#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 0.00 -3.38 1.61 0.02 -2.08 -3.41 113.55 106.31 2k1p h SER 64 Ca 0.00 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 60.30 2k1p h SER 64 Cb 0.00 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 62.35 2k1p h SER 64 CO 0.00 0.21 -0.83 -0.44 -1.14 0.00 0.00 176.83 174.63 2k1p s SER 65 N -6.72 3.32 0.00 3.07 0.01 -1.26 -5.10 113.70 107.01 2k1p s SER 65 Ca -0.03 -0.84 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2k1p s SER 65 Cb 0.15 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.14 2k1p s SER 65 CO 0.67 0.11 0.00 0.00 0.41 0.00 0.00 173.24 174.43 2k1p n ALA 66 N 0.40 0.05 -0.07 1.44 0.00 -1.26 -4.83 120.51 116.23 2k1p n ALA 66 Ca -0.14 -0.14 -0.05 0.00 0.00 0.00 0.00 53.44 53.11 2k1p n ALA 66 Cb 0.55 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.85 2k1p n ALA 66 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k1p n ASN 67 N -2.07 0.09 -4.77 0.00 4.05 -1.26 -4.83 115.26 106.48 2k1p n ASN 67 Ca 0.00 0.04 -0.30 0.00 0.45 0.00 0.00 54.58 54.77 2k1p n ASN 67 Cb 0.00 1.09 0.10 0.00 1.23 0.00 0.00 39.78 42.20 2k1p n ASN 67 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 177.26 175.72 2k1p s ASP 68 N -5.35 4.25 0.09 1.20 1.47 -1.20 -4.63 116.67 112.50 2k1p s ASP 68 Ca -0.09 1.53 0.01 0.00 1.18 0.00 0.00 52.55 55.18 2k1p s ASP 68 Cb 0.08 -2.25 -0.04 0.00 -0.34 0.00 0.00 42.92 40.36 2k1p s ASP 68 CO 0.84 -2.15 -0.06 -1.66 0.68 0.00 0.00 175.17 172.83 2k1p s TRP 69 N -3.01 0.81 -0.02 2.11 1.48 -1.25 -4.82 118.94 114.23 2k1p s TRP 69 Ca 0.61 -0.94 0.08 0.00 -1.06 0.00 0.00 56.10 54.80 2k1p s TRP 69 Cb -0.16 -0.49 -0.02 0.00 -1.16 0.00 0.00 33.47 31.64 2k1p s TRP 69 CO 0.56 -0.20 -0.26 -1.14 -4.06 0.00 0.00 176.95 171.85 2k1p s GLN 70 N -3.79 2.15 0.37 3.25 0.74 -1.26 -2.20 119.66 118.92 2k1p s GLN 70 Ca 0.10 -0.93 -0.25 0.00 0.05 0.00 0.00 55.36 54.33 2k1p s GLN 70 Cb 0.05 -2.05 -0.09 0.00 1.10 0.00 0.00 33.01 32.02 2k1p s GLN 70 CO -0.06 0.55 1.08 0.00 -0.55 0.00 0.00 175.29 176.31 2k1p n LYS 72 N 0.25 0.36 -0.09 0.00 5.02 -1.26 -2.67 118.16 119.77 2k1p n LYS 72 Ca 0.03 -0.18 -0.10 0.00 -2.02 0.00 0.00 58.31 56.04 2k1p n LYS 72 Cb 0.48 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.96 2k1p n LYS 72 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2k1p n THR 73 N -1.16 1.48 0.93 -0.18 -1.04 -1.26 -4.57 114.28 108.47 2k1p n THR 73 Ca 0.09 0.10 0.12 0.00 -2.04 0.00 0.00 64.05 62.32 2k1p n THR 73 Cb 0.33 -2.30 0.24 0.00 -1.82 0.00 0.00 70.33 66.78 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 -1.60 -4.95 -4.81 0.00 7.64 -1.09 -4.98 113.62 103.83 2k1p n SER 75 Ca 0.05 0.29 -0.37 0.00 1.01 0.00 0.00 58.87 59.86 2k1p n SER 75 Cb 0.35 -3.50 -0.07 0.00 -1.01 0.00 0.00 64.21 59.99 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 -2.64 6.49 -0.19 6.43 2.47 -1.26 -4.83 114.94 121.42 2k1p s ASN 76 Ca 0.00 0.58 -0.25 0.00 0.42 0.00 0.00 52.86 53.61 2k1p s ASN 76 Cb 0.00 -2.15 -0.01 0.00 -1.45 0.00 0.00 41.25 37.64 2k1p s ASN 76 CO 0.00 0.27 0.81 0.54 -3.72 0.00 0.00 177.10 175.00 2k1p s VAL 77 N -0.45 4.89 0.00 -5.21 0.11 -1.26 -1.16 120.40 117.32 2k1p s VAL 77 Ca 0.17 1.57 0.00 0.00 -2.93 0.00 0.00 61.98 60.79 2k1p s VAL 77 Cb -0.13 -4.11 0.00 0.00 -1.53 0.00 0.00 36.38 30.60 2k1p s VAL 77 CO 0.06 0.01 0.00 0.59 -3.33 0.00 0.00 175.10 172.43 2k1p n ASN 78 N 5.38 0.00 -4.76 3.54 3.02 -0.93 -4.95 115.26 116.56 2k1p n ASN 78 Ca 0.04 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.29 2k1p n ASN 78 Cb 0.49 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.77 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 0.03 2.55 0.22 3.10 -0.00 -1.26 -4.74 118.94 118.83 2k1p s TRP 79 Ca 0.00 1.17 0.30 0.00 -0.00 0.00 0.00 56.10 57.56 2k1p s TRP 79 Cb 0.00 -3.17 1.61 0.00 -0.00 0.00 0.00 33.47 31.91 2k1p s TRP 79 CO 0.00 -2.14 1.89 0.00 -0.00 0.00 0.00 176.95 176.70 2k1p h ALA 80 N -1.36 1.06 -0.25 5.86 0.00 -1.90 -3.17 119.26 119.51 2k1p h ALA 80 Ca -0.49 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.18 2k1p h ALA 80 Cb 1.28 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.85 2k1p h ALA 80 CO 0.57 -0.06 -0.57 2.89 0.00 0.00 0.00 179.25 182.08 2k1p n ARG 81 N -2.59 1.23 -2.49 0.00 0.00 -1.26 -3.27 116.66 108.29 2k1p n ARG 81 Ca -0.02 -2.16 -0.40 0.00 -0.00 0.00 0.00 57.85 55.27 2k1p n ARG 81 Cb 0.12 -0.33 -0.04 0.00 -0.00 0.00 0.00 32.46 32.20 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 -0.76 4.63 0.32 2.89 1.81 -1.20 -4.93 118.95 121.71 2k1p s ARG 82 Ca 0.22 1.78 0.11 0.00 -1.72 0.00 0.00 55.73 56.12 2k1p s ARG 82 Cb 0.42 -3.21 0.51 0.00 -0.45 0.00 0.00 34.95 32.22 2k1p s ARG 82 CO -0.06 0.19 1.71 0.77 -0.68 0.00 0.00 175.30 177.22 2k1p h SER 83 N 4.14 0.02 -5.01 0.23 0.02 -1.95 -3.43 113.55 107.57 2k1p h SER 83 Ca -0.46 -0.01 0.06 0.00 -0.84 0.00 0.00 61.79 60.54 2k1p h SER 83 Cb 1.21 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 63.69 2k1p h SER 83 CO 0.68 0.52 0.21 -1.83 -1.14 0.00 0.00 176.83 175.28 2k1p s GLU 84 N -3.90 1.76 0.67 3.45 -1.05 -1.26 -1.04 118.70 117.33 2k1p s GLU 84 Ca -0.02 -0.98 -0.16 0.00 -0.15 0.00 0.00 54.97 53.66 2k1p s GLU 84 Cb 0.13 0.60 0.01 0.00 -0.44 0.00 0.00 34.13 34.44 2k1p s GLU 84 CO 0.75 -0.80 1.16 0.00 0.95 0.00 0.00 175.26 177.32 2k1p h ASN 86 N 0.06 0.00 0.00 0.00 -1.07 -1.95 -2.94 115.58 109.69 2k1p h ASN 86 Ca -0.48 -0.07 -0.01 0.00 0.07 0.00 0.00 56.30 55.81 2k1p h ASN 86 Cb 1.27 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.52 2k1p h ASN 86 CO 0.52 0.03 -1.04 0.80 0.07 0.00 0.00 177.43 177.82 2k1p n MET 87 N -2.52 0.53 0.05 4.14 1.56 -1.26 -4.65 117.12 114.97 2k1p n MET 87 Ca 0.01 0.21 -0.00 0.00 -0.27 0.00 0.00 57.70 57.65 2k1p n MET 87 Cb 0.52 -1.43 -0.06 0.00 2.15 0.00 0.00 33.22 34.40 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 -3.00 -3.95 -4.68 0.00 4.05 -1.11 -4.94 115.26 101.63 2k1p n ASN 89 Ca -0.07 0.11 -0.42 0.00 0.45 0.00 0.00 54.58 54.65 2k1p n ASN 89 Cb 0.83 -2.86 -0.03 0.00 1.23 0.00 0.00 39.78 38.95 2k1p n ASN 89 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 2k1p s THR 90 N -2.50 2.87 0.20 -0.44 2.01 -1.26 -4.41 115.64 112.11 2k1p s THR 90 Ca 0.00 0.27 -0.33 0.00 0.31 0.00 0.00 61.69 61.95 2k1p s THR 90 Cb 0.00 -3.18 -0.13 0.00 0.01 0.00 0.00 72.50 69.20 2k1p s THR 90 CO 0.00 -0.00 1.58 -2.65 -0.69 0.00 0.00 174.62 172.86 2k1p n PRO 91 N 5.95 2.33 -0.19 4.92 -0.02 -1.26 -0.90 135.00 145.83 2k1p n PRO 91 Ca 0.17 0.84 -0.05 0.00 -2.02 0.00 0.00 63.50 62.44 2k1p n PRO 91 Cb 0.40 -2.61 -0.05 0.00 -0.02 0.00 0.00 33.50 31.23 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 3.14 -0.20 -3.43 -0.52 4.81 -0.21 -1.54 118.16 120.22 2k1p n LYS 92 Ca 0.15 0.69 -0.27 0.00 -0.87 0.00 0.00 58.31 58.01 2k1p n LYS 92 Cb 0.31 -1.02 -0.08 0.00 0.02 0.00 0.00 35.03 34.26 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 -4.53 3.24 1.68 5.64 4.01 -1.26 -4.75 117.16 121.18 2k1p n TYR 93 Ca 0.01 -4.11 0.11 0.00 -0.16 0.00 0.00 57.90 53.75 2k1p n TYR 93 Cb 0.12 -0.54 0.52 0.00 -0.31 0.00 0.00 39.34 39.13 2k1p n TYR 93 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2k1p n ALA 94 N 0.97 2.58 -1.91 -0.72 0.00 -0.59 -5.26 120.51 115.58 2k1p n ALA 94 Ca 0.29 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2k1p n ALA 94 Cb 0.42 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2k1p n ALA 94 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67