#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1p s SER 64 N 0.00 4.23 -0.47 1.61 1.04 -1.26 -5.09 113.70 113.77 2k1p s SER 64 Ca 0.00 -1.18 -0.28 0.00 0.48 0.00 0.00 55.95 54.97 2k1p s SER 64 Cb 0.00 -0.45 0.03 0.00 0.10 0.00 0.00 66.02 65.70 2k1p s SER 64 CO 0.00 -0.51 1.08 -0.44 0.98 0.00 0.00 173.24 174.35 2k1p s SER 65 N -3.84 6.61 -0.12 7.02 0.01 -1.26 -4.92 113.70 117.20 2k1p s SER 65 Ca 0.39 0.40 -0.07 0.00 1.31 0.00 0.00 55.95 57.98 2k1p s SER 65 Cb 0.06 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 2k1p s SER 65 CO 0.21 -1.18 0.04 0.00 0.41 0.00 0.00 173.24 172.71 2k1p h ALA 66 N 9.14 0.01 -0.08 1.44 0.00 -1.99 -3.40 119.26 124.38 2k1p h ALA 66 Ca -0.23 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2k1p h ALA 66 Cb 1.06 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2k1p h ALA 66 CO 1.10 0.18 0.00 -1.71 0.00 0.00 0.00 179.25 178.82 2k1p n ASN 67 N -4.70 2.30 -4.67 0.00 5.15 -1.26 -5.00 115.26 107.08 2k1p n ASN 67 Ca -0.05 -1.64 -0.27 0.00 -0.60 0.00 0.00 54.58 52.02 2k1p n ASN 67 Cb 0.16 -0.05 -0.09 0.00 -0.53 0.00 0.00 39.78 39.27 2k1p n ASN 67 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 2k1p s ASP 68 N -1.11 4.10 0.23 1.20 1.47 -1.24 -4.25 116.67 117.07 2k1p s ASP 68 Ca 0.18 -1.27 -0.02 0.00 1.18 0.00 0.00 52.55 52.62 2k1p s ASP 68 Cb 0.12 -0.39 -0.03 0.00 -0.34 0.00 0.00 42.92 42.28 2k1p s ASP 68 CO 0.17 -0.51 0.22 -1.66 0.68 0.00 0.00 175.17 174.08 2k1p s TRP 69 N -2.68 1.08 -0.04 2.11 1.48 -1.19 -4.69 118.94 115.01 2k1p s TRP 69 Ca 0.36 -1.29 0.03 0.00 -1.06 0.00 0.00 56.10 54.14 2k1p s TRP 69 Cb 0.07 -0.43 0.00 0.00 -1.16 0.00 0.00 33.47 31.96 2k1p s TRP 69 CO 0.19 -0.75 -0.12 -1.14 -4.06 0.00 0.00 176.95 171.08 2k1p s GLN 70 N -4.01 1.35 0.57 3.25 0.74 -1.26 -3.62 119.66 116.68 2k1p s GLN 70 Ca 0.36 -0.41 -0.18 0.00 0.05 0.00 0.00 55.36 55.18 2k1p s GLN 70 Cb 0.05 -1.19 -0.04 0.00 1.10 0.00 0.00 33.01 32.92 2k1p s GLN 70 CO 0.13 0.13 1.11 0.00 -0.55 0.00 0.00 175.29 176.11 2k1p n LYS 72 N -1.64 1.11 -0.12 0.00 2.85 -1.26 -2.70 118.16 116.40 2k1p n LYS 72 Ca 0.11 -0.90 -0.24 0.00 -1.05 0.00 0.00 58.31 56.23 2k1p n LYS 72 Cb 0.52 -1.47 -0.11 0.00 -0.65 0.00 0.00 35.03 33.31 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 -0.17 1.54 0.87 0.58 -1.04 -1.26 -4.46 114.28 110.34 2k1p n THR 73 Ca 0.09 -0.44 0.10 0.00 -2.04 0.00 0.00 64.05 61.76 2k1p n THR 73 Cb 0.45 -1.72 -0.13 0.00 -1.82 0.00 0.00 70.33 67.11 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 -5.23 -4.84 0.00 7.64 -1.10 -4.98 113.62 103.52 2k1p n SER 75 Ca 0.03 0.35 -0.36 0.00 1.01 0.00 0.00 58.87 59.90 2k1p n SER 75 Cb 0.36 -3.98 -0.07 0.00 -1.01 0.00 0.00 64.21 59.52 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 -2.65 6.16 -0.13 6.43 2.47 -1.25 -4.83 114.94 121.15 2k1p s ASN 76 Ca 0.00 0.40 -0.26 0.00 0.42 0.00 0.00 52.86 53.42 2k1p s ASN 76 Cb 0.00 -1.95 -0.02 0.00 -1.45 0.00 0.00 41.25 37.83 2k1p s ASN 76 CO 0.00 0.40 0.86 0.54 -3.72 0.00 0.00 177.10 175.18 2k1p s VAL 77 N -1.02 4.88 0.00 -5.21 0.11 -1.26 -1.68 120.40 116.23 2k1p s VAL 77 Ca 0.15 1.73 0.00 0.00 -2.93 0.00 0.00 61.98 60.94 2k1p s VAL 77 Cb -0.12 -4.18 0.00 0.00 -1.53 0.00 0.00 36.38 30.55 2k1p s VAL 77 CO 0.04 0.06 0.00 0.59 -3.33 0.00 0.00 175.10 172.47 2k1p n ASN 78 N 4.86 0.00 -4.79 3.54 3.02 -1.24 -4.96 115.26 115.69 2k1p n ASN 78 Ca 0.05 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.26 2k1p n ASN 78 Cb 0.49 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.64 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 2.20 2.93 0.52 3.10 -0.00 -1.26 -4.90 118.94 121.53 2k1p s TRP 79 Ca 0.00 1.56 0.36 0.00 -0.00 0.00 0.00 56.10 58.02 2k1p s TRP 79 Cb 0.00 -3.10 1.51 0.00 -0.00 0.00 0.00 33.47 31.88 2k1p s TRP 79 CO 0.00 -1.02 1.76 0.00 -0.00 0.00 0.00 176.95 177.69 2k1p h ALA 80 N 1.33 3.08 0.00 5.86 0.00 -1.89 -2.16 119.26 125.47 2k1p h ALA 80 Ca -0.49 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.24 2k1p h ALA 80 Cb 1.23 0.10 -0.34 0.00 0.00 0.00 0.00 17.79 18.78 2k1p h ALA 80 CO 0.58 -1.47 -0.97 2.89 0.00 0.00 0.00 179.25 180.29 2k1p n ARG 81 N -4.24 0.13 -1.69 0.00 1.85 -1.26 -3.20 116.66 108.25 2k1p n ARG 81 Ca 0.29 -2.05 -0.44 0.00 -1.00 0.00 0.00 57.85 54.65 2k1p n ARG 81 Cb 1.31 -0.16 -0.03 0.00 -1.05 0.00 0.00 32.46 32.52 2k1p n ARG 81 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2k1p n ARG 82 N 0.34 2.63 0.20 2.89 1.74 -0.81 -4.85 116.66 118.80 2k1p n ARG 82 Ca 0.07 0.95 0.14 0.00 -0.77 0.00 0.00 57.85 58.24 2k1p n ARG 82 Cb 1.09 -2.82 0.49 0.00 -1.02 0.00 0.00 32.46 30.20 2k1p n ARG 82 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2k1p h SER 83 N 8.01 0.00 -5.00 0.55 0.02 -1.96 -3.43 113.55 111.74 2k1p h SER 83 Ca -0.46 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.38 2k1p h SER 83 Cb 1.23 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.58 2k1p h SER 83 CO 0.94 0.00 -0.21 -1.83 -1.14 0.00 0.00 176.83 174.59 2k1p s GLU 84 N -3.40 0.74 0.57 3.45 -1.05 -1.26 -1.28 118.70 116.48 2k1p s GLU 84 Ca 0.05 -0.19 -0.19 0.00 -0.15 0.00 0.00 54.97 54.49 2k1p s GLU 84 Cb 0.09 0.33 -0.04 0.00 -0.44 0.00 0.00 34.13 34.07 2k1p s GLU 84 CO 0.54 -0.22 1.16 0.00 0.95 0.00 0.00 175.26 177.70 2k1p n ASN 86 N -1.51 0.86 -0.03 0.00 5.15 -1.26 -1.86 115.26 116.61 2k1p n ASN 86 Ca 0.12 0.37 -0.22 0.00 -0.60 0.00 0.00 54.58 54.26 2k1p n ASN 86 Cb 0.50 0.21 -0.13 0.00 -0.53 0.00 0.00 39.78 39.84 2k1p n ASN 86 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 2k1p n MET 87 N -2.85 0.71 -0.06 1.20 1.56 -1.26 -4.45 117.12 111.97 2k1p n MET 87 Ca -0.08 0.34 -0.01 0.00 -0.27 0.00 0.00 57.70 57.68 2k1p n MET 87 Cb 0.79 -1.71 -0.16 0.00 2.15 0.00 0.00 33.22 34.28 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 -2.53 -4.42 -4.80 0.00 5.15 -0.78 -4.97 115.26 102.91 2k1p n ASN 89 Ca -0.20 0.20 -0.38 0.00 -0.60 0.00 0.00 54.58 53.59 2k1p n ASN 89 Cb 0.90 -3.30 -0.06 0.00 -0.53 0.00 0.00 39.78 36.79 2k1p n ASN 89 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2k1p s THR 90 N -2.56 4.87 0.75 -0.44 -1.32 -1.26 -4.66 115.64 111.02 2k1p s THR 90 Ca 0.00 1.10 -0.14 0.00 -1.21 0.00 0.00 61.69 61.44 2k1p s THR 90 Cb 0.00 -3.85 0.05 0.00 -1.51 0.00 0.00 72.50 67.19 2k1p s THR 90 CO 0.00 0.53 1.20 -2.16 -2.21 0.00 0.00 174.62 171.98 2k1p s PRO 91 N -0.86 2.00 0.00 7.08 0.04 -1.26 0.62 135.00 142.61 2k1p s PRO 91 Ca 0.28 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2k1p s PRO 91 Cb -0.18 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2k1p s PRO 91 CO 0.17 -1.94 0.60 1.17 0.04 0.00 0.00 177.00 177.04 2k1p n LYS 92 N -2.92 0.00 -3.52 4.56 4.81 -0.40 -4.12 118.16 116.56 2k1p n LYS 92 Ca 0.13 0.60 -0.27 0.00 -0.87 0.00 0.00 58.31 57.90 2k1p n LYS 92 Cb 0.50 -0.93 -0.14 0.00 0.02 0.00 0.00 35.03 34.49 2k1p n LYS 92 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2k1p s TYR 93 N -2.65 0.20 -1.00 5.64 2.02 -1.26 -4.82 117.35 115.48 2k1p s TYR 93 Ca 0.00 -0.77 -0.03 0.00 -0.37 0.00 0.00 57.07 55.90 2k1p s TYR 93 Cb 0.00 -0.83 0.28 0.00 -0.40 0.00 0.00 41.96 41.01 2k1p s TYR 93 CO 0.00 -0.84 1.22 0.00 -1.57 0.00 0.00 175.55 174.37 2k1p n ALA 94 N 5.26 4.69 -1.54 3.71 0.00 -1.26 -5.26 120.51 126.10 2k1p n ALA 94 Ca -0.05 -4.76 0.00 0.00 0.00 0.00 0.00 53.44 48.63 2k1p n ALA 94 Cb 0.43 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.82 2k1p n ALA 94 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86