#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 4.57 0.00 -0.53 0.04 -1.26 -5.04 135.00 132.78 2rng s PRO 2 Ca 0.00 1.84 0.00 0.00 0.04 0.00 0.00 61.00 62.88 2rng s PRO 2 Cb 0.00 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.33 2rng s PRO 2 CO 0.00 0.08 0.00 -0.11 0.04 0.00 0.00 177.00 177.01 2rng n LEU 3 N 1.69 0.00 -4.63 -3.56 0.00 -1.26 -5.09 117.00 104.15 2rng n LEU 3 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 56.01 55.63 2rng n LEU 3 Cb 0.45 0.00 0.04 0.00 0.00 0.00 0.00 43.42 43.90 2rng n LEU 3 CO 0.55 -0.01 0.63 -0.38 0.00 0.00 0.00 177.39 178.18 2rng n ILE 4 N -0.01 3.26 -1.60 1.96 2.08 -1.26 -4.96 119.36 118.83 2rng n ILE 4 Ca 0.00 -0.50 -0.30 0.00 0.56 0.00 0.00 62.75 62.51 2rng n ILE 4 Cb 0.00 -1.24 0.08 0.00 -0.75 0.00 0.00 39.64 37.73 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 -2.52 2.24 0.28 0.38 0.04 -1.26 -4.97 135.00 129.19 2rng s PRO 5 Ca 0.71 0.63 0.17 0.00 0.04 0.00 0.00 61.00 62.55 2rng s PRO 5 Cb -0.46 -1.94 0.09 0.00 0.04 0.00 0.00 34.50 32.23 2rng s PRO 5 CO 0.51 -1.51 1.40 0.00 0.04 0.00 0.00 177.00 177.44 2rng h ALA 6 N -1.01 0.72 0.12 8.56 0.00 -1.95 -3.36 119.26 122.34 2rng h ALA 6 Ca -0.47 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.06 2rng h ALA 6 Cb 1.26 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.97 2rng h ALA 6 CO 0.60 0.53 -0.52 0.97 0.00 0.00 0.00 179.25 180.83 2rng h ILE 7 N 0.00 0.02 -1.22 0.00 6.09 -1.93 0.96 117.51 121.42 2rng h ILE 7 Ca -0.02 0.00 0.35 0.00 -1.37 0.00 0.00 64.86 63.83 2rng h ILE 7 Cb 1.33 0.02 -0.05 0.00 0.47 0.00 0.00 36.82 38.59 2rng h ILE 7 CO 0.05 0.00 0.97 1.88 -3.07 0.00 0.00 178.15 177.98 2rng h TYR 8 N -0.74 0.00 -3.17 2.19 0.05 -1.91 -3.29 116.97 110.09 2rng h TYR 8 Ca -0.00 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.25 2rng h TYR 8 Cb 0.75 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.52 2rng h TYR 8 CO -0.44 0.00 0.69 0.42 -1.05 0.00 0.00 178.16 177.77 2rng s ILE 9 N -4.81 3.30 -1.41 -2.88 1.01 0.33 -2.15 121.20 114.59 2rng s ILE 9 Ca -0.05 0.99 -0.03 0.00 0.00 0.00 0.00 60.65 61.56 2rng s ILE 9 Cb 0.21 -3.63 0.01 0.00 0.01 0.00 0.00 42.46 39.07 2rng s ILE 9 CO 0.74 0.11 0.23 0.61 0.00 0.00 0.00 174.94 176.62 2rng n GLY 10 N 3.00 -0.50 0.00 6.18 0.00 0.19 -4.93 105.19 109.12 2rng n GLY 10 Ca 0.09 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.70 0.00 -3.27 4.61 0.00 -0.91 -4.97 120.51 113.26 2rng n ALA 11 Ca -0.14 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.23 2rng n ALA 11 Cb 0.62 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.03 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 0.24 -0.71 0.44 0.00 2.01 -1.26 -1.98 115.64 114.39 2rng s THR 12 Ca 0.00 -0.26 -0.02 0.00 0.31 0.00 0.00 61.69 61.72 2rng s THR 12 Cb 0.00 -0.93 0.09 0.00 0.01 0.00 0.00 72.50 71.67 2rng s THR 12 CO 0.00 -0.23 0.61 1.33 -0.69 0.00 0.00 174.62 175.63 2rng n VAL 13 N 5.26 0.00 -1.60 3.82 0.24 0.29 -4.72 118.33 121.63 2rng n VAL 13 Ca 0.03 -0.83 0.00 0.00 -2.04 0.00 0.00 64.34 61.50 2rng n VAL 13 Cb 0.50 -1.23 0.00 0.00 -1.47 0.00 0.00 33.84 31.65 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 0.52 1.24 0.10 7.63 0.00 -1.24 -0.04 105.19 113.39 2rng n GLY 14 Ca 0.09 -1.95 -0.14 0.00 0.00 0.00 0.00 46.02 44.03 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 0.17 -0.13 1.61 0.13 -1.81 -2.11 132.00 129.86 2rng h PRO 15 Ca 0.00 -0.14 -0.02 0.00 -0.87 0.00 0.00 66.00 64.97 2rng h PRO 15 Cb 0.00 0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.15 2rng h PRO 15 CO 0.00 0.80 0.01 1.03 -0.23 0.00 0.00 178.00 179.61 2rng h SER 16 N -0.41 0.22 -0.33 1.44 0.87 -1.95 -2.79 113.55 110.59 2rng h SER 16 Ca -0.01 -0.28 0.02 0.00 -1.23 0.00 0.00 61.79 60.29 2rng h SER 16 Cb 0.83 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.71 2rng h SER 16 CO 0.03 0.44 0.18 0.58 -0.53 0.00 0.00 176.83 177.54 2rng h VAL 17 N -0.02 1.02 0.05 2.23 2.07 -1.93 -2.46 116.25 117.22 2rng h VAL 17 Ca 0.04 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.45 2rng h VAL 17 Cb 0.32 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 2rng h VAL 17 CO 0.00 0.07 -0.50 -0.25 0.02 0.00 0.00 177.57 176.92 2rng h TRP 18 N 0.38 -1.45 -1.02 1.57 7.01 -1.31 0.50 115.95 121.62 2rng h TRP 18 Ca 0.13 0.04 0.26 0.00 2.11 0.00 0.00 58.89 61.44 2rng h TRP 18 Cb 0.02 0.63 -0.08 0.00 -2.10 0.00 0.00 29.16 27.62 2rng h TRP 18 CO -0.08 -0.54 0.68 0.00 -2.79 0.00 0.00 178.44 175.70 2rng h ALA 19 N -0.56 2.38 0.31 2.65 0.00 -1.36 -0.79 119.26 121.90 2rng h ALA 19 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2rng h ALA 19 Cb 0.69 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2rng h ALA 19 CO -0.30 -0.75 -0.15 -0.92 0.00 0.00 0.00 179.25 177.13 2rng h TYR 20 N 0.32 -0.39 -0.48 0.00 3.20 -0.46 -1.27 116.97 117.89 2rng h TYR 20 Ca 0.56 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.56 2rng h TYR 20 Cb 1.56 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.94 2rng h TYR 20 CO -0.00 -0.24 0.59 1.25 -1.64 0.00 0.00 178.16 178.12 2rng h LEU 21 N -0.51 0.00 -0.12 2.82 6.46 -0.76 0.29 115.31 123.49 2rng h LEU 21 Ca -0.04 0.00 -0.17 0.00 -0.12 0.00 0.00 57.88 57.55 2rng h LEU 21 Cb 0.32 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.26 2rng h LEU 21 CO 0.07 0.00 -0.59 0.58 -0.62 0.00 0.00 178.44 177.88 2rng h VAL 22 N 0.00 1.33 0.00 1.05 2.07 -0.83 -1.85 116.25 118.02 2rng h VAL 22 Ca 0.23 -1.87 -0.02 0.00 0.82 0.00 0.00 66.70 65.86 2rng h VAL 22 Cb 1.40 2.11 -0.00 0.00 -1.52 0.00 0.00 31.29 33.28 2rng h VAL 22 CO -0.00 0.57 -0.09 0.00 0.02 0.00 0.00 177.57 178.07 2rng h ALA 23 N 0.50 1.73 0.03 1.67 0.00 0.76 2.30 119.26 126.26 2rng h ALA 23 Ca -0.04 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2rng h ALA 23 Cb 1.23 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.01 2rng h ALA 23 CO 0.12 0.12 -0.34 1.25 0.00 0.00 0.00 179.25 180.40 2rng h LEU 24 N 0.00 0.24 0.00 0.00 5.85 -1.32 -3.42 115.31 116.66 2rng h LEU 24 Ca -0.00 -0.88 -0.14 0.00 0.84 0.00 0.00 57.88 57.70 2rng h LEU 24 Cb 0.18 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 2rng h LEU 24 CO 0.01 1.09 -1.50 1.33 -0.34 0.00 0.00 178.44 179.03 2rng n VAL 25 N -4.43 0.50 0.00 1.05 0.24 -0.71 -5.11 118.33 109.88 2rng n VAL 25 Ca -0.11 -0.17 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 2rng n VAL 25 Cb 0.58 -1.03 0.00 0.00 -1.47 0.00 0.00 33.84 31.92 2rng n VAL 25 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2rng n GLY 26 N 2.90 2.56 0.21 7.63 0.00 0.77 -4.55 105.19 114.71 2rng n GLY 26 Ca -0.16 -2.14 0.05 0.00 0.00 0.00 0.00 46.02 43.76 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 1.46 0.16 4.61 0.00 -1.92 -1.76 119.26 121.81 2rng h ALA 27 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2rng h ALA 27 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2rng h ALA 27 CO 0.00 0.34 -0.08 0.00 0.00 0.00 0.00 179.25 179.52 2rng h ALA 28 N 1.73 -0.21 -0.41 0.00 0.00 -1.95 0.52 119.26 118.94 2rng h ALA 28 Ca -0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2rng h ALA 28 Cb 0.51 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2rng h ALA 28 CO 0.04 -0.49 0.13 0.00 0.00 0.00 0.00 179.25 178.92 2rng h ALA 29 N 0.32 0.53 0.00 0.00 0.00 -1.77 -0.93 119.26 117.42 2rng h ALA 29 Ca -0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2rng h ALA 29 Cb 0.37 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2rng h ALA 29 CO 0.04 0.18 -0.08 0.28 0.00 0.00 0.00 179.25 179.66 2rng h VAL 30 N 0.51 0.69 0.03 0.00 2.07 -1.27 -0.95 116.25 117.33 2rng h VAL 30 Ca 0.13 -0.34 -0.26 0.00 0.82 0.00 0.00 66.70 67.06 2rng h VAL 30 Cb 0.26 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 2rng h VAL 30 CO -0.00 0.08 -1.33 0.74 0.02 0.00 0.00 177.57 177.07 2rng h THR 31 N 0.00 1.33 0.00 2.57 2.02 -0.24 -3.12 112.91 115.48 2rng h THR 31 Ca -0.00 -3.06 0.00 0.00 0.77 0.00 0.00 66.41 64.12 2rng h THR 31 Cb 0.20 2.71 0.00 0.00 -1.74 0.00 0.00 68.15 69.32 2rng h THR 31 CO 0.01 0.80 -0.11 0.00 0.37 0.00 0.00 175.52 176.59 2rng h ALA 32 N 0.86 0.94 -0.31 6.16 0.00 -0.60 -3.14 119.26 123.17 2rng h ALA 32 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2rng h ALA 32 Cb 1.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.69 2rng h ALA 32 CO 0.13 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.38 2rng n ALA 33 N -1.96 2.47 -3.04 0.00 0.00 -0.41 -4.96 120.51 112.60 2rng n ALA 33 Ca 0.04 -0.62 -0.04 0.00 0.00 0.00 0.00 53.44 52.83 2rng n ALA 33 Cb 0.49 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.93 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 0.52 -7.68 -3.95 0.00 2.85 -1.19 -1.39 115.26 104.42 2rng n ASN 34 Ca 0.14 0.05 -0.30 0.00 -0.11 0.00 0.00 54.58 54.36 2rng n ASN 34 Cb 0.32 -5.12 -0.16 0.00 1.24 0.00 0.00 39.78 36.07 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 -2.87 1.44 0.18 -1.44 1.01 -1.18 0.54 121.20 118.88 2rng s ILE 35 Ca 0.07 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.82 2rng s ILE 35 Cb -0.02 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.82 2rng s ILE 35 CO 0.76 0.10 0.32 -0.13 0.00 0.00 0.00 174.94 175.99 2rng s ARG 36 N 1.48 3.45 0.21 2.79 0.52 -0.84 -4.88 118.95 121.68 2rng s ARG 36 Ca -0.02 -0.61 0.04 0.00 -0.52 0.00 0.00 55.73 54.63 2rng s ARG 36 Cb -0.16 -2.93 -0.03 0.00 0.52 0.00 0.00 34.95 32.34 2rng s ARG 36 CO -0.08 0.48 0.32 1.03 0.02 0.00 0.00 175.30 177.08 2rng s ARG 37 N -3.45 3.40 0.21 3.54 0.52 -1.26 -0.54 118.95 121.37 2rng s ARG 37 Ca 0.35 -0.73 0.01 0.00 -0.52 0.00 0.00 55.73 54.85 2rng s ARG 37 Cb -0.10 -2.89 -0.01 0.00 0.52 0.00 0.00 34.95 32.47 2rng s ARG 37 CO 0.29 0.46 0.05 0.00 0.02 0.00 0.00 175.30 176.12 2rng n ALA 38 N -1.12 0.26 0.31 2.13 0.00 0.94 -4.86 120.51 118.16 2rng n ALA 38 Ca -0.08 -1.03 0.17 0.00 0.00 0.00 0.00 53.44 52.50 2rng n ALA 38 Cb 0.56 0.66 0.99 0.00 0.00 0.00 0.00 19.45 21.65 2rng n ALA 38 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2rng h SER 39 N 0.73 0.00 -0.09 0.00 0.87 -1.89 -3.37 113.55 109.81 2rng h SER 39 Ca -0.17 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 2rng h SER 39 Cb 0.59 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2rng h SER 39 CO 0.27 0.01 0.00 -1.20 -0.53 0.00 0.00 176.83 175.38 2rng n SER 40 N -3.59 0.00 0.24 6.23 7.64 -1.26 -4.78 113.62 118.10 2rng n SER 40 Ca -0.03 -0.96 0.18 0.00 1.01 0.00 0.00 58.87 59.07 2rng n SER 40 Cb 0.10 0.00 0.88 0.00 -1.01 0.00 0.00 64.21 64.18 2rng n SER 40 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2rng h ASP 41 N 0.00 0.00 -3.60 6.43 5.19 -1.90 -3.31 116.42 119.23 2rng h ASP 41 Ca 0.00 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.77 2rng h ASP 41 Cb 0.00 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 39.37 2rng h ASP 41 CO 0.00 0.00 0.27 0.21 -3.12 0.00 0.00 179.24 176.60 2rng s ASN 42 N -5.49 6.39 0.22 6.45 3.84 -1.26 -4.55 114.94 120.54 2rng s ASN 42 Ca -0.04 -0.13 -0.00 0.00 0.21 0.00 0.00 52.86 52.89 2rng s ASN 42 Cb 0.14 -2.36 0.00 0.00 -0.55 0.00 0.00 41.25 38.48 2rng s ASN 42 CO 0.49 -0.84 0.29 0.00 -2.79 0.00 0.00 177.10 174.25 2rng n HIS 43 N 6.50 -0.98 -2.95 0.43 1.44 -1.26 -4.66 115.22 113.74 2rng n HIS 43 Ca 0.01 -1.52 -0.41 0.00 -2.01 0.00 0.00 57.72 53.80 2rng n HIS 43 Cb 0.48 0.32 -0.04 0.00 0.12 0.00 0.00 29.99 30.87 2rng n HIS 43 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2rng s SER 44 N -2.37 6.99 0.33 4.39 0.01 -1.26 -1.32 113.70 120.46 2rng s SER 44 Ca 0.19 1.21 0.03 0.00 1.31 0.00 0.00 55.95 58.69 2rng s SER 44 Cb -0.00 -2.44 -0.06 0.00 0.21 0.00 0.00 66.02 63.73 2rng s SER 44 CO 0.14 -0.26 0.07 0.00 0.41 0.00 0.00 173.24 173.59 2rng n ALA 46 N -0.69 -0.77 -0.64 0.00 0.00 -1.26 -2.41 120.51 114.73 2rng n ALA 46 Ca -0.02 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2rng n ALA 46 Cb 0.66 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.75 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 -1.06 1.37 1.62 0.00 0.00 -1.26 -2.37 105.19 103.49 2rng n GLY 47 Ca -0.17 -0.66 -0.11 0.00 0.00 0.00 0.00 46.02 45.07 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 0.46 4.62 -0.04 1.61 3.02 -1.26 -3.99 115.26 119.67 2rng n ASN 48 Ca 0.00 -2.76 -0.05 0.00 -0.03 0.00 0.00 54.58 51.74 2rng n ASN 48 Cb 0.00 -0.83 -0.05 0.00 -0.61 0.00 0.00 39.78 38.30 2rng n ASN 48 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2rng n ARG 49 N 0.19 1.25 -4.26 3.52 5.12 -1.00 -5.06 116.66 116.43 2rng n ARG 49 Ca 0.23 0.03 -0.15 0.00 -1.93 0.00 0.00 57.85 56.04 2rng n ARG 49 Cb 0.77 -1.17 -0.10 0.00 -1.16 0.00 0.00 32.46 30.80 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 -4.46 1.10 0.36 -0.13 0.00 -1.01 -4.45 107.32 98.73 2rng s GLY 50 Ca -0.09 -1.51 0.04 0.00 0.00 0.00 0.00 44.72 43.16 2rng s GLY 50 CO 0.23 -1.61 0.13 -0.98 0.00 0.00 0.00 173.10 170.87 2rng s TRP 51 N -3.30 1.76 -0.21 1.90 0.52 -0.84 -1.88 118.94 116.89 2rng s TRP 51 Ca 0.17 -1.25 0.01 0.00 0.02 0.00 0.00 56.10 55.05 2rng s TRP 51 Cb 0.02 -1.09 0.03 0.00 -1.15 0.00 0.00 33.47 31.29 2rng s TRP 51 CO 0.01 -0.31 -0.15 0.00 0.02 0.00 0.00 176.95 176.52 2rng s ARG 53 N 1.25 1.57 0.17 0.00 3.00 -0.83 -4.09 118.95 120.02 2rng s ARG 53 Ca 0.00 -1.88 -0.15 0.00 0.00 0.00 0.00 55.73 53.71 2rng s ARG 53 Cb -0.16 -0.52 0.12 0.00 0.00 0.00 0.00 34.95 34.39 2rng s ARG 53 CO -0.09 -0.28 1.73 0.66 0.00 0.00 0.00 175.30 177.32 2rng h SER 54 N 2.21 0.06 -4.52 0.23 4.64 -1.93 -1.95 113.55 112.29 2rng h SER 54 Ca -0.39 0.06 -0.48 0.00 -0.47 0.00 0.00 61.79 60.52 2rng h SER 54 Cb 1.25 0.07 -0.13 0.00 -0.31 0.00 0.00 62.40 63.28 2rng h SER 54 CO 0.63 0.07 -0.52 -0.75 -0.87 0.00 0.00 176.83 175.39 2rng s LYS 55 N -6.15 1.76 0.48 4.77 2.20 -1.26 -4.34 119.74 117.20 2rng s LYS 55 Ca -0.13 -2.03 0.03 0.00 -0.36 0.00 0.00 55.97 53.48 2rng s LYS 55 Cb 0.13 -0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.28 2rng s LYS 55 CO 0.72 -0.52 0.03 0.00 -0.36 0.00 0.00 175.35 175.22 2rng n PHE 57 N -1.21 -3.99 0.12 0.00 3.01 -1.26 -4.98 117.46 109.14 2rng n PHE 57 Ca -0.14 -0.77 -0.24 0.00 1.01 0.00 0.00 57.45 57.31 2rng n PHE 57 Cb 0.67 -0.68 -0.15 0.00 -0.01 0.00 0.00 39.48 39.31 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 0.48 0.00 -1.08 2.43 -2.01 -3.24 114.38 110.96 2rng h ARG 58 Ca -0.28 -0.81 0.00 0.00 -0.81 0.00 0.00 59.98 58.07 2rng h ARG 58 Cb 0.78 0.30 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2rng h ARG 58 CO 0.20 1.39 0.00 -2.39 -1.51 0.00 0.00 179.97 177.66 2rng n HIS 59 N -3.66 0.00 -4.03 2.20 1.44 -1.26 -4.82 115.22 105.09 2rng n HIS 59 Ca -0.20 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.50 2rng n HIS 59 Cb 1.09 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 31.20 2rng n HIS 59 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2rng n GLU 60 N -0.64 1.52 -0.18 -1.40 1.02 -1.22 -4.62 120.64 115.10 2rng n GLU 60 Ca 0.07 -0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 2rng n GLU 60 Cb 0.03 0.07 0.00 0.00 -0.02 0.00 0.00 31.44 31.52 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 -0.05 -0.08 -3.94 -0.32 4.11 -0.99 -4.77 117.16 111.11 2rng n TYR 61 Ca -0.01 0.00 -0.31 0.00 -0.00 0.00 0.00 57.90 57.59 2rng n TYR 61 Cb 0.03 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.22 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 -2.29 1.92 -0.85 -3.48 1.01 -1.26 -2.13 120.40 113.32 2rng s VAL 62 Ca 0.00 -2.14 -0.19 0.00 0.00 0.00 0.00 61.98 59.65 2rng s VAL 62 Cb 0.00 -2.43 -0.21 0.00 0.00 0.00 0.00 36.38 33.74 2rng s VAL 62 CO 0.00 -0.63 2.24 -0.90 0.00 0.00 0.00 175.10 175.81 2rng n ASP 63 N 4.36 0.46 -0.21 3.32 5.68 -0.63 -4.67 116.55 124.85 2rng n ASP 63 Ca 0.03 -1.23 0.29 0.00 -0.50 0.00 0.00 54.79 53.37 2rng n ASP 63 Cb 0.42 -1.23 0.50 0.00 -1.14 0.00 0.00 41.12 39.67 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 7.35 0.05 0.22 2.12 1.35 -1.96 0.16 112.91 122.20 2rng h THR 64 Ca 0.01 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.86 2rng h THR 64 Cb 1.05 0.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 2rng h THR 64 CO 1.22 0.00 -0.11 0.22 -0.25 0.00 0.00 175.52 176.60 2rng h TYR 65 N 0.00 -0.27 0.00 4.73 3.20 -1.96 -3.16 116.97 119.51 2rng h TYR 65 Ca 0.49 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.35 2rng h TYR 65 Cb 2.76 0.09 0.00 0.00 1.54 0.00 0.00 36.73 41.12 2rng h TYR 65 CO 0.00 0.04 -0.18 0.66 -1.64 0.00 0.00 178.16 177.04 2rng n TYR 66 N -5.08 0.28 0.00 -3.82 4.01 0.44 -3.75 117.16 109.23 2rng n TYR 66 Ca -0.09 0.08 0.22 0.00 -0.16 0.00 0.00 57.90 57.95 2rng n TYR 66 Cb 0.23 -0.56 0.57 0.00 -0.31 0.00 0.00 39.34 39.27 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 -1.20 -2.16 113.55 118.78 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 0.58 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 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 -2.20 -0.28 -0.44 6.23 0.00 -1.25 -2.50 120.51 120.07 2rng n ALA 68 Ca 0.13 0.00 0.41 0.00 0.00 0.00 0.00 53.44 53.97 2rng n ALA 68 Cb 1.01 0.00 0.69 0.00 0.00 0.00 0.00 19.45 21.15 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 0.09 0.04 0.00 3.04 -1.68 -0.88 116.25 116.87 2rng h VAL 69 Ca 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2rng h VAL 69 Cb 0.00 0.11 0.00 0.00 -2.01 0.00 0.00 31.29 29.39 2rng h VAL 69 CO 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 177.57 176.54 2rng n GLY 71 N -0.40 0.76 0.26 0.00 0.00 -0.34 -4.36 105.19 101.11 2rng n GLY 71 Ca -0.01 -1.16 0.10 0.00 0.00 0.00 0.00 46.02 44.96 2rng n GLY 71 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2rng h ARG 72 N 0.00 0.00 -6.64 1.61 1.12 -1.91 -3.43 114.38 105.13 2rng h ARG 72 Ca 0.00 0.00 -0.48 0.00 -1.11 0.00 0.00 59.98 58.39 2rng h ARG 72 Cb 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 29.97 29.99 2rng h ARG 72 CO 0.00 0.09 -0.11 0.71 -3.11 0.00 0.00 179.97 177.55 2rng s TYR 73 N -4.56 1.66 -0.03 2.20 1.51 -1.26 -4.97 117.35 111.89 2rng s TYR 73 Ca -0.04 -0.64 0.07 0.00 -1.01 0.00 0.00 57.07 55.45 2rng s TYR 73 Cb 0.15 -2.28 -0.01 0.00 -0.11 0.00 0.00 41.96 39.70 2rng s TYR 73 CO 0.62 -1.06 -0.24 -0.06 -1.11 0.00 0.00 175.55 173.69 2rng s PHE 74 N -2.64 2.25 -0.72 2.71 0.40 -0.73 -4.71 117.98 114.55 2rng s PHE 74 Ca 0.61 -0.53 -0.27 0.00 -0.60 0.00 0.00 56.93 56.14 2rng s PHE 74 Cb -0.06 -1.47 0.03 0.00 0.51 0.00 0.00 43.02 42.03 2rng s PHE 74 CO 0.38 -0.11 1.30 0.00 0.70 0.00 0.00 175.22 177.49 2rng s ARG 77 N -5.19 1.97 -0.35 0.00 3.00 -0.91 -1.98 118.95 115.49 2rng s ARG 77 Ca 0.56 -1.17 -0.11 0.00 -1.00 0.00 0.00 55.73 54.01 2rng s ARG 77 Cb -0.11 0.62 0.01 0.00 0.00 0.00 0.00 34.95 35.46 2rng s ARG 77 CO 0.54 -0.91 0.20 -1.54 0.00 0.00 0.00 175.30 173.59 2rng s SER 78 N -2.98 5.74 0.00 -2.12 1.04 -1.26 -2.35 113.70 111.77 2rng s SER 78 Ca 0.13 -0.74 0.30 0.00 0.48 0.00 0.00 55.95 56.12 2rng s SER 78 Cb -0.06 -2.04 1.58 0.00 0.10 0.00 0.00 66.02 65.60 2rng s SER 78 CO 0.09 -0.30 2.04 -1.14 0.98 0.00 0.00 173.24 174.91