#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1p s SER 64 N 0.00 5.55 0.18 1.61 0.01 -1.26 -5.05 113.70 114.75 2k1p s SER 64 Ca 0.00 2.01 0.01 0.00 1.31 0.00 0.00 55.95 59.28 2k1p s SER 64 Cb 0.00 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 2k1p s SER 64 CO 0.00 -1.33 0.35 -0.94 0.41 0.00 0.00 173.24 171.73 2k1p s SER 65 N -2.31 6.37 0.00 2.44 1.04 -1.26 -4.99 113.70 114.98 2k1p s SER 65 Ca 0.68 0.31 0.23 0.00 0.48 0.00 0.00 55.95 57.65 2k1p s SER 65 Cb -0.20 -1.97 0.11 0.00 0.10 0.00 0.00 66.02 64.05 2k1p s SER 65 CO 0.34 -0.01 1.17 0.00 0.98 0.00 0.00 173.24 175.72 2k1p n ALA 66 N -0.63 2.88 -0.01 5.32 0.00 -1.26 -4.53 120.51 122.29 2k1p n ALA 66 Ca -0.06 -0.67 -0.00 0.00 0.00 0.00 0.00 53.44 52.72 2k1p n ALA 66 Cb 0.54 -0.78 -0.00 0.00 0.00 0.00 0.00 19.45 19.21 2k1p n ALA 66 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2k1p h ASN 67 N 3.72 -0.00 -3.52 0.00 -1.24 -1.94 -3.45 115.58 109.14 2k1p h ASN 67 Ca 0.00 0.00 -0.53 0.00 0.71 0.00 0.00 56.30 56.48 2k1p h ASN 67 Cb 0.88 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.90 2k1p h ASN 67 CO 0.00 0.07 0.26 1.51 -1.29 0.00 0.00 177.43 177.98 2k1p s ASP 68 N -3.37 7.39 0.27 1.15 -4.77 -1.26 -2.50 116.67 113.58 2k1p s ASP 68 Ca -0.00 1.65 0.03 0.00 -3.30 0.00 0.00 52.55 50.93 2k1p s ASP 68 Cb 0.00 -2.53 -0.06 0.00 -1.09 0.00 0.00 42.92 39.24 2k1p s ASP 68 CO 0.00 0.02 0.04 -1.66 0.70 0.00 0.00 175.17 174.27 2k1p s TRP 69 N -0.25 1.70 -0.05 2.11 1.48 -1.26 -4.68 118.94 117.99 2k1p s TRP 69 Ca 0.42 -1.00 0.05 0.00 -1.06 0.00 0.00 56.10 54.51 2k1p s TRP 69 Cb -0.22 -1.04 -0.01 0.00 -1.16 0.00 0.00 33.47 31.04 2k1p s TRP 69 CO 0.27 -0.10 -0.20 -1.14 -4.06 0.00 0.00 176.95 171.72 2k1p s GLN 70 N -3.92 2.16 0.62 3.25 0.74 -1.26 -1.38 119.66 119.87 2k1p s GLN 70 Ca 0.34 -0.73 -0.13 0.00 0.05 0.00 0.00 55.36 54.89 2k1p s GLN 70 Cb 0.07 -1.83 -0.03 0.00 1.10 0.00 0.00 33.01 32.32 2k1p s GLN 70 CO 0.12 0.28 1.03 0.00 -0.55 0.00 0.00 175.29 176.18 2k1p n LYS 72 N -2.55 1.10 -0.13 0.00 2.85 -1.26 -3.11 118.16 115.06 2k1p n LYS 72 Ca 0.07 -0.89 -0.28 0.00 -1.05 0.00 0.00 58.31 56.16 2k1p n LYS 72 Cb 0.54 -1.48 -0.09 0.00 -0.65 0.00 0.00 35.03 33.34 2k1p n LYS 72 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2k1p n THR 73 N -0.17 1.51 0.94 0.58 -1.04 -1.26 -4.58 114.28 110.26 2k1p n THR 73 Ca 0.09 -0.34 0.11 0.00 -2.04 0.00 0.00 64.05 61.88 2k1p n THR 73 Cb 0.45 -1.92 0.06 0.00 -1.82 0.00 0.00 70.33 67.10 2k1p n THR 73 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k1p n SER 75 N -1.56 -5.44 -4.86 0.00 7.64 -1.18 -4.97 113.62 103.25 2k1p n SER 75 Ca 0.04 0.42 -0.37 0.00 1.01 0.00 0.00 58.87 59.98 2k1p n SER 75 Cb 0.35 -4.77 -0.06 0.00 -1.01 0.00 0.00 64.21 58.72 2k1p n SER 75 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2k1p s ASN 76 N -2.62 6.31 -0.23 6.43 2.20 -1.26 -4.83 114.94 120.94 2k1p s ASN 76 Ca 0.00 0.44 -0.29 0.00 -0.94 0.00 0.00 52.86 52.07 2k1p s ASN 76 Cb 0.00 -2.03 0.01 0.00 -2.00 0.00 0.00 41.25 37.22 2k1p s ASN 76 CO 0.00 0.39 1.04 0.54 -2.94 0.00 0.00 177.10 176.13 2k1p s VAL 77 N -0.94 4.68 0.00 3.54 0.11 -1.26 -1.54 120.40 124.99 2k1p s VAL 77 Ca 0.14 2.03 0.00 0.00 -2.93 0.00 0.00 61.98 61.22 2k1p s VAL 77 Cb -0.12 -4.31 0.00 0.00 -1.53 0.00 0.00 36.38 30.42 2k1p s VAL 77 CO 0.04 -0.18 0.00 0.59 -3.33 0.00 0.00 175.10 172.22 2k1p n ASN 78 N 6.31 -0.00 -4.74 3.54 3.02 -0.48 -4.96 115.26 117.94 2k1p n ASN 78 Ca 0.12 -0.41 -0.38 0.00 -0.03 0.00 0.00 54.58 53.88 2k1p n ASN 78 Cb 0.46 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.68 2k1p n ASN 78 CO 0.00 0.00 0.00 1.87 -2.62 0.00 0.00 177.26 176.51 2k1p n TRP 79 N -0.84 2.23 -0.72 3.10 -0.00 -1.26 -4.59 117.44 115.36 2k1p n TRP 79 Ca 0.00 0.43 -0.16 0.00 -0.00 0.00 0.00 57.50 57.76 2k1p n TRP 79 Cb 0.00 -2.34 -0.06 0.00 -0.00 0.00 0.00 31.31 28.91 2k1p n TRP 79 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2k1p n ALA 80 N -1.24 4.72 0.00 5.87 0.00 -1.26 -1.83 120.51 126.76 2k1p n ALA 80 Ca 0.12 -1.70 0.00 0.00 0.00 0.00 0.00 53.44 51.86 2k1p n ALA 80 Cb 0.45 -2.70 0.00 0.00 0.00 0.00 0.00 19.45 17.20 2k1p n ALA 80 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2k1p n ARG 81 N 3.47 0.00 -1.38 0.00 1.85 -1.04 -4.22 116.66 115.34 2k1p n ARG 81 Ca 0.39 0.00 -0.45 0.00 -1.00 0.00 0.00 57.85 56.78 2k1p n ARG 81 Cb 0.33 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.73 2k1p n ARG 81 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2k1p n ARG 82 N 0.00 0.12 0.17 2.89 1.74 -0.76 -4.87 116.66 115.95 2k1p n ARG 82 Ca 0.00 0.04 0.04 0.00 -0.77 0.00 0.00 57.85 57.17 2k1p n ARG 82 Cb 0.00 -1.09 0.24 0.00 -1.02 0.00 0.00 32.46 30.60 2k1p n ARG 82 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2k1p h SER 83 N 0.80 0.00 -5.05 0.55 4.64 -1.96 -3.44 113.55 109.09 2k1p h SER 83 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2k1p h SER 83 Cb 1.43 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.43 2k1p h SER 83 CO 0.53 0.43 0.11 -1.83 -0.87 0.00 0.00 176.83 175.20 2k1p s GLU 84 N -3.41 1.49 0.52 4.77 -1.05 -1.26 0.04 118.70 119.81 2k1p s GLU 84 Ca 0.01 -0.85 -0.21 0.00 -0.15 0.00 0.00 54.97 53.76 2k1p s GLU 84 Cb 0.10 0.56 -0.06 0.00 -0.44 0.00 0.00 34.13 34.29 2k1p s GLU 84 CO 0.70 -0.65 1.24 0.00 0.95 0.00 0.00 175.26 177.50 2k1p h ASN 86 N 1.56 0.00 0.00 0.00 -1.24 -1.95 -2.86 115.58 111.09 2k1p h ASN 86 Ca -0.50 0.00 -0.22 0.00 0.71 0.00 0.00 56.30 56.29 2k1p h ASN 86 Cb 1.28 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.29 2k1p h ASN 86 CO 0.58 0.41 -1.72 0.23 -1.29 0.00 0.00 177.43 175.64 2k1p n MET 87 N -3.16 0.55 0.09 6.67 0.00 -1.26 -4.60 117.12 115.40 2k1p n MET 87 Ca 0.01 0.23 0.09 0.00 0.00 0.00 0.00 57.70 58.03 2k1p n MET 87 Cb 0.70 -1.44 -0.01 0.00 0.00 0.00 0.00 33.22 32.47 2k1p n MET 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2k1p n ASN 89 N -2.76 -4.44 -4.68 0.00 5.15 -1.08 -4.96 115.26 102.49 2k1p n ASN 89 Ca -0.02 0.20 -0.42 0.00 -0.60 0.00 0.00 54.58 53.74 2k1p n ASN 89 Cb 0.62 -3.31 -0.03 0.00 -0.53 0.00 0.00 39.78 36.53 2k1p n ASN 89 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2k1p s THR 90 N -2.56 3.38 0.34 -0.44 2.01 -1.26 -4.51 115.64 112.59 2k1p s THR 90 Ca 0.00 0.73 -0.29 0.00 0.31 0.00 0.00 61.69 62.45 2k1p s THR 90 Cb 0.00 -3.47 -0.11 0.00 0.01 0.00 0.00 72.50 68.92 2k1p s THR 90 CO 0.00 -0.02 1.50 -0.81 -0.69 0.00 0.00 174.62 174.61 2k1p n PRO 91 N 5.88 2.62 0.00 4.92 -0.04 -1.26 -0.03 135.00 147.09 2k1p n PRO 91 Ca 0.15 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.54 2k1p n PRO 91 Cb 0.42 -2.66 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 2k1p n PRO 91 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2k1p n LYS 92 N 1.04 0.00 -3.22 0.54 4.81 0.11 -2.84 118.16 118.59 2k1p n LYS 92 Ca 0.04 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.24 2k1p n LYS 92 Cb 0.38 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.36 2k1p n LYS 92 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2k1p n TYR 93 N -0.50 0.13 -2.67 5.64 4.01 -1.26 -4.88 117.16 117.63 2k1p n TYR 93 Ca 0.00 -3.64 -0.42 0.00 -0.16 0.00 0.00 57.90 53.68 2k1p n TYR 93 Cb 0.00 -0.38 -0.03 0.00 -0.31 0.00 0.00 39.34 38.62 2k1p n TYR 93 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2k1p s ALA 94 N -1.37 2.92 -2.37 -0.72 0.00 -1.13 -5.24 121.76 113.85 2k1p s ALA 94 Ca 0.36 -1.46 0.29 0.00 0.00 0.00 0.00 51.96 51.15 2k1p s ALA 94 Cb 0.17 -4.07 1.27 0.00 0.00 0.00 0.00 23.12 20.48 2k1p s ALA 94 CO -0.10 -3.00 1.87 1.63 0.00 0.00 0.00 175.76 176.16