#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 3.09 -0.05 1.61 2.88 -1.26 -4.65 113.62 115.24 2cp2 n SER 2 Ca 0.00 -3.84 -0.11 0.00 -1.33 0.00 0.00 58.87 53.59 2cp2 n SER 2 Cb 0.00 -0.48 -0.14 0.00 -0.75 0.00 0.00 64.21 62.84 2cp2 n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2cp2 n SER 3 N -0.97 0.81 -1.45 -3.46 7.64 -1.26 -5.04 113.62 109.90 2cp2 n SER 3 Ca 0.30 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.44 2cp2 n SER 3 Cb 0.82 0.13 0.00 0.00 -1.01 0.00 0.00 64.21 64.16 2cp2 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cp2 n GLY 4 N 1.69 0.82 3.93 0.23 0.00 -1.26 -5.08 105.19 105.52 2cp2 n GLY 4 Ca -0.24 -0.29 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 2cp2 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cp2 s SER 5 N -2.88 6.34 0.03 1.61 0.15 -1.26 -5.05 113.70 112.63 2cp2 s SER 5 Ca 0.00 0.50 -0.30 0.00 0.70 0.00 0.00 55.95 56.84 2cp2 s SER 5 Cb 0.00 -2.05 -0.05 0.00 -1.71 0.00 0.00 66.02 62.21 2cp2 s SER 5 CO 0.00 -0.23 1.22 -0.55 1.20 0.00 0.00 173.24 174.88 2cp2 s SER 6 N -3.71 7.05 0.00 5.45 0.15 -1.26 -4.50 113.70 116.88 2cp2 s SER 6 Ca 0.40 1.97 0.00 0.00 0.70 0.00 0.00 55.95 59.03 2cp2 s SER 6 Cb -0.10 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2cp2 s SER 6 CO 0.34 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.86 2cp2 n GLY 7 N 3.29 -0.96 3.01 9.45 0.00 -1.26 -5.12 105.19 113.61 2cp2 n GLY 7 Ca 0.10 -0.48 -0.13 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.15 -0.55 -0.35 4.61 0.00 -1.26 -4.79 121.76 119.28 2cp2 s ALA 8 Ca 0.00 0.94 -0.01 0.00 0.00 0.00 0.00 51.96 52.89 2cp2 s ALA 8 Cb 0.00 -0.94 0.12 0.00 0.00 0.00 0.00 23.12 22.30 2cp2 s ALA 8 CO 0.00 -0.55 0.17 0.00 0.00 0.00 0.00 175.76 175.38 2cp2 s ALA 9 N 2.19 1.28 0.53 0.00 0.00 -1.26 -5.10 121.76 119.41 2cp2 s ALA 9 Ca -0.01 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.13 2cp2 s ALA 9 Cb -0.12 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.38 2cp2 s ALA 9 CO -0.08 -1.90 0.00 -1.91 0.00 0.00 0.00 175.76 171.87 2cp2 n GLU 10 N 4.37 -3.18 -4.08 0.00 4.07 -1.26 -4.87 120.64 115.69 2cp2 n GLU 10 Ca 0.04 2.46 -0.27 0.00 -0.06 0.00 0.00 57.16 59.33 2cp2 n GLU 10 Cb 0.39 -3.76 -0.03 0.00 -0.06 0.00 0.00 31.44 27.97 2cp2 n GLU 10 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2cp2 s VAL 11 N -3.63 1.71 0.00 6.31 -7.23 -1.26 -4.77 120.40 111.53 2cp2 s VAL 11 Ca 0.00 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 2cp2 s VAL 11 Cb 0.00 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.61 2cp2 s VAL 11 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 2cp2 n GLY 12 N -1.57 2.09 3.99 2.32 0.00 -1.12 -4.82 105.19 106.08 2cp2 n GLY 12 Ca -0.05 -2.10 -0.19 0.00 0.00 0.00 0.00 46.02 43.68 2cp2 n GLY 12 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cp2 s ASP 13 N -0.97 6.01 0.08 1.61 2.15 -0.52 -4.60 116.67 120.42 2cp2 s ASP 13 Ca 0.00 -0.13 -0.10 0.00 0.43 0.00 0.00 52.55 52.75 2cp2 s ASP 13 Cb 0.00 -1.32 -0.25 0.00 -0.30 0.00 0.00 42.92 41.05 2cp2 s ASP 13 CO 0.00 -0.40 1.15 0.44 -0.17 0.00 0.00 175.17 176.19 2cp2 h ASP 14 N 0.90 0.71 -2.69 -0.34 3.32 -1.97 -0.83 116.42 115.51 2cp2 h ASP 14 Ca -0.46 -0.66 -0.52 0.00 0.02 0.00 0.00 57.03 55.40 2cp2 h ASP 14 Cb 1.25 -0.22 -0.14 0.00 0.22 0.00 0.00 39.33 40.44 2cp2 h ASP 14 CO 0.54 1.48 -0.69 0.12 -1.72 0.00 0.00 179.24 178.97 2cp2 s PHE 15 N -2.96 2.05 0.67 4.55 5.36 -1.26 -4.86 117.98 121.52 2cp2 s PHE 15 Ca -0.07 -0.62 -0.02 0.00 -0.96 0.00 0.00 56.93 55.26 2cp2 s PHE 15 Cb 0.07 -1.13 0.14 0.00 -0.34 0.00 0.00 43.02 41.75 2cp2 s PHE 15 CO 0.91 0.38 0.91 1.28 -1.46 0.00 0.00 175.22 177.25 2cp2 n LEU 16 N -0.61 0.00 0.00 6.12 4.77 -1.26 -4.73 117.00 121.28 2cp2 n LEU 16 Ca -0.06 -1.80 0.00 0.00 -0.03 0.00 0.00 56.01 54.13 2cp2 n LEU 16 Cb 0.63 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2cp2 n LEU 16 CO 0.40 -0.97 0.00 0.61 -1.33 0.00 0.00 177.39 176.09 2cp2 n GLY 17 N -1.86 4.61 1.69 -0.72 0.00 -1.26 -4.92 105.19 102.74 2cp2 n GLY 17 Ca 0.15 -2.19 -0.15 0.00 0.00 0.00 0.00 46.02 43.83 2cp2 n GLY 17 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2cp2 n ASP 18 N -0.90 3.50 -4.87 1.61 9.92 -1.26 -4.99 116.55 119.55 2cp2 n ASP 18 Ca 0.00 -3.73 -0.34 0.00 -0.53 0.00 0.00 54.79 50.18 2cp2 n ASP 18 Cb 0.00 -0.72 -0.05 0.00 -0.64 0.00 0.00 41.12 39.70 2cp2 n ASP 18 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2cp2 s PHE 19 N -3.35 3.57 0.46 1.24 0.08 -1.26 -5.10 117.98 113.61 2cp2 s PHE 19 Ca 0.51 0.73 0.05 0.00 0.12 0.00 0.00 56.93 58.34 2cp2 s PHE 19 Cb 0.44 -2.12 -0.04 0.00 -0.57 0.00 0.00 43.02 40.73 2cp2 s PHE 19 CO 0.04 0.52 0.05 0.14 -0.10 0.00 0.00 175.22 175.87 2cp2 s VAL 20 N -1.42 1.71 -0.27 -0.44 -7.23 -1.26 -5.08 120.40 106.42 2cp2 s VAL 20 Ca 0.33 -1.93 -0.22 0.00 -1.81 0.00 0.00 61.98 58.35 2cp2 s VAL 20 Cb -0.14 -2.64 -0.01 0.00 0.56 0.00 0.00 36.38 34.15 2cp2 s VAL 20 CO 0.19 0.00 0.72 -0.69 -0.31 0.00 0.00 175.10 175.01 2cp2 s VAL 21 N -2.76 4.90 0.00 1.32 1.01 -1.26 -4.05 120.40 119.55 2cp2 s VAL 21 Ca 0.25 1.25 0.00 0.00 0.00 0.00 0.00 61.98 63.48 2cp2 s VAL 21 Cb 0.05 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.40 2cp2 s VAL 21 CO 0.13 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.77 2cp2 n GLY 22 N 4.07 1.94 3.53 4.51 0.00 -0.95 -5.01 105.19 113.28 2cp2 n GLY 22 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2cp2 n GLY 22 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2cp2 n GLU 23 N -0.42 0.57 -4.03 1.61 0.28 -1.26 -4.96 120.64 112.44 2cp2 n GLU 23 Ca 0.00 -3.63 -0.35 0.00 -0.16 0.00 0.00 57.16 53.02 2cp2 n GLU 23 Cb 0.00 1.93 -0.14 0.00 1.43 0.00 0.00 31.44 34.65 2cp2 n GLU 23 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2cp2 s ARG 24 N -3.64 3.34 -0.04 3.44 3.00 -1.26 -2.81 118.95 120.98 2cp2 s ARG 24 Ca 0.21 -0.65 0.04 0.00 0.00 0.00 0.00 55.73 55.32 2cp2 s ARG 24 Cb 0.01 -2.92 -0.00 0.00 0.00 0.00 0.00 34.95 32.04 2cp2 s ARG 24 CO 0.15 -0.15 -0.14 0.14 0.00 0.00 0.00 175.30 175.30 2cp2 s VAL 25 N 1.32 1.16 -0.63 3.52 -7.23 -0.64 -4.80 120.40 113.09 2cp2 s VAL 25 Ca 0.04 -0.56 -0.26 0.00 -1.81 0.00 0.00 61.98 59.38 2cp2 s VAL 25 Cb -0.14 -1.01 0.04 0.00 0.56 0.00 0.00 36.38 35.83 2cp2 s VAL 25 CO -0.03 0.34 1.12 0.26 -0.31 0.00 0.00 175.10 176.48 2cp2 s TRP 26 N 0.11 2.56 -0.19 2.82 0.51 0.12 0.08 118.94 124.95 2cp2 s TRP 26 Ca -0.04 0.02 -0.29 0.00 -2.12 0.00 0.00 56.10 53.68 2cp2 s TRP 26 Cb -0.10 -4.41 -0.03 0.00 -0.81 0.00 0.00 33.47 28.12 2cp2 s TRP 26 CO 0.01 -1.69 1.55 0.08 -0.51 0.00 0.00 176.95 176.39 2cp2 s VAL 27 N 4.82 3.79 -1.70 4.03 1.01 -0.86 -1.60 120.40 129.88 2cp2 s VAL 27 Ca 0.34 0.91 0.00 0.00 0.00 0.00 0.00 61.98 63.23 2cp2 s VAL 27 Cb -0.10 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.54 2cp2 s VAL 27 CO 0.18 -0.25 0.00 0.59 0.00 0.00 0.00 175.10 175.62 2cp2 n ASN 28 N 7.92 -5.55 -2.16 3.32 5.03 -1.20 -1.39 115.26 121.23 2cp2 n ASN 28 Ca 0.18 0.06 -0.18 0.00 0.87 0.00 0.00 54.58 55.50 2cp2 n ASN 28 Cb 0.45 -4.65 -0.03 0.00 -1.02 0.00 0.00 39.78 34.53 2cp2 n ASN 28 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2cp2 n GLY 29 N -0.93 0.13 0.03 7.41 0.00 -1.11 -4.87 105.19 105.85 2cp2 n GLY 29 Ca -0.23 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.34 0.56 -3.81 1.61 0.31 -0.49 -4.11 118.33 109.06 2cp2 n VAL 30 Ca -0.20 0.37 -0.12 0.00 -0.01 0.00 0.00 64.34 64.37 2cp2 n VAL 30 Cb 0.64 -1.82 -0.09 0.00 -0.91 0.00 0.00 33.84 31.66 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 -1.67 0.55 0.39 5.55 1.02 -1.25 -4.97 119.74 119.36 2cp2 s LYS 31 Ca -0.10 -0.21 -0.25 0.00 0.02 0.00 0.00 55.97 55.43 2cp2 s LYS 31 Cb 0.01 0.24 -0.09 0.00 -0.52 0.00 0.00 37.83 37.48 2cp2 s LYS 31 CO 0.15 -0.14 1.16 -1.25 -0.92 0.00 0.00 175.35 174.35 2cp2 s PRO 32 N -1.18 4.10 0.04 -1.68 0.04 -1.26 -2.04 135.00 133.02 2cp2 s PRO 32 Ca -0.12 1.82 0.00 0.00 0.04 0.00 0.00 61.00 62.74 2cp2 s PRO 32 Cb -0.06 -2.70 -0.03 0.00 0.04 0.00 0.00 34.50 31.75 2cp2 s PRO 32 CO 0.03 -0.28 -0.04 0.20 0.04 0.00 0.00 177.00 176.95 2cp2 s GLY 33 N -1.14 0.40 -0.26 0.56 0.00 0.11 -4.01 107.32 102.98 2cp2 s GLY 33 Ca 0.56 -0.88 -0.24 0.00 0.00 0.00 0.00 44.72 44.17 2cp2 s GLY 33 CO 0.38 -0.96 0.80 0.14 0.00 0.00 0.00 173.10 173.46 2cp2 s VAL 34 N -2.41 4.83 0.09 1.40 1.01 0.25 -1.62 120.40 123.94 2cp2 s VAL 34 Ca -0.05 1.42 -0.31 0.00 0.00 0.00 0.00 61.98 63.04 2cp2 s VAL 34 Cb -0.03 -4.11 -0.07 0.00 0.00 0.00 0.00 36.38 32.17 2cp2 s VAL 34 CO -0.04 -0.12 1.32 -0.69 0.00 0.00 0.00 175.10 175.57 2cp2 s VAL 35 N 2.86 3.58 -0.02 2.92 1.01 -1.13 0.98 120.40 130.60 2cp2 s VAL 35 Ca 0.33 1.13 -0.00 0.00 0.00 0.00 0.00 61.98 63.44 2cp2 s VAL 35 Cb -0.15 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 2cp2 s VAL 35 CO 0.09 0.08 -0.02 0.00 0.00 0.00 0.00 175.10 175.25 2cp2 n GLN 36 N 4.01 0.05 -4.40 2.72 1.13 0.25 -2.24 117.38 118.89 2cp2 n GLN 36 Ca 0.11 0.01 -0.27 0.00 -1.94 0.00 0.00 57.00 54.90 2cp2 n GLN 36 Cb 0.44 -0.91 -0.12 0.00 0.11 0.00 0.00 30.24 29.76 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 -2.04 2.33 -0.23 1.08 5.04 -1.01 -4.93 117.35 117.59 2cp2 s TYR 37 Ca -0.03 -0.35 -0.03 0.00 -2.44 0.00 0.00 57.07 54.22 2cp2 s TYR 37 Cb 0.01 -1.18 0.13 0.00 0.35 0.00 0.00 41.96 41.26 2cp2 s TYR 37 CO 0.04 0.46 0.39 -0.51 -1.34 0.00 0.00 175.55 174.59 2cp2 s LEU 38 N -2.52 -0.66 0.00 6.97 1.43 -1.26 -0.97 118.68 121.67 2cp2 s LEU 38 Ca 0.19 0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.70 2cp2 s LEU 38 Cb -0.09 1.20 0.00 0.00 0.03 0.00 0.00 46.19 47.33 2cp2 s LEU 38 CO 0.09 -0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.00 2cp2 n GLY 39 N 5.37 0.12 3.85 -3.19 0.00 -0.42 -5.03 105.19 105.90 2cp2 n GLY 39 Ca -0.04 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 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 -2.00 3.89 0.49 1.61 8.01 -1.26 0.50 118.70 129.94 2cp2 s GLU 40 Ca 0.00 0.80 0.06 0.00 0.01 0.00 0.00 54.97 55.83 2cp2 s GLU 40 Cb 0.00 -2.22 0.06 0.00 -4.31 0.00 0.00 34.13 27.66 2cp2 s GLU 40 CO 0.00 -0.20 0.46 0.25 0.01 0.00 0.00 175.26 175.78 2cp2 n THR 41 N -1.49 0.00 -0.09 3.63 -2.24 -1.25 -4.85 114.28 107.99 2cp2 n THR 41 Ca 0.05 -1.84 -0.12 0.00 -2.27 0.00 0.00 64.05 59.88 2cp2 n THR 41 Cb 0.54 -0.23 -0.08 0.00 -2.10 0.00 0.00 70.33 68.46 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 -1.76 0.57 0.14 -0.78 1.13 -1.26 -4.51 117.38 110.90 2cp2 n GLN 42 Ca 0.03 0.09 0.04 0.00 -1.94 0.00 0.00 57.00 55.22 2cp2 n GLN 42 Cb 0.54 -1.36 0.45 0.00 0.11 0.00 0.00 30.24 29.99 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 0.22 -3.14 1.08 -5.15 -1.88 -3.44 116.94 104.64 2cp2 h PHE 43 Ca -0.40 -0.01 -0.13 0.00 -0.20 0.00 0.00 57.97 57.23 2cp2 h PHE 43 Cb 1.64 -0.07 -0.21 0.00 0.22 0.00 0.00 35.95 37.53 2cp2 h PHE 43 CO 0.02 0.27 -0.34 0.00 -2.00 0.00 0.00 178.31 176.26 2cp2 s ALA 44 N -4.91 -0.67 1.00 12.09 0.00 -1.26 -4.48 121.76 123.54 2cp2 s ALA 44 Ca -0.06 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.22 2cp2 s ALA 44 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.26 2cp2 s ALA 44 CO 0.72 -0.23 0.00 -0.35 0.00 0.00 0.00 175.76 175.90 2cp2 n PRO 45 N 1.61 -0.44 0.00 0.00 -0.04 -1.26 -3.87 135.00 131.01 2cp2 n PRO 45 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 2cp2 n PRO 45 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 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 3.06 -1.86 3.86 0.55 0.00 -1.26 -2.79 105.19 106.75 2cp2 n GLY 46 Ca 0.00 -1.35 -0.37 0.00 0.00 0.00 0.00 46.02 44.30 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 0.00 3.69 0.17 1.61 -1.52 -0.32 -4.20 119.66 119.09 2cp2 s GLN 47 Ca 0.00 0.14 0.01 0.00 -1.95 0.00 0.00 55.36 53.55 2cp2 s GLN 47 Cb 0.00 -3.18 -0.04 0.00 -0.22 0.00 0.00 33.01 29.57 2cp2 s GLN 47 CO 0.00 0.71 0.03 -1.58 -0.25 0.00 0.00 175.29 174.20 2cp2 s TRP 48 N -1.11 1.16 -0.19 0.91 0.52 0.18 -1.44 118.94 118.97 2cp2 s TRP 48 Ca 0.21 -1.11 -0.04 0.00 0.02 0.00 0.00 56.10 55.19 2cp2 s TRP 48 Cb -0.14 -0.66 0.09 0.00 -1.15 0.00 0.00 33.47 31.61 2cp2 s TRP 48 CO 0.10 -0.32 0.27 0.00 0.02 0.00 0.00 176.95 177.02 2cp2 s ALA 49 N -3.79 -0.52 -0.26 0.98 0.00 -0.42 -1.30 121.76 116.45 2cp2 s ALA 49 Ca 0.26 0.58 -0.29 0.00 0.00 0.00 0.00 51.96 52.52 2cp2 s ALA 49 Cb 0.07 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2cp2 s ALA 49 CO 0.05 -1.06 1.20 0.20 0.00 0.00 0.00 175.76 176.15 2cp2 s GLY 50 N 2.40 1.53 0.10 0.00 0.00 -0.14 -3.04 107.32 108.16 2cp2 s GLY 50 Ca 0.07 0.17 0.10 0.00 0.00 0.00 0.00 44.72 45.05 2cp2 s GLY 50 CO -0.12 2.44 -0.24 0.14 0.00 0.00 0.00 173.10 175.32 2cp2 s VAL 51 N 3.83 2.43 -0.29 1.40 1.01 -0.79 -0.59 120.40 127.40 2cp2 s VAL 51 Ca 0.52 -1.54 -0.02 0.00 0.00 0.00 0.00 61.98 60.93 2cp2 s VAL 51 Cb -0.17 -2.05 0.04 0.00 0.00 0.00 0.00 36.38 34.20 2cp2 s VAL 51 CO 0.17 0.19 -0.00 -0.69 0.00 0.00 0.00 175.10 174.77 2cp2 s VAL 52 N -1.00 3.07 1.02 2.92 1.01 0.28 -1.68 120.40 126.03 2cp2 s VAL 52 Ca 0.14 -1.24 -0.12 0.00 0.00 0.00 0.00 61.98 60.76 2cp2 s VAL 52 Cb -0.10 -2.71 0.20 0.00 0.00 0.00 0.00 36.38 33.78 2cp2 s VAL 52 CO 0.06 -0.03 1.08 -0.76 0.00 0.00 0.00 175.10 175.45 2cp2 s LEU 53 N 1.29 1.69 -0.40 3.92 1.43 -0.89 0.85 118.68 126.57 2cp2 s LEU 53 Ca -0.03 1.60 0.05 0.00 -1.03 0.00 0.00 54.13 54.71 2cp2 s LEU 53 Cb -0.19 -3.77 0.63 0.00 0.03 0.00 0.00 46.19 42.90 2cp2 s LEU 53 CO -0.01 -3.44 1.84 -0.67 0.23 0.00 0.00 176.35 174.29 2cp2 n ASP 54 N -4.42 3.85 -3.59 2.29 -0.08 -1.26 -4.78 116.55 108.57 2cp2 n ASP 54 Ca 0.06 -3.44 0.01 0.00 -1.51 0.00 0.00 54.79 49.92 2cp2 n ASP 54 Cb 0.54 -0.80 -0.01 0.00 2.34 0.00 0.00 41.12 43.19 2cp2 n ASP 54 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 2cp2 s ASP 55 N -1.10 -0.02 -0.87 1.67 1.01 -1.26 -5.04 116.67 111.06 2cp2 s ASP 55 Ca 0.53 -0.02 -0.10 0.00 0.71 0.00 0.00 52.55 53.66 2cp2 s ASP 55 Cb 0.44 0.04 -0.08 0.00 1.01 0.00 0.00 42.92 44.33 2cp2 s ASP 55 CO 0.11 -0.07 2.04 -0.81 0.21 0.00 0.00 175.17 176.64 2cp2 n PRO 56 N -0.34 1.90 -1.15 8.23 -0.04 -1.26 -4.16 135.00 138.18 2cp2 n PRO 56 Ca -0.05 -1.56 0.05 0.00 -0.04 0.00 0.00 63.50 61.90 2cp2 n PRO 56 Cb 0.61 -2.58 0.08 0.00 -0.04 0.00 0.00 33.50 31.57 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 4.72 0.72 -0.14 0.52 0.24 -0.91 -4.98 118.33 118.48 2cp2 n VAL 57 Ca 0.45 -1.68 0.00 0.00 -2.04 0.00 0.00 64.34 61.07 2cp2 n VAL 57 Cb 0.21 0.57 0.00 0.00 -1.47 0.00 0.00 33.84 33.15 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 -0.06 2.13 1.99 7.63 0.00 0.06 -4.99 105.19 111.96 2cp2 n GLY 58 Ca 0.10 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.79 1.61 5.02 -1.26 -4.86 118.16 116.88 2cp2 n LYS 59 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 2cp2 n LYS 59 Cb 0.00 -0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.08 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 -3.08 0.80 -1.34 4.39 3.02 -1.19 -4.55 115.26 113.31 2cp2 n ASN 60 Ca 0.00 -1.68 -0.02 0.00 -0.03 0.00 0.00 54.58 52.85 2cp2 n ASN 60 Cb 0.00 -0.40 0.11 0.00 -0.61 0.00 0.00 39.78 38.88 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 -2.95 2.23 0.00 6.41 5.75 -1.24 -2.44 116.55 124.30 2cp2 n ASP 61 Ca 0.10 -3.25 0.00 0.00 -0.01 0.00 0.00 54.79 51.63 2cp2 n ASP 61 Cb 0.36 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 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 -0.61 3.10 3.82 6.12 0.00 -1.24 -4.22 105.19 112.15 2cp2 n GLY 62 Ca 0.20 -0.93 -0.34 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.43 3.70 -0.14 4.61 0.00 -1.26 -2.74 121.76 125.50 2cp2 s ALA 63 Ca 0.00 -0.79 -0.07 0.00 0.00 0.00 0.00 51.96 51.10 2cp2 s ALA 63 Cb 0.00 -1.72 0.05 0.00 0.00 0.00 0.00 23.12 21.45 2cp2 s ALA 63 CO 0.00 0.68 0.34 0.08 0.00 0.00 0.00 175.76 176.85 2cp2 s VAL 64 N -1.15 -0.07 -0.99 0.00 1.01 0.99 -4.91 120.40 115.28 2cp2 s VAL 64 Ca 0.21 0.12 -0.00 0.00 0.00 0.00 0.00 61.98 62.31 2cp2 s VAL 64 Cb -0.12 -0.51 -0.00 0.00 0.00 0.00 0.00 36.38 35.75 2cp2 s VAL 64 CO 0.11 0.05 0.83 0.61 0.00 0.00 0.00 175.10 176.70 2cp2 n GLY 65 N 4.33 -0.24 2.43 4.51 0.00 -1.26 -2.53 105.19 112.43 2cp2 n GLY 65 Ca -0.23 0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.11 0.04 2.97 -0.02 0.00 -1.26 -4.82 105.19 100.99 2cp2 n GLY 66 Ca -0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.93 0.74 -0.25 1.61 1.01 -1.05 -5.13 120.40 114.41 2cp2 s VAL 67 Ca 0.00 -0.31 -0.08 0.00 0.00 0.00 0.00 61.98 61.59 2cp2 s VAL 67 Cb 0.00 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 2cp2 s VAL 67 CO 0.00 0.25 0.09 -0.60 0.00 0.00 0.00 175.10 174.84 2cp2 s ARG 68 N 0.40 3.75 -0.20 2.72 3.52 -1.26 -0.01 118.95 127.87 2cp2 s ARG 68 Ca -0.06 -0.43 -0.12 0.00 -0.13 0.00 0.00 55.73 54.99 2cp2 s ARG 68 Cb -0.11 -3.37 -0.09 0.00 -1.56 0.00 0.00 34.95 29.82 2cp2 s ARG 68 CO 0.01 -0.13 -0.29 0.66 -0.81 0.00 0.00 175.30 174.74 2cp2 n TYR 69 N 4.78 0.00 -3.86 5.12 4.02 -1.11 -4.99 117.16 121.12 2cp2 n TYR 69 Ca -0.16 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.63 2cp2 n TYR 69 Cb 0.52 -0.71 -0.09 0.00 -0.02 0.00 0.00 39.34 39.04 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 -2.48 0.07 -0.27 -0.72 -0.12 -1.23 -4.88 117.98 108.36 2cp2 s PHE 70 Ca -0.29 -0.28 -0.11 0.00 -0.05 0.00 0.00 56.93 56.20 2cp2 s PHE 70 Cb 0.10 -0.05 -0.05 0.00 -0.63 0.00 0.00 43.02 42.39 2cp2 s PHE 70 CO 0.38 -0.39 0.18 -2.00 -0.05 0.00 0.00 175.22 173.35 2cp2 s GLU 71 N -2.31 3.95 0.21 1.99 2.12 -1.26 -4.23 118.70 119.17 2cp2 s GLU 71 Ca -0.07 -0.32 -0.22 0.00 0.36 0.00 0.00 54.97 54.71 2cp2 s GLU 71 Cb -0.02 -3.63 0.05 0.00 0.26 0.00 0.00 34.13 30.78 2cp2 s GLU 71 CO -0.03 -0.16 0.71 0.00 -0.54 0.00 0.00 175.26 175.25 2cp2 n PRO 73 N -0.42 -0.01 -1.93 0.00 -0.02 -1.26 -4.71 135.00 126.65 2cp2 n PRO 73 Ca -0.09 0.05 -0.33 0.00 -2.02 0.00 0.00 63.50 61.11 2cp2 n PRO 73 Cb 0.61 -1.86 0.03 0.00 -0.02 0.00 0.00 33.50 32.26 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 -2.17 2.60 -1.76 3.55 0.00 -1.26 -3.34 121.76 119.38 2cp2 s ALA 74 Ca 0.61 0.54 0.00 0.00 0.00 0.00 0.00 51.96 53.11 2cp2 s ALA 74 Cb -0.27 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2cp2 s ALA 74 CO 0.63 -1.04 0.00 1.28 0.00 0.00 0.00 175.76 176.63 2cp2 n LEU 75 N -2.11 -1.93 0.00 0.00 4.77 -1.18 -4.78 117.00 111.77 2cp2 n LEU 75 Ca 0.10 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2cp2 n LEU 75 Cb 0.52 -2.90 0.00 0.00 -2.33 0.00 0.00 43.42 38.72 2cp2 n LEU 75 CO 0.47 -0.23 -0.18 0.00 -1.33 0.00 0.00 177.39 176.12 2cp2 n GLN 76 N -2.96 0.00 -1.64 3.23 6.02 -1.17 -0.76 117.38 120.10 2cp2 n GLN 76 Ca -0.24 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.38 2cp2 n GLN 76 Cb 0.68 -0.44 -0.05 0.00 1.02 0.00 0.00 30.24 31.45 2cp2 n GLN 76 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cp2 n GLY 77 N 2.12 1.91 3.83 1.08 0.00 -1.02 -2.10 105.19 111.01 2cp2 n GLY 77 Ca 0.00 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 2cp2 n GLY 77 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2cp2 s ILE 78 N 7.64 4.62 -0.10 -0.61 2.07 -0.67 -3.20 121.20 130.95 2cp2 s ILE 78 Ca 0.62 1.15 -0.00 0.00 -1.41 0.00 0.00 60.65 61.00 2cp2 s ILE 78 Cb 0.07 -3.78 -0.03 0.00 0.13 0.00 0.00 42.46 38.86 2cp2 s ILE 78 CO 0.12 0.10 -0.08 -0.36 -1.91 0.00 0.00 174.94 172.81 2cp2 s PHE 79 N -1.65 2.92 0.13 3.50 0.40 -1.26 -1.88 117.98 120.14 2cp2 s PHE 79 Ca 0.46 -0.21 -0.22 0.00 -0.60 0.00 0.00 56.93 56.36 2cp2 s PHE 79 Cb -0.15 -1.80 0.06 0.00 0.51 0.00 0.00 43.02 41.64 2cp2 s PHE 79 CO 0.20 0.12 0.55 -0.08 0.70 0.00 0.00 175.22 176.70 2cp2 s THR 80 N -0.26 0.02 0.36 0.64 -1.32 -1.17 -5.01 115.64 108.90 2cp2 s THR 80 Ca 0.03 -0.16 -0.28 0.00 -1.21 0.00 0.00 61.69 60.07 2cp2 s THR 80 Cb -0.13 -1.03 -0.10 0.00 -1.51 0.00 0.00 72.50 69.72 2cp2 s THR 80 CO 0.03 -0.09 1.39 -0.13 -2.21 0.00 0.00 174.62 173.61 2cp2 s ARG 81 N -3.45 4.21 0.28 7.08 0.52 -1.26 -1.30 118.95 125.03 2cp2 s ARG 81 Ca -0.00 2.38 -0.03 0.00 -0.52 0.00 0.00 55.73 57.56 2cp2 s ARG 81 Cb -0.00 -3.00 0.39 0.00 0.52 0.00 0.00 34.95 32.86 2cp2 s ARG 81 CO -0.10 -0.37 1.94 -1.00 0.02 0.00 0.00 175.30 175.79 2cp2 h PRO 82 N 3.16 1.11 0.00 3.54 0.13 -1.82 -1.61 132.00 136.50 2cp2 h PRO 82 Ca -0.50 -0.09 -0.00 0.00 -0.87 0.00 0.00 66.00 64.55 2cp2 h PRO 82 Cb 1.23 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 2cp2 h PRO 82 CO 0.65 0.76 -0.01 1.03 -0.23 0.00 0.00 178.00 180.20 2cp2 h SER 83 N 1.14 0.00 0.94 1.44 0.87 -1.91 -0.85 113.55 115.18 2cp2 h SER 83 Ca 0.30 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.69 2cp2 h SER 83 Cb -0.08 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 2cp2 h SER 83 CO -0.06 0.01 -0.83 0.11 -0.53 0.00 0.00 176.83 175.52 2cp2 h LYS 84 N 0.00 0.00 -7.03 2.24 1.79 -1.67 -3.45 116.57 108.45 2cp2 h LYS 84 Ca -0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.95 2cp2 h LYS 84 Cb 0.01 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 30.76 2cp2 h LYS 84 CO 0.00 0.83 0.51 -0.51 -1.08 0.00 0.00 179.45 179.21 2cp2 s LEU 85 N -6.93 3.90 0.26 2.94 1.43 -0.33 -3.23 118.68 116.72 2cp2 s LEU 85 Ca 0.01 2.44 0.02 0.00 -1.03 0.00 0.00 54.13 55.57 2cp2 s LEU 85 Cb 0.10 -4.32 -0.05 0.00 0.03 0.00 0.00 46.19 41.95 2cp2 s LEU 85 CO 0.79 -1.22 0.06 0.42 0.23 0.00 0.00 176.35 176.63 2cp2 s THR 86 N -1.50 0.79 -0.27 5.49 -4.23 -0.63 -4.93 115.64 110.36 2cp2 s THR 86 Ca 0.68 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.28 2cp2 s THR 86 Cb -0.32 -2.56 0.49 0.00 1.34 0.00 0.00 72.50 71.45 2cp2 s THR 86 CO 0.38 -0.11 1.41 -1.14 -0.54 0.00 0.00 174.62 174.61 2cp2 n ARG 87 N -0.48 1.77 -3.65 3.99 0.00 -1.26 0.13 116.66 117.17 2cp2 n ARG 87 Ca -0.02 -3.23 -0.03 0.00 -0.00 0.00 0.00 57.85 54.57 2cp2 n ARG 87 Cb 0.66 -1.77 -0.07 0.00 0.00 0.00 0.00 32.46 31.28 2cp2 n ARG 87 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2cp2 s GLN 88 N -3.25 0.11 0.23 -0.14 -0.21 -1.26 -4.97 119.66 110.17 2cp2 s GLN 88 Ca 0.43 0.14 -0.31 0.00 0.02 0.00 0.00 55.36 55.63 2cp2 s GLN 88 Cb 0.40 0.05 -0.13 0.00 1.00 0.00 0.00 33.01 34.33 2cp2 s GLN 88 CO -0.02 -0.01 1.41 -2.30 -2.12 0.00 0.00 175.29 172.24 2cp2 n PRO 89 N 1.71 2.01 0.13 2.91 -0.02 -1.26 -4.86 135.00 135.61 2cp2 n PRO 89 Ca -0.11 0.71 -0.01 0.00 -2.02 0.00 0.00 63.50 62.07 2cp2 n PRO 89 Cb 0.57 -2.37 0.22 0.00 -0.02 0.00 0.00 33.50 31.89 2cp2 n PRO 89 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2cp2 h SER 90 N 4.26 0.11 -4.04 2.55 0.87 -1.95 -3.37 113.55 111.99 2cp2 h SER 90 Ca -0.45 -0.06 -0.66 0.00 -1.23 0.00 0.00 61.79 59.40 2cp2 h SER 90 Cb 1.28 -0.03 -0.39 0.00 -0.44 0.00 0.00 62.40 62.81 2cp2 h SER 90 CO 0.76 0.60 -0.51 -0.83 -0.53 0.00 0.00 176.83 176.33 2cp2 s GLY 91 N -4.34 2.60 0.09 5.77 0.00 -1.26 -5.08 107.32 105.09 2cp2 s GLY 91 Ca -0.03 -3.42 -0.35 0.00 0.00 0.00 0.00 44.72 40.92 2cp2 s GLY 91 CO 0.76 1.06 1.54 -1.05 0.00 0.00 0.00 173.10 175.42 2cp2 n PRO 92 N 2.95 1.78 -3.67 2.90 -0.02 -1.26 -4.98 135.00 132.70 2cp2 n PRO 92 Ca 0.09 0.64 -0.08 0.00 -2.02 0.00 0.00 63.50 62.14 2cp2 n PRO 92 Cb 0.34 -2.38 -0.09 0.00 -0.02 0.00 0.00 33.50 31.36 2cp2 n PRO 92 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2cp2 s SER 93 N 1.26 -0.69 0.01 2.55 0.01 -1.26 -5.16 113.70 110.41 2cp2 s SER 93 Ca 0.83 1.18 0.01 0.00 1.31 0.00 0.00 55.95 59.29 2cp2 s SER 93 Cb -0.79 1.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.60 2cp2 s SER 93 CO 0.44 -0.22 -0.04 -0.44 0.41 0.00 0.00 173.24 173.39 2cp2 s SER 94 N 1.72 0.49 0.00 2.44 0.01 -1.26 -5.22 113.70 111.88 2cp2 s SER 94 Ca -0.09 -0.19 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2cp2 s SER 94 Cb -0.08 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2cp2 s SER 94 CO -0.16 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.07