#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1p h SER 64 N 0.00 0.59 -1.87 1.61 0.02 -2.07 -3.27 113.55 108.57 2k1p h SER 64 Ca 0.00 -0.41 -0.70 0.00 -0.84 0.00 0.00 61.79 59.84 2k1p h SER 64 Cb 0.00 -0.18 -0.33 0.00 0.14 0.00 0.00 62.40 62.04 2k1p h SER 64 CO 0.00 1.18 0.38 -1.20 -1.14 0.00 0.00 176.83 176.05 2k1p n SER 65 N -3.84 6.43 0.02 3.07 7.64 -1.26 -4.65 113.62 121.04 2k1p n SER 65 Ca -0.06 -3.78 -0.08 0.00 1.01 0.00 0.00 58.87 55.96 2k1p n SER 65 Cb 0.75 -0.85 -0.13 0.00 -1.01 0.00 0.00 64.21 62.97 2k1p n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k1p h ALA 66 N 2.95 0.54 0.23 -0.43 0.00 -1.98 -3.34 119.26 117.24 2k1p h ALA 66 Ca 0.46 -1.18 -0.32 0.00 0.00 0.00 0.00 54.91 53.87 2k1p h ALA 66 Cb 0.37 0.16 0.03 0.00 0.00 0.00 0.00 17.79 18.35 2k1p h ALA 66 CO 1.19 1.40 -1.44 -0.91 0.00 0.00 0.00 179.25 179.49 2k1p h ASN 67 N 0.00 0.76 -1.44 0.00 2.35 -1.83 -3.42 115.58 112.00 2k1p h ASN 67 Ca -0.15 -0.93 -0.39 0.00 -0.55 0.00 0.00 56.30 54.28 2k1p h ASN 67 Cb 1.89 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 40.02 2k1p h ASN 67 CO 0.11 1.69 1.36 -1.81 -1.65 0.00 0.00 177.43 177.13 2k1p s ASP 68 N -7.46 4.41 0.63 5.81 1.11 -1.09 -4.53 116.67 115.54 2k1p s ASP 68 Ca -0.11 0.85 -0.05 0.00 0.18 0.00 0.00 52.55 53.42 2k1p s ASP 68 Cb 0.04 -2.51 0.03 0.00 1.07 0.00 0.00 42.92 41.55 2k1p s ASP 68 CO 0.91 -3.01 0.93 -1.66 1.18 0.00 0.00 175.17 173.52 2k1p s TRP 69 N 12.40 3.07 -0.05 4.23 1.48 -1.26 -4.94 118.94 133.87 2k1p s TRP 69 Ca 0.94 0.48 0.03 0.00 -1.06 0.00 0.00 56.10 56.49 2k1p s TRP 69 Cb -0.16 -2.91 0.01 0.00 -1.16 0.00 0.00 33.47 29.25 2k1p s TRP 69 CO 0.23 -1.05 -0.13 -1.14 -4.06 0.00 0.00 176.95 170.79 2k1p s GLN 70 N -5.06 1.63 0.53 3.25 0.74 -1.26 -2.37 119.66 117.12 2k1p s GLN 70 Ca 0.57 -0.46 -0.22 0.00 0.05 0.00 0.00 55.36 55.30 2k1p s GLN 70 Cb -0.11 -1.38 -0.06 0.00 1.10 0.00 0.00 33.01 32.57 2k1p s GLN 70 CO 0.44 0.10 1.27 0.00 -0.55 0.00 0.00 175.29 176.55 2k1p n LYS 72 N -0.84 2.17 -0.06 0.00 3.00 -1.26 -2.68 118.16 118.50 2k1p n LYS 72 Ca 0.10 -1.73 -0.11 0.00 -0.00 0.00 0.00 58.31 56.57 2k1p n LYS 72 Cb 0.44 -1.47 -0.04 0.00 0.00 0.00 0.00 35.03 33.97 2k1p n LYS 72 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2k1p n THR 73 N 1.02 1.26 1.06 3.15 -1.04 -1.26 -4.70 114.28 113.78 2k1p n THR 73 Ca 0.17 0.06 0.11 0.00 -2.04 0.00 0.00 64.05 62.35 2k1p n THR 73 Cb 0.52 -1.97 0.11 0.00 -1.82 0.00 0.00 70.33 67.17 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 -0.75 -5.64 -4.69 0.00 7.64 -1.09 -4.97 113.62 104.12 2k1p n SER 75 Ca 0.08 0.25 -0.36 0.00 1.01 0.00 0.00 58.87 59.86 2k1p n SER 75 Cb 0.39 -4.80 -0.09 0.00 -1.01 0.00 0.00 64.21 58.70 2k1p n SER 75 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2k1p s ASN 76 N -2.44 6.11 -0.26 6.43 2.47 -1.26 -4.75 114.94 121.25 2k1p s ASN 76 Ca 0.00 0.17 -0.29 0.00 0.42 0.00 0.00 52.86 53.16 2k1p s ASN 76 Cb 0.00 -2.08 0.01 0.00 -1.45 0.00 0.00 41.25 37.73 2k1p s ASN 76 CO 0.00 0.14 1.07 0.54 -3.72 0.00 0.00 177.10 175.12 2k1p s VAL 77 N 0.63 4.59 0.00 -5.21 0.11 -1.26 -1.20 120.40 118.06 2k1p s VAL 77 Ca 0.07 1.89 0.00 0.00 -2.93 0.00 0.00 61.98 61.01 2k1p s VAL 77 Cb -0.12 -4.33 0.00 0.00 -1.53 0.00 0.00 36.38 30.40 2k1p s VAL 77 CO 0.01 -0.29 0.00 0.59 -3.33 0.00 0.00 175.10 172.08 2k1p n ASN 78 N 6.56 0.00 -4.92 3.54 3.02 -1.00 -4.97 115.26 117.48 2k1p n ASN 78 Ca 0.12 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.41 2k1p n ASN 78 Cb 0.46 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.65 2k1p n ASN 78 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2k1p s TRP 79 N 0.33 3.33 0.62 3.10 -0.00 -1.26 -4.88 118.94 120.17 2k1p s TRP 79 Ca 0.00 0.62 0.27 0.00 -0.00 0.00 0.00 56.10 56.99 2k1p s TRP 79 Cb 0.00 -2.55 1.33 0.00 -0.00 0.00 0.00 33.47 32.25 2k1p s TRP 79 CO 0.00 -0.61 1.75 0.00 -0.00 0.00 0.00 176.95 178.09 2k1p h ALA 80 N 0.02 2.09 -0.13 5.86 0.00 -1.92 -3.00 119.26 122.18 2k1p h ALA 80 Ca -0.46 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.20 2k1p h ALA 80 Cb 1.24 0.03 -0.19 0.00 0.00 0.00 0.00 17.79 18.88 2k1p h ALA 80 CO 0.60 -0.80 -0.46 2.89 0.00 0.00 0.00 179.25 181.48 2k1p n ARG 81 N -3.36 1.22 -2.15 0.00 0.00 -1.26 -2.66 116.66 108.44 2k1p n ARG 81 Ca 0.08 -1.96 -0.40 0.00 -0.00 0.00 0.00 57.85 55.57 2k1p n ARG 81 Cb 0.76 -0.17 -0.01 0.00 -0.00 0.00 0.00 32.46 33.04 2k1p n ARG 81 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2k1p s ARG 82 N -0.30 4.12 0.26 2.89 0.52 -1.13 -4.92 118.95 120.39 2k1p s ARG 82 Ca 0.21 2.08 0.07 0.00 -0.52 0.00 0.00 55.73 57.57 2k1p s ARG 82 Cb 0.41 -2.84 0.34 0.00 0.52 0.00 0.00 34.95 33.39 2k1p s ARG 82 CO -0.08 -0.34 1.62 0.77 0.02 0.00 0.00 175.30 177.29 2k1p h SER 83 N 2.90 0.19 -5.00 0.23 0.02 -1.95 -3.41 113.55 106.53 2k1p h SER 83 Ca -0.49 -0.10 0.06 0.00 -0.84 0.00 0.00 61.79 60.42 2k1p h SER 83 Cb 1.24 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 2k1p h SER 83 CO 0.63 0.71 0.22 -1.83 -1.14 0.00 0.00 176.83 175.43 2k1p s GLU 84 N -3.84 1.80 0.33 3.45 1.03 -1.26 -0.16 118.70 120.05 2k1p s GLU 84 Ca -0.03 -1.01 -0.28 0.00 0.03 0.00 0.00 54.97 53.68 2k1p s GLU 84 Cb 0.13 0.61 -0.09 0.00 -0.80 0.00 0.00 34.13 33.97 2k1p s GLU 84 CO 0.78 -0.82 1.11 0.00 -1.33 0.00 0.00 175.26 174.99 2k1p n ASN 86 N 0.73 0.62 -0.08 0.00 6.94 -1.26 -1.80 115.26 120.41 2k1p n ASN 86 Ca 0.01 -0.45 -0.08 0.00 -0.02 0.00 0.00 54.58 54.04 2k1p n ASN 86 Cb 0.46 0.08 -0.03 0.00 -2.36 0.00 0.00 39.78 37.93 2k1p n ASN 86 CO 0.00 0.00 0.00 0.80 -1.03 0.00 0.00 177.26 177.03 2k1p n MET 87 N -1.11 0.46 0.05 -3.83 1.56 -1.26 -4.66 117.12 108.33 2k1p n MET 87 Ca 0.10 0.19 0.12 0.00 -0.27 0.00 0.00 57.70 57.84 2k1p n MET 87 Cb 0.33 -1.32 0.16 0.00 2.15 0.00 0.00 33.22 34.53 2k1p n MET 87 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2k1p n ASN 89 N -2.00 -4.50 -4.63 0.00 5.15 -0.74 -4.96 115.26 103.57 2k1p n ASN 89 Ca 0.03 0.26 -0.43 0.00 -0.60 0.00 0.00 54.58 53.84 2k1p n ASN 89 Cb 0.43 -3.28 -0.02 0.00 -0.53 0.00 0.00 39.78 36.37 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 -2.53 3.96 0.43 -0.44 2.01 -1.25 -4.58 115.64 113.24 2k1p s THR 90 Ca 0.00 1.09 -0.26 0.00 0.31 0.00 0.00 61.69 62.84 2k1p s THR 90 Cb 0.00 -3.95 -0.09 0.00 0.01 0.00 0.00 72.50 68.47 2k1p s THR 90 CO 0.00 -0.37 1.41 -2.84 -0.69 0.00 0.00 174.62 172.14 2k1p s PRO 91 N 4.31 3.81 0.00 4.92 0.02 -1.26 -0.22 135.00 146.57 2k1p s PRO 91 Ca 0.62 2.39 0.00 0.00 0.02 0.00 0.00 61.00 64.04 2k1p s PRO 91 Cb -0.21 -2.73 0.00 0.00 0.02 0.00 0.00 34.50 31.59 2k1p s PRO 91 CO 0.25 -0.71 0.00 1.17 -0.33 0.00 0.00 177.00 177.38 2k1p n LYS 92 N -0.03 0.00 -2.18 5.54 4.81 0.77 -1.83 118.16 125.24 2k1p n LYS 92 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 2k1p n LYS 92 Cb 0.42 0.00 0.04 0.00 0.02 0.00 0.00 35.03 35.51 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 -2.54 0.20 -3.08 5.64 4.01 -1.26 -4.95 117.16 115.18 2k1p n TYR 93 Ca 0.00 -1.37 -0.44 0.00 -0.16 0.00 0.00 57.90 55.92 2k1p n TYR 93 Cb 0.00 0.16 -0.00 0.00 -0.31 0.00 0.00 39.34 39.19 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 -1.57 4.27 0.00 -0.72 0.00 -0.76 -5.25 121.76 117.73 2k1p s ALA 94 Ca 0.23 -3.54 0.00 0.00 0.00 0.00 0.00 51.96 48.66 2k1p s ALA 94 Cb 0.32 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2k1p s ALA 94 CO -0.09 -2.57 0.26 0.36 0.00 0.00 0.00 175.76 173.71