#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 -7.06 -4.71 1.61 7.64 -1.26 -4.92 113.62 104.92 2k1p n SER 64 Ca 0.00 -0.02 -0.36 0.00 1.01 0.00 0.00 58.87 59.50 2k1p n SER 64 Cb 0.00 -4.24 0.09 0.00 -1.01 0.00 0.00 64.21 59.05 2k1p n SER 64 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2k1p n SER 65 N -1.19 1.65 -1.90 6.43 3.41 -1.26 -4.85 113.62 115.90 2k1p n SER 65 Ca -0.02 0.75 -0.10 0.00 -0.26 0.00 0.00 58.87 59.24 2k1p n SER 65 Cb 0.54 -1.53 -0.14 0.00 -0.26 0.00 0.00 64.21 62.83 2k1p n SER 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k1p n ALA 66 N -2.33 5.90 0.09 7.33 0.00 -1.26 -3.63 120.51 126.61 2k1p n ALA 66 Ca 0.15 -1.46 0.00 0.00 0.00 0.00 0.00 53.44 52.13 2k1p n ALA 66 Cb 0.49 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.88 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 2.30 0.15 -4.55 0.00 5.15 -1.26 -4.97 115.26 112.07 2k1p n ASN 67 Ca 0.34 0.30 -0.39 0.00 -0.60 0.00 0.00 54.58 54.23 2k1p n ASN 67 Cb 0.84 0.15 -0.03 0.00 -0.53 0.00 0.00 39.78 40.20 2k1p n ASN 67 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2k1p s ASP 68 N -5.22 5.58 0.64 1.20 1.11 -1.22 -4.41 116.67 114.34 2k1p s ASP 68 Ca 0.00 -0.03 -0.07 0.00 0.18 0.00 0.00 52.55 52.63 2k1p s ASP 68 Cb 0.00 -2.54 0.02 0.00 1.07 0.00 0.00 42.92 41.47 2k1p s ASP 68 CO 0.00 -2.20 0.97 -1.66 1.18 0.00 0.00 175.17 173.45 2k1p s TRP 69 N 7.95 3.21 -0.03 4.23 1.48 -1.26 -4.84 118.94 129.68 2k1p s TRP 69 Ca 0.56 0.70 0.03 0.00 -1.06 0.00 0.00 56.10 56.34 2k1p s TRP 69 Cb -0.10 -2.89 -0.00 0.00 -1.16 0.00 0.00 33.47 29.31 2k1p s TRP 69 CO 0.17 -1.00 -0.13 -1.14 -4.06 0.00 0.00 176.95 170.79 2k1p s GLN 70 N -5.12 1.25 0.66 3.25 0.74 -1.26 -3.27 119.66 115.91 2k1p s GLN 70 Ca 0.56 -0.44 -0.17 0.00 0.05 0.00 0.00 55.36 55.35 2k1p s GLN 70 Cb -0.11 -1.14 -0.01 0.00 1.10 0.00 0.00 33.01 32.85 2k1p s GLN 70 CO 0.47 0.20 1.18 0.00 -0.55 0.00 0.00 175.29 176.58 2k1p n LYS 72 N -1.84 1.25 -0.08 0.00 2.85 -1.26 -3.17 118.16 115.91 2k1p n LYS 72 Ca 0.15 -0.96 -0.10 0.00 -1.05 0.00 0.00 58.31 56.35 2k1p n LYS 72 Cb 0.48 -1.45 -0.03 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 -0.06 1.46 1.02 0.58 -1.04 -1.26 -4.65 114.28 110.32 2k1p n THR 73 Ca 0.09 0.12 0.11 0.00 -2.04 0.00 0.00 64.05 62.33 2k1p n THR 73 Cb 0.45 -2.23 0.15 0.00 -1.82 0.00 0.00 70.33 66.88 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 -1.41 -5.14 -4.81 0.00 7.64 -1.19 -4.98 113.62 103.73 2k1p n SER 75 Ca 0.06 0.41 -0.36 0.00 1.01 0.00 0.00 58.87 59.98 2k1p n SER 75 Cb 0.34 -4.21 -0.07 0.00 -1.01 0.00 0.00 64.21 59.26 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 -2.77 6.25 -0.15 6.43 2.47 -1.26 -4.71 114.94 121.20 2k1p s ASN 76 Ca 0.00 0.36 -0.29 0.00 0.42 0.00 0.00 52.86 53.34 2k1p s ASN 76 Cb 0.00 -2.05 -0.01 0.00 -1.45 0.00 0.00 41.25 37.74 2k1p s ASN 76 CO 0.00 0.32 1.05 0.54 -3.72 0.00 0.00 177.10 175.29 2k1p s VAL 77 N -0.48 4.68 0.00 -5.21 0.11 -1.26 -1.18 120.40 117.06 2k1p s VAL 77 Ca 0.12 1.98 0.00 0.00 -2.93 0.00 0.00 61.98 61.15 2k1p s VAL 77 Cb -0.12 -4.27 0.00 0.00 -1.53 0.00 0.00 36.38 30.46 2k1p s VAL 77 CO 0.02 -0.07 0.00 0.59 -3.33 0.00 0.00 175.10 172.31 2k1p n ASN 78 N 5.59 0.00 -4.80 3.54 3.02 -1.20 -4.96 115.26 116.45 2k1p n ASN 78 Ca 0.10 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.32 2k1p n ASN 78 Cb 0.47 0.00 0.00 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 0.90 2.96 -2.00 3.10 -0.00 -1.26 -4.88 118.94 117.76 2k1p s TRP 79 Ca 0.00 1.53 0.04 0.00 -0.00 0.00 0.00 56.10 57.67 2k1p s TRP 79 Cb 0.00 -3.04 0.24 0.00 -0.00 0.00 0.00 33.47 30.68 2k1p s TRP 79 CO 0.00 -1.10 0.61 0.00 -0.00 0.00 0.00 176.95 176.46 2k1p n ALA 80 N -1.82 1.72 -2.33 5.86 0.00 -1.26 -2.33 120.51 120.35 2k1p n ALA 80 Ca 0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.47 2k1p n ALA 80 Cb 0.53 -1.07 0.04 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.82 0.62 -2.00 0.00 0.00 -1.26 -3.42 116.66 109.78 2k1p n ARG 81 Ca 0.03 -0.86 -0.39 0.00 -0.00 0.00 0.00 57.85 56.63 2k1p n ARG 81 Cb 0.01 0.40 -0.00 0.00 -0.00 0.00 0.00 32.46 32.87 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 0.06 3.91 0.20 2.89 1.81 -0.99 -4.92 118.95 121.91 2k1p s ARG 82 Ca 0.04 2.21 0.05 0.00 -1.72 0.00 0.00 55.73 56.30 2k1p s ARG 82 Cb 0.20 -2.73 0.13 0.00 -0.45 0.00 0.00 34.95 32.10 2k1p s ARG 82 CO -0.06 -0.56 1.47 0.66 -0.68 0.00 0.00 175.30 176.14 2k1p h SER 83 N 2.60 0.21 -5.04 0.23 4.64 -1.96 -3.44 113.55 110.79 2k1p h SER 83 Ca -0.50 -0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 60.63 2k1p h SER 83 Cb 1.25 -0.06 -0.14 0.00 -0.31 0.00 0.00 62.40 63.14 2k1p h SER 83 CO 0.62 0.88 0.02 -1.83 -0.87 0.00 0.00 176.83 175.65 2k1p s GLU 84 N -3.44 1.11 0.44 4.77 -1.05 -1.26 -0.49 118.70 118.78 2k1p s GLU 84 Ca -0.03 -0.52 -0.25 0.00 -0.15 0.00 0.00 54.97 54.02 2k1p s GLU 84 Cb 0.11 0.50 -0.09 0.00 -0.44 0.00 0.00 34.13 34.21 2k1p s GLU 84 CO 0.81 -0.44 1.30 0.00 0.95 0.00 0.00 175.26 177.88 2k1p h ASN 86 N 2.05 0.00 0.00 0.00 -1.24 -1.95 -2.42 115.58 112.01 2k1p h ASN 86 Ca -0.49 -0.09 -0.33 0.00 0.71 0.00 0.00 56.30 56.11 2k1p h ASN 86 Cb 1.29 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 40.29 2k1p h ASN 86 CO 0.60 0.05 -2.06 0.23 -1.29 0.00 0.00 177.43 174.95 2k1p n MET 87 N -2.24 0.50 0.07 6.67 2.81 -1.26 -4.67 117.12 118.99 2k1p n MET 87 Ca 0.04 0.21 0.08 0.00 -1.81 0.00 0.00 57.70 56.23 2k1p n MET 87 Cb 0.44 -1.34 -0.04 0.00 -0.71 0.00 0.00 33.22 31.57 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 -2.69 -3.95 -4.66 0.00 2.85 -0.91 -4.97 115.26 100.93 2k1p n ASN 89 Ca -0.03 0.09 -0.43 0.00 -0.11 0.00 0.00 54.58 54.10 2k1p n ASN 89 Cb 0.64 -1.78 -0.02 0.00 1.24 0.00 0.00 39.78 39.85 2k1p n ASN 89 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2k1p s THR 90 N -1.97 4.11 0.29 -0.44 2.01 -1.26 -4.56 115.64 113.82 2k1p s THR 90 Ca 0.00 1.35 -0.30 0.00 0.31 0.00 0.00 61.69 63.05 2k1p s THR 90 Cb 0.00 -3.87 -0.12 0.00 0.01 0.00 0.00 72.50 68.52 2k1p s THR 90 CO 0.00 -0.11 1.53 -0.81 -0.69 0.00 0.00 174.62 174.54 2k1p n PRO 91 N 6.55 2.52 0.00 4.92 -0.04 -1.26 0.07 135.00 147.77 2k1p n PRO 91 Ca 0.14 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.50 2k1p n PRO 91 Cb 0.44 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 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 1.83 0.00 -2.40 0.54 4.81 0.36 -1.74 118.16 121.56 2k1p n LYS 92 Ca 0.08 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.36 2k1p n LYS 92 Cb 0.36 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.43 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 -0.89 2.29 -2.92 5.64 4.01 -1.26 -4.83 117.16 119.21 2k1p n TYR 93 Ca 0.00 -2.43 -0.44 0.00 -0.16 0.00 0.00 57.90 54.87 2k1p n TYR 93 Cb 0.00 -0.27 -0.03 0.00 -0.31 0.00 0.00 39.34 38.73 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 -3.59 3.31 -2.90 -0.72 0.00 -0.71 -5.22 121.76 111.93 2k1p s ALA 94 Ca 0.41 -2.53 0.25 0.00 0.00 0.00 0.00 51.96 50.09 2k1p s ALA 94 Cb 0.39 -3.98 0.37 0.00 0.00 0.00 0.00 23.12 19.90 2k1p s ALA 94 CO -0.02 -2.90 1.36 0.36 0.00 0.00 0.00 175.76 174.55