#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cp2 s SER 2 N 0.00 4.19 -0.26 1.61 0.01 -1.26 -5.00 113.70 113.00 2cp2 s SER 2 Ca 0.00 -2.43 -0.23 0.00 1.31 0.00 0.00 55.95 54.60 2cp2 s SER 2 Cb 0.00 -1.33 -0.01 0.00 0.21 0.00 0.00 66.02 64.90 2cp2 s SER 2 CO 0.00 -0.31 0.76 -0.55 0.41 0.00 0.00 173.24 173.55 2cp2 s SER 3 N 0.55 6.72 0.00 2.44 0.15 -1.26 -4.18 113.70 118.12 2cp2 s SER 3 Ca 0.14 0.85 0.00 0.00 0.70 0.00 0.00 55.95 57.65 2cp2 s SER 3 Cb -0.22 -2.40 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2cp2 s SER 3 CO -0.07 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.48 2cp2 n GLY 4 N 3.97 3.28 2.27 9.45 0.00 -1.26 -5.02 105.19 117.88 2cp2 n GLY 4 Ca 0.03 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2cp2 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cp2 n SER 5 N 0.00 -9.34 -1.42 1.61 7.64 -1.26 -4.91 113.62 105.94 2cp2 n SER 5 Ca 0.00 1.74 0.19 0.00 1.01 0.00 0.00 58.87 61.80 2cp2 n SER 5 Cb 0.00 -5.11 -0.06 0.00 -1.01 0.00 0.00 64.21 58.03 2cp2 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cp2 n SER 6 N 1.81 -8.52 -3.30 6.43 7.64 -1.26 -4.91 113.62 111.52 2cp2 n SER 6 Ca 0.00 0.89 0.00 0.00 1.01 0.00 0.00 58.87 60.77 2cp2 n SER 6 Cb 0.00 -4.52 0.00 0.00 -1.01 0.00 0.00 64.21 58.68 2cp2 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cp2 n GLY 7 N -4.26 -2.05 1.66 0.23 0.00 -1.26 -4.89 105.19 94.63 2cp2 n GLY 7 Ca -0.03 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2cp2 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cp2 n ALA 8 N -3.00 0.15 0.00 4.61 0.00 -1.26 -5.04 120.51 115.97 2cp2 n ALA 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2cp2 n ALA 8 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2cp2 n ALA 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cp2 n ALA 9 N -2.33 2.86 -1.90 0.00 0.00 -1.26 -5.09 120.51 112.79 2cp2 n ALA 9 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 2cp2 n ALA 9 Cb 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.43 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 -1.87 4.70 -0.05 0.00 8.01 -1.26 -5.06 118.70 123.17 2cp2 s GLU 10 Ca 0.00 1.31 -0.08 0.00 0.01 0.00 0.00 54.97 56.21 2cp2 s GLU 10 Cb 0.00 -3.28 0.01 0.00 -4.31 0.00 0.00 34.13 26.56 2cp2 s GLU 10 CO 0.00 0.53 0.20 0.08 0.01 0.00 0.00 175.26 176.09 2cp2 s VAL 11 N -1.10 0.03 0.60 2.63 1.01 -1.26 -4.54 120.40 117.78 2cp2 s VAL 11 Ca 0.38 -0.28 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 2cp2 s VAL 11 Cb -0.24 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 35.77 2cp2 s VAL 11 CO 0.29 -0.16 0.90 -0.83 0.00 0.00 0.00 175.10 175.30 2cp2 s GLY 12 N -0.56 1.64 0.62 4.51 0.00 0.47 -4.93 107.32 109.06 2cp2 s GLY 12 Ca -0.07 -0.82 -0.00 0.00 0.00 0.00 0.00 44.72 43.84 2cp2 s GLY 12 CO 0.01 -0.52 0.86 -0.35 0.00 0.00 0.00 173.10 173.11 2cp2 s ASP 13 N -4.35 4.96 -0.45 1.64 2.15 -0.91 -4.34 116.67 115.36 2cp2 s ASP 13 Ca 0.55 -0.07 0.03 0.00 0.43 0.00 0.00 52.55 53.49 2cp2 s ASP 13 Cb -0.11 -0.64 0.60 0.00 -0.30 0.00 0.00 42.92 42.47 2cp2 s ASP 13 CO 0.44 -1.40 1.88 -0.67 -0.17 0.00 0.00 175.17 175.26 2cp2 n ASP 14 N -2.54 4.21 -3.53 -0.34 2.03 -1.26 -1.19 116.55 113.92 2cp2 n ASP 14 Ca 0.10 -3.53 -0.12 0.00 0.52 0.00 0.00 54.79 51.76 2cp2 n ASP 14 Cb 0.60 -0.84 -0.11 0.00 -0.72 0.00 0.00 41.12 40.05 2cp2 n ASP 14 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2cp2 s PHE 15 N -3.16 -0.60 0.03 -0.67 2.19 -1.26 -5.02 117.98 109.50 2cp2 s PHE 15 Ca 0.54 0.91 0.14 0.00 0.33 0.00 0.00 56.93 58.86 2cp2 s PHE 15 Cb 0.45 -0.01 0.22 0.00 -1.31 0.00 0.00 43.02 42.38 2cp2 s PHE 15 CO 0.09 -0.54 1.51 -0.07 1.83 0.00 0.00 175.22 178.04 2cp2 h LEU 16 N 8.24 0.00 0.00 6.12 3.38 -1.96 -3.33 115.31 127.76 2cp2 h LEU 16 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2cp2 h LEU 16 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2cp2 h LEU 16 CO 0.20 0.57 0.00 0.61 0.09 0.00 0.00 178.44 179.91 2cp2 n GLY 17 N 0.87 0.62 1.59 0.83 0.00 -1.26 -4.41 105.19 103.43 2cp2 n GLY 17 Ca 0.01 -1.14 0.01 0.00 0.00 0.00 0.00 46.02 44.89 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 2.99 0.45 -4.77 1.61 8.00 -1.26 -5.10 116.55 118.46 2cp2 n ASP 18 Ca 0.00 -2.01 -0.39 0.00 0.71 0.00 0.00 54.79 53.10 2cp2 n ASP 18 Cb 0.00 -0.12 -0.06 0.00 -0.02 0.00 0.00 41.12 40.92 2cp2 n ASP 18 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2cp2 s PHE 19 N -0.44 3.70 0.58 1.24 0.08 -1.26 -5.08 117.98 116.80 2cp2 s PHE 19 Ca 0.24 1.20 0.08 0.00 0.12 0.00 0.00 56.93 58.56 2cp2 s PHE 19 Cb 0.29 -2.57 0.08 0.00 -0.57 0.00 0.00 43.02 40.24 2cp2 s PHE 19 CO -0.11 0.40 0.66 0.14 -0.10 0.00 0.00 175.22 176.21 2cp2 s VAL 20 N -0.37 1.81 -0.36 -0.44 -7.23 -1.26 -5.02 120.40 107.52 2cp2 s VAL 20 Ca 0.30 -1.20 -0.20 0.00 -1.81 0.00 0.00 61.98 59.07 2cp2 s VAL 20 Cb -0.18 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.75 2cp2 s VAL 20 CO 0.17 0.00 0.63 -0.69 -0.31 0.00 0.00 175.10 174.90 2cp2 s VAL 21 N -2.75 4.89 0.00 1.32 1.01 -1.26 -4.12 120.40 119.48 2cp2 s VAL 21 Ca 0.50 0.53 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2cp2 s VAL 21 Cb -0.04 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2cp2 s VAL 21 CO 0.32 -0.34 0.00 0.61 0.00 0.00 0.00 175.10 175.69 2cp2 n GLY 22 N 4.71 1.95 3.20 4.51 0.00 -0.73 -4.99 105.19 113.84 2cp2 n GLY 22 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.27 0.91 -0.35 1.61 -1.05 -1.26 -4.89 118.70 113.41 2cp2 s GLU 23 Ca 0.00 -1.11 -0.21 0.00 -0.15 0.00 0.00 54.97 53.50 2cp2 s GLU 23 Cb 0.00 -0.81 0.00 0.00 -0.44 0.00 0.00 34.13 32.88 2cp2 s GLU 23 CO 0.00 0.16 0.64 1.03 0.95 0.00 0.00 175.26 178.05 2cp2 s ARG 24 N -2.32 3.73 -0.07 -4.83 3.00 -1.25 -1.22 118.95 115.98 2cp2 s ARG 24 Ca 0.04 0.12 0.03 0.00 0.00 0.00 0.00 55.73 55.92 2cp2 s ARG 24 Cb -0.07 -3.79 -0.02 0.00 0.00 0.00 0.00 34.95 31.07 2cp2 s ARG 24 CO 0.02 -0.71 -0.16 0.14 0.00 0.00 0.00 175.30 174.59 2cp2 s VAL 25 N 2.72 2.88 -0.58 3.52 -7.23 -0.05 -4.68 120.40 116.97 2cp2 s VAL 25 Ca 0.25 -0.77 -0.24 0.00 -1.81 0.00 0.00 61.98 59.41 2cp2 s VAL 25 Cb -0.14 -2.13 0.05 0.00 0.56 0.00 0.00 36.38 34.71 2cp2 s VAL 25 CO 0.14 0.57 0.96 0.26 -0.31 0.00 0.00 175.10 176.73 2cp2 s TRP 26 N -0.43 2.74 -0.25 2.82 0.51 -0.23 -0.58 118.94 123.52 2cp2 s TRP 26 Ca 0.05 -0.14 -0.29 0.00 -2.12 0.00 0.00 56.10 53.60 2cp2 s TRP 26 Cb -0.12 -4.15 -0.01 0.00 -0.81 0.00 0.00 33.47 28.38 2cp2 s TRP 26 CO 0.02 -1.45 1.42 0.08 -0.51 0.00 0.00 176.95 176.50 2cp2 s VAL 27 N 4.05 3.99 -1.87 4.03 1.01 -1.00 -1.78 120.40 128.82 2cp2 s VAL 27 Ca 0.29 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.39 2cp2 s VAL 27 Cb -0.13 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.29 2cp2 s VAL 27 CO 0.17 -0.36 0.00 0.59 0.00 0.00 0.00 175.10 175.50 2cp2 n ASN 28 N 7.76 -5.79 -2.40 3.32 4.13 -1.21 -1.68 115.26 119.39 2cp2 n ASN 28 Ca 0.16 0.10 -0.19 0.00 1.68 0.00 0.00 54.58 56.33 2cp2 n ASN 28 Cb 0.46 -4.87 -0.01 0.00 -1.54 0.00 0.00 39.78 33.81 2cp2 n ASN 28 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2cp2 n GLY 29 N -0.88 -0.48 0.02 7.41 0.00 -1.16 -4.73 105.19 105.37 2cp2 n GLY 29 Ca -0.24 0.00 -0.02 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 -3.86 0.40 -3.84 1.61 0.31 -0.67 -1.66 118.33 110.62 2cp2 n VAL 30 Ca -0.23 0.40 -0.12 0.00 -0.01 0.00 0.00 64.34 64.39 2cp2 n VAL 30 Cb 0.67 -1.73 -0.10 0.00 -0.91 0.00 0.00 33.84 31.77 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 -1.51 0.48 0.61 5.55 1.02 -1.26 -4.95 119.74 119.69 2cp2 s LYS 31 Ca -0.08 -0.26 -0.15 0.00 0.02 0.00 0.00 55.97 55.50 2cp2 s LYS 31 Cb 0.01 0.20 -0.03 0.00 -0.52 0.00 0.00 37.83 37.50 2cp2 s LYS 31 CO 0.11 -0.11 1.06 -1.25 -0.92 0.00 0.00 175.35 174.24 2cp2 s PRO 32 N -1.15 3.22 -0.15 -1.68 0.04 -1.26 -2.38 135.00 131.65 2cp2 s PRO 32 Ca -0.12 1.19 -0.17 0.00 0.04 0.00 0.00 61.00 61.94 2cp2 s PRO 32 Cb -0.06 -2.02 0.04 0.00 0.04 0.00 0.00 34.50 32.50 2cp2 s PRO 32 CO 0.02 -0.89 0.47 0.20 0.04 0.00 0.00 177.00 176.84 2cp2 s GLY 33 N -2.88 -0.35 -0.22 0.56 0.00 0.26 -4.16 107.32 100.52 2cp2 s GLY 33 Ca 0.63 1.20 -0.29 0.00 0.00 0.00 0.00 44.72 46.26 2cp2 s GLY 33 CO 0.39 1.00 1.32 0.14 0.00 0.00 0.00 173.10 175.96 2cp2 s VAL 34 N -0.07 4.15 0.34 1.40 1.01 0.17 -0.87 120.40 126.53 2cp2 s VAL 34 Ca -0.03 1.35 -0.27 0.00 0.00 0.00 0.00 61.98 63.03 2cp2 s VAL 34 Cb -0.03 -4.02 -0.09 0.00 0.00 0.00 0.00 36.38 32.23 2cp2 s VAL 34 CO 0.02 -0.29 1.11 -0.69 0.00 0.00 0.00 175.10 175.25 2cp2 s VAL 35 N 4.03 3.45 0.00 2.92 1.01 -0.36 0.11 120.40 131.56 2cp2 s VAL 35 Ca 0.57 1.30 0.00 0.00 0.00 0.00 0.00 61.98 63.86 2cp2 s VAL 35 Cb -0.20 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.41 2cp2 s VAL 35 CO 0.20 0.19 0.00 0.00 0.00 0.00 0.00 175.10 175.49 2cp2 n GLN 36 N 0.57 0.00 -4.76 2.72 1.13 -1.15 -1.77 117.38 114.12 2cp2 n GLN 36 Ca 0.02 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.78 2cp2 n GLN 36 Cb 0.46 -0.53 -0.14 0.00 0.11 0.00 0.00 30.24 30.14 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 -1.90 2.32 -0.28 1.08 6.14 -1.23 -4.87 117.35 118.61 2cp2 s TYR 37 Ca 0.00 -0.40 -0.01 0.00 0.64 0.00 0.00 57.07 57.30 2cp2 s TYR 37 Cb 0.00 -1.35 0.13 0.00 0.42 0.00 0.00 41.96 41.15 2cp2 s TYR 37 CO 0.00 0.19 0.26 -0.51 0.64 0.00 0.00 175.55 176.13 2cp2 s LEU 38 N -1.48 -0.08 0.00 6.97 1.43 -1.26 -1.09 118.68 123.17 2cp2 s LEU 38 Ca 0.12 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 2cp2 s LEU 38 Cb -0.10 0.34 0.00 0.00 0.03 0.00 0.00 46.19 46.46 2cp2 s LEU 38 CO 0.03 -0.39 0.00 0.61 0.23 0.00 0.00 176.35 176.83 2cp2 n GLY 39 N 5.30 -0.70 3.78 -3.19 0.00 -0.89 -5.02 105.19 104.47 2cp2 n GLY 39 Ca -0.03 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 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 -1.22 2.96 0.55 1.61 2.02 -1.26 -1.22 118.70 122.13 2cp2 s GLU 40 Ca 0.00 1.37 0.05 0.00 0.02 0.00 0.00 54.97 56.41 2cp2 s GLU 40 Cb 0.00 -1.97 0.04 0.00 0.10 0.00 0.00 34.13 32.30 2cp2 s GLU 40 CO 0.00 -1.12 0.40 0.95 0.02 0.00 0.00 175.26 175.52 2cp2 s THR 41 N -2.31 1.63 -0.22 3.63 -4.23 -1.26 -4.84 115.64 108.03 2cp2 s THR 41 Ca 0.67 -1.49 0.12 0.00 -1.18 0.00 0.00 61.69 59.80 2cp2 s THR 41 Cb -0.20 -2.12 0.43 0.00 1.34 0.00 0.00 72.50 71.95 2cp2 s THR 41 CO 0.39 0.00 1.30 0.00 -0.54 0.00 0.00 174.62 175.77 2cp2 n GLN 42 N -1.77 1.72 0.00 3.99 1.13 -1.26 -4.67 117.38 116.52 2cp2 n GLN 42 Ca -0.02 -3.10 0.00 0.00 -1.94 0.00 0.00 57.00 51.94 2cp2 n GLN 42 Cb 0.64 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 29.32 2cp2 n GLN 42 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 2cp2 n PHE 43 N -1.13 0.00 -4.41 1.08 1.16 -1.26 -4.94 117.46 107.96 2cp2 n PHE 43 Ca 0.23 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.57 2cp2 n PHE 43 Cb 0.80 0.13 -0.13 0.00 -1.61 0.00 0.00 39.48 38.68 2cp2 n PHE 43 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2cp2 s ALA 44 N -1.65 1.78 0.93 1.98 0.00 -1.26 -4.22 121.76 119.32 2cp2 s ALA 44 Ca 0.00 -1.18 -0.12 0.00 0.00 0.00 0.00 51.96 50.66 2cp2 s ALA 44 Cb 0.00 -0.28 0.15 0.00 0.00 0.00 0.00 23.12 22.99 2cp2 s ALA 44 CO 0.00 0.37 1.10 -1.25 0.00 0.00 0.00 175.76 175.98 2cp2 s PRO 45 N -1.64 1.01 0.00 0.00 0.04 -1.26 -4.42 135.00 128.73 2cp2 s PRO 45 Ca 0.07 0.65 0.00 0.00 0.04 0.00 0.00 61.00 61.76 2cp2 s PRO 45 Cb -0.10 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.65 2cp2 s PRO 45 CO 0.03 -2.37 0.00 0.41 0.04 0.00 0.00 177.00 175.11 2cp2 n GLY 46 N -1.28 -1.07 3.77 0.56 0.00 -1.26 -0.40 105.19 105.51 2cp2 n GLY 46 Ca 0.06 -1.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.25 4.64 0.41 1.61 -1.52 -0.33 -4.35 119.66 118.86 2cp2 s GLN 47 Ca 0.00 1.31 0.04 0.00 -1.95 0.00 0.00 55.36 54.75 2cp2 s GLN 47 Cb 0.00 -3.04 -0.03 0.00 -0.22 0.00 0.00 33.01 29.72 2cp2 s GLN 47 CO 0.00 0.42 0.12 -1.58 -0.25 0.00 0.00 175.29 174.00 2cp2 s TRP 48 N -1.39 1.80 -0.28 0.91 0.52 -0.36 -2.15 118.94 117.98 2cp2 s TRP 48 Ca 0.44 -1.26 -0.07 0.00 0.02 0.00 0.00 56.10 55.24 2cp2 s TRP 48 Cb -0.22 -1.18 0.14 0.00 -1.15 0.00 0.00 33.47 31.07 2cp2 s TRP 48 CO 0.27 -0.26 0.59 0.00 0.02 0.00 0.00 176.95 177.56 2cp2 s ALA 49 N -3.20 -1.94 0.14 0.98 0.00 -0.55 -2.11 121.76 115.09 2cp2 s ALA 49 Ca 0.24 2.02 -0.23 0.00 0.00 0.00 0.00 51.96 53.99 2cp2 s ALA 49 Cb 0.03 -1.83 -0.08 0.00 0.00 0.00 0.00 23.12 21.25 2cp2 s ALA 49 CO 0.14 -1.04 0.71 0.20 0.00 0.00 0.00 175.76 175.77 2cp2 s GLY 50 N 2.83 2.82 0.08 0.00 0.00 -0.25 -1.97 107.32 110.83 2cp2 s GLY 50 Ca 0.03 0.25 0.03 0.00 0.00 0.00 0.00 44.72 45.03 2cp2 s GLY 50 CO -0.19 0.72 -0.09 0.14 0.00 0.00 0.00 173.10 173.69 2cp2 s VAL 51 N -1.17 0.75 -0.32 1.40 1.01 0.13 -2.93 120.40 119.28 2cp2 s VAL 51 Ca 0.34 -1.49 -0.01 0.00 0.00 0.00 0.00 61.98 60.83 2cp2 s VAL 51 Cb -0.22 -1.15 0.07 0.00 0.00 0.00 0.00 36.38 35.08 2cp2 s VAL 51 CO 0.24 -0.55 0.03 -0.69 0.00 0.00 0.00 175.10 174.13 2cp2 s VAL 52 N -2.26 2.84 0.52 2.92 1.01 0.29 -0.03 120.40 125.70 2cp2 s VAL 52 Ca 0.01 -1.69 -0.20 0.00 0.00 0.00 0.00 61.98 60.11 2cp2 s VAL 52 Cb -0.04 -2.77 -0.07 0.00 0.00 0.00 0.00 36.38 33.51 2cp2 s VAL 52 CO -0.01 -0.28 1.09 -0.76 0.00 0.00 0.00 175.10 175.14 2cp2 s LEU 53 N 1.16 3.77 -0.01 3.92 1.43 -0.96 0.44 118.68 128.44 2cp2 s LEU 53 Ca -0.01 2.06 -0.25 0.00 -1.03 0.00 0.00 54.13 54.90 2cp2 s LEU 53 Cb -0.20 -4.57 -0.18 0.00 0.03 0.00 0.00 46.19 41.26 2cp2 s LEU 53 CO -0.03 -1.04 1.23 -0.78 0.23 0.00 0.00 176.35 175.95 2cp2 h ASP 54 N 1.29 -0.12 -3.65 2.29 1.82 -1.93 -3.45 116.42 112.67 2cp2 h ASP 54 Ca -0.50 -0.36 -0.50 0.00 -0.39 0.00 0.00 57.03 55.28 2cp2 h ASP 54 Cb 1.24 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 41.28 2cp2 h ASP 54 CO 0.58 0.32 0.08 -1.81 -1.61 0.00 0.00 179.24 176.80 2cp2 s ASP 55 N -5.47 6.59 -0.90 2.28 1.01 -1.26 -4.95 116.67 113.97 2cp2 s ASP 55 Ca -0.15 1.13 -0.10 0.00 0.71 0.00 0.00 52.55 54.14 2cp2 s ASP 55 Cb 0.02 -2.32 -0.08 0.00 1.01 0.00 0.00 42.92 41.56 2cp2 s ASP 55 CO 0.61 -0.31 2.08 -0.81 0.21 0.00 0.00 175.17 176.95 2cp2 n PRO 56 N -0.94 1.98 -1.10 8.23 -0.04 -1.26 -4.25 135.00 137.62 2cp2 n PRO 56 Ca 0.02 -1.59 0.04 0.00 -0.04 0.00 0.00 63.50 61.93 2cp2 n PRO 56 Cb 0.54 -2.59 0.12 0.00 -0.04 0.00 0.00 33.50 31.52 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 4.66 1.25 0.00 0.52 0.24 -1.11 -4.96 118.33 118.93 2cp2 n VAL 57 Ca 0.46 -2.31 0.00 0.00 -2.04 0.00 0.00 64.34 60.45 2cp2 n VAL 57 Cb 0.21 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.88 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 -0.40 1.13 2.01 7.63 0.00 -0.12 -4.99 105.19 110.45 2cp2 n GLY 58 Ca 0.14 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.58 1.61 5.02 -1.26 -4.86 118.16 116.08 2cp2 n LYS 59 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.07 2cp2 n LYS 59 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.05 2cp2 n LYS 59 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2cp2 s ASN 60 N -3.16 5.20 -0.28 4.39 0.01 -1.18 -4.49 114.94 115.43 2cp2 s ASN 60 Ca 0.00 0.03 0.09 0.00 -0.71 0.00 0.00 52.86 52.27 2cp2 s ASN 60 Cb 0.00 -0.88 0.47 0.00 0.41 0.00 0.00 41.25 41.25 2cp2 s ASN 60 CO 0.00 -1.21 1.38 -0.90 -1.51 0.00 0.00 177.10 174.85 2cp2 n ASP 61 N -2.42 2.52 0.00 -1.22 5.68 -1.25 -1.61 116.55 118.24 2cp2 n ASP 61 Ca 0.08 -3.83 0.00 0.00 -0.50 0.00 0.00 54.79 50.54 2cp2 n ASP 61 Cb 0.60 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.99 2cp2 n ASP 61 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cp2 n GLY 62 N -1.09 2.60 3.29 6.12 0.00 -1.25 -4.18 105.19 110.68 2cp2 n GLY 62 Ca 0.30 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.66 2.66 -0.21 4.61 0.00 -1.26 -1.50 121.76 123.40 2cp2 s ALA 63 Ca 0.00 -1.10 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 2cp2 s ALA 63 Cb 0.00 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.68 2cp2 s ALA 63 CO 0.00 -0.22 -0.13 0.08 0.00 0.00 0.00 175.76 175.49 2cp2 s VAL 64 N 1.12 2.55 0.00 0.00 1.01 -0.83 -4.97 120.40 119.28 2cp2 s VAL 64 Ca 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.07 2cp2 s VAL 64 Cb -0.14 -2.18 0.00 0.00 0.00 0.00 0.00 36.38 34.05 2cp2 s VAL 64 CO -0.03 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2cp2 n GLY 65 N 4.66 2.01 1.10 4.51 0.00 -1.26 -3.00 105.19 113.20 2cp2 n GLY 65 Ca -0.19 -0.12 -0.04 0.00 0.00 0.00 0.00 46.02 45.66 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 5.51 3.14 -0.02 0.00 -1.26 -5.02 105.19 107.53 2cp2 n GLY 66 Ca 0.00 -1.72 -0.09 0.00 0.00 0.00 0.00 46.02 44.21 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 -3.66 0.14 0.11 1.61 1.01 -1.16 -5.05 120.40 113.40 2cp2 s VAL 67 Ca 0.43 -1.17 0.10 0.00 0.00 0.00 0.00 61.98 61.34 2cp2 s VAL 67 Cb 0.39 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 2cp2 s VAL 67 CO -0.03 -0.64 -0.22 -0.60 0.00 0.00 0.00 175.10 173.61 2cp2 s ARG 68 N -2.97 1.66 0.04 2.72 3.52 -1.26 -1.97 118.95 120.68 2cp2 s ARG 68 Ca -0.02 -1.23 0.00 0.00 -0.13 0.00 0.00 55.73 54.35 2cp2 s ARG 68 Cb 0.01 -2.03 0.00 0.00 -1.56 0.00 0.00 34.95 31.37 2cp2 s ARG 68 CO -0.06 0.47 0.00 0.66 -0.81 0.00 0.00 175.30 175.56 2cp2 n TYR 69 N 0.93 -0.04 -3.90 5.12 4.02 -0.56 -4.99 117.16 117.73 2cp2 n TYR 69 Ca -0.17 0.01 -0.14 0.00 -0.01 0.00 0.00 57.90 57.59 2cp2 n TYR 69 Cb 0.53 0.02 -0.15 0.00 -0.02 0.00 0.00 39.34 39.72 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 -1.41 0.12 -0.71 -0.72 -0.71 -1.23 -4.92 117.98 108.40 2cp2 s PHE 70 Ca 0.00 0.01 -0.27 0.00 -1.04 0.00 0.00 56.93 55.63 2cp2 s PHE 70 Cb 0.00 -0.15 0.03 0.00 -1.21 0.00 0.00 43.02 41.68 2cp2 s PHE 70 CO 0.00 -0.04 1.31 -1.21 -1.34 0.00 0.00 175.22 173.94 2cp2 s GLU 71 N 0.34 3.19 0.20 1.99 0.41 -1.26 -4.28 118.70 119.30 2cp2 s GLU 71 Ca -0.03 -0.14 -0.01 0.00 -0.41 0.00 0.00 54.97 54.38 2cp2 s GLU 71 Cb -0.05 -4.17 -0.04 0.00 -1.78 0.00 0.00 34.13 28.09 2cp2 s GLU 71 CO -0.01 -2.13 0.14 0.00 -0.49 0.00 0.00 175.26 172.76 2cp2 n PRO 73 N -0.27 -2.02 -3.32 0.00 -0.02 -1.26 -4.70 135.00 123.41 2cp2 n PRO 73 Ca 0.02 -0.58 -0.30 0.00 -2.02 0.00 0.00 63.50 60.62 2cp2 n PRO 73 Cb 0.66 -1.67 -0.04 0.00 -0.02 0.00 0.00 33.50 32.43 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 -2.19 3.57 -1.66 3.55 0.00 -1.26 -4.03 121.76 119.74 2cp2 s ALA 74 Ca 0.52 -0.40 -0.01 0.00 0.00 0.00 0.00 51.96 52.07 2cp2 s ALA 74 Cb -0.11 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.62 2cp2 s ALA 74 CO 0.58 0.33 0.10 1.28 0.00 0.00 0.00 175.76 178.05 2cp2 n LEU 75 N -0.64 -2.04 0.00 0.00 4.77 -1.24 -4.78 117.00 113.06 2cp2 n LEU 75 Ca -0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2cp2 n LEU 75 Cb 0.53 -2.83 0.00 0.00 -2.33 0.00 0.00 43.42 38.79 2cp2 n LEU 75 CO 0.47 -0.13 -0.08 0.00 -1.33 0.00 0.00 177.39 176.32 2cp2 n GLN 76 N -3.08 0.00 -1.77 3.23 6.02 -1.19 -0.94 117.38 119.64 2cp2 n GLN 76 Ca -0.21 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.55 2cp2 n GLN 76 Cb 0.67 -0.29 -0.09 0.00 1.02 0.00 0.00 30.24 31.54 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 1.78 0.37 3.90 1.08 0.00 -0.63 -2.26 105.19 109.42 2cp2 n GLY 77 Ca 0.00 -0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.38 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 13.71 4.95 -0.05 -0.61 2.07 0.96 -3.11 121.20 139.11 2cp2 s ILE 78 Ca 0.74 0.19 0.05 0.00 -1.41 0.00 0.00 60.65 60.22 2cp2 s ILE 78 Cb -0.02 -3.77 -0.01 0.00 0.13 0.00 0.00 42.46 38.80 2cp2 s ILE 78 CO 0.17 -0.48 -0.21 -0.36 -1.91 0.00 0.00 174.94 172.15 2cp2 s PHE 79 N -2.29 2.08 0.38 3.50 0.08 -1.26 0.22 117.98 120.69 2cp2 s PHE 79 Ca 0.46 -0.63 -0.07 0.00 0.12 0.00 0.00 56.93 56.81 2cp2 s PHE 79 Cb -0.10 -1.38 0.03 0.00 -0.57 0.00 0.00 43.02 40.99 2cp2 s PHE 79 CO 0.33 -0.21 0.63 -2.37 -0.10 0.00 0.00 175.22 173.50 2cp2 n THR 80 N 3.10 0.00 -2.88 0.64 5.66 -0.83 -5.00 114.28 114.95 2cp2 n THR 80 Ca -0.18 -1.49 -0.40 0.00 -3.05 0.00 0.00 64.05 58.93 2cp2 n THR 80 Cb 0.52 1.08 -0.05 0.00 -1.55 0.00 0.00 70.33 70.33 2cp2 n THR 80 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2cp2 s ARG 81 N -2.52 4.59 0.21 1.09 0.52 -1.26 -1.48 118.95 120.10 2cp2 s ARG 81 Ca 0.24 1.22 -0.08 0.00 -0.52 0.00 0.00 55.73 56.59 2cp2 s ARG 81 Cb -0.03 -3.36 0.30 0.00 0.52 0.00 0.00 34.95 32.39 2cp2 s ARG 81 CO 0.18 0.29 1.76 -1.35 0.02 0.00 0.00 175.30 176.20 2cp2 h PRO 82 N 5.46 0.48 -0.25 3.54 0.11 -1.85 -0.59 132.00 138.90 2cp2 h PRO 82 Ca -0.44 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.69 2cp2 h PRO 82 Cb 1.21 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2cp2 h PRO 82 CO 0.71 0.32 0.17 1.03 -0.21 0.00 0.00 178.00 180.02 2cp2 h SER 83 N 0.50 0.13 0.42 -2.05 0.87 -1.83 -0.66 113.55 110.93 2cp2 h SER 83 Ca 0.32 -0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.76 2cp2 h SER 83 Cb 0.37 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.28 2cp2 h SER 83 CO -0.28 0.09 -0.53 0.11 -0.53 0.00 0.00 176.83 175.69 2cp2 h LYS 84 N 0.15 0.12 -7.06 2.24 1.79 -1.49 -3.44 116.57 108.88 2cp2 h LYS 84 Ca 0.11 -0.07 -0.52 0.00 -2.18 0.00 0.00 60.65 58.00 2cp2 h LYS 84 Cb 0.25 0.01 0.09 0.00 -1.58 0.00 0.00 32.23 31.00 2cp2 h LYS 84 CO -0.02 0.62 0.48 -0.51 -1.08 0.00 0.00 179.45 178.94 2cp2 s LEU 85 N -7.94 3.82 0.23 2.94 1.43 -0.25 -3.33 118.68 115.57 2cp2 s LEU 85 Ca -0.03 2.34 0.03 0.00 -1.03 0.00 0.00 54.13 55.44 2cp2 s LEU 85 Cb 0.13 -4.44 -0.05 0.00 0.03 0.00 0.00 46.19 41.85 2cp2 s LEU 85 CO 0.77 -1.26 0.01 0.42 0.23 0.00 0.00 176.35 176.52 2cp2 s THR 86 N -1.60 0.93 -0.34 5.49 -4.23 -0.74 -4.93 115.64 110.22 2cp2 s THR 86 Ca 0.71 -2.02 0.08 0.00 -1.18 0.00 0.00 61.69 59.28 2cp2 s THR 86 Cb -0.29 -2.37 0.61 0.00 1.34 0.00 0.00 72.50 71.80 2cp2 s THR 86 CO 0.33 -0.29 1.69 -1.14 -0.54 0.00 0.00 174.62 174.66 2cp2 n ARG 87 N -0.41 2.43 -3.65 3.99 0.00 -1.26 -1.07 116.66 116.69 2cp2 n ARG 87 Ca -0.05 -3.08 -0.01 0.00 -0.00 0.00 0.00 57.85 54.71 2cp2 n ARG 87 Cb 0.64 -2.02 -0.05 0.00 0.00 0.00 0.00 32.46 31.03 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 -3.18 0.01 -0.03 -0.14 -0.21 -1.26 -4.99 119.66 109.86 2cp2 s GLN 88 Ca 0.51 0.01 -0.35 0.00 0.02 0.00 0.00 55.36 55.54 2cp2 s GLN 88 Cb 0.43 0.01 -0.13 0.00 1.00 0.00 0.00 33.01 34.32 2cp2 s GLN 88 CO 0.07 -0.00 1.72 -2.30 -2.12 0.00 0.00 175.29 172.66 2cp2 n PRO 89 N 0.77 1.91 -0.09 2.91 -0.02 -1.26 -4.81 135.00 134.40 2cp2 n PRO 89 Ca -0.02 0.70 -0.13 0.00 -2.02 0.00 0.00 63.50 62.02 2cp2 n PRO 89 Cb 0.58 -2.47 -0.05 0.00 -0.02 0.00 0.00 33.50 31.54 2cp2 n PRO 89 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2cp2 n SER 90 N 5.12 1.88 -5.00 2.55 2.88 -1.25 -5.01 113.62 114.80 2cp2 n SER 90 Ca 0.21 0.46 -0.18 0.00 -1.33 0.00 0.00 58.87 58.03 2cp2 n SER 90 Cb 0.26 -0.84 0.02 0.00 -0.75 0.00 0.00 64.21 62.89 2cp2 n SER 90 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2cp2 s GLY 91 N -4.74 1.91 0.12 0.46 0.00 -0.66 -5.05 107.32 99.35 2cp2 s GLY 91 Ca -0.25 -1.59 -0.02 0.00 0.00 0.00 0.00 44.72 42.86 2cp2 s GLY 91 CO 0.39 -1.37 0.11 -1.55 0.00 0.00 0.00 173.10 170.68 2cp2 n PRO 92 N -2.00 -1.21 -4.34 2.90 -0.04 -1.26 -4.85 135.00 124.20 2cp2 n PRO 92 Ca 0.08 -0.17 -0.18 0.00 -0.04 0.00 0.00 63.50 63.19 2cp2 n PRO 92 Cb 0.59 -0.16 -0.10 0.00 -0.04 0.00 0.00 33.50 33.80 2cp2 n PRO 92 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cp2 s SER 93 N -1.79 1.44 -0.21 3.54 0.15 -1.26 -4.93 113.70 110.63 2cp2 s SER 93 Ca 0.07 -1.49 -0.27 0.00 0.70 0.00 0.00 55.95 54.96 2cp2 s SER 93 Cb -0.01 0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 2cp2 s SER 93 CO 0.05 -0.82 0.95 -0.44 1.20 0.00 0.00 173.24 174.19 2cp2 s SER 94 N -3.36 7.02 0.00 5.45 0.01 -1.26 -5.29 113.70 116.28 2cp2 s SER 94 Ca 0.36 1.28 0.00 0.00 1.31 0.00 0.00 55.95 58.90 2cp2 s SER 94 Cb 0.06 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.79 2cp2 s SER 94 CO 0.16 -0.57 0.00 0.61 0.41 0.00 0.00 173.24 173.85