#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cp2 n SER 2 N 0.00 0.00 -2.44 1.61 7.64 -1.26 -4.96 113.62 114.21 2cp2 n SER 2 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 2cp2 n SER 2 Cb 0.00 0.19 0.01 0.00 -1.01 0.00 0.00 64.21 63.40 2cp2 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cp2 n SER 3 N -1.83 6.98 -4.08 6.43 7.64 -1.26 -4.87 113.62 122.62 2cp2 n SER 3 Ca 0.00 -3.45 -0.32 0.00 1.01 0.00 0.00 58.87 56.11 2cp2 n SER 3 Cb 0.00 -1.11 -0.15 0.00 -1.01 0.00 0.00 64.21 61.94 2cp2 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2cp2 s GLY 4 N -0.46 1.63 0.28 0.23 0.00 -1.26 -5.11 107.32 102.63 2cp2 s GLY 4 Ca 0.53 -1.70 0.11 0.00 0.00 0.00 0.00 44.72 43.65 2cp2 s GLY 4 CO -0.19 0.58 -0.11 -0.45 0.00 0.00 0.00 173.10 172.92 2cp2 s SER 5 N 1.13 3.97 -0.15 1.64 0.15 -1.26 -5.06 113.70 114.13 2cp2 s SER 5 Ca -0.07 -0.90 0.04 0.00 0.70 0.00 0.00 55.95 55.72 2cp2 s SER 5 Cb -0.19 -0.51 -0.11 0.00 -1.71 0.00 0.00 66.02 63.50 2cp2 s SER 5 CO -0.06 -0.00 -0.09 -1.54 1.20 0.00 0.00 173.24 172.75 2cp2 n SER 6 N -0.74 2.60 0.00 5.45 3.41 -1.26 -5.09 113.62 117.98 2cp2 n SER 6 Ca -0.05 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 2cp2 n SER 6 Cb 0.60 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 2cp2 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cp2 n GLY 7 N 2.63 -2.02 2.72 5.00 0.00 -1.26 -5.07 105.19 107.19 2cp2 n GLY 7 Ca -0.25 0.83 -0.18 0.00 0.00 0.00 0.00 46.02 46.41 2cp2 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cp2 s ALA 8 N -1.00 0.13 -0.39 4.61 0.00 -1.26 -5.02 121.76 118.83 2cp2 s ALA 8 Ca 0.00 0.28 0.06 0.00 0.00 0.00 0.00 51.96 52.30 2cp2 s ALA 8 Cb 0.00 -0.57 0.58 0.00 0.00 0.00 0.00 23.12 23.12 2cp2 s ALA 8 CO 0.00 -0.42 1.71 0.00 0.00 0.00 0.00 175.76 177.05 2cp2 n ALA 9 N 5.06 5.10 -2.25 0.00 0.00 -1.26 -4.85 120.51 122.31 2cp2 n ALA 9 Ca -0.09 -3.09 -0.40 0.00 0.00 0.00 0.00 53.44 49.86 2cp2 n ALA 9 Cb 0.50 -1.13 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 2cp2 n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2cp2 s GLU 10 N -3.33 4.59 0.48 0.00 8.01 -1.26 -5.06 118.70 122.12 2cp2 s GLU 10 Ca 0.52 1.22 -0.02 0.00 0.01 0.00 0.00 54.97 56.70 2cp2 s GLU 10 Cb 0.45 -3.34 -0.01 0.00 -4.31 0.00 0.00 34.13 26.92 2cp2 s GLU 10 CO 0.05 0.33 0.73 0.14 0.01 0.00 0.00 175.26 176.51 2cp2 s VAL 11 N -0.30 4.11 0.26 2.63 -7.23 -1.26 -4.73 120.40 113.88 2cp2 s VAL 11 Ca 0.41 -0.30 0.09 0.00 -1.81 0.00 0.00 61.98 60.37 2cp2 s VAL 11 Cb -0.22 -3.55 -0.04 0.00 0.56 0.00 0.00 36.38 33.13 2cp2 s VAL 11 CO 0.26 -0.44 0.00 -0.83 -0.31 0.00 0.00 175.10 173.78 2cp2 s GLY 12 N -4.21 1.65 0.21 2.32 0.00 -1.18 -4.89 107.32 101.21 2cp2 s GLY 12 Ca 0.49 -1.63 -0.30 0.00 0.00 0.00 0.00 44.72 43.28 2cp2 s GLY 12 CO 0.40 -1.69 1.04 -0.35 0.00 0.00 0.00 173.10 172.50 2cp2 s ASP 13 N -3.63 7.41 0.29 1.64 2.15 -0.98 -4.45 116.67 119.11 2cp2 s ASP 13 Ca 0.31 2.05 0.05 0.00 0.43 0.00 0.00 52.55 55.39 2cp2 s ASP 13 Cb -0.07 -2.61 0.45 0.00 -0.30 0.00 0.00 42.92 40.39 2cp2 s ASP 13 CO 0.20 -0.08 1.71 -0.78 -0.17 0.00 0.00 175.17 176.05 2cp2 h ASP 14 N 4.64 0.34 -2.56 -0.34 1.82 -1.94 0.66 116.42 119.05 2cp2 h ASP 14 Ca -0.45 -0.13 -0.49 0.00 -0.39 0.00 0.00 57.03 55.58 2cp2 h ASP 14 Cb 1.21 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 41.12 2cp2 h ASP 14 CO 0.70 0.67 -0.33 0.12 -1.61 0.00 0.00 179.24 178.79 2cp2 s PHE 15 N -4.30 3.48 0.15 0.28 5.36 -1.26 -4.62 117.98 117.08 2cp2 s PHE 15 Ca -0.05 0.19 -0.00 0.00 -0.96 0.00 0.00 56.93 56.10 2cp2 s PHE 15 Cb 0.14 -1.74 -0.04 0.00 -0.34 0.00 0.00 43.02 41.03 2cp2 s PHE 15 CO 0.78 0.33 0.33 -0.51 -1.46 0.00 0.00 175.22 174.68 2cp2 s LEU 16 N -3.90 4.29 0.00 6.12 1.43 -1.26 -4.80 118.68 120.56 2cp2 s LEU 16 Ca 0.37 0.33 -0.02 0.00 -1.03 0.00 0.00 54.13 53.78 2cp2 s LEU 16 Cb -0.10 -3.07 0.11 0.00 0.03 0.00 0.00 46.19 43.17 2cp2 s LEU 16 CO 0.31 0.03 0.77 0.61 0.23 0.00 0.00 176.35 178.31 2cp2 n GLY 17 N -0.38 0.44 2.93 -3.19 0.00 -1.26 -4.95 105.19 98.78 2cp2 n GLY 17 Ca -0.05 -1.98 -0.40 0.00 0.00 0.00 0.00 46.02 43.59 2cp2 n GLY 17 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2cp2 n ASP 18 N -3.01 5.78 -4.00 1.61 -0.08 -1.26 -4.99 116.55 110.60 2cp2 n ASP 18 Ca 0.12 -3.38 -0.09 0.00 -1.51 0.00 0.00 54.79 49.93 2cp2 n ASP 18 Cb 0.44 -1.16 -0.08 0.00 2.34 0.00 0.00 41.12 42.66 2cp2 n ASP 18 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 2cp2 s PHE 19 N -2.57 0.47 0.37 -0.67 0.08 -1.26 -5.09 117.98 109.32 2cp2 s PHE 19 Ca 0.32 -0.88 0.06 0.00 0.12 0.00 0.00 56.93 56.56 2cp2 s PHE 19 Cb 0.05 -0.20 -0.02 0.00 -0.57 0.00 0.00 43.02 42.27 2cp2 s PHE 19 CO 0.06 -0.59 0.23 0.14 -0.10 0.00 0.00 175.22 174.96 2cp2 s VAL 20 N -3.96 0.19 -0.09 -0.44 -7.23 -1.26 -5.11 120.40 102.50 2cp2 s VAL 20 Ca 0.15 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.12 2cp2 s VAL 20 Cb 0.05 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 2cp2 s VAL 20 CO -0.03 0.00 0.56 -0.69 -0.31 0.00 0.00 175.10 174.63 2cp2 s VAL 21 N -3.31 5.12 0.00 1.32 1.01 -1.26 -4.27 120.40 119.01 2cp2 s VAL 21 Ca 0.33 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.45 2cp2 s VAL 21 Cb 0.02 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.50 2cp2 s VAL 21 CO 0.23 0.31 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2cp2 n GLY 22 N 3.15 1.42 3.35 4.51 0.00 -1.13 -5.01 105.19 111.48 2cp2 n GLY 22 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 2cp2 n GLY 22 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2cp2 s GLU 23 N -0.38 1.29 -0.33 1.61 -1.05 -1.26 -4.98 118.70 113.60 2cp2 s GLU 23 Ca 0.00 -1.43 -0.14 0.00 -0.15 0.00 0.00 54.97 53.25 2cp2 s GLU 23 Cb 0.00 0.35 -0.02 0.00 -0.44 0.00 0.00 34.13 34.02 2cp2 s GLU 23 CO 0.00 -0.47 0.31 1.03 0.95 0.00 0.00 175.26 177.08 2cp2 s ARG 24 N -4.08 3.60 -0.06 -4.83 3.00 -1.26 -2.82 118.95 112.50 2cp2 s ARG 24 Ca 0.29 -0.45 0.04 0.00 0.00 0.00 0.00 55.73 55.61 2cp2 s ARG 24 Cb 0.04 -3.79 0.00 0.00 0.00 0.00 0.00 34.95 31.20 2cp2 s ARG 24 CO 0.09 -0.46 -0.17 0.14 0.00 0.00 0.00 175.30 174.89 2cp2 s VAL 25 N 1.91 1.49 -0.33 3.52 -7.23 -0.87 -4.81 120.40 114.08 2cp2 s VAL 25 Ca 0.10 -0.72 -0.28 0.00 -1.81 0.00 0.00 61.98 59.26 2cp2 s VAL 25 Cb -0.17 -1.30 0.02 0.00 0.56 0.00 0.00 36.38 35.49 2cp2 s VAL 25 CO 0.11 0.43 1.03 0.26 -0.31 0.00 0.00 175.10 176.62 2cp2 s TRP 26 N 0.23 3.12 -0.40 2.82 0.51 0.27 -1.01 118.94 124.48 2cp2 s TRP 26 Ca -0.09 1.07 -0.29 0.00 -2.12 0.00 0.00 56.10 54.67 2cp2 s TRP 26 Cb -0.14 -3.69 0.01 0.00 -0.81 0.00 0.00 33.47 28.85 2cp2 s TRP 26 CO 0.04 -0.79 1.38 0.08 -0.51 0.00 0.00 176.95 177.15 2cp2 s VAL 27 N 3.61 3.95 -1.67 4.03 1.01 -0.12 -0.78 120.40 130.43 2cp2 s VAL 27 Ca 0.43 0.99 -0.01 0.00 0.00 0.00 0.00 61.98 63.39 2cp2 s VAL 27 Cb -0.12 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.04 2cp2 s VAL 27 CO 0.17 -0.73 0.10 0.59 0.00 0.00 0.00 175.10 175.22 2cp2 n ASN 28 N 8.60 -5.76 -2.38 3.32 3.02 0.15 -1.70 115.26 120.51 2cp2 n ASN 28 Ca 0.16 -0.06 -0.20 0.00 -0.03 0.00 0.00 54.58 54.45 2cp2 n ASN 28 Cb 0.48 -4.75 -0.01 0.00 -0.61 0.00 0.00 39.78 34.89 2cp2 n ASN 28 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cp2 n GLY 29 N -1.10 -0.44 0.20 7.41 0.00 -1.20 -4.84 105.19 105.23 2cp2 n GLY 29 Ca -0.22 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.78 2cp2 n GLY 29 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2cp2 n VAL 30 N -3.90 0.50 -3.90 1.61 0.31 -0.69 -3.05 118.33 109.22 2cp2 n VAL 30 Ca -0.24 0.34 -0.11 0.00 -0.01 0.00 0.00 64.34 64.32 2cp2 n VAL 30 Cb 0.68 -1.69 -0.10 0.00 -0.91 0.00 0.00 33.84 31.82 2cp2 n VAL 30 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2cp2 s LYS 31 N -1.61 0.48 0.87 5.55 1.02 -1.25 -4.84 119.74 119.97 2cp2 s LYS 31 Ca -0.08 -0.50 -0.12 0.00 0.02 0.00 0.00 55.97 55.30 2cp2 s LYS 31 Cb 0.01 0.20 0.12 0.00 -0.52 0.00 0.00 37.83 37.63 2cp2 s LYS 31 CO 0.12 -0.11 1.10 -1.25 -0.92 0.00 0.00 175.35 174.29 2cp2 s PRO 32 N -1.63 1.45 -0.22 -1.68 0.04 -1.26 -0.94 135.00 130.76 2cp2 s PRO 32 Ca -0.13 0.66 -0.28 0.00 0.04 0.00 0.00 61.00 61.30 2cp2 s PRO 32 Cb -0.07 -1.84 0.13 0.00 0.04 0.00 0.00 34.50 32.76 2cp2 s PRO 32 CO 0.00 -2.07 1.04 0.20 0.04 0.00 0.00 177.00 176.21 2cp2 s GLY 33 N -3.66 -0.18 -0.29 0.56 0.00 -0.18 -4.31 107.32 99.25 2cp2 s GLY 33 Ca 0.63 2.38 -0.29 0.00 0.00 0.00 0.00 44.72 47.44 2cp2 s GLY 33 CO 0.56 1.40 1.27 0.14 0.00 0.00 0.00 173.10 176.46 2cp2 s VAL 34 N -0.51 4.21 0.26 1.40 1.01 0.22 -2.04 120.40 124.94 2cp2 s VAL 34 Ca 0.01 1.38 -0.30 0.00 0.00 0.00 0.00 61.98 63.07 2cp2 s VAL 34 Cb -0.03 -4.18 -0.09 0.00 0.00 0.00 0.00 36.38 32.08 2cp2 s VAL 34 CO -0.03 -0.44 1.30 -0.69 0.00 0.00 0.00 175.10 175.24 2cp2 s VAL 35 N 4.18 3.02 0.00 2.92 1.01 -1.13 0.32 120.40 130.72 2cp2 s VAL 35 Ca 0.55 0.92 0.00 0.00 0.00 0.00 0.00 61.98 63.44 2cp2 s VAL 35 Cb -0.17 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.63 2cp2 s VAL 35 CO 0.21 0.17 0.00 0.00 0.00 0.00 0.00 175.10 175.49 2cp2 n GLN 36 N 1.82 0.00 -4.83 2.72 1.13 -1.17 -2.83 117.38 114.23 2cp2 n GLN 36 Ca 0.03 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.78 2cp2 n GLN 36 Cb 0.42 -0.69 -0.13 0.00 0.11 0.00 0.00 30.24 29.95 2cp2 n GLN 36 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 2cp2 s TYR 37 N -1.87 2.60 -0.24 1.08 6.14 -1.19 -4.94 117.35 118.92 2cp2 s TYR 37 Ca 0.00 -0.23 -0.03 0.00 0.64 0.00 0.00 57.07 57.45 2cp2 s TYR 37 Cb 0.00 -1.54 0.13 0.00 0.42 0.00 0.00 41.96 40.97 2cp2 s TYR 37 CO 0.00 0.19 0.37 -0.51 0.64 0.00 0.00 175.55 176.24 2cp2 s LEU 38 N -1.05 -0.60 0.00 6.97 1.43 -1.26 -1.74 118.68 122.44 2cp2 s LEU 38 Ca 0.13 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2cp2 s LEU 38 Cb -0.10 1.07 0.00 0.00 0.03 0.00 0.00 46.19 47.18 2cp2 s LEU 38 CO 0.03 -0.30 0.00 0.61 0.23 0.00 0.00 176.35 176.92 2cp2 n GLY 39 N 5.36 -1.30 3.18 -3.19 0.00 0.11 -5.02 105.19 104.33 2cp2 n GLY 39 Ca -0.04 0.48 -0.10 0.00 0.00 0.00 0.00 46.02 46.36 2cp2 n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cp2 s GLU 40 N 0.00 1.04 0.40 1.61 2.02 -1.24 0.11 118.70 122.64 2cp2 s GLU 40 Ca 0.00 -1.49 0.00 0.00 0.02 0.00 0.00 54.97 53.50 2cp2 s GLU 40 Cb 0.00 0.26 -0.00 0.00 0.10 0.00 0.00 34.13 34.49 2cp2 s GLU 40 CO 0.00 -0.32 0.02 0.25 0.02 0.00 0.00 175.26 175.22 2cp2 n THR 41 N -0.17 0.00 -0.06 3.63 -2.24 -1.26 -4.75 114.28 109.44 2cp2 n THR 41 Ca -0.03 -1.96 -0.08 0.00 -2.27 0.00 0.00 64.05 59.72 2cp2 n THR 41 Cb 0.64 0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 69.25 2cp2 n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cp2 n GLN 42 N -1.00 0.55 0.15 -0.78 1.13 -1.26 -4.59 117.38 111.58 2cp2 n GLN 42 Ca -0.16 0.06 0.02 0.00 -1.94 0.00 0.00 57.00 54.98 2cp2 n GLN 42 Cb 0.52 -1.23 0.38 0.00 0.11 0.00 0.00 30.24 30.02 2cp2 n GLN 42 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 2cp2 h PHE 43 N 0.00 0.16 -3.89 1.08 -0.00 -1.97 -3.43 116.94 108.88 2cp2 h PHE 43 Ca -0.26 -0.02 -0.24 0.00 -0.00 0.00 0.00 57.97 57.45 2cp2 h PHE 43 Cb 1.42 -0.04 -0.24 0.00 -0.00 0.00 0.00 35.95 37.08 2cp2 h PHE 43 CO 0.01 0.37 -0.72 0.00 -0.00 0.00 0.00 178.31 177.97 2cp2 s ALA 44 N -4.53 0.25 1.00 12.09 0.00 -1.26 -4.98 121.76 124.32 2cp2 s ALA 44 Ca -0.05 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.52 2cp2 s ALA 44 Cb 0.15 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.30 2cp2 s ALA 44 CO 0.73 -0.03 0.00 -0.35 0.00 0.00 0.00 175.76 176.11 2cp2 n PRO 45 N 2.24 -0.27 -1.02 0.00 -0.04 -1.26 -4.07 135.00 130.59 2cp2 n PRO 45 Ca -0.18 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.41 2cp2 n PRO 45 Cb 0.57 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.98 2cp2 n PRO 45 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cp2 n GLY 46 N 3.60 -2.26 3.72 0.55 0.00 -1.26 -3.11 105.19 106.43 2cp2 n GLY 46 Ca 0.00 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 2cp2 n GLY 46 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cp2 s GLN 47 N -2.63 4.45 0.17 1.61 -1.52 0.23 -4.25 119.66 117.72 2cp2 s GLN 47 Ca 0.00 1.83 0.07 0.00 -1.95 0.00 0.00 55.36 55.30 2cp2 s GLN 47 Cb 0.00 -3.30 -0.04 0.00 -0.22 0.00 0.00 33.01 29.45 2cp2 s GLN 47 CO 0.00 -0.19 -0.13 -1.58 -0.25 0.00 0.00 175.29 173.13 2cp2 s TRP 48 N 0.61 1.54 -0.25 0.91 0.52 0.12 -2.31 118.94 120.08 2cp2 s TRP 48 Ca 0.57 -0.62 -0.02 0.00 0.02 0.00 0.00 56.10 56.05 2cp2 s TRP 48 Cb -0.31 -0.75 0.12 0.00 -1.15 0.00 0.00 33.47 31.38 2cp2 s TRP 48 CO 0.32 0.24 0.28 0.00 0.02 0.00 0.00 176.95 177.81 2cp2 s ALA 49 N -2.88 -0.50 0.34 0.98 0.00 -0.26 -0.71 121.76 118.73 2cp2 s ALA 49 Ca 0.18 0.12 -0.26 0.00 0.00 0.00 0.00 51.96 52.00 2cp2 s ALA 49 Cb -0.01 -1.59 -0.10 0.00 0.00 0.00 0.00 23.12 21.42 2cp2 s ALA 49 CO 0.04 -1.44 0.99 0.20 0.00 0.00 0.00 175.76 175.55 2cp2 s GLY 50 N 2.38 2.82 -0.01 0.00 0.00 -0.71 -3.13 107.32 108.68 2cp2 s GLY 50 Ca 0.09 0.61 0.02 0.00 0.00 0.00 0.00 44.72 45.44 2cp2 s GLY 50 CO -0.22 1.07 -0.08 0.14 0.00 0.00 0.00 173.10 174.01 2cp2 s VAL 51 N -1.57 0.61 -0.36 1.40 1.01 -0.10 -3.03 120.40 118.36 2cp2 s VAL 51 Ca 0.51 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 62.02 2cp2 s VAL 51 Cb -0.21 -0.51 -0.01 0.00 0.00 0.00 0.00 36.38 35.65 2cp2 s VAL 51 CO 0.27 0.17 0.30 -0.69 0.00 0.00 0.00 175.10 175.15 2cp2 s VAL 52 N -0.18 5.23 0.44 2.92 1.01 0.15 -1.72 120.40 128.25 2cp2 s VAL 52 Ca 0.03 -0.19 -0.22 0.00 0.00 0.00 0.00 61.98 61.60 2cp2 s VAL 52 Cb -0.03 -3.80 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 2cp2 s VAL 52 CO -0.00 -0.10 1.07 -0.76 0.00 0.00 0.00 175.10 175.30 2cp2 s LEU 53 N 1.85 4.01 0.24 3.92 1.43 -1.03 0.73 118.68 129.82 2cp2 s LEU 53 Ca 0.08 2.05 -0.01 0.00 -1.03 0.00 0.00 54.13 55.22 2cp2 s LEU 53 Cb -0.17 -4.33 0.28 0.00 0.03 0.00 0.00 46.19 41.99 2cp2 s LEU 53 CO 0.11 -0.69 1.66 -0.78 0.23 0.00 0.00 176.35 176.88 2cp2 h ASP 54 N 2.06 0.64 -3.13 2.29 3.58 -1.94 -3.44 116.42 116.49 2cp2 h ASP 54 Ca -0.49 -0.23 -0.63 0.00 0.42 0.00 0.00 57.03 56.10 2cp2 h ASP 54 Cb 1.22 -0.18 -0.10 0.00 1.72 0.00 0.00 39.33 42.00 2cp2 h ASP 54 CO 0.61 0.88 -0.62 -1.81 -2.88 0.00 0.00 179.24 175.41 2cp2 s ASP 55 N -6.79 5.26 -0.87 2.28 1.11 -1.26 -5.02 116.67 111.39 2cp2 s ASP 55 Ca -0.08 -0.13 -0.22 0.00 0.18 0.00 0.00 52.55 52.29 2cp2 s ASP 55 Cb 0.13 -1.32 -0.14 0.00 1.07 0.00 0.00 42.92 42.66 2cp2 s ASP 55 CO 0.82 0.15 1.92 -0.81 1.18 0.00 0.00 175.17 178.42 2cp2 n PRO 56 N 0.30 1.51 -1.52 8.23 -0.04 -1.26 -4.29 135.00 137.93 2cp2 n PRO 56 Ca -0.09 -2.01 0.03 0.00 -0.04 0.00 0.00 63.50 61.38 2cp2 n PRO 56 Cb 0.53 -3.13 0.01 0.00 -0.04 0.00 0.00 33.50 30.86 2cp2 n PRO 56 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2cp2 n VAL 57 N 6.52 0.06 0.00 0.52 0.24 0.13 -4.92 118.33 120.88 2cp2 n VAL 57 Ca 0.48 -0.98 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2cp2 n VAL 57 Cb 0.42 0.96 0.00 0.00 -1.47 0.00 0.00 33.84 33.75 2cp2 n VAL 57 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2cp2 n GLY 58 N 0.38 1.23 0.96 7.63 0.00 0.23 -4.96 105.19 110.67 2cp2 n GLY 58 Ca 0.02 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2cp2 n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2cp2 n LYS 59 N 0.00 0.00 -1.40 1.61 5.02 -1.26 -4.82 118.16 117.31 2cp2 n LYS 59 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 2cp2 n LYS 59 Cb 0.00 0.00 0.10 0.00 -0.02 0.00 0.00 35.03 35.11 2cp2 n LYS 59 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2cp2 n ASN 60 N -1.88 0.40 -1.04 4.39 3.02 -0.79 -4.46 115.26 114.90 2cp2 n ASN 60 Ca 0.00 -1.46 0.03 0.00 -0.03 0.00 0.00 54.58 53.12 2cp2 n ASN 60 Cb 0.00 -0.49 0.14 0.00 -0.61 0.00 0.00 39.78 38.82 2cp2 n ASN 60 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2cp2 n ASP 61 N -3.24 1.70 0.00 6.41 5.75 -1.25 -2.17 116.55 123.75 2cp2 n ASP 61 Ca 0.10 -3.26 0.00 0.00 -0.01 0.00 0.00 54.79 51.61 2cp2 n ASP 61 Cb 0.34 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.98 2cp2 n ASP 61 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cp2 n GLY 62 N -0.59 2.52 3.34 6.12 0.00 -1.26 -4.18 105.19 111.14 2cp2 n GLY 62 Ca 0.16 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 2cp2 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cp2 s ALA 63 N -2.09 2.35 -0.03 4.61 0.00 -1.26 -1.57 121.76 123.77 2cp2 s ALA 63 Ca 0.00 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 50.99 2cp2 s ALA 63 Cb 0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.30 2cp2 s ALA 63 CO 0.00 0.44 -0.16 0.08 0.00 0.00 0.00 175.76 176.12 2cp2 s VAL 64 N -0.27 1.32 0.00 0.00 1.01 -0.54 -4.96 120.40 116.96 2cp2 s VAL 64 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2cp2 s VAL 64 Cb -0.13 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.14 2cp2 s VAL 64 CO 0.03 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2cp2 n GLY 65 N 2.91 0.50 1.27 4.51 0.00 -1.26 -1.84 105.19 111.28 2cp2 n GLY 65 Ca -0.16 0.59 0.01 0.00 0.00 0.00 0.00 46.02 46.46 2cp2 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cp2 n GLY 66 N 0.00 0.85 2.99 -0.02 0.00 -1.26 -5.09 105.19 102.66 2cp2 n GLY 66 Ca 0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 2cp2 n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cp2 s VAL 67 N 0.00 -0.01 -0.01 1.61 1.01 -0.77 -5.16 120.40 117.07 2cp2 s VAL 67 Ca 0.23 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.22 2cp2 s VAL 67 Cb 0.27 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.41 2cp2 s VAL 67 CO -0.12 0.01 0.15 -0.60 0.00 0.00 0.00 175.10 174.55 2cp2 s ARG 68 N 0.24 3.33 0.05 2.72 3.52 -1.26 -1.47 118.95 126.08 2cp2 s ARG 68 Ca -0.01 -0.36 -0.01 0.00 -0.13 0.00 0.00 55.73 55.22 2cp2 s ARG 68 Cb -0.03 -3.03 -0.00 0.00 -1.56 0.00 0.00 34.95 30.33 2cp2 s ARG 68 CO -0.01 0.67 -0.01 0.66 -0.81 0.00 0.00 175.30 175.80 2cp2 n TYR 69 N 1.05 0.00 -4.59 5.12 4.02 -0.61 -4.98 117.16 117.16 2cp2 n TYR 69 Ca -0.12 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.54 2cp2 n TYR 69 Cb 0.53 -0.02 -0.16 0.00 -0.02 0.00 0.00 39.34 39.67 2cp2 n TYR 69 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 176.86 175.26 2cp2 s PHE 70 N -1.68 1.30 -0.83 -0.72 -0.12 -1.20 -5.01 117.98 109.71 2cp2 s PHE 70 Ca -0.01 -0.34 -0.24 0.00 -0.05 0.00 0.00 56.93 56.29 2cp2 s PHE 70 Cb 0.00 -0.89 0.06 0.00 -0.63 0.00 0.00 43.02 41.56 2cp2 s PHE 70 CO 0.02 -0.12 1.24 -1.21 -0.05 0.00 0.00 175.22 175.09 2cp2 s GLU 71 N 0.10 3.35 0.13 1.99 0.41 -1.26 -4.16 118.70 119.26 2cp2 s GLU 71 Ca -0.03 -0.86 0.01 0.00 -0.41 0.00 0.00 54.97 53.68 2cp2 s GLU 71 Cb -0.10 -4.65 -0.04 0.00 -1.78 0.00 0.00 34.13 27.56 2cp2 s GLU 71 CO 0.01 -2.04 -0.03 0.00 -0.49 0.00 0.00 175.26 172.72 2cp2 n PRO 73 N -0.11 -0.13 -1.68 0.00 -0.02 -1.26 -4.57 135.00 127.23 2cp2 n PRO 73 Ca -0.10 0.01 -0.32 0.00 -2.02 0.00 0.00 63.50 61.08 2cp2 n PRO 73 Cb 0.62 -1.96 0.05 0.00 -0.02 0.00 0.00 33.50 32.18 2cp2 n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2cp2 s ALA 74 N -2.28 2.53 -1.84 3.55 0.00 -1.26 -3.43 121.76 119.02 2cp2 s ALA 74 Ca 0.61 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2cp2 s ALA 74 Cb -0.25 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.61 2cp2 s ALA 74 CO 0.63 -1.26 0.00 1.28 0.00 0.00 0.00 175.76 176.41 2cp2 n LEU 75 N -2.72 -1.90 0.00 0.00 4.77 -1.19 -4.76 117.00 111.20 2cp2 n LEU 75 Ca 0.09 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2cp2 n LEU 75 Cb 0.53 -2.93 0.00 0.00 -2.33 0.00 0.00 43.42 38.69 2cp2 n LEU 75 CO 0.50 -0.33 -0.13 0.00 -1.33 0.00 0.00 177.39 176.10 2cp2 n GLN 76 N -2.92 0.00 -1.93 3.23 6.02 -1.18 0.76 117.38 121.35 2cp2 n GLN 76 Ca -0.24 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.51 2cp2 n GLN 76 Cb 0.69 -0.44 -0.06 0.00 1.02 0.00 0.00 30.24 31.45 2cp2 n GLN 76 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2cp2 s GLY 77 N -3.94 -0.13 -0.18 1.08 0.00 -0.92 -2.48 107.32 100.75 2cp2 s GLY 77 Ca 0.00 -1.57 -0.09 0.00 0.00 0.00 0.00 44.72 43.05 2cp2 s GLY 77 CO 0.00 3.72 0.13 -1.50 0.00 0.00 0.00 173.10 175.45 2cp2 s ILE 78 N 11.87 5.43 -0.12 0.90 2.07 -0.70 -1.88 121.20 138.78 2cp2 s ILE 78 Ca 0.74 0.20 -0.08 0.00 -1.41 0.00 0.00 60.65 60.11 2cp2 s ILE 78 Cb -0.06 -3.46 -0.04 0.00 0.13 0.00 0.00 42.46 39.04 2cp2 s ILE 78 CO 0.07 0.48 0.16 -0.36 -1.91 0.00 0.00 174.94 173.37 2cp2 s PHE 79 N 0.04 3.60 0.35 3.50 0.40 -1.26 -0.92 117.98 123.68 2cp2 s PHE 79 Ca 0.10 0.55 -0.18 0.00 -0.60 0.00 0.00 56.93 56.80 2cp2 s PHE 79 Cb -0.11 -1.97 0.04 0.00 0.51 0.00 0.00 43.02 41.49 2cp2 s PHE 79 CO -0.01 0.72 0.77 -0.08 0.70 0.00 0.00 175.22 177.32 2cp2 s THR 80 N -0.99 0.00 0.29 0.64 -1.32 -1.18 -4.99 115.64 108.09 2cp2 s THR 80 Ca 0.15 -1.00 -0.18 0.00 -1.21 0.00 0.00 61.69 59.45 2cp2 s THR 80 Cb -0.12 -2.59 -0.09 0.00 -1.51 0.00 0.00 72.50 68.19 2cp2 s THR 80 CO 0.04 0.00 0.77 -0.13 -2.21 0.00 0.00 174.62 173.09 2cp2 s ARG 81 N -2.84 4.17 0.24 7.08 0.52 -1.26 -1.10 118.95 125.76 2cp2 s ARG 81 Ca 0.14 0.84 -0.04 0.00 -0.52 0.00 0.00 55.73 56.15 2cp2 s ARG 81 Cb -0.05 -2.62 0.44 0.00 0.52 0.00 0.00 34.95 33.23 2cp2 s ARG 81 CO 0.10 0.25 1.75 -1.35 0.02 0.00 0.00 175.30 176.07 2cp2 h PRO 82 N 2.77 0.52 -0.42 3.54 0.11 -1.86 -0.20 132.00 136.45 2cp2 h PRO 82 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2cp2 h PRO 82 Cb 1.18 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2cp2 h PRO 82 CO 0.65 0.34 0.28 1.03 -0.21 0.00 0.00 178.00 180.09 2cp2 h SER 83 N 0.54 0.49 0.09 -2.05 0.87 -1.92 -1.33 113.55 110.23 2cp2 h SER 83 Ca 0.41 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.93 2cp2 h SER 83 Cb 0.55 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.39 2cp2 h SER 83 CO -0.35 0.36 -0.10 0.11 -0.53 0.00 0.00 176.83 176.32 2cp2 h LYS 84 N 0.58 0.04 -6.64 2.24 1.79 -1.41 -3.42 116.57 109.74 2cp2 h LYS 84 Ca 0.16 -0.01 -0.51 0.00 -2.18 0.00 0.00 60.65 58.11 2cp2 h LYS 84 Cb -0.06 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.57 2cp2 h LYS 84 CO -0.03 0.15 0.37 -0.51 -1.08 0.00 0.00 179.45 178.34 2cp2 s LEU 85 N -8.82 4.55 0.13 2.94 1.43 -0.50 0.31 118.68 118.72 2cp2 s LEU 85 Ca -0.05 1.88 -0.02 0.00 -1.03 0.00 0.00 54.13 54.92 2cp2 s LEU 85 Cb 0.16 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.75 2cp2 s LEU 85 CO 0.69 0.00 0.08 0.42 0.23 0.00 0.00 176.35 177.78 2cp2 s THR 86 N -0.46 0.10 -0.53 5.49 -4.23 0.04 -4.90 115.64 111.14 2cp2 s THR 86 Ca 0.45 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 2cp2 s THR 86 Cb -0.25 -1.99 0.48 0.00 1.34 0.00 0.00 72.50 72.08 2cp2 s THR 86 CO 0.31 -0.47 1.96 0.54 -0.54 0.00 0.00 174.62 176.43 2cp2 n ARG 87 N -0.10 2.38 -3.64 3.99 5.12 -1.26 0.94 116.66 124.08 2cp2 n ARG 87 Ca -0.06 -2.87 -0.05 0.00 -1.93 0.00 0.00 57.85 52.94 2cp2 n ARG 87 Cb 0.63 -2.13 -0.06 0.00 -1.16 0.00 0.00 32.46 29.75 2cp2 n ARG 87 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2cp2 s GLN 88 N -3.28 0.20 -0.89 5.56 -0.21 -1.26 -4.98 119.66 114.79 2cp2 s GLN 88 Ca 0.56 0.16 -0.24 0.00 0.02 0.00 0.00 55.36 55.85 2cp2 s GLN 88 Cb 0.45 0.09 -0.01 0.00 1.00 0.00 0.00 33.01 34.54 2cp2 s GLN 88 CO 0.03 -0.04 1.76 -1.25 -2.12 0.00 0.00 175.29 173.67 2cp2 s PRO 89 N -0.30 2.89 -0.43 2.91 0.04 -1.26 -4.65 135.00 134.20 2cp2 s PRO 89 Ca 0.06 -0.42 -0.08 0.00 0.04 0.00 0.00 61.00 60.60 2cp2 s PRO 89 Cb -0.04 -5.02 0.10 0.00 0.04 0.00 0.00 34.50 29.58 2cp2 s PRO 89 CO -0.10 -2.90 0.27 -1.54 0.04 0.00 0.00 177.00 172.77 2cp2 s SER 90 N 6.92 5.55 0.00 6.66 1.04 -1.17 -4.77 113.70 127.93 2cp2 s SER 90 Ca 0.61 -1.76 0.00 0.00 0.48 0.00 0.00 55.95 55.28 2cp2 s SER 90 Cb -0.06 -1.95 0.00 0.00 0.10 0.00 0.00 66.02 64.11 2cp2 s SER 90 CO -0.00 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2cp2 n GLY 91 N 4.84 -0.94 0.11 7.32 0.00 -1.25 -4.28 105.19 110.99 2cp2 n GLY 91 Ca -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 46.02 45.78 2cp2 n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cp2 n PRO 92 N -0.41 -1.02 -3.85 1.61 -0.04 -1.21 -4.30 135.00 125.79 2cp2 n PRO 92 Ca 0.00 -0.06 -0.11 0.00 -0.04 0.00 0.00 63.50 63.30 2cp2 n PRO 92 Cb 0.00 -0.05 -0.09 0.00 -0.04 0.00 0.00 33.50 33.32 2cp2 n PRO 92 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2cp2 s SER 93 N -1.57 0.02 -0.04 3.54 1.04 -1.26 -4.95 113.70 110.48 2cp2 s SER 93 Ca 0.02 -0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.19 2cp2 s SER 93 Cb -0.00 0.27 0.08 0.00 0.10 0.00 0.00 66.02 66.47 2cp2 s SER 93 CO 0.02 -0.50 1.08 -0.24 0.98 0.00 0.00 173.24 174.57 2cp2 n SER 94 N 0.92 -0.89 0.00 7.02 2.88 -1.26 -5.14 113.62 117.15 2cp2 n SER 94 Ca -0.20 -2.03 0.00 0.00 -1.33 0.00 0.00 58.87 55.31 2cp2 n SER 94 Cb 0.58 0.30 0.00 0.00 -0.75 0.00 0.00 64.21 64.33 2cp2 n SER 94 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42