#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1p n SER 64 N 0.00 1.20 -3.61 1.61 7.64 -1.26 -4.55 113.62 114.65 2k1p n SER 64 Ca 0.00 -2.06 -0.41 0.00 1.01 0.00 0.00 58.87 57.40 2k1p n SER 64 Cb 0.00 -0.25 -0.01 0.00 -1.01 0.00 0.00 64.21 62.94 2k1p n SER 64 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2k1p n SER 65 N 0.00 5.37 -1.30 6.43 7.64 -1.26 -4.43 113.62 126.06 2k1p n SER 65 Ca 0.05 -2.78 0.12 0.00 1.01 0.00 0.00 58.87 57.27 2k1p n SER 65 Cb 0.23 -1.62 0.29 0.00 -1.01 0.00 0.00 64.21 62.11 2k1p n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k1p n ALA 66 N 5.22 2.39 -1.64 -0.43 0.00 -1.26 -4.75 120.51 120.04 2k1p n ALA 66 Ca 0.59 -1.21 0.00 0.00 0.00 0.00 0.00 53.44 52.82 2k1p n ALA 66 Cb 0.34 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2k1p n ALA 66 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2k1p n ASN 67 N 1.62 0.00 -4.77 0.00 6.94 -1.26 -5.06 115.26 112.73 2k1p n ASN 67 Ca 0.23 0.00 -0.38 0.00 -0.02 0.00 0.00 54.58 54.41 2k1p n ASN 67 Cb 0.62 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 38.03 2k1p n ASN 67 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2k1p s ASP 68 N 0.75 6.23 0.42 0.53 1.01 -1.25 -4.57 116.67 119.79 2k1p s ASP 68 Ca 0.00 2.40 0.08 0.00 0.71 0.00 0.00 52.55 55.74 2k1p s ASP 68 Cb 0.00 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 2k1p s ASP 68 CO 0.00 -0.88 0.46 -1.66 0.21 0.00 0.00 175.17 173.30 2k1p s TRP 69 N -1.45 2.74 -0.07 4.23 1.48 -1.20 -4.93 118.94 119.74 2k1p s TRP 69 Ca 0.61 -0.46 0.05 0.00 -1.06 0.00 0.00 56.10 55.25 2k1p s TRP 69 Cb -0.31 -2.26 -0.01 0.00 -1.16 0.00 0.00 33.47 29.72 2k1p s TRP 69 CO 0.39 -0.25 -0.23 -1.14 -4.06 0.00 0.00 176.95 171.66 2k1p s GLN 70 N -4.23 2.65 0.69 3.25 0.74 -1.26 -0.66 119.66 120.84 2k1p s GLN 70 Ca 0.51 -0.86 -0.16 0.00 0.05 0.00 0.00 55.36 54.90 2k1p s GLN 70 Cb -0.06 -2.24 0.02 0.00 1.10 0.00 0.00 33.01 31.83 2k1p s GLN 70 CO 0.30 0.38 1.22 0.00 -0.55 0.00 0.00 175.29 176.64 2k1p n LYS 72 N -2.41 2.42 0.01 0.00 2.85 -1.26 -3.46 118.16 116.31 2k1p n LYS 72 Ca 0.14 -2.15 -0.03 0.00 -1.05 0.00 0.00 58.31 55.22 2k1p n LYS 72 Cb 0.50 -1.49 -0.01 0.00 -0.65 0.00 0.00 35.03 33.38 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 1.43 0.88 0.94 0.58 -1.04 -1.26 -4.77 114.28 111.03 2k1p n THR 73 Ca 0.17 0.20 0.11 0.00 -2.04 0.00 0.00 64.05 62.49 2k1p n THR 73 Cb 0.60 -1.65 0.04 0.00 -1.82 0.00 0.00 70.33 67.49 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 -4.76 -4.82 0.00 7.64 -1.22 -4.99 113.62 103.91 2k1p n SER 75 Ca 0.04 0.34 -0.37 0.00 1.01 0.00 0.00 58.87 59.89 2k1p n SER 75 Cb 0.35 -3.57 -0.06 0.00 -1.01 0.00 0.00 64.21 59.91 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 -2.82 6.55 -0.08 6.43 2.20 -1.26 -4.71 114.94 121.25 2k1p s ASN 76 Ca 0.00 0.65 -0.28 0.00 -0.94 0.00 0.00 52.86 52.30 2k1p s ASN 76 Cb 0.00 -2.16 -0.02 0.00 -2.00 0.00 0.00 41.25 37.06 2k1p s ASN 76 CO 0.00 0.29 0.90 0.54 -2.94 0.00 0.00 177.10 175.89 2k1p s VAL 77 N -0.63 4.88 0.00 3.54 0.11 -1.26 -0.76 120.40 126.29 2k1p s VAL 77 Ca 0.18 1.84 0.00 0.00 -2.93 0.00 0.00 61.98 61.08 2k1p s VAL 77 Cb -0.14 -4.22 0.00 0.00 -1.53 0.00 0.00 36.38 30.49 2k1p s VAL 77 CO 0.07 0.10 0.00 0.59 -3.33 0.00 0.00 175.10 172.54 2k1p n ASN 78 N 4.48 0.00 -5.00 3.54 3.02 0.16 -4.96 115.26 116.50 2k1p n ASN 78 Ca 0.05 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.42 2k1p n ASN 78 Cb 0.50 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.69 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 1.51 2.74 0.65 3.10 -0.00 -1.26 -4.76 118.94 120.91 2k1p s TRP 79 Ca 0.00 -0.36 0.28 0.00 -0.00 0.00 0.00 56.10 56.02 2k1p s TRP 79 Cb 0.00 -2.43 1.50 0.00 -0.00 0.00 0.00 33.47 32.55 2k1p s TRP 79 CO 0.00 -0.52 1.86 0.00 -0.00 0.00 0.00 176.95 178.29 2k1p h ALA 80 N 0.53 1.54 0.00 5.86 0.00 -1.92 -3.18 119.26 122.10 2k1p h ALA 80 Ca -0.40 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.36 2k1p h ALA 80 Cb 1.28 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.96 2k1p h ALA 80 CO 0.46 -0.45 -0.18 2.89 0.00 0.00 0.00 179.25 181.97 2k1p n ARG 81 N -3.02 0.90 -1.91 0.00 1.85 -1.26 -3.84 116.66 109.38 2k1p n ARG 81 Ca 0.00 -1.22 -0.41 0.00 -1.00 0.00 0.00 57.85 55.22 2k1p n ARG 81 Cb 0.47 0.10 -0.02 0.00 -1.05 0.00 0.00 32.46 31.97 2k1p n ARG 81 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2k1p s ARG 82 N 0.12 4.20 0.33 2.89 0.52 -1.21 -4.89 118.95 120.92 2k1p s ARG 82 Ca 0.12 2.43 0.15 0.00 -0.52 0.00 0.00 55.73 57.91 2k1p s ARG 82 Cb 0.30 -3.07 0.55 0.00 0.52 0.00 0.00 34.95 33.24 2k1p s ARG 82 CO -0.08 -0.52 1.69 0.77 0.02 0.00 0.00 175.30 177.18 2k1p h SER 83 N 5.04 0.00 -5.13 0.23 0.02 -1.96 -3.43 113.55 108.31 2k1p h SER 83 Ca -0.46 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.43 2k1p h SER 83 Cb 1.22 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.63 2k1p h SER 83 CO 0.79 0.47 -0.16 -1.83 -1.14 0.00 0.00 176.83 174.96 2k1p s GLU 84 N -3.62 1.11 0.68 3.45 -1.05 -1.26 -0.75 118.70 117.25 2k1p s GLU 84 Ca -0.01 -0.89 -0.17 0.00 -0.15 0.00 0.00 54.97 53.75 2k1p s GLU 84 Cb 0.12 0.44 0.01 0.00 -0.44 0.00 0.00 34.13 34.25 2k1p s GLU 84 CO 0.72 -0.42 1.27 0.00 0.95 0.00 0.00 175.26 177.78 2k1p h ASN 86 N 0.25 0.00 0.00 0.00 -1.07 -1.95 -2.25 115.58 110.56 2k1p h ASN 86 Ca -0.50 -0.10 -0.35 0.00 0.07 0.00 0.00 56.30 55.42 2k1p h ASN 86 Cb 1.33 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 37.53 2k1p h ASN 86 CO 0.52 0.05 -2.10 0.23 0.07 0.00 0.00 177.43 176.20 2k1p n MET 87 N -2.44 0.57 0.04 4.14 2.81 -1.26 -4.59 117.12 116.40 2k1p n MET 87 Ca 0.02 0.29 0.01 0.00 -1.81 0.00 0.00 57.70 56.20 2k1p n MET 87 Cb 0.50 -1.51 -0.07 0.00 -0.71 0.00 0.00 33.22 31.43 2k1p n MET 87 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2k1p n ASN 89 N -2.89 -5.30 -4.72 0.00 3.02 -0.85 -4.94 115.26 99.58 2k1p n ASN 89 Ca -0.08 0.21 -0.41 0.00 -0.03 0.00 0.00 54.58 54.27 2k1p n ASN 89 Cb 0.81 -4.40 -0.04 0.00 -0.61 0.00 0.00 39.78 35.55 2k1p n ASN 89 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2k1p s THR 90 N -2.81 4.88 0.41 3.41 2.01 -1.26 -4.53 115.64 117.74 2k1p s THR 90 Ca 0.00 1.85 -0.25 0.00 0.31 0.00 0.00 61.69 63.61 2k1p s THR 90 Cb 0.00 -4.23 -0.11 0.00 0.01 0.00 0.00 72.50 68.18 2k1p s THR 90 CO 0.00 0.22 1.04 -2.65 -0.69 0.00 0.00 174.62 172.54 2k1p n PRO 91 N 3.68 1.42 -0.31 4.92 -0.02 -1.26 -0.38 135.00 143.04 2k1p n PRO 91 Ca 0.03 0.51 0.03 0.00 -2.02 0.00 0.00 63.50 62.05 2k1p n PRO 91 Cb 0.51 -2.07 0.09 0.00 -0.02 0.00 0.00 33.50 32.00 2k1p n PRO 91 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2k1p n LYS 92 N 0.16 -0.12 -2.67 -0.52 4.81 0.07 -2.04 118.16 117.85 2k1p n LYS 92 Ca 0.09 1.32 -0.15 0.00 -0.87 0.00 0.00 58.31 58.69 2k1p n LYS 92 Cb 0.39 -1.96 0.01 0.00 0.02 0.00 0.00 35.03 33.49 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 -5.33 1.79 -2.50 5.64 4.01 -1.26 -4.90 117.16 114.62 2k1p n TYR 93 Ca 0.12 -3.03 -0.40 0.00 -0.16 0.00 0.00 57.90 54.43 2k1p n TYR 93 Cb 0.39 -0.31 -0.01 0.00 -0.31 0.00 0.00 39.34 39.10 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 -3.18 2.98 -2.00 -0.72 0.00 -0.86 -5.24 121.76 112.73 2k1p s ALA 94 Ca 0.35 -2.68 0.31 0.00 0.00 0.00 0.00 51.96 49.94 2k1p s ALA 94 Cb 0.43 -4.63 1.86 0.00 0.00 0.00 0.00 23.12 20.78 2k1p s ALA 94 CO -0.04 -3.64 2.19 1.63 0.00 0.00 0.00 175.76 175.89