#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rng s PRO 2 N 0.00 3.42 0.00 1.20 0.04 -1.26 -5.04 135.00 133.36 2rng s PRO 2 Ca 0.00 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2rng s PRO 2 Cb 0.00 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2rng s PRO 2 CO 0.00 -0.74 0.00 1.47 0.04 0.00 0.00 177.00 177.77 2rng n LEU 3 N -1.72 0.00 -4.82 -3.56 -0.00 -1.26 -4.91 117.00 100.73 2rng n LEU 3 Ca 0.09 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.74 2rng n LEU 3 Cb 0.53 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.89 2rng n LEU 3 CO 0.45 -0.72 0.34 -0.63 -0.00 0.00 0.00 177.39 176.83 2rng s ILE 4 N -0.19 4.67 0.67 1.47 -1.09 -1.26 -5.06 121.20 120.41 2rng s ILE 4 Ca 0.00 1.17 -0.11 0.00 -2.23 0.00 0.00 60.65 59.48 2rng s ILE 4 Cb 0.00 -3.85 -0.01 0.00 -1.58 0.00 0.00 42.46 37.02 2rng s ILE 4 CO 0.00 0.31 1.06 -2.16 -1.23 0.00 0.00 174.94 172.93 2rng s PRO 5 N -1.73 3.16 0.37 2.79 0.04 -1.26 -4.97 135.00 133.39 2rng s PRO 5 Ca 0.38 0.64 0.22 0.00 0.04 0.00 0.00 61.00 62.29 2rng s PRO 5 Cb -0.17 -2.04 0.24 0.00 0.04 0.00 0.00 34.50 32.57 2rng s PRO 5 CO 0.20 -0.86 1.46 0.00 0.04 0.00 0.00 177.00 177.84 2rng h ALA 6 N -0.53 0.86 -0.94 8.56 0.00 -1.97 -3.31 119.26 121.93 2rng h ALA 6 Ca -0.45 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.49 2rng h ALA 6 Cb 1.22 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 2rng h ALA 6 CO 0.62 0.04 0.61 0.97 0.00 0.00 0.00 179.25 181.50 2rng h ILE 7 N 0.00 1.10 0.00 0.00 6.09 -1.94 -0.40 117.51 122.36 2rng h ILE 7 Ca -0.00 -0.38 -0.01 0.00 -1.37 0.00 0.00 64.86 63.09 2rng h ILE 7 Cb 1.03 -0.11 -0.00 0.00 0.47 0.00 0.00 36.82 38.20 2rng h ILE 7 CO 0.00 0.20 -0.05 1.88 -3.07 0.00 0.00 178.15 177.11 2rng h TYR 8 N 1.11 0.00 -3.02 2.19 0.05 -1.92 -3.34 116.97 112.04 2rng h TYR 8 Ca 0.40 0.00 -0.54 0.00 0.05 0.00 0.00 58.73 58.64 2rng h TYR 8 Cb 0.14 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.88 2rng h TYR 8 CO -0.00 0.05 0.74 0.42 -1.05 0.00 0.00 178.16 178.32 2rng s ILE 9 N -4.24 3.88 -1.42 -2.88 1.01 -0.16 -2.24 121.20 115.14 2rng s ILE 9 Ca -0.03 1.28 -0.01 0.00 0.00 0.00 0.00 60.65 61.88 2rng s ILE 9 Cb 0.13 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.78 2rng s ILE 9 CO 0.53 0.03 0.10 0.61 0.00 0.00 0.00 174.94 176.21 2rng n GLY 10 N 3.48 -0.33 0.00 6.18 0.00 0.12 -4.98 105.19 109.66 2rng n GLY 10 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2rng n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rng n ALA 11 N -2.10 0.00 -3.25 4.61 0.00 -0.87 -4.91 120.51 113.99 2rng n ALA 11 Ca -0.18 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.21 2rng n ALA 11 Cb 0.64 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.05 2rng n ALA 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2rng s THR 12 N 0.48 -0.76 0.68 0.00 2.01 -1.26 -1.92 115.64 114.88 2rng s THR 12 Ca 0.00 -0.21 0.03 0.00 0.31 0.00 0.00 61.69 61.82 2rng s THR 12 Cb 0.00 -0.96 0.12 0.00 0.01 0.00 0.00 72.50 71.67 2rng s THR 12 CO 0.00 -0.19 0.94 0.68 -0.69 0.00 0.00 174.62 175.36 2rng s VAL 13 N 2.60 2.09 0.00 3.82 -7.23 0.32 -4.75 120.40 117.24 2rng s VAL 13 Ca 0.10 -0.74 0.00 0.00 -1.81 0.00 0.00 61.98 59.53 2rng s VAL 13 Cb -0.11 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.48 2rng s VAL 13 CO -0.28 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 2rng n GLY 14 N -2.67 0.43 0.12 2.32 0.00 -1.23 0.23 105.19 104.38 2rng n GLY 14 Ca 0.16 -1.83 -0.15 0.00 0.00 0.00 0.00 46.02 44.20 2rng n GLY 14 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rng h PRO 15 N 0.00 0.28 -0.15 1.61 0.13 -1.82 -2.37 132.00 129.69 2rng h PRO 15 Ca 0.00 -0.23 -0.02 0.00 -0.87 0.00 0.00 66.00 64.88 2rng h PRO 15 Cb 0.00 0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.17 2rng h PRO 15 CO 0.00 0.87 0.02 0.77 -0.23 0.00 0.00 178.00 179.43 2rng h SER 16 N -0.24 0.24 -0.44 1.44 0.02 -1.94 -2.77 113.55 109.86 2rng h SER 16 Ca -0.02 -0.28 0.02 0.00 -0.84 0.00 0.00 61.79 60.68 2rng h SER 16 Cb 0.92 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 2rng h SER 16 CO 0.06 0.45 0.25 0.58 -1.14 0.00 0.00 176.83 177.03 2rng h VAL 17 N 0.02 1.04 -0.00 2.27 2.07 -1.94 -2.48 116.25 117.22 2rng h VAL 17 Ca 0.04 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.42 2rng h VAL 17 Cb 0.32 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.52 2rng h VAL 17 CO 0.00 0.09 -0.34 -0.25 0.02 0.00 0.00 177.57 177.10 2rng h TRP 18 N 0.51 -0.94 -0.80 1.57 7.01 -1.35 -0.54 115.95 121.41 2rng h TRP 18 Ca 0.17 0.03 0.16 0.00 2.11 0.00 0.00 58.89 61.37 2rng h TRP 18 Cb 0.02 0.41 -0.06 0.00 -2.10 0.00 0.00 29.16 27.44 2rng h TRP 18 CO -0.07 -0.43 0.53 0.00 -2.79 0.00 0.00 178.44 175.68 2rng h ALA 19 N 0.21 2.13 0.64 2.65 0.00 -1.28 -1.75 119.26 121.85 2rng h ALA 19 Ca 0.06 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2rng h ALA 19 Cb 0.58 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2rng h ALA 19 CO -0.28 -0.35 -0.31 -0.92 0.00 0.00 0.00 179.25 177.39 2rng h TYR 20 N 0.43 -0.79 -0.93 0.00 3.20 -0.67 -2.51 116.97 115.69 2rng h TYR 20 Ca 0.40 -0.02 0.19 0.00 3.14 0.00 0.00 58.73 62.45 2rng h TYR 20 Cb 0.93 0.26 -0.08 0.00 1.54 0.00 0.00 36.73 39.38 2rng h TYR 20 CO -0.00 -0.47 0.60 1.25 -1.64 0.00 0.00 178.16 177.91 2rng h LEU 21 N -1.17 0.52 -0.12 2.82 6.46 -0.90 -0.98 115.31 121.94 2rng h LEU 21 Ca -0.09 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 57.72 2rng h LEU 21 Cb 0.69 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 2rng h LEU 21 CO 0.14 0.21 0.05 0.58 -0.62 0.00 0.00 178.44 178.81 2rng h VAL 22 N 0.52 1.13 -0.65 1.05 2.07 -1.23 -1.91 116.25 117.23 2rng h VAL 22 Ca 0.49 -0.39 0.08 0.00 0.82 0.00 0.00 66.70 67.71 2rng h VAL 22 Cb 1.07 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 2rng h VAL 22 CO -0.23 0.12 0.43 0.00 0.02 0.00 0.00 177.57 177.91 2rng h ALA 23 N 0.91 1.88 -0.37 1.67 0.00 -0.74 2.17 119.26 124.78 2rng h ALA 23 Ca 0.04 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 2rng h ALA 23 Cb 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2rng h ALA 23 CO -0.00 -0.01 -0.37 1.25 0.00 0.00 0.00 179.25 180.12 2rng h LEU 24 N 0.55 0.93 0.00 0.00 5.85 -0.97 -3.42 115.31 118.26 2rng h LEU 24 Ca 0.29 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2rng h LEU 24 Cb 0.42 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2rng h LEU 24 CO -0.09 1.19 -0.45 0.55 -0.34 0.00 0.00 178.44 179.30 2rng n VAL 25 N -4.06 0.14 0.00 1.05 3.14 -0.56 -5.05 118.33 112.99 2rng n VAL 25 Ca -0.02 0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.41 2rng n VAL 25 Cb 0.53 -1.07 0.00 0.00 -1.06 0.00 0.00 33.84 32.24 2rng n VAL 25 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2rng n GLY 26 N 2.40 3.67 0.00 7.55 0.00 0.72 -4.83 105.19 114.70 2rng n GLY 26 Ca 0.00 -1.71 0.04 0.00 0.00 0.00 0.00 46.02 44.34 2rng n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rng n ALA 27 N -1.74 1.44 0.02 4.61 0.00 -1.26 -2.03 120.51 121.55 2rng n ALA 27 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 2rng n ALA 27 Cb 0.00 -1.12 -0.01 0.00 0.00 0.00 0.00 19.45 18.32 2rng n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rng h ALA 28 N 2.31 -0.22 0.00 0.00 0.00 -1.95 -1.94 119.26 117.46 2rng h ALA 28 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2rng h ALA 28 Cb 0.10 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2rng h ALA 28 CO 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.04 2rng h ALA 29 N -1.74 1.00 -0.01 0.00 0.00 -1.88 -1.16 119.26 115.48 2rng h ALA 29 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 2rng h ALA 29 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2rng h ALA 29 CO 0.01 0.00 -0.82 0.28 0.00 0.00 0.00 179.25 178.72 2rng h VAL 30 N 0.00 1.47 0.00 0.00 2.07 -1.47 -1.62 116.25 116.70 2rng h VAL 30 Ca 0.00 -2.48 -0.19 0.00 0.82 0.00 0.00 66.70 64.85 2rng h VAL 30 Cb 0.23 2.37 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 2rng h VAL 30 CO 0.00 0.73 -1.27 0.74 0.02 0.00 0.00 177.57 177.78 2rng h THR 31 N 0.13 0.77 0.00 2.57 2.02 -0.45 -3.27 112.91 114.67 2rng h THR 31 Ca -0.04 -2.34 0.00 0.00 0.77 0.00 0.00 66.41 64.80 2rng h THR 31 Cb 1.42 2.27 0.00 0.00 -1.74 0.00 0.00 68.15 70.10 2rng h THR 31 CO 0.13 0.44 -0.29 0.00 0.37 0.00 0.00 175.52 176.16 2rng h ALA 32 N 1.30 0.85 -0.16 6.16 0.00 -1.27 -3.19 119.26 122.95 2rng h ALA 32 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2rng h ALA 32 Cb 1.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2rng h ALA 32 CO 0.07 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.32 2rng n ALA 33 N -2.12 2.49 -3.04 0.00 0.00 -0.61 -4.93 120.51 112.30 2rng n ALA 33 Ca 0.03 -0.30 -0.03 0.00 0.00 0.00 0.00 53.44 53.13 2rng n ALA 33 Cb 0.53 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.97 2rng n ALA 33 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2rng n ASN 34 N -0.04 -7.72 -3.98 0.00 4.05 -1.21 -1.29 115.26 105.08 2rng n ASN 34 Ca 0.07 0.05 -0.30 0.00 0.45 0.00 0.00 54.58 54.85 2rng n ASN 34 Cb 0.15 -5.17 -0.16 0.00 1.23 0.00 0.00 39.78 35.83 2rng n ASN 34 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2rng s ILE 35 N -2.88 1.57 0.12 -1.44 1.01 -1.23 0.13 121.20 118.47 2rng s ILE 35 Ca 0.07 -0.97 -0.00 0.00 0.00 0.00 0.00 60.65 59.75 2rng s ILE 35 Cb -0.02 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 2rng s ILE 35 CO 0.76 0.15 0.29 -0.13 0.00 0.00 0.00 174.94 176.02 2rng s ARG 36 N 1.43 3.48 0.35 2.79 0.52 -0.81 -4.91 118.95 121.81 2rng s ARG 36 Ca -0.01 -0.40 -0.00 0.00 -0.52 0.00 0.00 55.73 54.79 2rng s ARG 36 Cb -0.16 -2.95 -0.03 0.00 0.52 0.00 0.00 34.95 32.32 2rng s ARG 36 CO -0.08 0.52 0.57 1.03 0.02 0.00 0.00 175.30 177.36 2rng s ARG 37 N -2.87 3.50 0.17 3.54 0.52 -1.25 -0.52 118.95 122.03 2rng s ARG 37 Ca 0.37 -0.27 0.02 0.00 -0.52 0.00 0.00 55.73 55.33 2rng s ARG 37 Cb -0.12 -2.64 -0.05 0.00 0.52 0.00 0.00 34.95 32.66 2rng s ARG 37 CO 0.28 0.13 -0.01 0.00 0.02 0.00 0.00 175.30 175.72 2rng s ALA 38 N -2.33 1.36 0.60 2.13 0.00 0.13 -4.83 121.76 118.83 2rng s ALA 38 Ca 0.41 -1.58 0.28 0.00 0.00 0.00 0.00 51.96 51.06 2rng s ALA 38 Cb -0.10 0.50 1.16 0.00 0.00 0.00 0.00 23.12 24.68 2rng s ALA 38 CO 0.36 -0.30 1.55 0.77 0.00 0.00 0.00 175.76 178.14 2rng h SER 39 N 2.70 0.00 -0.00 0.00 0.02 -1.89 -3.31 113.55 111.06 2rng h SER 39 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2rng h SER 39 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2rng h SER 39 CO 0.63 0.00 0.00 -1.20 -1.14 0.00 0.00 176.83 175.12 2rng n SER 40 N -3.41 0.00 0.01 3.07 7.64 -1.26 -4.74 113.62 114.93 2rng n SER 40 Ca 0.17 -0.14 0.05 0.00 1.01 0.00 0.00 58.87 59.96 2rng n SER 40 Cb 1.17 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 64.59 2rng n SER 40 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2rng n ASP 41 N -0.00 0.06 -4.33 6.43 8.00 -1.26 -3.56 116.55 121.89 2rng n ASP 41 Ca 0.00 0.52 -0.46 0.00 0.71 0.00 0.00 54.79 55.56 2rng n ASP 41 Cb 0.00 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 40.52 2rng n ASP 41 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2rng s ASN 42 N -3.11 6.19 0.28 -2.24 3.04 -1.26 -4.50 114.94 113.33 2rng s ASN 42 Ca 0.04 -1.66 0.00 0.00 0.04 0.00 0.00 52.86 51.28 2rng s ASN 42 Cb 0.06 -2.24 -0.02 0.00 -1.54 0.00 0.00 41.25 37.51 2rng s ASN 42 CO 0.17 -0.93 0.30 -1.38 -3.04 0.00 0.00 177.10 172.22 2rng s HIS 43 N 1.95 1.24 -0.10 0.43 -3.43 -1.26 -4.72 115.29 109.40 2rng s HIS 43 Ca 0.06 -1.38 -0.29 0.00 -0.80 0.00 0.00 55.06 52.65 2rng s HIS 43 Cb -0.28 -0.41 -0.01 0.00 -1.43 0.00 0.00 32.58 30.44 2rng s HIS 43 CO 0.04 -0.87 0.99 -1.54 -2.00 0.00 0.00 174.74 171.36 2rng s SER 44 N -3.23 7.23 0.50 7.38 1.04 -1.26 -1.14 113.70 124.22 2rng s SER 44 Ca 0.36 1.51 0.02 0.00 0.48 0.00 0.00 55.95 58.32 2rng s SER 44 Cb 0.03 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.58 2rng s SER 44 CO 0.19 -0.43 0.04 0.00 0.98 0.00 0.00 173.24 174.02 2rng n ALA 46 N -1.28 -1.56 -0.73 0.00 0.00 -1.26 -2.13 120.51 113.55 2rng n ALA 46 Ca -0.16 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2rng n ALA 46 Cb 0.67 -2.82 0.00 0.00 0.00 0.00 0.00 19.45 17.30 2rng n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rng n GLY 47 N -1.67 0.57 1.64 0.00 0.00 -1.26 -2.61 105.19 101.86 2rng n GLY 47 Ca -0.08 -0.79 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 2rng n GLY 47 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2rng n ASN 48 N -1.97 5.03 -0.01 1.61 0.23 -1.26 -3.86 115.26 115.03 2rng n ASN 48 Ca 0.00 -2.75 -0.01 0.00 -0.53 0.00 0.00 54.58 51.29 2rng n ASN 48 Cb 0.00 -0.90 -0.01 0.00 -2.08 0.00 0.00 39.78 36.78 2rng n ASN 48 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2rng n ARG 49 N 0.40 3.25 -4.47 -3.83 1.74 -1.07 -5.06 116.66 107.61 2rng n ARG 49 Ca 0.21 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 57.04 2rng n ARG 49 Cb 0.69 -1.05 -0.10 0.00 -1.02 0.00 0.00 32.46 30.98 2rng n ARG 49 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2rng s GLY 50 N -3.36 2.07 0.14 -0.13 0.00 -0.91 -4.31 107.32 100.83 2rng s GLY 50 Ca -0.01 -1.99 -0.02 0.00 0.00 0.00 0.00 44.72 42.70 2rng s GLY 50 CO 0.08 -1.97 0.09 -0.98 0.00 0.00 0.00 173.10 170.31 2rng s TRP 51 N -2.55 0.85 -0.40 1.90 0.52 -0.94 -1.87 118.94 116.44 2rng s TRP 51 Ca 0.32 -1.20 -0.11 0.00 0.02 0.00 0.00 56.10 55.13 2rng s TRP 51 Cb -0.00 -0.44 0.05 0.00 -1.15 0.00 0.00 33.47 31.92 2rng s TRP 51 CO 0.17 -0.56 0.25 0.00 0.02 0.00 0.00 176.95 176.83 2rng s ARG 53 N 1.53 0.95 0.13 0.00 0.52 -0.70 -4.38 118.95 116.99 2rng s ARG 53 Ca 0.03 -1.04 -0.20 0.00 -0.52 0.00 0.00 55.73 54.00 2rng s ARG 53 Cb -0.21 -1.07 -0.02 0.00 0.52 0.00 0.00 34.95 34.17 2rng s ARG 53 CO 0.05 0.24 1.71 0.66 0.02 0.00 0.00 175.30 177.98 2rng h SER 54 N 4.21 -0.17 -3.52 0.23 4.64 -1.93 -2.03 113.55 114.98 2rng h SER 54 Ca -0.43 0.06 -0.48 0.00 -0.47 0.00 0.00 61.79 60.47 2rng h SER 54 Cb 1.19 0.12 -0.14 0.00 -0.31 0.00 0.00 62.40 63.26 2rng h SER 54 CO 0.40 -0.06 -0.57 -0.75 -0.87 0.00 0.00 176.83 174.98 2rng s LYS 55 N -6.20 1.72 0.26 4.77 2.20 -1.26 -4.39 119.74 116.84 2rng s LYS 55 Ca -0.13 -2.00 -0.08 0.00 -0.36 0.00 0.00 55.97 53.40 2rng s LYS 55 Cb 0.10 -0.61 -0.01 0.00 -1.51 0.00 0.00 37.83 35.81 2rng s LYS 55 CO 0.69 -0.34 0.41 0.00 -0.36 0.00 0.00 175.35 175.74 2rng n PHE 57 N -0.40 -3.96 -0.03 0.00 3.01 -1.26 -5.00 117.46 109.82 2rng n PHE 57 Ca -0.00 -0.03 -0.21 0.00 1.01 0.00 0.00 57.45 58.21 2rng n PHE 57 Cb 0.63 -0.03 -0.13 0.00 -0.01 0.00 0.00 39.48 39.93 2rng n PHE 57 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2rng h ARG 58 N 0.00 0.16 -0.03 -1.08 2.43 -2.02 -3.30 114.38 110.54 2rng h ARG 58 Ca -0.01 -0.28 0.01 0.00 -0.81 0.00 0.00 59.98 58.89 2rng h ARG 58 Cb 0.04 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2rng h ARG 58 CO 0.01 1.13 0.47 1.25 -1.51 0.00 0.00 179.97 181.32 2rng h HIS 59 N -0.48 0.00 -1.49 2.20 2.76 -1.98 -3.40 115.15 112.76 2rng h HIS 59 Ca -0.32 0.00 -0.57 0.00 -2.20 0.00 0.00 60.37 57.29 2rng h HIS 59 Cb 1.63 0.00 -0.08 0.00 1.55 0.00 0.00 27.41 30.51 2rng h HIS 59 CO 0.12 0.00 -0.48 -1.21 -1.30 0.00 0.00 177.93 175.06 2rng s GLU 60 N -4.10 2.24 0.00 5.26 2.02 -1.24 -4.31 118.70 118.56 2rng s GLU 60 Ca -0.03 -1.86 0.00 0.00 0.02 0.00 0.00 54.97 53.10 2rng s GLU 60 Cb 0.07 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 32.31 2rng s GLU 60 CO 0.24 -0.16 0.00 2.48 0.02 0.00 0.00 175.26 177.84 2rng n TYR 61 N -1.28 0.00 -3.70 1.61 4.11 -1.01 -4.71 117.16 112.18 2rng n TYR 61 Ca -0.01 0.00 -0.37 0.00 -0.00 0.00 0.00 57.90 57.52 2rng n TYR 61 Cb 0.65 0.00 -0.09 0.00 -0.00 0.00 0.00 39.34 39.89 2rng n TYR 61 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 2rng s VAL 62 N -1.47 3.83 -1.00 -3.48 1.01 -1.26 -2.04 120.40 115.99 2rng s VAL 62 Ca 0.00 -2.96 -0.13 0.00 0.00 0.00 0.00 61.98 58.89 2rng s VAL 62 Cb 0.00 -3.49 -0.32 0.00 0.00 0.00 0.00 36.38 32.58 2rng s VAL 62 CO 0.00 -0.89 2.24 -0.67 0.00 0.00 0.00 175.10 175.78 2rng n ASP 63 N 3.47 -1.17 -0.13 3.32 -0.08 0.45 -4.68 116.55 117.74 2rng n ASP 63 Ca 0.09 -0.44 0.14 0.00 -1.51 0.00 0.00 54.79 53.06 2rng n ASP 63 Cb 0.38 -0.60 0.50 0.00 2.34 0.00 0.00 41.12 43.74 2rng n ASP 63 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2rng h THR 64 N 7.16 0.83 -0.24 5.18 1.35 -1.95 0.18 112.91 125.42 2rng h THR 64 Ca 0.03 -0.14 -0.02 0.00 -0.55 0.00 0.00 66.41 65.72 2rng h THR 64 Cb 1.16 0.39 -0.01 0.00 -1.73 0.00 0.00 68.15 67.95 2rng h THR 64 CO 1.59 0.08 0.08 0.22 -0.25 0.00 0.00 175.52 177.23 2rng h TYR 65 N 0.41 0.39 -0.00 4.73 3.20 -1.93 -2.89 116.97 120.88 2rng h TYR 65 Ca 0.33 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.16 2rng h TYR 65 Cb 0.73 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.89 2rng h TYR 65 CO -0.00 0.44 -0.23 0.66 -1.64 0.00 0.00 178.16 177.39 2rng n TYR 66 N -4.76 0.00 0.24 -3.82 4.02 -0.73 -3.84 117.16 108.28 2rng n TYR 66 Ca -0.03 0.00 0.16 0.00 -0.01 0.00 0.00 57.90 58.02 2rng n TYR 66 Cb 0.15 -0.21 0.70 0.00 -0.02 0.00 0.00 39.34 39.96 2rng n TYR 66 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2rng h SER 67 N 0.60 0.00 0.17 7.72 0.87 -0.45 -2.24 113.55 120.21 2rng h SER 67 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2rng h SER 67 Cb 0.45 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 2rng h SER 67 CO 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 176.83 176.22 2rng h ALA 68 N 1.21 -0.58 -0.70 6.23 0.00 -1.75 -2.76 119.26 120.91 2rng h ALA 68 Ca 0.08 -0.05 0.20 0.00 0.00 0.00 0.00 54.91 55.15 2rng h ALA 68 Cb 1.04 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 2rng h ALA 68 CO -0.00 -0.56 0.73 -0.24 0.00 0.00 0.00 179.25 179.18 2rng h VAL 69 N -0.37 0.26 0.51 0.00 3.04 -1.70 -1.42 116.25 116.58 2rng h VAL 69 Ca -0.02 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.64 2rng h VAL 69 Cb 0.17 0.43 0.01 0.00 -2.01 0.00 0.00 31.29 29.88 2rng h VAL 69 CO 0.04 0.00 -0.25 0.00 -1.01 0.00 0.00 177.57 176.35 2rng n GLY 71 N -0.57 0.95 0.11 0.00 0.00 -0.54 -4.37 105.19 100.77 2rng n GLY 71 Ca -0.09 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.81 2rng n GLY 71 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2rng h ARG 72 N 0.00 0.26 0.00 1.61 3.08 -1.90 -3.44 114.38 113.99 2rng h ARG 72 Ca 0.00 -0.03 -0.38 0.00 0.07 0.00 0.00 59.98 59.65 2rng h ARG 72 Cb 0.00 -0.05 0.14 0.00 0.08 0.00 0.00 29.97 30.13 2rng h ARG 72 CO 0.00 0.23 0.31 0.66 -1.07 0.00 0.00 179.97 180.09 2rng n TYR 73 N -4.92 -3.78 -5.21 3.04 4.01 -1.26 -4.96 117.16 104.07 2rng n TYR 73 Ca -0.04 -1.13 -0.30 0.00 -0.16 0.00 0.00 57.90 56.28 2rng n TYR 73 Cb 0.06 -0.83 -0.16 0.00 -0.31 0.00 0.00 39.34 38.09 2rng n TYR 73 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2rng s PHE 74 N -3.33 2.21 -0.78 -0.72 0.40 -0.76 -4.73 117.98 110.28 2rng s PHE 74 Ca 0.63 -0.48 -0.26 0.00 -0.60 0.00 0.00 56.93 56.22 2rng s PHE 74 Cb -0.02 -1.43 0.03 0.00 0.51 0.00 0.00 43.02 42.11 2rng s PHE 74 CO 0.44 -0.08 1.32 0.00 0.70 0.00 0.00 175.22 177.60 2rng s ARG 77 N -5.65 2.23 -0.30 0.00 0.52 -0.87 -2.22 118.95 112.66 2rng s ARG 77 Ca 0.67 -1.45 -0.11 0.00 -0.52 0.00 0.00 55.73 54.32 2rng s ARG 77 Cb -0.09 0.61 -0.03 0.00 0.52 0.00 0.00 34.95 35.97 2rng s ARG 77 CO 0.51 -1.05 0.18 -1.12 0.02 0.00 0.00 175.30 173.85 2rng s SER 78 N -3.11 5.83 0.00 0.23 0.01 -1.26 -2.42 113.70 112.98 2rng s SER 78 Ca 0.16 -0.28 0.29 0.00 1.31 0.00 0.00 55.95 57.43 2rng s SER 78 Cb -0.05 -2.08 1.18 0.00 0.21 0.00 0.00 66.02 65.28 2rng s SER 78 CO 0.12 -0.14 1.82 0.54 0.41 0.00 0.00 173.24 175.98