#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 2.39 0.00 3.52 0.04 -1.26 -5.04 135.00 134.66 2rng s PRO 2 Ca 0.00 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.03 2rng s PRO 2 Cb 0.00 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.61 2rng s PRO 2 CO 0.00 -1.50 0.00 1.28 0.04 0.00 0.00 177.00 176.82 2rng n LEU 3 N -3.40 0.00 -4.75 -3.56 4.32 -1.26 -4.88 117.00 103.46 2rng n LEU 3 Ca 0.08 0.00 -0.35 0.00 -0.02 0.00 0.00 56.01 55.72 2rng n LEU 3 Cb 0.54 0.00 0.04 0.00 -1.62 0.00 0.00 43.42 42.38 2rng n LEU 3 CO 0.55 -0.92 0.81 -0.63 -1.22 0.00 0.00 177.39 175.98 2rng s ILE 4 N -0.39 2.71 0.80 -0.08 1.01 -1.26 -5.00 121.20 118.98 2rng s ILE 4 Ca 0.00 0.40 -0.11 0.00 0.00 0.00 0.00 60.65 60.94 2rng s ILE 4 Cb 0.00 -3.07 0.07 0.00 0.01 0.00 0.00 42.46 39.47 2rng s ILE 4 CO 0.00 -0.13 1.10 -2.16 0.00 0.00 0.00 174.94 173.75 2rng s PRO 5 N -3.56 2.07 0.23 2.79 0.04 -1.26 -4.97 135.00 130.34 2rng s PRO 5 Ca 0.75 0.65 0.18 0.00 0.04 0.00 0.00 61.00 62.62 2rng s PRO 5 Cb -0.28 -1.92 0.04 0.00 0.04 0.00 0.00 34.50 32.39 2rng s PRO 5 CO 0.36 -1.63 1.22 0.00 0.04 0.00 0.00 177.00 176.99 2rng h ALA 6 N -1.10 0.69 -0.83 8.56 0.00 -1.96 -3.33 119.26 121.29 2rng h ALA 6 Ca -0.47 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.06 2rng h ALA 6 Cb 1.27 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.07 2rng h ALA 6 CO 0.59 0.46 0.55 0.97 0.00 0.00 0.00 179.25 181.82 2rng h ILE 7 N 0.00 1.21 0.00 0.00 6.09 -1.94 -0.83 117.51 122.05 2rng h ILE 7 Ca -0.05 -0.39 0.00 0.00 -1.37 0.00 0.00 64.86 63.05 2rng h ILE 7 Cb 1.29 -0.01 0.00 0.00 0.47 0.00 0.00 36.82 38.57 2rng h ILE 7 CO 0.03 0.21 0.00 1.88 -3.07 0.00 0.00 178.15 177.20 2rng h TYR 8 N 1.13 0.00 -3.24 2.19 -1.99 -1.91 -3.33 116.97 109.82 2rng h TYR 8 Ca 0.30 0.00 -0.57 0.00 2.00 0.00 0.00 58.73 60.47 2rng h TYR 8 Cb -0.13 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.55 2rng h TYR 8 CO 0.00 0.00 0.56 0.42 -0.00 0.00 0.00 178.16 179.14 2rng s ILE 9 N -3.84 4.79 -0.98 -2.88 1.01 -0.32 -3.03 121.20 115.95 2rng s ILE 9 Ca -0.02 1.94 -0.01 0.00 0.00 0.00 0.00 60.65 62.57 2rng s ILE 9 Cb 0.10 -4.27 0.00 0.00 0.01 0.00 0.00 42.46 38.30 2rng s ILE 9 CO 0.42 -0.02 0.12 0.61 0.00 0.00 0.00 174.94 176.07 2rng n GLY 10 N 3.21 -0.09 0.00 6.18 0.00 0.11 -4.98 105.19 109.62 2rng n GLY 10 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.01 0.00 -3.25 4.61 0.00 -0.86 -4.87 120.51 114.12 2rng n ALA 11 Ca -0.12 0.00 -0.05 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 0.41 -0.76 0.64 0.00 2.01 -1.26 -1.80 115.64 114.88 2rng s THR 12 Ca 0.00 -0.28 -0.02 0.00 0.31 0.00 0.00 61.69 61.70 2rng s THR 12 Cb 0.00 -0.66 0.06 0.00 0.01 0.00 0.00 72.50 71.92 2rng s THR 12 CO 0.00 -0.20 0.90 0.68 -0.69 0.00 0.00 174.62 175.31 2rng s VAL 13 N 2.20 2.43 0.00 3.82 -7.23 0.44 -4.75 120.40 117.32 2rng s VAL 13 Ca 0.13 -0.51 0.00 0.00 -1.81 0.00 0.00 61.98 59.79 2rng s VAL 13 Cb -0.10 -2.92 0.00 0.00 0.56 0.00 0.00 36.38 33.92 2rng s VAL 13 CO -0.18 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.22 2rng n GLY 14 N -2.65 -0.29 0.14 2.32 0.00 -1.24 0.78 105.19 104.26 2rng n GLY 14 Ca 0.09 -1.71 -0.16 0.00 0.00 0.00 0.00 46.02 44.24 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 0.38 0.37 1.61 0.13 -1.77 -1.97 132.00 130.75 2rng h PRO 15 Ca 0.00 -0.34 -0.02 0.00 -0.87 0.00 0.00 66.00 64.77 2rng h PRO 15 Cb 0.00 0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.21 2rng h PRO 15 CO 0.00 1.00 -0.18 0.77 -0.23 0.00 0.00 178.00 179.36 2rng h SER 16 N -0.12 -0.42 -0.56 1.44 0.02 -1.93 -2.38 113.55 109.60 2rng h SER 16 Ca -0.04 -0.14 0.06 0.00 -0.84 0.00 0.00 61.79 60.84 2rng h SER 16 Cb 1.10 0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.70 2rng h SER 16 CO 0.09 -0.06 0.26 0.58 -1.14 0.00 0.00 176.83 176.56 2rng h VAL 17 N -0.84 0.90 0.09 2.27 2.07 -1.93 -2.58 116.25 116.24 2rng h VAL 17 Ca -0.05 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.31 2rng h VAL 17 Cb 0.53 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 2rng h VAL 17 CO 0.08 0.09 -0.37 -0.25 0.02 0.00 0.00 177.57 177.14 2rng h TRP 18 N 0.49 -1.09 -1.09 1.57 2.91 -1.33 0.08 115.95 117.49 2rng h TRP 18 Ca 0.26 0.03 0.39 0.00 1.13 0.00 0.00 58.89 60.70 2rng h TRP 18 Cb 0.22 0.46 -0.16 0.00 -0.51 0.00 0.00 29.16 29.17 2rng h TRP 18 CO -0.12 -0.42 0.64 0.00 -1.03 0.00 0.00 178.44 177.50 2rng h ALA 19 N -0.85 2.26 0.82 2.65 0.00 -1.13 0.28 119.26 123.28 2rng h ALA 19 Ca -0.01 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 2rng h ALA 19 Cb 0.54 0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.57 2rng h ALA 19 CO -0.20 -0.94 -0.39 -0.92 0.00 0.00 0.00 179.25 176.80 2rng h TYR 20 N 0.13 -1.01 -0.39 0.00 3.20 -0.63 -2.64 116.97 115.63 2rng h TYR 20 Ca 0.80 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.72 2rng h TYR 20 Cb 2.15 0.34 -0.09 0.00 1.54 0.00 0.00 36.73 40.66 2rng h TYR 20 CO -0.01 -0.63 -0.37 1.25 -1.64 0.00 0.00 178.16 176.76 2rng h LEU 21 N -1.27 -1.21 -0.65 2.82 6.46 -0.06 -1.46 115.31 119.93 2rng h LEU 21 Ca -0.11 0.20 0.09 0.00 -0.12 0.00 0.00 57.88 57.94 2rng h LEU 21 Cb 0.84 0.55 -0.11 0.00 -0.73 0.00 0.00 40.66 41.21 2rng h LEU 21 CO 0.18 -0.34 -0.45 0.58 -0.62 0.00 0.00 178.44 177.79 2rng h VAL 22 N -0.29 0.07 -0.87 1.05 2.07 -1.31 0.35 116.25 117.32 2rng h VAL 22 Ca 0.16 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.86 2rng h VAL 22 Cb 0.56 0.07 -0.11 0.00 -1.52 0.00 0.00 31.29 30.28 2rng h VAL 22 CO -0.55 0.00 0.40 0.00 0.02 0.00 0.00 177.57 177.45 2rng h ALA 23 N 0.64 1.35 -0.81 1.67 0.00 -0.90 0.16 119.26 121.37 2rng h ALA 23 Ca 0.19 0.13 0.12 0.00 0.00 0.00 0.00 54.91 55.35 2rng h ALA 23 Cb 0.55 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.34 2rng h ALA 23 CO -0.73 -0.24 0.42 1.25 0.00 0.00 0.00 179.25 179.94 2rng h LEU 24 N 0.49 0.53 0.00 0.00 5.85 0.32 -3.42 115.31 119.08 2rng h LEU 24 Ca 0.51 0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.31 2rng h LEU 24 Cb 0.88 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.90 2rng h LEU 24 CO -0.46 0.26 0.00 0.55 -0.34 0.00 0.00 178.44 178.45 2rng n VAL 25 N -4.85 0.00 0.00 1.05 3.14 0.40 -5.08 118.33 112.99 2rng n VAL 25 Ca 0.15 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.53 2rng n VAL 25 Cb 0.37 -0.10 0.00 0.00 -1.06 0.00 0.00 33.84 33.05 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 2.94 0.80 0.33 7.55 0.00 -0.26 -4.98 105.19 111.57 2rng n GLY 26 Ca 0.00 -0.81 0.22 0.00 0.00 0.00 0.00 46.02 45.44 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 1.00 0.27 4.61 0.00 -1.96 -0.40 119.26 122.78 2rng h ALA 27 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2rng h ALA 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2rng h ALA 27 CO 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 179.25 179.12 2rng h ALA 28 N 2.00 -0.51 0.00 0.00 0.00 -1.97 -0.46 119.26 118.32 2rng h ALA 28 Ca 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2rng h ALA 28 Cb 0.06 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2rng h ALA 28 CO 0.00 -0.48 -0.00 0.00 0.00 0.00 0.00 179.25 178.77 2rng h ALA 29 N -1.44 1.01 0.04 0.00 0.00 -1.92 -1.50 119.26 115.46 2rng h ALA 29 Ca -0.04 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.64 2rng h ALA 29 Cb 0.28 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2rng h ALA 29 CO 0.06 0.00 -1.02 0.28 0.00 0.00 0.00 179.25 178.57 2rng h VAL 30 N 0.00 1.51 0.08 0.00 2.07 -1.05 -1.86 116.25 116.99 2rng h VAL 30 Ca -0.00 -2.85 -0.26 0.00 0.82 0.00 0.00 66.70 64.42 2rng h VAL 30 Cb 0.24 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 2rng h VAL 30 CO 0.00 0.83 -1.21 0.74 0.02 0.00 0.00 177.57 177.95 2rng h THR 31 N 0.10 1.51 0.00 2.57 2.02 -0.21 -3.19 112.91 115.71 2rng h THR 31 Ca -0.07 -3.15 -0.07 0.00 0.77 0.00 0.00 66.41 63.89 2rng h THR 31 Cb 1.71 2.87 -0.01 0.00 -1.74 0.00 0.00 68.15 70.98 2rng h THR 31 CO 0.16 0.90 -0.32 0.00 0.37 0.00 0.00 175.52 176.63 2rng h ALA 32 N 0.73 0.82 0.00 6.16 0.00 -1.37 -3.03 119.26 122.57 2rng h ALA 32 Ca -0.11 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2rng h ALA 32 Cb 1.91 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.65 2rng h ALA 32 CO 0.17 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.82 2rng n ALA 33 N -2.19 2.50 -3.11 0.00 0.00 -0.70 -4.90 120.51 112.12 2rng n ALA 33 Ca 0.02 -0.09 -0.09 0.00 0.00 0.00 0.00 53.44 53.28 2rng n ALA 33 Cb 0.63 -1.24 0.04 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.76 -6.92 -4.36 0.00 2.85 -1.15 -1.17 115.26 103.76 2rng n ASN 34 Ca 0.11 -0.44 -0.33 0.00 -0.11 0.00 0.00 54.58 53.81 2rng n ASN 34 Cb 0.05 -5.08 -0.14 0.00 1.24 0.00 0.00 39.78 35.85 2rng n ASN 34 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2rng s ILE 35 N -3.23 3.10 0.02 -1.44 1.01 -1.20 0.04 121.20 119.50 2rng s ILE 35 Ca 0.27 -0.64 0.03 0.00 0.00 0.00 0.00 60.65 60.31 2rng s ILE 35 Cb -0.03 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 2rng s ILE 35 CO 0.71 0.51 -0.05 -0.13 0.00 0.00 0.00 174.94 175.99 2rng s ARG 36 N 0.52 2.57 0.32 2.79 0.52 -0.74 -4.90 118.95 120.02 2rng s ARG 36 Ca -0.08 -0.73 -0.07 0.00 -0.52 0.00 0.00 55.73 54.33 2rng s ARG 36 Cb -0.16 -2.52 -0.06 0.00 0.52 0.00 0.00 34.95 32.73 2rng s ARG 36 CO 0.04 0.59 0.62 1.03 0.02 0.00 0.00 175.30 177.60 2rng s ARG 37 N -1.59 3.69 0.32 3.54 0.52 -1.25 -0.42 118.95 123.76 2rng s ARG 37 Ca 0.19 0.17 0.03 0.00 -0.52 0.00 0.00 55.73 55.59 2rng s ARG 37 Cb -0.11 -2.57 -0.06 0.00 0.52 0.00 0.00 34.95 32.73 2rng s ARG 37 CO 0.09 0.14 0.07 0.00 0.02 0.00 0.00 175.30 175.63 2rng s ALA 38 N -2.15 2.31 0.43 2.13 0.00 0.23 -4.83 121.76 119.88 2rng s ALA 38 Ca 0.46 -1.92 0.11 0.00 0.00 0.00 0.00 51.96 50.61 2rng s ALA 38 Cb -0.11 0.75 0.98 0.00 0.00 0.00 0.00 23.12 24.74 2rng s ALA 38 CO 0.30 -0.34 2.05 1.03 0.00 0.00 0.00 175.76 178.79 2rng h SER 39 N 2.12 0.37 -5.00 0.00 0.87 -1.88 -3.12 113.55 106.91 2rng h SER 39 Ca -0.40 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.14 2rng h SER 39 Cb 1.25 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2rng h SER 39 CO 0.66 0.25 0.27 -0.44 -0.53 0.00 0.00 176.83 177.05 2rng s SER 40 N -6.59 0.01 0.46 6.23 0.01 -1.26 -4.55 113.70 108.01 2rng s SER 40 Ca -0.08 -1.16 0.21 0.00 1.31 0.00 0.00 55.95 56.24 2rng s SER 40 Cb 0.18 0.85 1.20 0.00 0.21 0.00 0.00 66.02 68.46 2rng s SER 40 CO 0.73 -1.70 1.88 0.44 0.41 0.00 0.00 173.24 175.01 2rng h ASP 41 N 2.00 0.28 -2.44 2.44 5.19 -1.89 -3.29 116.42 118.72 2rng h ASP 41 Ca -0.32 0.03 -0.57 0.00 -0.62 0.00 0.00 57.03 55.54 2rng h ASP 41 Cb 1.25 -0.02 -0.10 0.00 0.18 0.00 0.00 39.33 40.63 2rng h ASP 41 CO 0.41 0.12 0.89 0.21 -3.12 0.00 0.00 179.24 177.75 2rng s ASN 42 N -5.73 6.17 0.33 6.45 3.84 -1.26 -4.36 114.94 120.38 2rng s ASN 42 Ca -0.07 -0.65 0.05 0.00 0.21 0.00 0.00 52.86 52.39 2rng s ASN 42 Cb 0.22 -2.51 -0.03 0.00 -0.55 0.00 0.00 41.25 38.38 2rng s ASN 42 CO 0.77 -1.70 0.20 -1.38 -2.79 0.00 0.00 177.10 172.20 2rng s HIS 43 N 5.16 1.68 0.31 0.43 -3.43 -1.25 -4.84 115.29 113.35 2rng s HIS 43 Ca 0.31 -1.47 -0.28 0.00 -0.80 0.00 0.00 55.06 52.82 2rng s HIS 43 Cb -0.11 -0.86 -0.09 0.00 -1.43 0.00 0.00 32.58 30.09 2rng s HIS 43 CO 0.13 -0.61 1.07 -1.54 -2.00 0.00 0.00 174.74 171.78 2rng s SER 44 N -3.42 7.17 0.40 7.38 1.04 -1.26 -0.93 113.70 124.08 2rng s SER 44 Ca 0.35 2.17 0.04 0.00 0.48 0.00 0.00 55.95 58.99 2rng s SER 44 Cb 0.03 -2.61 -0.02 0.00 0.10 0.00 0.00 66.02 63.52 2rng s SER 44 CO 0.20 -0.20 0.16 0.00 0.98 0.00 0.00 173.24 174.38 2rng n ALA 46 N -0.88 -1.61 -0.65 0.00 0.00 -1.26 -2.38 120.51 113.73 2rng n ALA 46 Ca -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2rng n ALA 46 Cb 0.64 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.93 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 -1.76 0.23 1.76 0.00 0.00 -1.26 -2.90 105.19 101.26 2rng n GLY 47 Ca -0.11 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 2rng n GLY 47 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rng n ASN 48 N -1.83 5.84 0.00 1.61 5.15 -1.26 -3.83 115.26 120.94 2rng n ASN 48 Ca 0.00 -2.72 0.00 0.00 -0.60 0.00 0.00 54.58 51.26 2rng n ASN 48 Cb 0.00 -1.13 0.00 0.00 -0.53 0.00 0.00 39.78 38.12 2rng n ASN 48 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2rng n ARG 49 N 1.11 2.61 -4.66 1.20 5.12 -1.14 -5.08 116.66 115.81 2rng n ARG 49 Ca 0.18 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.81 2rng n ARG 49 Cb 0.57 -0.99 -0.09 0.00 -1.16 0.00 0.00 32.46 30.78 2rng n ARG 49 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2rng s GLY 50 N -3.31 2.69 0.13 -0.13 0.00 -1.00 -4.59 107.32 101.11 2rng s GLY 50 Ca 0.00 -1.45 -0.13 0.00 0.00 0.00 0.00 44.72 43.14 2rng s GLY 50 CO 0.00 -2.10 0.33 -0.98 0.00 0.00 0.00 173.10 170.34 2rng s TRP 51 N -2.85 0.02 -0.51 1.90 0.52 -1.02 -1.96 118.94 115.03 2rng s TRP 51 Ca 0.23 -0.38 -0.18 0.00 0.02 0.00 0.00 56.10 55.79 2rng s TRP 51 Cb 0.06 0.12 0.07 0.00 -1.15 0.00 0.00 33.47 32.57 2rng s TRP 51 CO 0.12 -0.68 0.55 0.00 0.02 0.00 0.00 176.95 176.96 2rng s ARG 53 N 2.25 1.43 0.10 0.00 0.52 -0.28 -4.35 118.95 118.62 2rng s ARG 53 Ca 0.10 -1.40 -0.26 0.00 -0.52 0.00 0.00 55.73 53.65 2rng s ARG 53 Cb -0.22 -1.86 -0.11 0.00 0.52 0.00 0.00 34.95 33.28 2rng s ARG 53 CO 0.09 0.43 1.67 0.66 0.02 0.00 0.00 175.30 178.17 2rng h SER 54 N 3.65 -0.45 -3.08 0.23 4.64 -1.90 -2.60 113.55 114.04 2rng h SER 54 Ca -0.49 0.05 -0.51 0.00 -0.47 0.00 0.00 61.79 60.37 2rng h SER 54 Cb 1.18 0.16 -0.14 0.00 -0.31 0.00 0.00 62.40 63.30 2rng h SER 54 CO 0.42 -0.24 -0.57 -0.75 -0.87 0.00 0.00 176.83 174.81 2rng s LYS 55 N -6.12 1.76 0.21 4.77 2.20 -1.26 -4.60 119.74 116.71 2rng s LYS 55 Ca -0.15 -2.02 -0.11 0.00 -0.36 0.00 0.00 55.97 53.33 2rng s LYS 55 Cb 0.07 -0.81 -0.01 0.00 -1.51 0.00 0.00 37.83 35.57 2rng s LYS 55 CO 0.65 -0.29 0.38 0.00 -0.36 0.00 0.00 175.35 175.74 2rng s PHE 57 N -4.01 1.89 0.01 0.00 0.08 -1.26 -4.99 117.98 109.70 2rng s PHE 57 Ca 0.22 0.42 -0.20 0.00 0.12 0.00 0.00 56.93 57.48 2rng s PHE 57 Cb 0.01 -3.98 -0.22 0.00 -0.57 0.00 0.00 43.02 38.26 2rng s PHE 57 CO 0.06 -2.47 1.12 -0.09 -0.10 0.00 0.00 175.22 173.73 2rng h ARG 58 N -1.52 0.40 -0.21 0.44 2.43 -2.02 -3.06 114.38 110.85 2rng h ARG 58 Ca -0.45 -0.41 0.06 0.00 -0.81 0.00 0.00 59.98 58.38 2rng h ARG 58 Cb 1.26 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.91 2rng h ARG 58 CO 0.44 1.07 0.65 1.25 -1.51 0.00 0.00 179.97 181.87 2rng h HIS 59 N -0.11 0.00 -1.01 2.20 2.76 -1.98 -3.40 115.15 113.62 2rng h HIS 59 Ca -0.06 0.00 -0.64 0.00 -2.20 0.00 0.00 60.37 57.47 2rng h HIS 59 Cb 1.24 0.00 -0.12 0.00 1.55 0.00 0.00 27.41 30.09 2rng h HIS 59 CO 0.14 0.00 -0.53 -1.21 -1.30 0.00 0.00 177.93 175.04 2rng s GLU 60 N -4.21 2.12 0.00 5.26 2.02 -1.16 -4.55 118.70 118.19 2rng s GLU 60 Ca -0.03 -2.19 0.00 0.00 0.02 0.00 0.00 54.97 52.77 2rng s GLU 60 Cb 0.08 -1.68 0.00 0.00 0.10 0.00 0.00 34.13 32.63 2rng s GLU 60 CO 0.28 -0.24 0.00 2.48 0.02 0.00 0.00 175.26 177.80 2rng n TYR 61 N -1.20 0.00 -3.76 1.61 4.11 -1.00 -4.70 117.16 112.21 2rng n TYR 61 Ca -0.10 0.00 -0.35 0.00 -0.00 0.00 0.00 57.90 57.45 2rng n TYR 61 Cb 0.66 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.90 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 -1.42 3.51 -0.99 -3.48 1.01 -1.26 -2.06 120.40 115.71 2rng s VAL 62 Ca 0.00 -3.09 -0.10 0.00 0.00 0.00 0.00 61.98 58.79 2rng s VAL 62 Cb 0.00 -3.31 -0.33 0.00 0.00 0.00 0.00 36.38 32.74 2rng s VAL 62 CO 0.00 -0.87 2.16 -0.67 0.00 0.00 0.00 175.10 175.72 2rng n ASP 63 N 3.34 -1.36 0.19 3.32 -0.08 0.33 -4.64 116.55 117.65 2rng n ASP 63 Ca 0.08 -0.50 0.18 0.00 -1.51 0.00 0.00 54.79 53.04 2rng n ASP 63 Cb 0.37 -0.55 0.77 0.00 2.34 0.00 0.00 41.12 44.04 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 7.00 0.22 -0.07 5.18 1.35 -1.95 -0.39 112.91 124.24 2rng h THR 64 Ca 0.03 0.00 -0.14 0.00 -0.55 0.00 0.00 66.41 65.75 2rng h THR 64 Cb 1.13 0.65 0.01 0.00 -1.73 0.00 0.00 68.15 68.20 2rng h THR 64 CO 1.60 0.00 -0.51 0.22 -0.25 0.00 0.00 175.52 176.58 2rng h TYR 65 N 0.00 0.65 -0.00 4.73 3.20 -1.92 -3.29 116.97 120.33 2rng h TYR 65 Ca 0.11 -0.30 0.00 0.00 3.14 0.00 0.00 58.73 61.68 2rng h TYR 65 Cb 0.92 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.10 2rng h TYR 65 CO 0.00 1.09 -0.49 0.66 -1.64 0.00 0.00 178.16 177.78 2rng n TYR 66 N -4.25 0.00 0.23 -3.82 4.01 -0.43 -3.92 117.16 108.98 2rng n TYR 66 Ca -0.09 0.00 0.16 0.00 -0.16 0.00 0.00 57.90 57.82 2rng n TYR 66 Cb 0.61 -0.25 0.73 0.00 -0.31 0.00 0.00 39.34 40.12 2rng n TYR 66 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2rng h SER 67 N 0.02 0.00 0.15 7.72 4.64 -1.20 -0.68 113.55 124.20 2rng h SER 67 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2rng h SER 67 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2rng h SER 67 CO 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 176.83 175.89 2rng h ALA 68 N 1.28 -0.20 -0.44 5.18 0.00 -1.78 -2.84 119.26 120.46 2rng h ALA 68 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2rng h ALA 68 Cb 0.97 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2rng h ALA 68 CO -0.00 -0.39 0.29 -0.24 0.00 0.00 0.00 179.25 178.91 2rng h VAL 69 N -0.64 1.11 0.17 0.00 3.04 -1.40 -2.54 116.25 115.98 2rng h VAL 69 Ca -0.02 -0.20 -0.01 0.00 -1.01 0.00 0.00 66.70 65.46 2rng h VAL 69 Cb 0.48 0.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.23 2rng h VAL 69 CO 0.03 0.11 -0.08 0.00 -1.01 0.00 0.00 177.57 176.62 2rng n GLY 71 N -1.13 1.18 0.00 0.00 0.00 -0.96 -4.08 105.19 100.20 2rng n GLY 71 Ca -0.09 -0.65 0.12 0.00 0.00 0.00 0.00 46.02 45.41 2rng n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rng n ARG 72 N 0.00 0.39 -4.73 1.61 1.74 -1.26 -4.80 116.66 109.61 2rng n ARG 72 Ca 0.00 0.05 -0.33 0.00 -0.77 0.00 0.00 57.85 56.80 2rng n ARG 72 Cb 0.00 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 29.86 2rng n ARG 72 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2rng s TYR 73 N -2.53 1.88 -0.04 -1.55 2.02 -1.26 -4.89 117.35 110.99 2rng s TYR 73 Ca 0.25 -0.94 0.07 0.00 -0.37 0.00 0.00 57.07 56.08 2rng s TYR 73 Cb 0.17 -1.63 -0.02 0.00 -0.40 0.00 0.00 41.96 40.09 2rng s TYR 73 CO 0.38 0.22 -0.25 -0.06 -1.57 0.00 0.00 175.55 174.26 2rng s PHE 74 N -2.87 2.32 -0.90 2.71 0.40 -0.98 -4.57 117.98 114.09 2rng s PHE 74 Ca 0.08 -0.56 -0.25 0.00 -0.60 0.00 0.00 56.93 55.60 2rng s PHE 74 Cb 0.02 -1.51 0.04 0.00 0.51 0.00 0.00 43.02 42.08 2rng s PHE 74 CO 0.04 -0.12 1.39 0.00 0.70 0.00 0.00 175.22 177.23 2rng n ARG 77 N -3.56 0.85 -3.65 0.00 1.74 -0.87 -2.45 116.66 108.72 2rng n ARG 77 Ca 0.08 -1.67 -0.38 0.00 -0.77 0.00 0.00 57.85 55.11 2rng n ARG 77 Cb 0.60 2.09 -0.08 0.00 -1.02 0.00 0.00 32.46 34.05 2rng n ARG 77 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2rng s SER 78 N -2.58 5.51 0.00 0.55 0.01 -1.26 -2.39 113.70 113.55 2rng s SER 78 Ca 0.12 -2.76 0.23 0.00 1.31 0.00 0.00 55.95 54.85 2rng s SER 78 Cb -0.04 -1.92 1.38 0.00 0.21 0.00 0.00 66.02 65.65 2rng s SER 78 CO 0.09 -0.42 1.75 -1.14 0.41 0.00 0.00 173.24 173.92