#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 5.67 -3.42 1.61 7.64 -1.26 -4.69 113.62 119.17 2k1p n SER 64 Ca 0.00 -2.75 -0.23 0.00 1.01 0.00 0.00 58.87 56.91 2k1p n SER 64 Cb 0.00 -1.62 -0.10 0.00 -1.01 0.00 0.00 64.21 61.48 2k1p n SER 64 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2k1p s SER 65 N 2.80 2.17 -0.11 6.43 0.01 -1.26 -5.02 113.70 118.72 2k1p s SER 65 Ca 0.55 -1.71 -0.03 0.00 1.31 0.00 0.00 55.95 56.07 2k1p s SER 65 Cb 0.15 0.09 -0.03 0.00 0.21 0.00 0.00 66.02 66.44 2k1p s SER 65 CO -0.08 -0.31 0.08 0.00 0.41 0.00 0.00 173.24 173.34 2k1p h ALA 66 N 7.30 0.00 0.00 1.44 0.00 -2.01 -3.46 119.26 122.53 2k1p h ALA 66 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2k1p h ALA 66 Cb 1.02 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2k1p h ALA 66 CO 0.26 0.01 -0.75 -1.71 0.00 0.00 0.00 179.25 177.06 2k1p n ASN 67 N -4.76 0.25 -4.73 0.00 5.15 -1.26 -5.03 115.26 104.88 2k1p n ASN 67 Ca -0.01 0.03 -0.42 0.00 -0.60 0.00 0.00 54.58 53.58 2k1p n ASN 67 Cb 0.06 -0.07 -0.03 0.00 -0.53 0.00 0.00 39.78 39.21 2k1p n ASN 67 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2k1p n ASP 68 N -3.10 3.89 -4.66 1.20 5.75 -1.15 -4.69 116.55 113.79 2k1p n ASP 68 Ca 0.00 1.10 -0.26 0.00 -0.01 0.00 0.00 54.79 55.61 2k1p n ASP 68 Cb 0.37 -1.57 -0.09 0.00 -1.03 0.00 0.00 41.12 38.80 2k1p n ASP 68 CO 0.00 0.00 0.00 -1.66 -0.11 0.00 0.00 177.20 175.43 2k1p s TRP 69 N 0.70 2.55 -0.07 2.11 1.48 -1.25 -4.72 118.94 119.73 2k1p s TRP 69 Ca 0.71 -0.59 0.02 0.00 -1.06 0.00 0.00 56.10 55.18 2k1p s TRP 69 Cb -0.51 -1.76 0.01 0.00 -1.16 0.00 0.00 33.47 30.05 2k1p s TRP 69 CO 0.39 0.37 -0.12 -1.14 -4.06 0.00 0.00 176.95 172.39 2k1p s GLN 70 N -3.77 1.69 0.45 3.25 0.74 -1.26 -1.79 119.66 118.97 2k1p s GLN 70 Ca 0.37 -0.39 -0.22 0.00 0.05 0.00 0.00 55.36 55.17 2k1p s GLN 70 Cb 0.06 -1.44 -0.08 0.00 1.10 0.00 0.00 33.01 32.64 2k1p s GLN 70 CO 0.20 -0.02 1.05 0.00 -0.55 0.00 0.00 175.29 175.97 2k1p n LYS 72 N -0.61 0.26 -0.08 0.00 2.85 -1.26 -2.28 118.16 117.05 2k1p n LYS 72 Ca 0.08 0.14 -0.12 0.00 -1.05 0.00 0.00 58.31 57.35 2k1p n LYS 72 Cb 0.51 -1.73 -0.07 0.00 -0.65 0.00 0.00 35.03 33.09 2k1p n LYS 72 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 2k1p h THR 73 N 0.00 0.70 0.00 0.58 2.02 -1.95 -3.38 112.91 110.88 2k1p h THR 73 Ca 0.00 -1.70 -0.00 0.00 0.77 0.00 0.00 66.41 65.48 2k1p h THR 73 Cb 0.73 1.50 -0.00 0.00 -1.74 0.00 0.00 68.15 68.64 2k1p h THR 73 CO 0.00 0.24 -0.68 0.00 0.37 0.00 0.00 175.52 175.45 2k1p n SER 75 N -2.82 -4.76 -4.82 0.00 7.64 -0.96 -5.00 113.62 102.89 2k1p n SER 75 Ca 0.01 0.27 -0.36 0.00 1.01 0.00 0.00 58.87 59.80 2k1p n SER 75 Cb 0.55 -3.68 -0.07 0.00 -1.01 0.00 0.00 64.21 60.00 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 -2.70 6.22 -0.03 6.43 2.47 -1.25 -4.89 114.94 121.19 2k1p s ASN 76 Ca 0.00 0.38 -0.30 0.00 0.42 0.00 0.00 52.86 53.36 2k1p s ASN 76 Cb 0.00 -2.02 -0.03 0.00 -1.45 0.00 0.00 41.25 37.76 2k1p s ASN 76 CO 0.00 0.35 1.01 0.54 -3.72 0.00 0.00 177.10 175.29 2k1p s VAL 77 N -0.70 4.75 0.00 -5.21 0.11 -1.26 -1.98 120.40 116.11 2k1p s VAL 77 Ca 0.13 1.99 0.00 0.00 -2.93 0.00 0.00 61.98 61.17 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 0.03 0.11 0.00 0.59 -3.33 0.00 0.00 175.10 172.49 2k1p n ASN 78 N 4.25 0.00 -4.75 3.54 3.02 -0.74 -4.96 115.26 115.62 2k1p n ASN 78 Ca 0.07 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.32 2k1p n ASN 78 Cb 0.50 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.78 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 0.78 2.53 -1.27 3.10 -0.00 -1.26 -4.84 118.94 117.99 2k1p s TRP 79 Ca 0.00 1.37 0.06 0.00 -0.00 0.00 0.00 56.10 57.53 2k1p s TRP 79 Cb 0.00 -3.09 0.30 0.00 -0.00 0.00 0.00 33.47 30.68 2k1p s TRP 79 CO 0.00 -2.02 1.11 0.00 -0.00 0.00 0.00 176.95 176.04 2k1p n ALA 80 N -3.64 1.41 -2.43 5.86 0.00 -1.26 -3.29 120.51 117.15 2k1p n ALA 80 Ca 0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.46 2k1p n ALA 80 Cb 0.54 -1.10 0.06 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 -1.37 0.81 -2.28 0.00 1.85 -1.26 -2.92 116.66 111.49 2k1p n ARG 81 Ca 0.02 -0.96 -0.36 0.00 -1.00 0.00 0.00 57.85 55.56 2k1p n ARG 81 Cb 0.06 0.40 -0.01 0.00 -1.05 0.00 0.00 32.46 31.86 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 0.08 3.60 0.11 2.89 0.52 -1.21 -4.95 118.95 119.99 2k1p s ARG 82 Ca 0.05 1.67 0.07 0.00 -0.52 0.00 0.00 55.73 57.01 2k1p s ARG 82 Cb 0.27 -2.22 -0.21 0.00 0.52 0.00 0.00 34.95 33.31 2k1p s ARG 82 CO -0.08 -0.66 1.24 0.77 0.02 0.00 0.00 175.30 176.59 2k1p h SER 83 N 1.66 0.02 -5.12 0.23 0.02 -1.95 -3.44 113.55 104.97 2k1p h SER 83 Ca -0.50 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.39 2k1p h SER 83 Cb 1.25 -0.01 -0.11 0.00 0.14 0.00 0.00 62.40 63.68 2k1p h SER 83 CO 0.59 1.02 -0.05 -1.83 -1.14 0.00 0.00 176.83 175.41 2k1p s GLU 84 N -2.70 1.31 0.62 3.45 1.03 -1.26 -0.23 118.70 120.92 2k1p s GLU 84 Ca 0.00 -0.92 -0.16 0.00 0.03 0.00 0.00 54.97 53.92 2k1p s GLU 84 Cb 0.10 0.49 -0.02 0.00 -0.80 0.00 0.00 34.13 33.89 2k1p s GLU 84 CO 0.82 -0.54 1.12 0.00 -1.33 0.00 0.00 175.26 175.33 2k1p n ASN 86 N -2.05 0.50 -0.08 0.00 6.94 -1.26 -2.52 115.26 116.79 2k1p n ASN 86 Ca 0.11 0.20 -0.12 0.00 -0.02 0.00 0.00 54.58 54.75 2k1p n ASN 86 Cb 0.52 0.98 -0.06 0.00 -2.36 0.00 0.00 39.78 38.86 2k1p n ASN 86 CO 0.00 0.00 0.00 0.24 -1.03 0.00 0.00 177.26 176.47 2k1p h MET 87 N 0.00 0.00 0.00 -3.83 2.86 -1.99 -3.40 114.93 108.57 2k1p h MET 87 Ca -0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2k1p h MET 87 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 2k1p h MET 87 CO 0.01 0.44 -1.20 0.00 1.06 0.00 0.00 176.91 177.22 2k1p n ASN 89 N -2.07 -5.09 -4.63 0.00 5.15 -1.05 -4.94 115.26 102.63 2k1p n ASN 89 Ca 0.01 0.23 -0.43 0.00 -0.60 0.00 0.00 54.58 53.79 2k1p n ASN 89 Cb 0.47 -4.14 -0.02 0.00 -0.53 0.00 0.00 39.78 35.55 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 -2.74 4.02 0.43 -0.44 2.01 -1.26 -4.48 115.64 113.19 2k1p s THR 90 Ca 0.00 1.17 -0.26 0.00 0.31 0.00 0.00 61.69 62.91 2k1p s THR 90 Cb 0.00 -4.01 -0.09 0.00 0.01 0.00 0.00 72.50 68.41 2k1p s THR 90 CO 0.00 -0.39 1.40 -2.65 -0.69 0.00 0.00 174.62 172.29 2k1p n PRO 91 N 7.34 2.22 -0.06 4.92 -0.02 -1.26 -0.62 135.00 147.52 2k1p n PRO 91 Ca 0.16 0.79 -0.01 0.00 -2.02 0.00 0.00 63.50 62.41 2k1p n PRO 91 Cb 0.46 -2.57 -0.01 0.00 -0.02 0.00 0.00 33.50 31.36 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 -0.04 -0.06 -2.64 -0.52 4.81 0.68 -1.27 118.16 119.12 2k1p n LYS 92 Ca 0.05 0.26 -0.14 0.00 -0.87 0.00 0.00 58.31 57.61 2k1p n LYS 92 Cb 0.40 -0.38 0.02 0.00 0.02 0.00 0.00 35.03 35.09 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 -3.66 1.71 -2.71 5.64 4.01 -1.26 -4.93 117.16 115.96 2k1p n TYR 93 Ca 0.00 -2.93 -0.43 0.00 -0.16 0.00 0.00 57.90 54.38 2k1p n TYR 93 Cb 0.04 -0.31 -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 -3.20 3.35 0.00 -0.72 0.00 -0.40 -5.26 121.76 115.53 2k1p s ALA 94 Ca 0.33 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.91 2k1p s ALA 94 Cb 0.44 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.88 2k1p s ALA 94 CO -0.02 -1.78 0.09 0.36 0.00 0.00 0.00 175.76 174.40