#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gyr s ARG 6 N 2.53 1.62 0.09 0.00 1.70 -0.87 -4.87 118.95 119.16 2gyr s ARG 6 Ca 0.16 -1.82 -0.26 0.00 -0.47 0.00 0.00 55.73 53.35 2gyr s ARG 6 Cb -0.17 0.34 -0.06 0.00 -0.57 0.00 0.00 34.95 34.48 2gyr s ARG 6 CO 0.14 -0.60 0.80 -1.17 -1.08 0.00 0.00 175.30 173.38 2gyr s LEU 7 N -3.27 4.51 -0.09 -1.89 2.96 -1.26 -2.94 118.68 116.69 2gyr s LEU 7 Ca 0.37 1.56 -0.02 0.00 -0.22 0.00 0.00 54.13 55.83 2gyr s LEU 7 Cb 0.03 -3.30 -0.03 0.00 0.50 0.00 0.00 46.19 43.39 2gyr s LEU 7 CO 0.21 0.07 -0.02 -0.13 -1.32 0.00 0.00 176.35 175.16 2gyr s ARG 8 N -0.42 3.06 -0.10 1.98 1.81 0.72 -4.91 118.95 121.09 2gyr s ARG 8 Ca 0.39 -0.45 0.03 0.00 -1.72 0.00 0.00 55.73 53.98 2gyr s ARG 8 Cb -0.22 -2.78 0.01 0.00 -0.45 0.00 0.00 34.95 31.51 2gyr s ARG 8 CO 0.25 0.62 -0.20 0.45 -0.68 0.00 0.00 175.30 175.74 2gyr s SER 9 N -0.66 2.73 0.13 0.23 0.15 -1.26 0.24 113.70 115.25 2gyr s SER 9 Ca 0.10 -0.49 -0.12 0.00 0.70 0.00 0.00 55.95 56.14 2gyr s SER 9 Cb -0.12 -1.25 0.01 0.00 -1.71 0.00 0.00 66.02 62.96 2gyr s SER 9 CO 0.02 0.10 0.32 -1.10 1.20 0.00 0.00 173.24 173.78 2gyr s GLN 10 N 0.59 1.06 -0.20 5.44 -0.21 -0.91 -5.00 119.66 120.43 2gyr s GLN 10 Ca -0.14 -0.92 -0.09 0.00 0.02 0.00 0.00 55.36 54.23 2gyr s GLN 10 Cb -0.17 0.41 -0.05 0.00 1.00 0.00 0.00 33.01 34.21 2gyr s GLN 10 CO 0.04 -0.39 0.12 -0.51 -2.12 0.00 0.00 175.29 172.43 2gyr s LEU 11 N -2.87 4.07 0.03 2.90 1.43 -1.26 -0.07 118.68 122.92 2gyr s LEU 11 Ca 0.08 0.16 -0.01 0.00 -1.03 0.00 0.00 54.13 53.33 2gyr s LEU 11 Cb 0.03 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 2gyr s LEU 11 CO -0.08 0.15 -0.02 0.68 0.23 0.00 0.00 176.35 177.32 2gyr s VAL 12 N 0.51 0.15 0.37 -1.59 -7.23 -0.02 -4.90 120.40 107.69 2gyr s VAL 12 Ca 0.07 -1.25 -0.27 0.00 -1.81 0.00 0.00 61.98 58.72 2gyr s VAL 12 Cb -0.12 -0.77 -0.09 0.00 0.56 0.00 0.00 36.38 35.96 2gyr s VAL 12 CO -0.00 -0.69 1.22 -2.84 -0.31 0.00 0.00 175.10 172.48 2gyr s PRO 13 N -2.45 4.17 0.03 4.82 0.02 -1.26 -1.11 135.00 139.21 2gyr s PRO 13 Ca -0.07 2.00 0.21 0.00 0.02 0.00 0.00 61.00 63.16 2gyr s PRO 13 Cb -0.03 -2.85 0.87 0.00 0.02 0.00 0.00 34.50 32.51 2gyr s PRO 13 CO -0.05 -0.27 1.66 1.33 -0.33 0.00 0.00 177.00 179.34 2gyr n VAL 14 N 0.39 0.62 0.07 3.83 0.24 -1.14 -2.07 118.33 120.27 2gyr n VAL 14 Ca 0.02 0.14 -0.08 0.00 -2.04 0.00 0.00 64.34 62.38 2gyr n VAL 14 Cb 0.44 -0.82 0.06 0.00 -1.47 0.00 0.00 33.84 32.05 2gyr n VAL 14 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2gyr h ARG 15 N 0.00 0.32 0.00 7.34 2.43 -1.82 -2.78 114.38 119.86 2gyr h ARG 15 Ca 0.00 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 2gyr h ARG 15 Cb 0.37 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 2gyr h ARG 15 CO 0.00 0.89 0.00 0.00 -1.51 0.00 0.00 179.97 179.35 2gyr h ALA 16 N 1.04 1.00 0.00 2.80 0.00 -1.75 -3.12 119.26 119.23 2gyr h ALA 16 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2gyr h ALA 16 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2gyr h ALA 16 CO 0.11 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.64 2gyr n LEU 17 N -2.73 0.00 -3.56 0.00 4.77 -1.05 -4.89 117.00 109.54 2gyr n LEU 17 Ca 0.04 0.04 -0.28 0.00 -0.03 0.00 0.00 56.01 55.78 2gyr n LEU 17 Cb 0.42 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.49 2gyr n LEU 17 CO 0.30 -0.02 -0.19 0.61 -1.33 0.00 0.00 177.39 176.75 2gyr n GLY 18 N -0.05 -0.70 0.00 -0.72 0.00 -1.18 -4.91 105.19 97.63 2gyr n GLY 18 Ca 0.11 0.87 0.00 0.00 0.00 0.00 0.00 46.02 47.00 2gyr n GLY 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gyr n LEU 19 N -1.41 0.26 0.00 0.99 4.77 -1.26 -5.04 117.00 115.30 2gyr n LEU 19 Ca -0.17 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 2gyr n LEU 19 Cb 0.66 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 2gyr n LEU 19 CO 0.59 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 2gyr n GLY 20 N -0.03 3.29 3.89 -0.72 0.00 -1.26 -5.09 105.19 105.27 2gyr n GLY 20 Ca 0.00 -1.04 -0.21 0.00 0.00 0.00 0.00 46.02 44.77 2gyr n GLY 20 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2gyr s HIS 21 N -0.04 3.25 0.30 1.61 0.00 -1.26 -5.12 115.29 114.03 2gyr s HIS 21 Ca 0.00 -0.08 0.07 0.00 -3.00 0.00 0.00 55.06 52.04 2gyr s HIS 21 Cb 0.00 -1.51 -0.02 0.00 -4.00 0.00 0.00 32.58 27.04 2gyr s HIS 21 CO 0.00 0.45 0.33 -0.98 -1.00 0.00 0.00 174.74 173.54 2gyr s ARG 22 N -3.92 3.01 -0.16 -0.38 1.70 -1.26 -4.16 118.95 113.77 2gyr s ARG 22 Ca 0.34 -1.07 -0.29 0.00 -0.47 0.00 0.00 55.73 54.24 2gyr s ARG 22 Cb -0.08 -2.66 0.11 0.00 -0.57 0.00 0.00 34.95 31.75 2gyr s ARG 22 CO 0.27 0.22 0.94 0.45 -1.08 0.00 0.00 175.30 176.10 2gyr s SER 23 N -4.00 -0.44 -0.58 -2.89 0.15 -1.26 -4.27 113.70 100.40 2gyr s SER 23 Ca 0.39 0.55 -0.01 0.00 0.70 0.00 0.00 55.95 57.58 2gyr s SER 23 Cb -0.08 0.45 0.45 0.00 -1.71 0.00 0.00 66.02 65.14 2gyr s SER 23 CO 0.28 -0.36 2.00 -0.90 1.20 0.00 0.00 173.24 175.46 2gyr n ASP 24 N 1.01 6.85 -3.93 5.45 3.85 -1.26 -4.58 116.55 123.93 2gyr n ASP 24 Ca -0.12 -3.65 -0.26 0.00 -0.71 0.00 0.00 54.79 50.05 2gyr n ASP 24 Cb 0.57 -0.96 -0.17 0.00 -1.35 0.00 0.00 41.12 39.22 2gyr n ASP 24 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 2gyr s GLU 25 N -3.46 1.52 -0.16 0.11 2.12 -1.26 -5.11 118.70 112.46 2gyr s GLU 25 Ca 0.59 -0.28 -0.21 0.00 0.36 0.00 0.00 54.97 55.43 2gyr s GLU 25 Cb 0.47 -1.50 -0.03 0.00 0.26 0.00 0.00 34.13 33.33 2gyr s GLU 25 CO 0.01 -0.18 0.64 -0.51 -0.54 0.00 0.00 175.26 174.67 2gyr s LEU 26 N 1.41 4.19 0.29 2.70 1.43 -1.26 -2.88 118.68 124.56 2gyr s LEU 26 Ca -0.01 0.92 0.11 0.00 -1.03 0.00 0.00 54.13 54.12 2gyr s LEU 26 Cb -0.13 -2.92 -0.05 0.00 0.03 0.00 0.00 46.19 43.11 2gyr s LEU 26 CO -0.05 -0.22 -0.11 0.68 0.23 0.00 0.00 176.35 176.88 2gyr s VAL 27 N 1.56 2.74 0.20 -1.59 -7.23 -0.27 -4.84 120.40 110.98 2gyr s VAL 27 Ca 0.31 -2.21 -0.28 0.00 -1.81 0.00 0.00 61.98 57.98 2gyr s VAL 27 Cb -0.16 -2.53 -0.08 0.00 0.56 0.00 0.00 36.38 34.16 2gyr s VAL 27 CO 0.12 -0.35 0.88 -0.13 -0.31 0.00 0.00 175.10 175.30 2gyr s ARG 28 N -3.59 4.74 -0.09 4.82 1.81 -1.26 -0.84 118.95 124.54 2gyr s ARG 28 Ca 0.31 1.36 -0.03 0.00 -1.72 0.00 0.00 55.73 55.65 2gyr s ARG 28 Cb -0.04 -3.28 0.04 0.00 -0.45 0.00 0.00 34.95 31.22 2gyr s ARG 28 CO 0.17 0.52 0.08 0.12 -0.68 0.00 0.00 175.30 175.50 2gyr s PHE 29 N -1.09 0.11 -0.10 -0.53 5.36 0.90 -4.92 117.98 117.71 2gyr s PHE 29 Ca 0.39 0.04 -0.02 0.00 -0.96 0.00 0.00 56.93 56.37 2gyr s PHE 29 Cb -0.25 -0.56 -0.03 0.00 -0.34 0.00 0.00 43.02 41.84 2gyr s PHE 29 CO 0.30 -0.32 0.00 1.03 -1.46 0.00 0.00 175.22 174.76 2gyr s ARG 30 N 2.16 3.14 0.21 10.12 0.52 -1.25 -2.14 118.95 131.71 2gyr s ARG 30 Ca 0.04 -0.41 -0.02 0.00 -0.52 0.00 0.00 55.73 54.82 2gyr s ARG 30 Cb -0.14 -2.84 -0.04 0.00 0.52 0.00 0.00 34.95 32.46 2gyr s ARG 30 CO -0.06 0.62 0.17 -0.59 0.02 0.00 0.00 175.30 175.47 2gyr s PHE 31 N -0.65 1.10 -0.15 -0.53 -0.12 0.14 -1.51 117.98 116.27 2gyr s PHE 31 Ca 0.10 -1.33 -0.06 0.00 -0.05 0.00 0.00 56.93 55.60 2gyr s PHE 31 Cb -0.12 -0.49 -0.04 0.00 -0.63 0.00 0.00 43.02 41.75 2gyr s PHE 31 CO 0.02 -0.69 0.06 0.00 -0.05 0.00 0.00 175.22 174.57 2gyr s SER 33 N -0.22 0.19 0.00 0.00 1.04 -1.15 -4.82 113.70 108.73 2gyr s SER 33 Ca 0.08 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.40 2gyr s SER 33 Cb -0.12 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2gyr s SER 33 CO 0.01 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.62 2gyr n GLY 34 N -0.44 2.27 3.87 7.32 0.00 -1.24 -2.04 105.19 114.93 2gyr n GLY 34 Ca -0.01 -2.06 -0.31 0.00 0.00 0.00 0.00 46.02 43.64 2gyr n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gyr s SER 35 N 0.00 5.91 0.00 1.61 1.04 -1.23 -4.40 113.70 116.63 2gyr s SER 35 Ca 0.00 1.33 0.00 0.00 0.48 0.00 0.00 55.95 57.76 2gyr s SER 35 Cb 0.00 -2.28 0.00 0.00 0.10 0.00 0.00 66.02 63.84 2gyr s SER 35 CO 0.00 -1.07 0.43 0.00 0.98 0.00 0.00 173.24 173.58 2gyr n ARG 37 N -0.03 0.00 0.05 0.00 1.85 -1.26 -0.18 116.66 117.09 2gyr n ARG 37 Ca 0.00 0.15 -0.15 0.00 -1.00 0.00 0.00 57.85 56.85 2gyr n ARG 37 Cb 0.43 -1.79 -0.14 0.00 -1.05 0.00 0.00 32.46 29.91 2gyr n ARG 37 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2gyr h ARG 38 N 0.00 0.20 -0.81 2.89 3.08 -1.99 -3.28 114.38 114.46 2gyr h ARG 38 Ca 0.00 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.70 2gyr h ARG 38 Cb 0.59 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.77 2gyr h ARG 38 CO 0.00 1.05 0.00 0.00 -1.07 0.00 0.00 179.97 179.95 2gyr n ALA 39 N -2.64 3.05 -1.58 0.04 0.00 0.74 -4.89 120.51 115.23 2gyr n ALA 39 Ca -0.15 -0.77 -0.45 0.00 0.00 0.00 0.00 53.44 52.06 2gyr n ALA 39 Cb 1.04 -1.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.39 2gyr n ALA 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2gyr n ARG 40 N 0.26 1.91 -1.11 0.00 1.74 -1.24 -4.72 116.66 113.50 2gyr n ARG 40 Ca 0.11 0.58 -0.30 0.00 -0.77 0.00 0.00 57.85 57.48 2gyr n ARG 40 Cb 0.63 -2.96 0.15 0.00 -1.02 0.00 0.00 32.46 29.26 2gyr n ARG 40 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2gyr s SER 41 N 7.07 3.11 0.45 0.55 1.04 -1.26 -4.81 113.70 119.85 2gyr s SER 41 Ca 1.00 1.50 0.21 0.00 0.48 0.00 0.00 55.95 59.14 2gyr s SER 41 Cb -0.51 -2.17 1.08 0.00 0.10 0.00 0.00 66.02 64.51 2gyr s SER 41 CO 0.41 -2.87 1.94 -0.65 0.98 0.00 0.00 173.24 173.06 2gyr h PRO 42 N -1.71 0.00 0.00 4.02 0.11 -2.00 0.17 132.00 132.60 2gyr h PRO 42 Ca -0.51 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2gyr h PRO 42 Cb 1.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 2gyr h PRO 42 CO 0.54 0.23 -0.11 1.25 -0.21 0.00 0.00 178.00 179.70 2gyr h HIS 43 N 0.00 0.00 0.18 0.65 -0.00 -2.00 -2.10 115.15 111.88 2gyr h HIS 43 Ca -0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 60.37 60.06 2gyr h HIS 43 Cb 0.51 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 27.95 2gyr h HIS 43 CO 0.00 0.11 -1.30 -0.44 -0.00 0.00 0.00 177.93 176.29 2gyr h ASP 44 N 0.00 0.84 -0.05 3.26 3.32 -0.97 -2.18 116.42 120.63 2gyr h ASP 44 Ca -0.00 -0.87 0.02 0.00 0.02 0.00 0.00 57.03 56.19 2gyr h ASP 44 Cb 0.26 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 2gyr h ASP 44 CO 0.01 1.64 -0.05 -0.07 -1.72 0.00 0.00 179.24 179.05 2gyr h LEU 45 N 0.16 -0.16 -0.75 1.55 3.38 -0.77 0.32 115.31 119.05 2gyr h LEU 45 Ca -0.21 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 2gyr h LEU 45 Cb 2.00 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 42.80 2gyr h LEU 45 CO 0.25 -0.07 0.19 0.28 0.09 0.00 0.00 178.44 179.17 2gyr h SER 46 N -0.07 1.07 -0.77 -0.43 0.02 -1.50 -0.81 113.55 111.06 2gyr h SER 46 Ca 0.04 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 2gyr h SER 46 Cb 0.13 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.35 2gyr h SER 46 CO -0.09 1.01 0.46 0.25 -1.14 0.00 0.00 176.83 177.32 2gyr h LEU 47 N 1.08 0.93 -0.19 5.07 5.85 -0.88 0.26 115.31 127.42 2gyr h LEU 47 Ca 0.23 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 2gyr h LEU 47 Cb 0.35 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2gyr h LEU 47 CO -0.00 0.73 0.02 0.00 -0.34 0.00 0.00 178.44 178.85 2gyr h ALA 48 N 1.24 0.25 -0.62 1.25 0.00 -0.00 -2.10 119.26 119.29 2gyr h ALA 48 Ca 0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2gyr h ALA 48 Cb -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2gyr h ALA 48 CO -0.05 -0.07 0.36 1.03 0.00 0.00 0.00 179.25 180.52 2gyr h SER 49 N 0.09 0.75 0.61 0.00 0.87 -0.76 1.09 113.55 116.20 2gyr h SER 49 Ca 0.06 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.52 2gyr h SER 49 Cb 0.33 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 2gyr h SER 49 CO 0.00 0.60 -0.49 -0.07 -0.53 0.00 0.00 176.83 176.34 2gyr h LEU 50 N 0.84 -1.32 -2.14 2.23 3.38 -0.41 0.25 115.31 118.13 2gyr h LEU 50 Ca 0.22 0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.30 2gyr h LEU 50 Cb -0.00 0.42 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2gyr h LEU 50 CO -0.04 -0.69 0.04 -0.07 0.09 0.00 0.00 178.44 177.77 2gyr h LEU 51 N -1.07 0.00 -2.12 1.67 3.38 -1.25 0.68 115.31 116.60 2gyr h LEU 51 Ca -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2gyr h LEU 51 Cb 0.90 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 2gyr h LEU 51 CO 0.00 0.00 -0.07 1.23 0.09 0.00 0.00 178.44 179.69 2gyr h GLY 52 N 0.00 0.00 -1.51 0.83 0.00 0.32 -2.31 103.07 100.40 2gyr h GLY 52 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.28 2gyr h GLY 52 CO -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 176.54 176.48 2gyr n ALA 53 N -2.22 3.47 -3.00 3.60 0.00 0.13 -4.94 120.51 117.55 2gyr n ALA 53 Ca -0.02 -2.76 -0.14 0.00 0.00 0.00 0.00 53.44 50.52 2gyr n ALA 53 Cb 0.20 -0.66 -0.01 0.00 0.00 0.00 0.00 19.45 18.98 2gyr n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gyr n GLY 54 N -0.94 -0.48 0.03 0.00 0.00 -0.87 -4.75 105.19 98.19 2gyr n GLY 54 Ca 0.25 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.43 2gyr n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gyr n ALA 55 N -2.92 2.98 -3.12 4.61 0.00 -0.61 -4.75 120.51 116.70 2gyr n ALA 55 Ca -0.01 -0.23 -0.37 0.00 0.00 0.00 0.00 53.44 52.83 2gyr n ALA 55 Cb 0.52 -1.24 -0.13 0.00 0.00 0.00 0.00 19.45 18.60 2gyr n ALA 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2gyr s LEU 56 N -3.54 3.52 -0.16 0.00 1.43 -1.26 -4.98 118.68 113.69 2gyr s LEU 56 Ca 0.10 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.55 2gyr s LEU 56 Cb 0.16 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 2gyr s LEU 56 CO 0.66 -0.08 1.70 -0.13 0.23 0.00 0.00 176.35 178.73 2gyr s ARG 57 N 1.58 3.87 -0.46 1.70 1.81 -1.26 -4.86 118.95 121.32 2gyr s ARG 57 Ca 0.05 1.90 -0.43 0.00 -1.72 0.00 0.00 55.73 55.53 2gyr s ARG 57 Cb -0.16 -4.06 -0.18 0.00 -0.45 0.00 0.00 34.95 30.11 2gyr s ARG 57 CO 0.03 -1.21 1.98 -2.30 -0.68 0.00 0.00 175.30 173.11 2gyr n PRO 58 N 7.59 0.23 -1.13 3.54 -0.02 -1.26 -4.92 135.00 139.02 2gyr n PRO 58 Ca 0.19 0.07 -0.31 0.00 -2.02 0.00 0.00 63.50 61.43 2gyr n PRO 58 Cb 0.44 -1.67 0.11 0.00 -0.02 0.00 0.00 33.50 32.37 2gyr n PRO 58 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2gyr s PRO 59 N 5.06 1.90 -0.55 0.52 0.04 -1.26 -4.89 135.00 135.83 2gyr s PRO 59 Ca 1.13 1.22 -0.26 0.00 0.04 0.00 0.00 61.00 63.13 2gyr s PRO 59 Cb -1.39 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 31.21 2gyr s PRO 59 CO 0.68 -1.91 2.44 -0.35 0.04 0.00 0.00 177.00 177.91 2gyr n PRO 60 N -3.71 0.92 0.00 0.56 -0.04 -1.26 -4.64 135.00 126.83 2gyr n PRO 60 Ca 0.09 -0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 2gyr n PRO 60 Cb 0.53 -3.28 0.00 0.00 -0.04 0.00 0.00 33.50 30.71 2gyr n PRO 60 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2gyr n GLY 61 N 6.09 0.81 3.67 0.55 0.00 -1.26 -5.00 105.19 110.04 2gyr n GLY 61 Ca 0.40 -1.52 -0.44 0.00 0.00 0.00 0.00 46.02 44.45 2gyr n GLY 61 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gyr n SER 62 N 0.00 3.89 -4.69 1.61 3.41 -1.26 -4.93 113.62 111.64 2gyr n SER 62 Ca 0.00 0.91 -0.41 0.00 -0.26 0.00 0.00 58.87 59.11 2gyr n SER 62 Cb 0.00 -1.47 0.01 0.00 -0.26 0.00 0.00 64.21 62.49 2gyr n SER 62 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2gyr n ARG 63 N 7.25 1.87 -1.40 4.33 3.00 -1.26 -4.92 116.66 125.54 2gyr n ARG 63 Ca 0.21 0.66 -0.30 0.00 -0.00 0.00 0.00 57.85 58.43 2gyr n ARG 63 Cb 0.37 -2.34 0.10 0.00 0.00 0.00 0.00 32.46 30.59 2gyr n ARG 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2gyr s PRO 64 N -2.17 1.90 -0.06 -0.14 0.04 -1.26 -5.06 135.00 128.25 2gyr s PRO 64 Ca 0.61 0.80 0.01 0.00 0.04 0.00 0.00 61.00 62.46 2gyr s PRO 64 Cb -0.52 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 2gyr s PRO 64 CO 0.58 -1.79 -0.05 0.14 0.04 0.00 0.00 177.00 175.92 2gyr s VAL 65 N -3.04 3.84 -0.47 -0.36 -7.23 -1.26 -5.03 120.40 106.84 2gyr s VAL 65 Ca 0.61 -0.49 0.03 0.00 -1.81 0.00 0.00 61.98 60.33 2gyr s VAL 65 Cb -0.16 -2.60 0.57 0.00 0.56 0.00 0.00 36.38 34.74 2gyr s VAL 65 CO 0.55 0.55 1.83 -1.54 -0.31 0.00 0.00 175.10 176.18 2gyr n SER 66 N 2.04 4.72 -3.61 4.85 3.41 -1.26 -4.95 113.62 118.82 2gyr n SER 66 Ca -0.17 -3.70 0.01 0.00 -0.26 0.00 0.00 58.87 54.74 2gyr n SER 66 Cb 0.53 -0.81 -0.01 0.00 -0.26 0.00 0.00 64.21 63.66 2gyr n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gyr s GLN 67 N -3.46 0.33 0.95 4.33 -2.07 -1.26 -4.70 119.66 113.77 2gyr s GLN 67 Ca 0.57 -0.17 -0.12 0.00 -1.82 0.00 0.00 55.36 53.82 2gyr s GLN 67 Cb 0.47 0.12 0.16 0.00 -1.09 0.00 0.00 33.01 32.67 2gyr s GLN 67 CO 0.05 -0.15 1.09 -2.14 -1.32 0.00 0.00 175.29 172.82 2gyr s PRO 68 N -2.36 0.84 -0.09 9.60 0.02 -1.26 -5.04 135.00 136.70 2gyr s PRO 68 Ca 0.13 0.80 -0.01 0.00 0.02 0.00 0.00 61.00 61.94 2gyr s PRO 68 Cb 0.04 -1.76 -0.03 0.00 0.02 0.00 0.00 34.50 32.77 2gyr s PRO 68 CO -0.04 -2.52 -0.04 0.00 -0.33 0.00 0.00 177.00 174.06 2gyr s ARG 71 N 2.87 0.54 0.15 0.00 1.81 -0.52 -4.67 118.95 119.13 2gyr s ARG 71 Ca 0.60 -0.89 -0.31 0.00 -1.72 0.00 0.00 55.73 53.41 2gyr s ARG 71 Cb -0.27 0.20 -0.09 0.00 -0.45 0.00 0.00 34.95 34.34 2gyr s ARG 71 CO 0.22 -0.11 1.41 -1.25 -0.68 0.00 0.00 175.30 174.88 2gyr s PRO 72 N -2.84 4.31 -0.35 3.54 0.04 -1.26 -1.88 135.00 136.56 2gyr s PRO 72 Ca -0.03 2.15 0.06 0.00 0.04 0.00 0.00 61.00 63.22 2gyr s PRO 72 Cb 0.00 -3.21 0.47 0.00 0.04 0.00 0.00 34.50 31.81 2gyr s PRO 72 CO -0.06 -0.43 1.44 0.25 0.04 0.00 0.00 177.00 178.24 2gyr n THR 73 N 3.53 2.71 0.00 1.26 -2.24 0.67 -4.92 114.28 115.29 2gyr n THR 73 Ca 0.10 -3.42 0.00 0.00 -2.27 0.00 0.00 64.05 58.47 2gyr n THR 73 Cb 0.41 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 2gyr n THR 73 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2gyr n ARG 74 N -0.92 0.00 -3.14 -0.78 0.63 -1.25 -4.84 116.66 106.36 2gyr n ARG 74 Ca 0.42 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 57.23 2gyr n ARG 74 Cb 0.92 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.80 2gyr n ARG 74 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2gyr n TYR 75 N -1.07 -0.09 -3.47 -0.14 4.01 -1.26 -1.49 117.16 113.64 2gyr n TYR 75 Ca 0.00 -1.30 -0.12 0.00 -0.16 0.00 0.00 57.90 56.31 2gyr n TYR 75 Cb 0.00 0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.05 2gyr n TYR 75 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 2gyr s GLU 76 N -2.72 1.07 0.73 -0.72 -1.05 0.78 -4.69 118.70 112.09 2gyr s GLU 76 Ca 0.13 -0.23 -0.11 0.00 -0.15 0.00 0.00 54.97 54.61 2gyr s GLU 76 Cb 0.01 0.49 0.03 0.00 -0.44 0.00 0.00 34.13 34.22 2gyr s GLU 76 CO 0.09 -0.43 1.08 0.00 0.95 0.00 0.00 175.26 176.95 2gyr s ALA 77 N -2.86 2.55 -0.16 -0.84 0.00 -1.26 -1.48 121.76 117.73 2gyr s ALA 77 Ca -0.01 -0.08 0.02 0.00 0.00 0.00 0.00 51.96 51.89 2gyr s ALA 77 Cb -0.01 -3.13 0.02 0.00 0.00 0.00 0.00 23.12 20.00 2gyr s ALA 77 CO -0.06 -1.38 -0.20 0.08 0.00 0.00 0.00 175.76 174.20 2gyr s VAL 78 N -3.12 1.96 0.16 0.00 1.01 -0.13 -4.78 120.40 115.51 2gyr s VAL 78 Ca 0.59 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.74 2gyr s VAL 78 Cb -0.14 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2gyr s VAL 78 CO 0.54 0.53 -0.01 -0.94 0.00 0.00 0.00 175.10 175.23 2gyr s SER 79 N 1.11 4.79 -0.03 3.32 1.04 -1.26 -1.14 113.70 121.53 2gyr s SER 79 Ca -0.00 -0.36 -0.29 0.00 0.48 0.00 0.00 55.95 55.77 2gyr s SER 79 Cb -0.14 -1.03 0.09 0.00 0.10 0.00 0.00 66.02 65.04 2gyr s SER 79 CO -0.08 0.11 0.78 0.72 0.98 0.00 0.00 173.24 175.74 2gyr s PHE 80 N -1.64 -0.51 -0.24 5.02 -0.12 -0.88 -4.95 117.98 114.65 2gyr s PHE 80 Ca 0.27 0.70 -0.23 0.00 -0.05 0.00 0.00 56.93 57.62 2gyr s PHE 80 Cb -0.10 0.47 -0.01 0.00 -0.63 0.00 0.00 43.02 42.75 2gyr s PHE 80 CO 0.18 -0.58 0.73 -1.64 -0.05 0.00 0.00 175.22 173.86 2gyr s MET 81 N -2.00 4.16 0.00 1.99 -1.94 -1.26 -2.40 119.30 117.85 2gyr s MET 81 Ca -0.04 0.76 0.00 0.00 -1.71 0.00 0.00 55.69 54.71 2gyr s MET 81 Cb -0.00 -3.64 0.00 0.00 2.01 0.00 0.00 34.83 33.20 2gyr s MET 81 CO 0.00 -0.44 0.00 -0.40 -0.01 0.00 0.00 175.02 174.17 2gyr n ASP 82 N 5.75 -0.79 0.00 3.03 5.68 -0.82 -4.74 116.55 124.66 2gyr n ASP 82 Ca 0.02 -0.45 0.00 0.00 -0.50 0.00 0.00 54.79 53.86 2gyr n ASP 82 Cb 0.48 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 2gyr n ASP 82 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2gyr n VAL 83 N -2.16 0.00 0.36 2.12 0.24 -1.26 -0.81 118.33 116.82 2gyr n VAL 83 Ca 0.00 1.50 0.00 0.00 -2.04 0.00 0.00 64.34 63.80 2gyr n VAL 83 Cb 0.00 -2.26 0.00 0.00 -1.47 0.00 0.00 33.84 30.11 2gyr n VAL 83 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 2gyr n ASN 84 N -2.46 2.16 -3.92 -1.34 0.23 -1.26 -4.81 115.26 103.86 2gyr n ASN 84 Ca 0.00 -1.36 -0.33 0.00 -0.53 0.00 0.00 54.58 52.35 2gyr n ASN 84 Cb 0.00 -0.40 0.01 0.00 -2.08 0.00 0.00 39.78 37.31 2gyr n ASN 84 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2gyr n SER 85 N 0.97 -4.53 -4.25 0.53 3.41 0.01 -5.00 113.62 104.76 2gyr n SER 85 Ca 0.00 -1.11 -0.31 0.00 -0.26 0.00 0.00 58.87 57.19 2gyr n SER 85 Cb 0.30 -1.59 -0.16 0.00 -0.26 0.00 0.00 64.21 62.49 2gyr n SER 85 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2gyr s THR 86 N -3.19 1.99 0.61 6.66 2.01 -1.26 -4.80 115.64 117.66 2gyr s THR 86 Ca 0.18 -1.03 -0.18 0.00 0.31 0.00 0.00 61.69 60.97 2gyr s THR 86 Cb -0.10 -1.69 -0.03 0.00 0.01 0.00 0.00 72.50 70.69 2gyr s THR 86 CO 0.93 0.55 1.20 0.86 -0.69 0.00 0.00 174.62 177.47 2gyr s TRP 87 N -0.08 2.38 0.28 4.92 -0.00 -1.26 -1.94 118.94 123.23 2gyr s TRP 87 Ca -0.05 1.52 -0.20 0.00 -0.00 0.00 0.00 56.10 57.37 2gyr s TRP 87 Cb -0.14 -3.46 0.02 0.00 -0.00 0.00 0.00 33.47 29.88 2gyr s TRP 87 CO 0.04 -2.21 0.69 1.03 -0.00 0.00 0.00 176.95 176.50 2gyr s ARG 88 N -3.41 1.77 -0.13 5.86 0.52 -1.01 -4.92 118.95 117.63 2gyr s ARG 88 Ca 0.77 -1.03 -0.30 0.00 -0.52 0.00 0.00 55.73 54.64 2gyr s ARG 88 Cb -0.30 0.59 0.09 0.00 0.52 0.00 0.00 34.95 35.86 2gyr s ARG 88 CO 0.34 -0.80 0.82 -0.08 0.02 0.00 0.00 175.30 175.60 2gyr s THR 89 N -3.89 0.00 -0.12 0.02 -1.32 -1.26 -2.08 115.64 106.98 2gyr s THR 89 Ca 0.13 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.63 2gyr s THR 89 Cb -0.05 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 69.95 2gyr s THR 89 CO 0.07 0.00 -0.20 -0.69 -2.21 0.00 0.00 174.62 171.60 2gyr s VAL 90 N -0.92 1.85 0.57 5.08 1.01 -0.29 -4.95 120.40 122.75 2gyr s VAL 90 Ca -0.06 -0.86 -0.17 0.00 0.00 0.00 0.00 61.98 60.89 2gyr s VAL 90 Cb -0.01 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2gyr s VAL 90 CO 0.05 0.51 1.07 -1.81 0.00 0.00 0.00 175.10 174.92 2gyr s ASP 91 N 0.77 5.79 -0.11 3.32 -0.00 -1.26 -0.95 116.67 124.23 2gyr s ASP 91 Ca -0.09 1.93 -0.10 0.00 -0.00 0.00 0.00 52.55 54.29 2gyr s ASP 91 Cb -0.16 -2.55 0.01 0.00 -0.00 0.00 0.00 42.92 40.23 2gyr s ASP 91 CO 0.00 -1.16 0.16 0.54 -0.00 0.00 0.00 175.17 174.71 2gyr n ARG 92 N -1.74 -0.61 0.00 8.23 1.74 -1.24 -4.81 116.66 118.23 2gyr n ARG 92 Ca 0.10 0.78 0.00 0.00 -0.77 0.00 0.00 57.85 57.95 2gyr n ARG 92 Cb 0.52 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 30.93 2gyr n ARG 92 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2gyr n LEU 93 N 0.76 0.00 -4.34 0.55 4.77 -0.55 -4.89 117.00 113.30 2gyr n LEU 93 Ca -0.02 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.64 2gyr n LEU 93 Cb 0.45 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.39 2gyr n LEU 93 CO 0.14 0.00 -0.52 -0.55 -1.33 0.00 0.00 177.39 175.13 2gyr s SER 94 N -0.64 3.48 0.47 -1.43 0.15 -0.60 -4.87 113.70 110.26 2gyr s SER 94 Ca 0.00 -0.40 -0.20 0.00 0.70 0.00 0.00 55.95 56.05 2gyr s SER 94 Cb 0.00 -1.00 -0.09 0.00 -1.71 0.00 0.00 66.02 63.22 2gyr s SER 94 CO 0.00 0.25 1.01 0.00 1.20 0.00 0.00 173.24 175.70 2gyr s ALA 95 N -0.20 2.92 0.00 5.45 0.00 -0.57 -0.16 121.76 129.21 2gyr s ALA 95 Ca -0.02 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.47 2gyr s ALA 95 Cb -0.13 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.77 2gyr s ALA 95 CO 0.03 -0.20 0.34 0.25 0.00 0.00 0.00 175.76 176.19 2gyr n THR 96 N -0.93 0.00 -3.64 0.00 -2.24 -0.55 -4.63 114.28 102.28 2gyr n THR 96 Ca 0.08 -0.38 -0.03 0.00 -2.27 0.00 0.00 64.05 61.45 2gyr n THR 96 Cb 0.53 1.21 -0.06 0.00 -2.10 0.00 0.00 70.33 69.91 2gyr n THR 96 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gyr s ALA 97 N -0.08 -2.17 0.45 6.98 0.00 -1.26 -5.01 121.76 120.67 2gyr s ALA 97 Ca 0.00 1.77 0.00 0.00 0.00 0.00 0.00 51.96 53.73 2gyr s ALA 97 Cb 0.00 -1.64 -0.00 0.00 0.00 0.00 0.00 23.12 21.48 2gyr s ALA 97 CO 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 175.76 175.60 2gyr n GLY 99 N -0.40 1.64 0.30 0.00 0.00 -0.79 -4.72 105.19 101.23 2gyr n GLY 99 Ca -0.18 -0.61 0.15 0.00 0.00 0.00 0.00 46.02 45.37 2gyr n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32