#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 2.84 0.27 1.20 0.04 -1.26 -4.99 135.00 133.10 2rng s PRO 2 Ca 0.00 0.35 -0.04 0.00 0.04 0.00 0.00 61.00 61.36 2rng s PRO 2 Cb 0.00 -4.31 -0.05 0.00 0.04 0.00 0.00 34.50 30.18 2rng s PRO 2 CO 0.00 -2.51 0.52 -1.17 0.04 0.00 0.00 177.00 173.88 2rng s LEU 3 N 7.89 4.09 0.47 -3.56 0.20 -1.26 -5.03 118.68 121.48 2rng s LEU 3 Ca 0.57 0.62 -0.23 0.00 0.69 0.00 0.00 54.13 55.78 2rng s LEU 3 Cb -0.11 -3.43 -0.09 0.00 -0.43 0.00 0.00 46.19 42.13 2rng s LEU 3 CO 0.19 -0.17 1.07 -0.38 -0.29 0.00 0.00 176.35 176.78 2rng n ILE 4 N -0.94 2.82 -1.68 6.68 2.08 -1.26 -4.96 119.36 122.10 2rng n ILE 4 Ca -0.03 -0.50 -0.30 0.00 0.56 0.00 0.00 62.75 62.48 2rng n ILE 4 Cb 0.54 -1.28 0.06 0.00 -0.75 0.00 0.00 39.64 38.22 2rng n ILE 4 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2rng s PRO 5 N -2.27 2.57 0.36 0.38 0.04 -1.26 -4.97 135.00 129.84 2rng s PRO 5 Ca 0.66 0.64 0.19 0.00 0.04 0.00 0.00 61.00 62.53 2rng s PRO 5 Cb -0.50 -1.97 0.20 0.00 0.04 0.00 0.00 34.50 32.26 2rng s PRO 5 CO 0.54 -1.28 1.52 0.00 0.04 0.00 0.00 177.00 177.82 2rng h ALA 6 N -0.84 0.83 -0.14 8.56 0.00 -1.96 -3.34 119.26 122.38 2rng h ALA 6 Ca -0.46 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.27 2rng h ALA 6 Cb 1.25 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 2rng h ALA 6 CO 0.60 0.31 -0.33 0.97 0.00 0.00 0.00 179.25 180.81 2rng h ILE 7 N 0.00 0.28 -1.16 0.00 6.09 -1.93 0.92 117.51 121.70 2rng h ILE 7 Ca -0.00 0.00 0.33 0.00 -1.37 0.00 0.00 64.86 63.82 2rng h ILE 7 Cb 1.19 0.28 -0.05 0.00 0.47 0.00 0.00 36.82 38.71 2rng h ILE 7 CO 0.03 0.00 0.83 1.88 -3.07 0.00 0.00 178.15 177.82 2rng h TYR 8 N -0.40 0.08 -3.44 2.19 0.05 -1.92 -3.31 116.97 110.22 2rng h TYR 8 Ca 0.10 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.35 2rng h TYR 8 Cb 0.55 -0.02 0.04 0.00 1.01 0.00 0.00 36.73 38.31 2rng h TYR 8 CO -0.41 0.00 0.68 0.42 -1.05 0.00 0.00 178.16 177.81 2rng s ILE 9 N -5.01 2.98 -1.37 -2.88 1.01 0.32 -2.04 121.20 114.21 2rng s ILE 9 Ca -0.05 0.83 -0.05 0.00 0.00 0.00 0.00 60.65 61.38 2rng s ILE 9 Cb 0.23 -3.53 0.03 0.00 0.01 0.00 0.00 42.46 39.20 2rng s ILE 9 CO 0.80 0.13 0.36 0.61 0.00 0.00 0.00 174.94 176.85 2rng n GLY 10 N 2.14 -0.50 0.00 6.18 0.00 0.19 -4.93 105.19 108.27 2rng n GLY 10 Ca 0.06 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.08 0.00 -3.26 4.61 0.00 -0.86 -4.95 120.51 112.97 2rng n ALA 11 Ca -0.10 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.28 2rng n ALA 11 Cb 0.60 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.01 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 0.40 -0.74 0.00 0.00 2.01 -1.26 -1.75 115.64 114.30 2rng s THR 12 Ca 0.00 -0.35 0.00 0.00 0.31 0.00 0.00 61.69 61.65 2rng s THR 12 Cb 0.00 -0.45 0.00 0.00 0.01 0.00 0.00 72.50 72.06 2rng s THR 12 CO 0.00 -0.22 0.00 1.33 -0.69 0.00 0.00 174.62 175.04 2rng n VAL 13 N 4.60 0.00 -3.13 3.82 0.24 0.29 -4.65 118.33 119.50 2rng n VAL 13 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 2rng n VAL 13 Cb 0.52 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 2rng n VAL 13 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2rng n GLY 14 N 5.00 6.73 0.11 7.63 0.00 -1.26 -0.30 105.19 123.10 2rng n GLY 14 Ca 0.00 -1.89 -0.14 0.00 0.00 0.00 0.00 46.02 43.99 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 0.22 0.34 1.61 0.13 -1.84 -2.23 132.00 130.24 2rng h PRO 15 Ca 0.00 -0.18 -0.02 0.00 -0.87 0.00 0.00 66.00 64.94 2rng h PRO 15 Cb 0.00 0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.17 2rng h PRO 15 CO 0.00 0.82 -0.16 1.03 -0.23 0.00 0.00 178.00 179.46 2rng h SER 16 N -0.33 -0.39 -1.00 1.44 0.87 -1.97 -2.78 113.55 109.40 2rng h SER 16 Ca -0.01 -0.16 0.14 0.00 -1.23 0.00 0.00 61.79 60.52 2rng h SER 16 Cb 0.86 0.10 -0.09 0.00 -0.44 0.00 0.00 62.40 62.83 2rng h SER 16 CO 0.04 0.01 0.62 0.58 -0.53 0.00 0.00 176.83 177.56 2rng h VAL 17 N -0.87 0.86 0.50 2.23 2.07 -1.97 -2.38 116.25 116.70 2rng h VAL 17 Ca -0.05 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 2rng h VAL 17 Cb 0.53 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2rng h VAL 17 CO 0.08 0.17 -0.41 -0.25 0.02 0.00 0.00 177.57 177.17 2rng h TRP 18 N 0.91 -1.14 -1.11 1.57 7.01 -1.35 -1.41 115.95 120.44 2rng h TRP 18 Ca 0.52 0.00 0.37 0.00 2.11 0.00 0.00 58.89 61.88 2rng h TRP 18 Cb 0.61 0.43 -0.14 0.00 -2.10 0.00 0.00 29.16 27.96 2rng h TRP 18 CO -0.00 -0.57 0.67 0.00 -2.79 0.00 0.00 178.44 175.74 2rng h ALA 19 N -1.15 2.27 -0.36 2.65 0.00 -1.15 0.53 119.26 122.06 2rng h ALA 19 Ca -0.06 0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2rng h ALA 19 Cb 0.75 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2rng h ALA 19 CO -0.00 -0.89 0.00 -0.92 0.00 0.00 0.00 179.25 177.44 2rng h TYR 20 N 0.21 0.69 0.00 0.00 3.20 -0.97 -2.57 116.97 117.53 2rng h TYR 20 Ca 0.76 -0.12 -0.04 0.00 3.14 0.00 0.00 58.73 62.47 2rng h TYR 20 Cb 2.03 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 40.11 2rng h TYR 20 CO -0.01 0.73 -0.20 1.25 -1.64 0.00 0.00 178.16 178.29 2rng h LEU 21 N 0.45 0.00 -0.22 2.82 6.46 0.10 -2.51 115.31 122.41 2rng h LEU 21 Ca 0.10 0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.72 2rng h LEU 21 Cb 0.45 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.39 2rng h LEU 21 CO 0.02 0.20 -0.43 0.58 -0.62 0.00 0.00 178.44 178.19 2rng h VAL 22 N 0.00 1.31 -0.11 1.05 2.07 -0.89 -2.48 116.25 117.20 2rng h VAL 22 Ca -0.00 -1.65 -0.09 0.00 0.82 0.00 0.00 66.70 65.78 2rng h VAL 22 Cb 0.41 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 2rng h VAL 22 CO 0.03 0.52 -0.32 0.00 0.02 0.00 0.00 177.57 177.82 2rng h ALA 23 N 0.62 1.26 0.02 1.67 0.00 -1.18 1.01 119.26 122.66 2rng h ALA 23 Ca 0.01 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2rng h ALA 23 Cb 1.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2rng h ALA 23 CO 0.10 0.50 -0.01 1.25 0.00 0.00 0.00 179.25 181.09 2rng h LEU 24 N 0.19 -0.02 0.00 0.00 5.85 -1.39 -3.39 115.31 116.55 2rng h LEU 24 Ca 0.03 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.57 2rng h LEU 24 Cb 0.66 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 2rng h LEU 24 CO 0.05 0.00 -1.32 1.62 -0.34 0.00 0.00 178.44 178.45 2rng h VAL 25 N -0.07 0.64 0.00 1.05 3.04 -1.55 -3.50 116.25 115.87 2rng h VAL 25 Ca -0.00 -2.18 0.00 0.00 -1.01 0.00 0.00 66.70 63.50 2rng h VAL 25 Cb 0.02 2.17 0.00 0.00 -2.01 0.00 0.00 31.29 31.47 2rng h VAL 25 CO 0.00 0.37 0.00 0.61 -1.01 0.00 0.00 177.57 177.54 2rng n GLY 26 N 1.40 3.14 0.31 3.17 0.00 0.35 -4.57 105.19 108.98 2rng n GLY 26 Ca -0.09 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.81 2rng n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rng h ALA 27 N 0.00 -1.04 -0.93 4.61 0.00 -1.86 -1.95 119.26 118.09 2rng h ALA 27 Ca 0.00 -0.17 0.23 0.00 0.00 0.00 0.00 54.91 54.97 2rng h ALA 27 Cb 0.00 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 2rng h ALA 27 CO 0.00 -0.98 0.62 0.00 0.00 0.00 0.00 179.25 178.89 2rng h ALA 28 N -1.53 2.34 -0.49 0.00 0.00 -1.93 0.76 119.26 118.41 2rng h ALA 28 Ca -0.08 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2rng h ALA 28 Cb 0.59 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2rng h ALA 28 CO 0.13 -0.64 0.18 0.00 0.00 0.00 0.00 179.25 178.91 2rng h ALA 29 N 1.60 0.65 -0.93 0.00 0.00 -1.76 -1.90 119.26 116.91 2rng h ALA 29 Ca 0.49 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 2rng h ALA 29 Cb 1.35 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 2rng h ALA 29 CO -0.17 0.28 0.56 0.28 0.00 0.00 0.00 179.25 180.20 2rng h VAL 30 N 0.66 1.26 0.00 0.00 2.07 -0.06 -1.39 116.25 118.79 2rng h VAL 30 Ca 0.16 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 67.09 2rng h VAL 30 Cb 0.23 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2rng h VAL 30 CO -0.01 0.27 -0.20 0.74 0.02 0.00 0.00 177.57 178.39 2rng h THR 31 N 1.29 0.49 0.00 2.57 2.02 -1.18 -2.84 112.91 115.25 2rng h THR 31 Ca 0.34 -1.05 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 2rng h THR 31 Cb -0.06 1.74 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 2rng h THR 31 CO -0.06 0.19 -0.49 0.00 0.37 0.00 0.00 175.52 175.53 2rng h ALA 32 N 1.80 0.77 -0.35 6.16 0.00 -0.48 -3.25 119.26 123.92 2rng h ALA 32 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2rng h ALA 32 Cb 0.73 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2rng h ALA 32 CO 0.03 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.39 2rng n ALA 33 N -2.16 2.45 -3.11 0.00 0.00 -0.66 -4.95 120.51 112.08 2rng n ALA 33 Ca 0.02 -0.64 -0.03 0.00 0.00 0.00 0.00 53.44 52.78 2rng n ALA 33 Cb 0.57 -0.99 0.01 0.00 0.00 0.00 0.00 19.45 19.05 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 0.57 -7.55 -4.07 0.00 4.05 -1.23 -1.34 115.26 105.69 2rng n ASN 34 Ca 0.13 -0.18 -0.32 0.00 0.45 0.00 0.00 54.58 54.66 2rng n ASN 34 Cb 0.32 -5.15 -0.15 0.00 1.23 0.00 0.00 39.78 36.03 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 -3.04 2.15 0.39 -1.44 1.01 -1.22 0.55 121.20 119.60 2rng s ILE 35 Ca 0.05 -1.57 -0.01 0.00 0.00 0.00 0.00 60.65 59.12 2rng s ILE 35 Cb -0.01 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 2rng s ILE 35 CO 0.76 0.01 0.63 -0.13 0.00 0.00 0.00 174.94 176.21 2rng s ARG 36 N 1.12 3.49 0.12 2.79 0.52 -0.72 -4.88 118.95 121.39 2rng s ARG 36 Ca -0.08 -0.16 0.06 0.00 -0.52 0.00 0.00 55.73 55.03 2rng s ARG 36 Cb -0.19 -2.57 -0.04 0.00 0.52 0.00 0.00 34.95 32.67 2rng s ARG 36 CO -0.06 0.02 -0.03 1.03 0.02 0.00 0.00 175.30 176.29 2rng s ARG 37 N -4.46 2.39 0.13 3.54 0.52 -1.26 -0.55 118.95 119.26 2rng s ARG 37 Ca 0.43 -0.98 0.00 0.00 -0.52 0.00 0.00 55.73 54.66 2rng s ARG 37 Cb -0.10 -2.42 0.00 0.00 0.52 0.00 0.00 34.95 32.95 2rng s ARG 37 CO 0.39 0.50 0.00 0.00 0.02 0.00 0.00 175.30 176.21 2rng n ALA 38 N 0.37 0.11 1.03 2.13 0.00 0.58 -4.90 120.51 119.84 2rng n ALA 38 Ca -0.11 -0.59 0.09 0.00 0.00 0.00 0.00 53.44 52.83 2rng n ALA 38 Cb 0.53 0.32 0.51 0.00 0.00 0.00 0.00 19.45 20.81 2rng n ALA 38 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2rng n SER 39 N -1.09 0.00 0.00 0.00 2.88 -1.26 -4.35 113.62 109.79 2rng n SER 39 Ca -0.05 -0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.19 2rng n SER 39 Cb 0.17 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2rng n SER 39 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2rng n SER 40 N -1.14 0.00 0.00 -3.46 7.64 -1.26 -4.92 113.62 110.48 2rng n SER 40 Ca 0.11 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.07 2rng n SER 40 Cb 0.10 0.00 0.35 0.00 -1.01 0.00 0.00 64.21 63.66 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 0.77 0.00 -4.35 6.43 8.00 -1.26 -4.03 116.55 122.11 2rng n ASP 41 Ca 0.00 0.46 -0.45 0.00 0.71 0.00 0.00 54.79 55.51 2rng n ASP 41 Cb 0.00 -0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 40.57 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 -2.97 6.19 0.30 -2.24 3.84 -1.26 -4.53 114.94 114.27 2rng s ASN 42 Ca 0.09 -1.57 0.03 0.00 0.21 0.00 0.00 52.86 51.61 2rng s ASN 42 Cb 0.11 -2.25 -0.02 0.00 -0.55 0.00 0.00 41.25 38.53 2rng s ASN 42 CO 0.29 -0.97 0.30 -1.38 -2.79 0.00 0.00 177.10 172.56 2rng s HIS 43 N 2.14 1.43 0.01 0.43 -3.43 -1.26 -4.73 115.29 109.88 2rng s HIS 43 Ca 0.07 -1.49 -0.30 0.00 -0.80 0.00 0.00 55.06 52.54 2rng s HIS 43 Cb -0.27 -0.51 -0.04 0.00 -1.43 0.00 0.00 32.58 30.34 2rng s HIS 43 CO 0.05 -0.89 1.04 -1.54 -2.00 0.00 0.00 174.74 171.40 2rng s SER 44 N -3.28 7.29 0.45 7.38 1.04 -1.26 -0.83 113.70 124.48 2rng s SER 44 Ca 0.37 1.74 0.03 0.00 0.48 0.00 0.00 55.95 58.58 2rng s SER 44 Cb 0.03 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.54 2rng s SER 44 CO 0.22 -0.32 0.04 0.00 0.98 0.00 0.00 173.24 174.16 2rng n ALA 46 N -1.06 -1.46 -0.81 0.00 0.00 -1.26 -2.35 120.51 113.56 2rng n ALA 46 Ca -0.11 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2rng n ALA 46 Cb 0.66 -3.21 0.00 0.00 0.00 0.00 0.00 19.45 16.90 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 -1.61 0.75 1.70 0.00 0.00 -1.26 -2.43 105.19 102.34 2rng n GLY 47 Ca -0.03 -0.71 -0.10 0.00 0.00 0.00 0.00 46.02 45.17 2rng n GLY 47 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2rng n ASN 48 N -2.27 5.67 -0.02 1.61 4.13 -1.26 -3.92 115.26 119.21 2rng n ASN 48 Ca 0.00 -2.79 -0.02 0.00 1.68 0.00 0.00 54.58 53.45 2rng n ASN 48 Cb 0.00 -1.02 -0.02 0.00 -1.54 0.00 0.00 39.78 37.20 2rng n ASN 48 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2rng n ARG 49 N 0.64 1.68 -4.44 3.52 1.74 -1.02 -5.07 116.66 113.71 2rng n ARG 49 Ca 0.19 0.01 -0.22 0.00 -0.77 0.00 0.00 57.85 57.07 2rng n ARG 49 Cb 0.59 -1.08 -0.10 0.00 -1.02 0.00 0.00 32.46 30.85 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 -3.92 1.90 0.30 -0.13 0.00 -0.99 -4.60 107.32 99.88 2rng s GLY 50 Ca -0.04 -1.94 0.03 0.00 0.00 0.00 0.00 44.72 42.78 2rng s GLY 50 CO 0.11 -1.86 0.18 -0.98 0.00 0.00 0.00 173.10 170.55 2rng s TRP 51 N -3.01 1.59 -0.24 1.90 0.52 -0.87 -1.59 118.94 117.25 2rng s TRP 51 Ca 0.31 -1.42 -0.06 0.00 0.02 0.00 0.00 56.10 54.94 2rng s TRP 51 Cb 0.04 -0.81 -0.02 0.00 -1.15 0.00 0.00 33.47 31.53 2rng s TRP 51 CO 0.13 -0.59 0.03 0.00 0.02 0.00 0.00 176.95 176.54 2rng s ARG 53 N 1.56 0.23 0.36 0.00 0.52 -0.63 -4.38 118.95 116.61 2rng s ARG 53 Ca 0.06 -0.34 0.17 0.00 -0.52 0.00 0.00 55.73 55.10 2rng s ARG 53 Cb -0.15 -0.05 1.11 0.00 0.52 0.00 0.00 34.95 36.39 2rng s ARG 53 CO 0.01 0.00 1.69 0.77 0.02 0.00 0.00 175.30 177.79 2rng h SER 54 N 5.38 0.49 -0.93 0.23 0.02 -1.93 -2.56 113.55 114.26 2rng h SER 54 Ca -0.29 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 2rng h SER 54 Cb 1.21 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.84 2rng h SER 54 CO 0.46 -0.06 0.00 2.29 -1.14 0.00 0.00 176.83 178.38 2rng n LYS 55 N -4.89 1.24 -4.20 3.45 0.00 -1.26 -4.30 118.16 108.19 2rng n LYS 55 Ca 0.31 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.44 2rng n LYS 55 Cb 0.99 0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 35.96 2rng n LYS 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2rng n PHE 57 N -0.60 -4.00 0.08 0.00 3.72 -1.26 -4.99 117.46 110.41 2rng n PHE 57 Ca 0.05 -0.73 -0.21 0.00 -0.05 0.00 0.00 57.45 56.50 2rng n PHE 57 Cb 0.62 -0.64 -0.15 0.00 -0.94 0.00 0.00 39.48 38.37 2rng n PHE 57 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 2rng h ARG 58 N 0.00 0.37 -0.05 -1.08 2.43 -2.01 -3.27 114.38 110.76 2rng h ARG 58 Ca -0.27 -0.63 0.00 0.00 -0.81 0.00 0.00 59.98 58.28 2rng h ARG 58 Cb 0.74 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 2rng h ARG 58 CO 0.19 1.27 0.00 0.72 -1.51 0.00 0.00 179.97 180.64 2rng n HIS 59 N -3.56 0.07 -3.82 2.20 8.25 -1.26 -4.83 115.22 112.28 2rng n HIS 59 Ca -0.21 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 2rng n HIS 59 Cb 1.07 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.18 2rng n HIS 59 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2rng n GLU 60 N -0.35 1.89 -0.01 -0.41 1.02 -1.23 -4.50 120.64 117.04 2rng n GLU 60 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2rng n GLU 60 Cb 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.47 2rng n GLU 60 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 2rng n TYR 61 N 0.00 -0.01 -3.93 -0.32 4.11 -0.96 -4.80 117.16 111.25 2rng n TYR 61 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.90 57.60 2rng n TYR 61 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.19 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 -2.44 2.10 -0.86 -3.48 1.01 -1.26 -2.10 120.40 113.37 2rng s VAL 62 Ca 0.00 -2.53 -0.20 0.00 0.00 0.00 0.00 61.98 59.25 2rng s VAL 62 Cb 0.00 -2.52 -0.21 0.00 0.00 0.00 0.00 36.38 33.65 2rng s VAL 62 CO 0.00 -0.70 2.29 -0.90 0.00 0.00 0.00 175.10 175.79 2rng n ASP 63 N 3.93 0.59 -0.12 3.32 5.68 -0.57 -4.67 116.55 124.71 2rng n ASP 63 Ca 0.04 -1.20 0.25 0.00 -0.50 0.00 0.00 54.79 53.38 2rng n ASP 63 Cb 0.38 -1.26 0.49 0.00 -1.14 0.00 0.00 41.12 39.60 2rng n ASP 63 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 2rng h THR 64 N 7.41 0.08 0.33 2.12 1.35 -1.96 0.69 112.91 122.93 2rng h THR 64 Ca 0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.86 2rng h THR 64 Cb 1.05 0.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 2rng h THR 64 CO 1.22 0.00 -0.16 0.22 -0.25 0.00 0.00 175.52 176.55 2rng h TYR 65 N 0.00 -0.41 -0.00 4.73 5.03 -1.96 -3.18 116.97 121.18 2rng h TYR 65 Ca 0.40 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.70 2rng h TYR 65 Cb 2.46 0.14 0.00 0.00 1.55 0.00 0.00 36.73 40.87 2rng h TYR 65 CO 0.00 -0.08 -0.10 0.66 -1.32 0.00 0.00 178.16 177.32 2rng n TYR 66 N -5.14 0.00 0.09 -3.82 4.01 0.09 -3.67 117.16 108.72 2rng n TYR 66 Ca -0.09 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 57.84 2rng n TYR 66 Cb 0.27 -0.45 0.60 0.00 -0.31 0.00 0.00 39.34 39.45 2rng n TYR 66 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2rng h SER 67 N 0.00 0.00 0.00 7.72 0.87 -1.13 -2.34 113.55 118.67 2rng h SER 67 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2rng h SER 67 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2rng h SER 67 CO 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.30 2rng n ALA 68 N -2.12 -0.26 -0.51 6.23 0.00 -1.24 -2.52 120.51 120.09 2rng n ALA 68 Ca 0.09 0.00 0.44 0.00 0.00 0.00 0.00 53.44 53.97 2rng n ALA 68 Cb 0.85 0.00 0.76 0.00 0.00 0.00 0.00 19.45 21.06 2rng n ALA 68 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 2rng h VAL 69 N 0.00 0.16 0.78 0.00 3.04 -1.71 0.15 116.25 118.66 2rng h VAL 69 Ca 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.65 2rng h VAL 69 Cb 0.00 0.17 0.01 0.00 -2.01 0.00 0.00 31.29 29.45 2rng h VAL 69 CO 0.00 0.00 -0.37 0.00 -1.01 0.00 0.00 177.57 176.19 2rng n GLY 71 N -1.19 0.99 0.46 0.00 0.00 0.50 -4.20 105.19 101.76 2rng n GLY 71 Ca -0.14 -1.48 0.27 0.00 0.00 0.00 0.00 46.02 44.68 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 0.00 -7.04 1.61 3.08 -1.90 -3.40 114.38 106.73 2rng h ARG 72 Ca 0.00 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.57 2rng h ARG 72 Cb 0.00 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.12 2rng h ARG 72 CO 0.00 0.00 0.08 0.71 -1.07 0.00 0.00 179.97 179.69 2rng s TYR 73 N -4.75 1.33 -0.04 3.04 2.02 -1.26 -4.95 117.35 112.74 2rng s TYR 73 Ca -0.04 -0.43 0.06 0.00 -0.37 0.00 0.00 57.07 56.28 2rng s TYR 73 Cb 0.19 -2.83 -0.01 0.00 -0.40 0.00 0.00 41.96 38.90 2rng s TYR 73 CO 0.65 -1.70 -0.22 -0.06 -1.57 0.00 0.00 175.55 172.65 2rng s PHE 74 N -3.08 2.07 -0.64 2.71 0.08 -0.97 -4.72 117.98 113.44 2rng s PHE 74 Ca 0.67 -0.52 -0.28 0.00 0.12 0.00 0.00 56.93 56.92 2rng s PHE 74 Cb -0.05 -1.36 0.02 0.00 -0.57 0.00 0.00 43.02 41.07 2rng s PHE 74 CO 0.44 -0.13 1.30 0.00 -0.10 0.00 0.00 175.22 176.73 2rng n ARG 77 N -2.96 0.03 -4.06 0.00 1.74 -0.89 -2.04 116.66 108.48 2rng n ARG 77 Ca 0.07 -0.05 -0.32 0.00 -0.77 0.00 0.00 57.85 56.78 2rng n ARG 77 Cb 0.56 0.07 -0.16 0.00 -1.02 0.00 0.00 32.46 31.91 2rng n ARG 77 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2rng s SER 78 N -1.05 3.63 0.00 0.55 1.04 -1.26 -2.26 113.70 114.35 2rng s SER 78 Ca 0.00 -0.97 0.26 0.00 0.48 0.00 0.00 55.95 55.73 2rng s SER 78 Cb -0.00 -1.40 1.58 0.00 0.10 0.00 0.00 66.02 66.29 2rng s SER 78 CO 0.00 -0.11 1.93 -1.14 0.98 0.00 0.00 173.24 174.90