5p s GLU 38 Cb -0.08 -2.61 0.03 0.00 -0.44 0.00 0.00 34.13 31.03 2k5p s GLU 38 CO 0.00 -0.12 1.13 -1.17 0.95 0.00 0.00 175.26 176.05 2k5p s LEU 39 N 1.12 3.62 -1.12 1.83 1.98 0.97 -1.59 118.68 125.48 2k5p s LEU 39 Ca 0.00 0.12 -0.06 0.00 -2.89 0.00 0.00 54.13 51.31 2k5p s LEU 39 Cb -0.14 -3.21 0.01 0.00 0.66 0.00 0.00 46.19 43.51 2k5p s LEU 39 CO -0.07 -1.37 0.79 0.59 -1.89 0.00 0.00 176.35 174.41 2k5p n ASN 40 N 8.09 -5.39 -0.49 3.68 5.03 0.51 -2.79 115.26 123.91 2k5p n ASN 40 Ca 0.08 -0.36 -0.04 0.00 0.87 0.00 0.00 54.58 55.13 2k5p n ASN 40 Cb 0.49 -4.07 -0.00 0.00 -1.02 0.00 0.00 39.78 35.18 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 -1.59 0.21 3.00 7.41 0.00 -1.23 -5.04 105.19 107.93 2k5p n GLY 41 Ca -0.02 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.17 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 -4.16 0.25 0.41 1.61 2.12 -1.12 -5.05 118.70 112.76 2k5p s GLU 42 Ca 0.00 0.67 -0.23 0.00 0.36 0.00 0.00 54.97 55.77 2k5p s GLU 42 Cb 0.00 -0.26 -0.10 0.00 0.26 0.00 0.00 34.13 34.03 2k5p s GLU 42 CO 0.00 -0.43 1.00 0.54 -0.54 0.00 0.00 175.26 175.83 2k5p s VAL 43 N 2.48 4.00 0.22 3.70 0.11 -1.26 -0.02 120.40 129.63 2k5p s VAL 43 Ca 0.05 1.43 0.06 0.00 -2.93 0.00 0.00 61.98 60.59 2k5p s VAL 43 Cb -0.14 -3.68 -0.04 0.00 -1.53 0.00 0.00 36.38 30.99 2k5p s VAL 43 CO -0.12 -0.10 0.15 -0.76 -3.33 0.00 0.00 175.10 170.95 2k5p s LEU 44 N -2.82 3.76 0.67 2.54 2.01 -1.24 -4.91 118.68 118.68 2k5p s LEU 44 Ca 0.59 -0.23 -0.11 0.00 0.01 0.00 0.00 54.13 54.39 2k5p s LEU 44 Cb -0.17 -2.32 -0.01 0.00 0.01 0.00 0.00 46.19 43.70 2k5p s LEU 44 CO 0.22 0.01 1.05 -0.70 1.01 0.00 0.00 176.35 177.94 2k5p s GLU 45 N -3.51 3.16 0.20 1.70 2.12 -1.26 -4.92 118.70 116.19 2k5p s GLU 45 Ca 0.32 0.91 -0.13 0.00 0.36 0.00 0.00 54.97 56.43 2k5p s GLU 45 Cb -0.09 -2.02 0.22 0.00 0.26 0.00 0.00 34.13 32.50 2k5p s GLU 45 CO 0.24 -0.92 1.65 0.00 -0.54 0.00 0.00 175.26 175.69 2k5p h ARG 46 N -0.51 0.05 0.00 4.30 -0.00 -1.96 -0.03 114.38 116.23 2k5p h ARG 46 Ca -0.44 -0.00 -0.07 0.00 -0.50 0.00 0.00 59.98 58.97 2k5p h ARG 46 Cb 1.20 -0.01 -0.01 0.00 0.00 0.00 0.00 29.97 31.15 2k5p h ARG 46 CO 0.58 0.03 -0.38 1.05 0.00 0.00 0.00 179.97 181.25 2k5p h GLU 47 N 0.05 0.00 -0.02 0.04 9.09 -1.96 -3.27 114.58 118.52 2k5p h GLU 47 Ca 0.28 0.00 0.01 0.00 0.05 0.00 0.00 59.36 59.69 2k5p h GLU 47 Cb 0.43 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.53 2k5p h GLU 47 CO -0.53 0.30 0.08 0.00 0.05 0.00 0.00 179.01 178.92 2k5p h ALA 48 N 1.69 1.20 -0.05 1.06 0.00 -1.36 -1.38 119.26 120.41 2k5p h ALA 48 Ca -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2k5p h ALA 48 Cb 1.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2k5p h ALA 48 CO 0.04 -0.09 -0.02 0.74 0.00 0.00 0.00 179.25 179.92 2k5p h PHE 49 N 0.00 0.07 0.00 0.00 0.04 -1.59 0.58 116.94 116.03 2k5p h PHE 49 Ca 0.01 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 2k5p h PHE 49 Cb 0.17 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 2k5p h PHE 49 CO 0.00 0.09 -0.72 -0.44 -0.60 0.00 0.00 178.31 176.64 2k5p h ASP 50 N 0.07 0.00 -0.09 2.17 3.32 -1.51 -0.24 116.42 120.13 2k5p h ASP 50 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2k5p h ASP 50 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2k5p h ASP 50 CO 0.00 0.15 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 2k5p n ALA 51 N -2.20 2.54 -3.80 3.45 0.00 -0.27 -4.81 120.51 115.43 2k5p n ALA 51 Ca -0.00 -0.52 -0.34 0.00 0.00 0.00 0.00 53.44 52.58 2k5p n ALA 51 Cb 0.61 -1.10 -0.15 0.00 0.00 0.00 0.00 19.45 18.82 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 -1.89 2.72 -0.45 0.00 2.01 0.03 -5.05 115.64 113.02 2k5p s THR 52 Ca 0.35 -0.98 -0.22 0.00 0.31 0.00 0.00 61.69 61.15 2k5p s THR 52 Cb 0.20 -2.33 0.03 0.00 0.01 0.00 0.00 72.50 70.40 2k5p s THR 52 CO 0.30 0.28 0.75 -0.89 -0.69 0.00 0.00 174.62 174.37 2k5p s THR 53 N 1.32 4.69 0.20 -0.82 2.01 -1.26 -1.82 115.64 119.96 2k5p s THR 53 Ca 0.01 0.32 -0.30 0.00 0.31 0.00 0.00 61.69 62.04 2k5p s THR 53 Cb -0.16 -4.30 -0.08 0.00 0.01 0.00 0.00 72.50 67.98 2k5p s THR 53 CO -0.06 -0.70 1.03 -0.69 -0.69 0.00 0.00 174.62 173.51 2k5p s VAL 54 N 3.17 3.98 0.33 3.82 1.01 0.21 -4.89 120.40 128.02 2k5p s VAL 54 Ca 0.28 1.81 0.04 0.00 0.00 0.00 0.00 61.98 64.10 2k5p s VAL 54 Cb -0.13 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 2k5p s VAL 54 CO 0.21 0.35 0.18 -1.59 0.00 0.00 0.00 175.10 174.26 2k5p s LYS 55 N -0.68 1.69 -0.36 2.72 -2.85 -1.26 -1.95 119.74 117.04 2k5p s LYS 55 Ca 0.46 -1.98 -0.28 0.00 -1.00 0.00 0.00 55.97 53.17 2k5p s LYS 55 Cb -0.28 -0.10 -0.07 0.00 -2.06 0.00 0.00 37.83 35.33 2k5p s LYS 55 CO 0.34 -0.50 2.32 -3.47 0.10 0.00 0.00 175.35 174.14 2k5p n ASP 56 N -1.12 2.69 0.00 0.03 2.03 -1.26 -2.13 116.55 116.78 2k5p n ASP 56 Ca 0.01 -0.08 0.00 0.00 0.52 0.00 0.00 54.79 55.24 2k5p n ASP 56 Cb 0.64 -1.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.51 2k5p n ASP 56 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k5p n GLY 57 N 5.96 1.31 3.87 0.27 0.00 0.21 -4.90 105.19 111.91 2k5p n GLY 57 Ca 0.35 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.06 2k5p n GLY 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k5p s ASP 58 N -1.68 6.57 -0.28 1.61 1.01 -0.91 -4.87 116.67 118.13 2k5p s ASP 58 Ca 0.00 1.11 0.03 0.00 0.71 0.00 0.00 52.55 54.40 2k5p s ASP 58 Cb 0.00 -2.31 0.07 0.00 1.01 0.00 0.00 42.92 41.69 2k5p s ASP 58 CO 0.00 -0.32 -0.07 0.00 0.21 0.00 0.00 175.17 174.99 2k5p s ALA 59 N -2.23 2.55 -0.37 5.23 0.00 -1.26 -1.48 121.76 124.21 2k5p s ALA 59 Ca 0.51 -1.89 -0.11 0.00 0.00 0.00 0.00 51.96 50.47 2k5p s ALA 59 Cb -0.10 -1.66 0.02 0.00 0.00 0.00 0.00 23.12 21.38 2k5p s ALA 59 CO 0.28 -1.31 0.20 0.54 0.00 0.00 0.00 175.76 175.47 2k5p s VAL 60 N 1.10 4.60 -0.39 0.00 0.11 0.29 -0.36 120.40 125.75 2k5p s VAL 60 Ca -0.04 -0.80 -0.15 0.00 -2.93 0.00 0.00 61.98 58.06 2k5p s VAL 60 Cb -0.20 -3.54 0.01 0.00 -1.53 0.00 0.00 36.38 31.12 2k5p s VAL 60 CO -0.06 -0.20 0.33 -1.61 -3.33 0.00 0.00 175.10 170.22 2k5p s GLU 61 N 1.56 3.17 0.01 1.54 2.02 -0.62 -3.71 118.70 122.68 2k5p s GLU 61 Ca 0.02 -0.82 -0.29 0.00 0.02 0.00 0.00 54.97 53.91 2k5p s GLU 61 Cb -0.19 -3.92 -0.04 0.00 0.10 0.00 0.00 34.13 30.08 2k5p s GLU 61 CO 0.07 -0.69 0.94 -0.06 0.02 0.00 0.00 175.26 175.54 2k5p s PHE 62 N 1.84 3.68 0.18 1.61 0.40 -1.26 -1.78 117.98 122.65 2k5p s PHE 62 Ca 0.08 1.67 -0.03 0.00 -0.60 0.00 0.00 56.93 58.05 2k5p s PHE 62 Cb -0.18 -3.07 -0.03 0.00 0.51 0.00 0.00 43.02 40.25 2k5p s PHE 62 CO 0.11 0.04 0.16 -0.48 0.70 0.00 0.00 175.22 175.75 2k5p s LEU 63 N 0.79 1.23 0.00 -0.37 2.34 -1.20 -4.85 118.68 116.61 2k5p s LEU 63 Ca 0.49 -1.25 0.00 0.00 0.06 0.00 0.00 54.13 53.44 2k5p s LEU 63 Cb -0.21 0.56 0.00 0.00 -0.56 0.00 0.00 46.19 45.98 2k5p s LEU 63 CO 0.27 -0.84 0.00 -1.22 -1.06 0.00 0.00 176.35 173.50 2k5p n TYR 64 N -0.23 0.00 0.50 3.48 4.01 -1.26 -4.65 117.16 119.02 2k5p n TYR 64 Ca -0.01 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.84 2k5p n TYR 64 Cb 0.65 0.00 0.44 0.00 -0.31 0.00 0.00 39.34 40.12 2k5p n TYR 64 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2k5p n PHE 65 N 0.00 0.55 -4.16 -0.72 3.72 -1.26 -4.85 117.46 110.74 2k5p n PHE 65 Ca 0.00 0.20 -0.16 0.00 -0.05 0.00 0.00 57.45 57.44 2k5p n PHE 65 Cb 0.00 -0.82 -0.05 0.00 -0.94 0.00 0.00 39.48 37.66 2k5p n PHE 65 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k5p n MET 66 N -1.98 0.49 0.00 -1.08 0.00 -1.26 -5.10 117.12 108.18 2k5p n MET 66 Ca 0.03 -2.85 0.00 0.00 0.00 0.00 0.00 57.70 54.88 2k5p n MET 66 Cb 0.25 2.50 0.00 0.00 0.00 0.00 0.00 33.22 35.97 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 -0.56 0.63 0.50 3.17 0.00 -1.26 -5.03 105.19 102.64 2k5p n GLY 67 Ca 0.04 -0.37 0.06 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 -0.05 2.43 -0.02 0.00 -1.26 -4.99 105.19 101.30 2k5p n GLY 68 Ca 0.00 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 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 0.67 0.22 3.33 -0.02 0.00 -1.26 -4.96 105.19 103.18 2k5p n GLY 69 Ca 0.07 -0.06 -0.46 0.00 0.00 0.00 0.00 46.02 45.58 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 -4.61 3.00 -1.27 1.61 2.20 -1.26 -4.35 119.74 115.05 2k5p s LYS 70 Ca 0.00 -1.59 0.00 0.00 -0.36 0.00 0.00 55.97 54.02 2k5p s LYS 70 Cb 0.00 -4.26 0.00 0.00 -1.51 0.00 0.00 37.83 32.06 2k5p s LYS 70 CO 0.00 -1.29 0.00 1.28 -0.36 0.00 0.00 175.35 174.98 2k5p n LEU 71 N 5.36 -1.04 -1.08 5.43 4.32 -1.26 -4.80 117.00 123.92 2k5p n LEU 71 Ca -0.13 0.27 0.03 0.00 -0.02 0.00 0.00 56.01 56.15 2k5p n LEU 71 Cb 0.41 -2.05 0.17 0.00 -1.62 0.00 0.00 43.42 40.33 2k5p n LEU 71 CO 0.53 -0.47 0.51 1.21 -1.22 0.00 0.00 177.39 177.96 2k5p n GLU 72 N -2.23 2.64 -2.32 3.23 2.13 -1.26 -4.77 120.64 118.06 2k5p n GLU 72 Ca -0.14 -1.32 -0.36 0.00 0.66 0.00 0.00 57.16 56.00 2k5p n GLU 72 Cb 0.50 -1.82 -0.04 0.00 0.27 0.00 0.00 31.44 30.35 2k5p n GLU 72 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 2k5p s HIS 73 N -1.74 2.14 -0.08 4.31 3.76 -1.26 -4.94 115.29 117.48 2k5p s HIS 73 Ca 0.23 -0.03 0.00 0.00 -0.15 0.00 0.00 55.06 55.11 2k5p s HIS 73 Cb 0.17 -4.39 0.02 0.00 1.11 0.00 0.00 32.58 29.50 2k5p s HIS 73 CO 0.07 -1.94 -0.06 -1.01 -0.85 0.00 0.00 174.74 170.95 2k5p s HIS 74 N 7.32 1.11 -0.14 1.40 3.76 -1.26 -5.11 115.29 122.38 2k5p s HIS 74 Ca 0.55 -0.45 -0.29 0.00 -0.15 0.00 0.00 55.06 54.72 2k5p s HIS 74 Cb -0.05 -0.98 -0.05 0.00 1.11 0.00 0.00 32.58 32.61 2k5p s HIS 74 CO 0.01 -0.36 1.92 -1.01 -0.85 0.00 0.00 174.74 174.44 2k5p s HIS 75 N 1.46 1.55 0.45 1.40 3.76 -1.26 -4.97 115.29 117.68 2k5p s HIS 75 Ca -0.01 0.22 -0.17 0.00 -0.15 0.00 0.00 55.06 54.95 2k5p s HIS 75 Cb -0.13 -4.05 -0.09 0.00 1.11 0.00 0.00 32.58 29.42 2k5p s HIS 75 CO -0.04 -4.15 0.91 -1.01 -0.85 0.00 0.00 174.74 169.61 2k5p s HIS 76 N 5.93 3.40 1.02 1.40 0.09 -1.26 -5.07 115.29 120.79 2k5p s HIS 76 Ca 0.86 1.43 -0.17 0.00 -0.00 0.00 0.00 55.06 57.18 2k5p s HIS 76 Cb -0.33 -2.74 0.24 0.00 -0.00 0.00 0.00 32.58 29.75 2k5p s HIS 76 CO 0.35 -0.19 1.33 -2.39 -0.00 0.00 0.00 174.74 173.85 2k5p n HIS 77 N -1.07 -3.99 -0.85 1.40 1.44 -1.26 -5.26 115.22 105.63 2k5p n HIS 77 Ca 0.06 -1.18 0.00 0.00 -2.01 0.00 0.00 57.72 54.59 2k5p n HIS 77 Cb 0.54 -1.05 0.00 0.00 0.12 0.00 0.00 29.99 29.59 2k5p n HIS 77 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14