#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cp3 n SER 2 N 0.00 -8.68 -0.06 1.61 7.64 -1.26 -4.86 113.62 108.02 2cp3 n SER 2 Ca 0.00 0.88 -0.09 0.00 1.01 0.00 0.00 58.87 60.67 2cp3 n SER 2 Cb 0.00 -4.58 -0.05 0.00 -1.01 0.00 0.00 64.21 58.57 2cp3 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cp3 n SER 3 N -4.30 2.47 0.00 6.43 7.64 -1.26 -5.14 113.62 119.46 2cp3 n SER 3 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2cp3 n SER 3 Cb 0.67 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 2cp3 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cp3 n GLY 4 N 2.78 -0.53 3.24 0.23 0.00 -1.26 -5.14 105.19 104.51 2cp3 n GLY 4 Ca -0.20 -1.66 -0.20 0.00 0.00 0.00 0.00 46.02 43.96 2cp3 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cp3 s SER 5 N -1.19 2.12 -0.29 1.61 0.15 -1.26 -5.14 113.70 109.70 2cp3 s SER 5 Ca 0.00 -0.73 -0.14 0.00 0.70 0.00 0.00 55.95 55.78 2cp3 s SER 5 Cb 0.00 -0.09 0.10 0.00 -1.71 0.00 0.00 66.02 64.32 2cp3 s SER 5 CO 0.00 -0.06 0.70 -0.94 1.20 0.00 0.00 173.24 174.14 2cp3 s SER 6 N -2.14 -0.98 0.00 5.45 1.04 -1.26 -4.98 113.70 110.84 2cp3 s SER 6 Ca 0.06 1.48 0.00 0.00 0.48 0.00 0.00 55.95 57.97 2cp3 s SER 6 Cb -0.08 1.66 0.00 0.00 0.10 0.00 0.00 66.02 67.71 2cp3 s SER 6 CO 0.04 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.64 2cp3 n GLY 7 N 4.64 0.38 3.98 7.32 0.00 -1.26 -5.10 105.19 115.16 2cp3 n GLY 7 Ca -0.17 0.58 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 2cp3 n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cp3 s LEU 8 N 0.00 3.22 0.00 0.99 1.43 -1.26 -5.10 118.68 117.96 2cp3 s LEU 8 Ca 0.00 -0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 52.89 2cp3 s LEU 8 Cb 0.00 -2.62 -0.05 0.00 0.03 0.00 0.00 46.19 43.55 2cp3 s LEU 8 CO 0.00 -1.28 0.27 -0.13 0.23 0.00 0.00 176.35 175.44 2cp3 s ARG 9 N -4.82 3.59 -0.41 1.70 0.52 -1.26 -5.02 118.95 113.25 2cp3 s ARG 9 Ca 0.59 -0.06 -0.27 0.00 -0.52 0.00 0.00 55.73 55.47 2cp3 s ARG 9 Cb -0.09 -3.09 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 2cp3 s ARG 9 CO 0.39 0.66 2.10 -0.51 0.02 0.00 0.00 175.30 177.96 2cp3 s LEU 10 N -1.69 3.41 0.00 2.53 1.43 -1.26 -2.84 118.68 120.26 2cp3 s LEU 10 Ca 0.27 1.17 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 2cp3 s LEU 10 Cb -0.13 -3.00 0.00 0.00 0.03 0.00 0.00 46.19 43.09 2cp3 s LEU 10 CO 0.15 -2.27 0.00 0.61 0.23 0.00 0.00 176.35 175.07 2cp3 n GLY 11 N 5.74 0.49 3.32 -3.19 0.00 -0.67 -5.02 105.19 105.86 2cp3 n GLY 11 Ca 0.28 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 2cp3 n GLY 11 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cp3 s ASP 12 N -1.32 2.89 -0.26 1.61 2.15 -1.13 -4.77 116.67 115.85 2cp3 s ASP 12 Ca 0.00 -0.63 -0.29 0.00 0.43 0.00 0.00 52.55 52.06 2cp3 s ASP 12 Cb 0.00 -0.22 -0.01 0.00 -0.30 0.00 0.00 42.92 42.39 2cp3 s ASP 12 CO 0.00 0.18 1.42 -0.60 -0.17 0.00 0.00 175.17 176.00 2cp3 s ARG 13 N -1.53 3.90 0.39 4.34 3.52 -1.26 0.46 118.95 128.77 2cp3 s ARG 13 Ca 0.10 1.44 0.04 0.00 -0.13 0.00 0.00 55.73 57.18 2cp3 s ARG 13 Cb -0.10 -3.93 -0.05 0.00 -1.56 0.00 0.00 34.95 29.31 2cp3 s ARG 13 CO 0.03 -1.15 0.05 0.14 -0.81 0.00 0.00 175.30 173.56 2cp3 s VAL 14 N 4.61 1.29 -0.21 7.11 -7.23 0.14 -3.57 120.40 122.54 2cp3 s VAL 14 Ca 0.62 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.79 2cp3 s VAL 14 Cb -0.20 -2.66 0.05 0.00 0.56 0.00 0.00 36.38 34.13 2cp3 s VAL 14 CO 0.25 0.00 -0.07 -0.22 -0.31 0.00 0.00 175.10 174.74 2cp3 s LEU 15 N -3.64 2.25 -0.47 1.32 2.96 0.07 -1.64 118.68 119.54 2cp3 s LEU 15 Ca 0.28 -0.95 -0.19 0.00 -0.22 0.00 0.00 54.13 53.05 2cp3 s LEU 15 Cb 0.07 -1.15 0.04 0.00 0.50 0.00 0.00 46.19 45.65 2cp3 s LEU 15 CO 0.14 -0.19 0.56 -0.69 -1.32 0.00 0.00 176.35 174.85 2cp3 s VAL 16 N 1.44 4.95 0.00 1.68 1.01 -0.98 -2.92 120.40 125.59 2cp3 s VAL 16 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.57 2cp3 s VAL 16 Cb -0.17 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.01 2cp3 s VAL 16 CO -0.07 -0.65 0.00 0.61 0.00 0.00 0.00 175.10 174.99 2cp3 n GLY 17 N 5.13 2.92 0.00 4.51 0.00 -1.26 -3.77 105.19 112.72 2cp3 n GLY 17 Ca -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2cp3 n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cp3 n GLY 18 N 0.00 1.81 0.73 -0.02 0.00 -1.26 -4.96 105.19 101.50 2cp3 n GLY 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2cp3 n GLY 18 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2cp3 n THR 19 N -0.49 0.00 -2.51 2.61 -1.04 -1.26 -5.07 114.28 106.51 2cp3 n THR 19 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 2cp3 n THR 19 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 2cp3 n THR 19 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2cp3 s LYS 20 N -1.45 3.18 -0.07 -2.82 1.02 -1.25 -4.98 119.74 113.38 2cp3 s LYS 20 Ca 0.00 -0.13 -0.27 0.00 0.02 0.00 0.00 55.97 55.60 2cp3 s LYS 20 Cb 0.00 -4.18 -0.03 0.00 -0.52 0.00 0.00 37.83 33.11 2cp3 s LYS 20 CO 0.00 -2.14 0.87 0.95 -0.92 0.00 0.00 175.35 174.11 2cp3 s THR 21 N 5.90 4.91 0.16 2.17 -4.23 -1.26 -2.31 115.64 120.99 2cp3 s THR 21 Ca 0.38 1.78 -0.21 0.00 -1.18 0.00 0.00 61.69 62.46 2cp3 s THR 21 Cb -0.08 -4.20 0.06 0.00 1.34 0.00 0.00 72.50 69.62 2cp3 s THR 21 CO 0.17 0.14 0.56 -0.83 -0.54 0.00 0.00 174.62 174.12 2cp3 s GLY 22 N 0.99 -0.49 0.28 3.99 0.00 -0.65 -4.25 107.32 107.18 2cp3 s GLY 22 Ca 0.44 0.30 -0.09 0.00 0.00 0.00 0.00 44.72 45.37 2cp3 s GLY 22 CO 0.20 0.03 0.60 0.14 0.00 0.00 0.00 173.10 174.07 2cp3 s VAL 23 N -3.78 4.91 0.07 1.40 1.01 -0.82 0.28 120.40 123.47 2cp3 s VAL 23 Ca 0.02 0.44 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 2cp3 s VAL 23 Cb -0.01 -3.66 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 2cp3 s VAL 23 CO -0.11 -0.20 1.18 -0.69 0.00 0.00 0.00 175.10 175.27 2cp3 s VAL 24 N -1.97 4.07 -0.08 2.92 1.01 0.17 0.22 120.40 126.74 2cp3 s VAL 24 Ca 0.48 1.51 0.05 0.00 0.00 0.00 0.00 61.98 64.01 2cp3 s VAL 24 Cb -0.11 -3.97 -0.08 0.00 0.00 0.00 0.00 36.38 32.23 2cp3 s VAL 24 CO 0.24 0.13 -0.01 0.54 0.00 0.00 0.00 175.10 176.00 2cp3 n ARG 25 N 3.79 1.98 -4.56 2.72 5.12 0.15 -1.67 116.66 124.20 2cp3 n ARG 25 Ca 0.08 0.01 -0.22 0.00 -1.93 0.00 0.00 57.85 55.80 2cp3 n ARG 25 Cb 0.47 -1.18 -0.15 0.00 -1.16 0.00 0.00 32.46 30.44 2cp3 n ARG 25 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 2cp3 s TYR 26 N -2.18 1.26 -0.18 -1.55 5.04 -1.16 -4.87 117.35 113.71 2cp3 s TYR 26 Ca -0.06 -0.28 -0.04 0.00 -2.44 0.00 0.00 57.07 54.25 2cp3 s TYR 26 Cb 0.02 -0.79 0.09 0.00 0.35 0.00 0.00 41.96 41.63 2cp3 s TYR 26 CO 0.27 0.00 0.26 0.08 -1.34 0.00 0.00 175.55 174.82 2cp3 s VAL 27 N -0.50 -0.40 -5.00 3.14 1.01 -1.26 -2.31 120.40 115.08 2cp3 s VAL 27 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2cp3 s VAL 27 Cb -0.06 -0.62 0.00 0.00 0.00 0.00 0.00 36.38 35.70 2cp3 s VAL 27 CO 0.00 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.63 2cp3 n GLY 28 N 5.34 -0.16 2.03 4.51 0.00 -1.18 -5.07 105.19 110.65 2cp3 n GLY 28 Ca -0.05 -1.24 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 2cp3 n GLY 28 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cp3 n GLU 29 N 0.00 -0.15 -4.11 1.61 1.02 -1.26 -0.97 120.64 116.78 2cp3 n GLU 29 Ca 0.00 -1.28 -0.18 0.00 -0.02 0.00 0.00 57.16 55.69 2cp3 n GLU 29 Cb 0.00 -0.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.86 2cp3 n GLU 29 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2cp3 n THR 30 N -2.49 0.00 -2.15 2.62 -2.24 -1.18 -4.64 114.28 104.20 2cp3 n THR 30 Ca 0.09 -2.18 0.05 0.00 -2.27 0.00 0.00 64.05 59.74 2cp3 n THR 30 Cb 0.31 1.16 0.08 0.00 -2.10 0.00 0.00 70.33 69.78 2cp3 n THR 30 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2cp3 n ASP 31 N -1.68 1.21 0.00 3.42 8.00 -1.26 -4.47 116.55 121.77 2cp3 n ASP 31 Ca 0.05 -2.64 0.00 0.00 0.71 0.00 0.00 54.79 52.91 2cp3 n ASP 31 Cb 0.59 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 2cp3 n ASP 31 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2cp3 n PHE 32 N -0.10 0.00 0.11 1.24 1.16 -1.26 -4.88 117.46 113.73 2cp3 n PHE 32 Ca 0.10 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.71 2cp3 n PHE 32 Cb 0.97 0.22 0.05 0.00 -1.61 0.00 0.00 39.48 39.11 2cp3 n PHE 32 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2cp3 n ALA 33 N -2.19 2.32 -1.26 1.98 0.00 -1.26 -5.11 120.51 114.98 2cp3 n ALA 33 Ca 0.00 -0.79 0.15 0.00 0.00 0.00 0.00 53.44 52.80 2cp3 n ALA 33 Cb 0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 2cp3 n ALA 33 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2cp3 n LYS 34 N 0.25 -2.24 0.00 0.00 4.81 -1.26 -4.97 118.16 114.74 2cp3 n LYS 34 Ca 0.05 1.48 0.00 0.00 -0.87 0.00 0.00 58.31 58.97 2cp3 n LYS 34 Cb 0.25 -2.74 0.00 0.00 0.02 0.00 0.00 35.03 32.56 2cp3 n LYS 34 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2cp3 n GLY 35 N -3.30 -0.78 3.40 3.14 0.00 -1.26 -4.63 105.19 101.76 2cp3 n GLY 35 Ca 0.01 -1.09 -0.37 0.00 0.00 0.00 0.00 46.02 44.56 2cp3 n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cp3 s GLU 36 N 0.00 3.33 0.18 1.61 8.01 -1.26 -3.11 118.70 127.46 2cp3 s GLU 36 Ca 0.00 -0.70 0.08 0.00 0.01 0.00 0.00 54.97 54.36 2cp3 s GLU 36 Cb 0.00 -3.39 -0.04 0.00 -4.31 0.00 0.00 34.13 26.39 2cp3 s GLU 36 CO 0.00 -0.35 -0.03 -1.58 0.01 0.00 0.00 175.26 173.32 2cp3 s TRP 37 N 1.56 2.78 -0.03 1.61 0.52 -0.14 -0.88 118.94 124.35 2cp3 s TRP 37 Ca 0.04 -0.16 0.01 0.00 0.02 0.00 0.00 56.10 56.01 2cp3 s TRP 37 Cb -0.16 -1.34 0.02 0.00 -1.15 0.00 0.00 33.47 30.84 2cp3 s TRP 37 CO 0.03 0.52 -0.02 0.00 0.02 0.00 0.00 176.95 177.51 2cp3 s GLY 39 N 0.89 2.21 -0.01 0.00 0.00 -0.98 -2.37 107.32 107.07 2cp3 s GLY 39 Ca -0.10 -0.49 0.05 0.00 0.00 0.00 0.00 44.72 44.18 2cp3 s GLY 39 CO -0.01 0.18 -0.17 0.14 0.00 0.00 0.00 173.10 173.25 2cp3 s VAL 40 N -0.08 2.87 -0.33 1.40 1.01 -1.03 0.33 120.40 124.58 2cp3 s VAL 40 Ca 0.16 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 2cp3 s VAL 40 Cb -0.13 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.11 2cp3 s VAL 40 CO 0.04 0.48 0.14 -0.70 0.00 0.00 0.00 175.10 175.07 2cp3 s GLU 41 N -1.02 3.04 0.23 2.72 -6.30 0.13 -0.37 118.70 117.14 2cp3 s GLU 41 Ca 0.13 -0.91 -0.08 0.00 -2.50 0.00 0.00 54.97 51.61 2cp3 s GLU 41 Cb -0.11 -3.53 -0.07 0.00 0.00 0.00 0.00 34.13 30.43 2cp3 s GLU 41 CO 0.03 -0.53 0.52 -0.51 0.02 0.00 0.00 175.26 174.79 2cp3 s LEU 42 N 1.54 4.16 0.03 2.70 1.43 -1.26 -1.94 118.68 125.34 2cp3 s LEU 42 Ca 0.03 0.83 -0.16 0.00 -1.03 0.00 0.00 54.13 53.79 2cp3 s LEU 42 Cb -0.18 -3.59 -0.36 0.00 0.03 0.00 0.00 46.19 42.09 2cp3 s LEU 42 CO 0.05 -0.08 0.98 0.44 0.23 0.00 0.00 176.35 177.97 2cp3 h ASP 43 N 2.41 0.84 -2.83 2.29 3.32 -1.95 -3.45 116.42 117.05 2cp3 h ASP 43 Ca -0.47 -0.92 -0.64 0.00 0.02 0.00 0.00 57.03 55.03 2cp3 h ASP 43 Cb 1.17 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 40.39 2cp3 h ASP 43 CO 0.69 1.72 -0.44 -1.61 -1.72 0.00 0.00 179.24 177.88 2cp3 s GLU 44 N -2.60 3.50 -0.85 3.56 2.02 -1.26 -4.99 118.70 118.08 2cp3 s GLU 44 Ca -0.09 -0.19 -0.21 0.00 0.02 0.00 0.00 54.97 54.50 2cp3 s GLU 44 Cb 0.04 -3.10 -0.20 0.00 0.10 0.00 0.00 34.13 30.97 2cp3 s GLU 44 CO 0.94 0.68 2.33 -2.30 0.02 0.00 0.00 175.26 176.93 2cp3 n PRO 45 N 1.15 0.39 -1.49 0.39 -0.02 -1.26 -4.53 135.00 129.62 2cp3 n PRO 45 Ca -0.12 -0.62 0.01 0.00 -2.02 0.00 0.00 63.50 60.75 2cp3 n PRO 45 Cb 0.53 -2.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 2cp3 n PRO 45 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2cp3 n LEU 46 N 14.91 0.44 0.00 2.45 4.77 -1.26 -5.10 117.00 133.22 2cp3 n LEU 46 Ca 0.53 -2.11 -0.11 0.00 -0.03 0.00 0.00 56.01 54.29 2cp3 n LEU 46 Cb 0.35 0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.47 2cp3 n LEU 46 CO 0.70 0.84 0.00 0.61 -1.33 0.00 0.00 177.39 178.21 2cp3 n GLY 47 N 0.23 3.11 0.45 -0.72 0.00 -1.26 -5.01 105.19 102.00 2cp3 n GLY 47 Ca -0.04 -2.23 0.01 0.00 0.00 0.00 0.00 46.02 43.76 2cp3 n GLY 47 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2cp3 n LYS 48 N -0.92 0.12 -3.84 1.61 2.85 -1.26 -4.82 118.16 111.90 2cp3 n LYS 48 Ca -0.02 -1.13 -0.00 0.00 -1.05 0.00 0.00 58.31 56.10 2cp3 n LYS 48 Cb 0.25 -0.59 0.01 0.00 -0.65 0.00 0.00 35.03 34.05 2cp3 n LYS 48 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2cp3 s ASN 49 N -1.15 -0.03 -0.20 -5.58 0.01 -1.19 -4.99 114.94 101.81 2cp3 s ASN 49 Ca 0.03 -0.38 0.12 0.00 -0.71 0.00 0.00 52.86 51.92 2cp3 s ASN 49 Cb 0.02 0.32 0.42 0.00 0.41 0.00 0.00 41.25 42.43 2cp3 s ASN 49 CO 0.00 -0.62 1.21 -0.90 -1.51 0.00 0.00 177.10 175.28 2cp3 n ASP 50 N -0.92 1.86 -0.03 -1.22 5.75 -1.26 -2.66 116.55 118.07 2cp3 n ASP 50 Ca -0.03 -3.71 -0.00 0.00 -0.01 0.00 0.00 54.79 51.04 2cp3 n ASP 50 Cb 0.60 -0.50 -0.00 0.00 -1.03 0.00 0.00 41.12 40.19 2cp3 n ASP 50 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cp3 n GLY 51 N -0.94 0.37 3.10 6.12 0.00 -1.26 -3.75 105.19 108.83 2cp3 n GLY 51 Ca 0.19 -0.92 -0.19 0.00 0.00 0.00 0.00 46.02 45.11 2cp3 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cp3 s ALA 52 N -2.01 1.01 -0.21 4.61 0.00 -1.26 -2.21 121.76 121.68 2cp3 s ALA 52 Ca 0.00 -0.68 -0.04 0.00 0.00 0.00 0.00 51.96 51.24 2cp3 s ALA 52 Cb 0.00 -0.17 0.09 0.00 0.00 0.00 0.00 23.12 23.04 2cp3 s ALA 52 CO 0.00 0.20 0.23 0.08 0.00 0.00 0.00 175.76 176.26 2cp3 s VAL 53 N -0.68 -0.33 -1.28 0.00 1.01 -0.15 -4.88 120.40 114.08 2cp3 s VAL 53 Ca 0.01 -0.12 -0.04 0.00 0.00 0.00 0.00 61.98 61.84 2cp3 s VAL 53 Cb -0.07 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.64 2cp3 s VAL 53 CO 0.01 -0.21 1.03 0.00 0.00 0.00 0.00 175.10 175.93 2cp3 n ALA 54 N 5.32 -1.75 -1.94 5.51 0.00 -1.26 -2.10 120.51 124.29 2cp3 n ALA 54 Ca -0.05 0.09 -0.08 0.00 0.00 0.00 0.00 53.44 53.40 2cp3 n ALA 54 Cb 0.50 -3.50 -0.01 0.00 0.00 0.00 0.00 19.45 16.44 2cp3 n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cp3 n GLY 55 N -1.50 0.26 2.79 0.00 0.00 -1.26 -5.01 105.19 100.48 2cp3 n GLY 55 Ca -0.18 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 2cp3 n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cp3 s THR 56 N -2.39 1.17 -0.28 2.61 2.01 -0.89 -5.10 115.64 112.76 2cp3 s THR 56 Ca 0.00 -1.60 -0.11 0.00 0.31 0.00 0.00 61.69 60.30 2cp3 s THR 56 Cb 0.00 -1.88 -0.05 0.00 0.01 0.00 0.00 72.50 70.58 2cp3 s THR 56 CO 0.00 -0.66 0.18 -0.60 -0.69 0.00 0.00 174.62 172.85 2cp3 s ARG 57 N 1.47 3.90 -0.18 4.92 3.52 -1.26 -0.98 118.95 130.34 2cp3 s ARG 57 Ca 0.10 -0.35 -0.18 0.00 -0.13 0.00 0.00 55.73 55.17 2cp3 s ARG 57 Cb -0.18 -3.62 -0.21 0.00 -1.56 0.00 0.00 34.95 29.38 2cp3 s ARG 57 CO -0.22 -0.19 0.27 1.88 -0.81 0.00 0.00 175.30 176.24 2cp3 h TYR 58 N 8.36 0.14 -3.30 5.12 -1.99 -1.82 -3.47 116.97 120.00 2cp3 h TYR 58 Ca -0.35 -0.10 -0.59 0.00 2.00 0.00 0.00 58.73 59.69 2cp3 h TYR 58 Cb 1.19 -0.01 -0.34 0.00 2.00 0.00 0.00 36.73 39.57 2cp3 h TYR 58 CO 0.75 1.56 -0.84 -0.59 -0.00 0.00 0.00 178.16 179.04 2cp3 s PHE 59 N -2.41 1.98 -0.12 4.88 -0.12 -1.26 -5.07 117.98 115.86 2cp3 s PHE 59 Ca -0.27 -0.89 -0.29 0.00 -0.05 0.00 0.00 56.93 55.43 2cp3 s PHE 59 Cb 0.06 -1.41 -0.05 0.00 -0.63 0.00 0.00 43.02 40.99 2cp3 s PHE 59 CO 0.64 -0.44 1.80 -1.14 -0.05 0.00 0.00 175.22 176.03 2cp3 s GLN 60 N 0.83 3.87 -0.03 1.99 2.00 -1.26 -4.54 119.66 122.52 2cp3 s GLN 60 Ca -0.10 2.07 -0.15 0.00 -2.00 0.00 0.00 55.36 55.18 2cp3 s GLN 60 Cb -0.15 -4.10 0.03 0.00 0.80 0.00 0.00 33.01 29.58 2cp3 s GLN 60 CO 0.01 -1.22 0.33 0.00 -0.50 0.00 0.00 175.29 173.91 2cp3 s PRO 62 N -1.12 1.29 0.26 0.00 0.04 -1.26 -4.72 135.00 129.49 2cp3 s PRO 62 Ca -0.12 0.71 -0.31 0.00 0.04 0.00 0.00 61.00 61.33 2cp3 s PRO 62 Cb -0.05 -1.82 -0.12 0.00 0.04 0.00 0.00 34.50 32.55 2cp3 s PRO 62 CO 0.04 -2.19 1.61 -2.30 0.04 0.00 0.00 177.00 174.20 2cp3 n PRO 63 N -3.83 2.64 -3.29 0.56 -0.02 -1.26 -2.42 135.00 127.38 2cp3 n PRO 63 Ca 0.07 0.94 -0.17 0.00 -2.02 0.00 0.00 63.50 62.32 2cp3 n PRO 63 Cb 0.56 -2.73 0.06 0.00 -0.02 0.00 0.00 33.50 31.37 2cp3 n PRO 63 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2cp3 n LYS 64 N 2.66 -5.73 -1.51 -0.52 4.76 -1.19 -4.92 118.16 111.72 2cp3 n LYS 64 Ca 0.11 0.59 0.02 0.00 -2.87 0.00 0.00 58.31 56.16 2cp3 n LYS 64 Cb 0.35 -4.93 0.01 0.00 -1.84 0.00 0.00 35.03 28.63 2cp3 n LYS 64 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2cp3 n PHE 65 N -4.30 0.05 -3.33 2.13 3.72 -1.02 -3.99 117.46 110.73 2cp3 n PHE 65 Ca 0.01 -0.62 0.03 0.00 -0.05 0.00 0.00 57.45 56.82 2cp3 n PHE 65 Cb 0.54 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 39.03 2cp3 n PHE 65 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2cp3 s GLY 66 N -1.93 -0.32 0.42 1.37 0.00 -1.09 -4.08 107.32 101.69 2cp3 s GLY 66 Ca 0.27 2.85 0.08 0.00 0.00 0.00 0.00 44.72 47.92 2cp3 s GLY 66 CO -0.13 3.38 0.57 -2.27 0.00 0.00 0.00 173.10 174.65 2cp3 s LEU 67 N 2.62 3.67 -0.27 0.66 0.20 0.51 -3.20 118.68 122.87 2cp3 s LEU 67 Ca -0.00 -0.40 -0.03 0.00 0.69 0.00 0.00 54.13 54.38 2cp3 s LEU 67 Cb -0.08 -2.67 0.10 0.00 -0.43 0.00 0.00 46.19 43.11 2cp3 s LEU 67 CO -0.16 -0.75 0.17 -0.36 -0.29 0.00 0.00 176.35 174.96 2cp3 s PHE 68 N -2.35 0.08 0.08 5.38 0.08 -1.26 -2.47 117.98 117.52 2cp3 s PHE 68 Ca 0.55 -0.57 0.03 0.00 0.12 0.00 0.00 56.93 57.06 2cp3 s PHE 68 Cb -0.10 -0.74 -0.03 0.00 -0.57 0.00 0.00 43.02 41.58 2cp3 s PHE 68 CO 0.33 -0.79 -0.09 0.00 -0.10 0.00 0.00 175.22 174.56 2cp3 s ALA 69 N 2.18 0.98 0.52 5.36 0.00 -1.00 -4.96 121.76 124.84 2cp3 s ALA 69 Ca 0.08 -1.12 -0.22 0.00 0.00 0.00 0.00 51.96 50.70 2cp3 s ALA 69 Cb -0.16 0.05 -0.07 0.00 0.00 0.00 0.00 23.12 22.95 2cp3 s ALA 69 CO -0.31 -0.06 1.10 -2.30 0.00 0.00 0.00 175.76 174.19 2cp3 n PRO 70 N 0.66 1.32 -0.16 0.00 -0.02 -1.26 -0.53 135.00 135.01 2cp3 n PRO 70 Ca -0.17 0.49 -0.05 0.00 -2.02 0.00 0.00 63.50 61.74 2cp3 n PRO 70 Cb 0.57 -2.25 0.04 0.00 -0.02 0.00 0.00 33.50 31.84 2cp3 n PRO 70 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2cp3 h ILE 71 N 1.17 1.01 0.00 4.25 2.10 -1.29 -0.72 117.51 124.02 2cp3 h ILE 71 Ca -0.48 -0.18 -0.00 0.00 1.08 0.00 0.00 64.86 65.28 2cp3 h ILE 71 Cb 1.34 0.43 -0.00 0.00 -1.09 0.00 0.00 36.82 37.50 2cp3 h ILE 71 CO 0.55 0.10 -0.01 1.12 -1.08 0.00 0.00 178.15 178.83 2cp3 h HIS 72 N 0.53 0.00 -0.62 2.19 2.07 -1.91 -1.41 115.15 116.00 2cp3 h HIS 72 Ca 0.20 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.54 2cp3 h HIS 72 Cb 0.07 0.00 -0.11 0.00 2.57 0.00 0.00 27.41 29.94 2cp3 h HIS 72 CO -0.08 0.01 0.23 1.63 -3.07 0.00 0.00 177.93 176.64 2cp3 n LYS 73 N -3.13 3.29 -4.11 5.12 4.76 -0.28 -4.86 118.16 118.94 2cp3 n LYS 73 Ca -0.02 -2.54 -0.34 0.00 -2.87 0.00 0.00 58.31 52.55 2cp3 n LYS 73 Cb 0.15 -2.06 -0.15 0.00 -1.84 0.00 0.00 35.03 31.12 2cp3 n LYS 73 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2cp3 s VAL 74 N -2.56 2.48 -0.25 -0.18 1.01 -0.53 -4.59 120.40 115.78 2cp3 s VAL 74 Ca 0.46 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 2cp3 s VAL 74 Cb 0.36 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2cp3 s VAL 74 CO 0.11 0.50 0.33 -0.63 0.00 0.00 0.00 175.10 175.42 2cp3 s ILE 75 N 1.30 5.22 -0.09 2.22 1.01 -1.15 -4.95 121.20 124.75 2cp3 s ILE 75 Ca 0.04 0.51 -0.28 0.00 0.00 0.00 0.00 60.65 60.92 2cp3 s ILE 75 Cb -0.14 -3.66 -0.02 0.00 0.01 0.00 0.00 42.46 38.65 2cp3 s ILE 75 CO -0.09 0.21 0.91 -0.60 0.00 0.00 0.00 174.94 175.37 2cp3 s ARG 76 N 1.76 4.42 -0.21 2.79 3.52 -1.26 -0.75 118.95 129.21 2cp3 s ARG 76 Ca 0.14 1.22 0.11 0.00 -0.13 0.00 0.00 55.73 57.07 2cp3 s ARG 76 Cb -0.15 -3.52 0.43 0.00 -1.56 0.00 0.00 34.95 30.15 2cp3 s ARG 76 CO 0.09 -0.20 1.21 0.44 -0.81 0.00 0.00 175.30 176.03 2cp3 n ILE 77 N 4.34 2.15 -2.11 4.11 -5.35 -1.23 -4.96 119.36 116.30 2cp3 n ILE 77 Ca 0.05 -3.29 -0.32 0.00 -0.27 0.00 0.00 62.75 58.93 2cp3 n ILE 77 Cb 0.50 -0.31 -0.01 0.00 -1.74 0.00 0.00 39.64 38.08 2cp3 n ILE 77 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2cp3 s GLY 78 N -3.24 1.89 0.12 3.28 0.00 -1.26 -4.99 107.32 103.12 2cp3 s GLY 78 Ca 0.40 0.10 0.08 0.00 0.00 0.00 0.00 44.72 45.29 2cp3 s GLY 78 CO -0.06 0.37 -0.19 -0.56 0.00 0.00 0.00 173.10 172.66 2cp3 s SER 79 N -3.50 2.52 -0.59 1.64 0.01 -1.26 -5.11 113.70 107.42 2cp3 s SER 79 Ca 0.58 -0.75 0.04 0.00 1.31 0.00 0.00 55.95 57.13 2cp3 s SER 79 Cb -0.11 -0.14 0.15 0.00 0.21 0.00 0.00 66.02 66.13 2cp3 s SER 79 CO 0.42 0.01 0.36 -0.83 0.41 0.00 0.00 173.24 173.61 2cp3 s GLY 80 N -2.17 2.53 0.38 3.44 0.00 -1.26 -4.93 107.32 105.32 2cp3 s GLY 80 Ca 0.09 -3.42 0.16 0.00 0.00 0.00 0.00 44.72 41.56 2cp3 s GLY 80 CO 0.05 1.14 1.81 -0.56 0.00 0.00 0.00 173.10 175.53 2cp3 h PRO 81 N 6.02 0.00 0.00 2.90 0.13 -2.03 -3.43 132.00 135.59 2cp3 h PRO 81 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2cp3 h PRO 81 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2cp3 h PRO 81 CO 0.67 0.36 0.00 0.45 -0.23 0.00 0.00 178.00 179.25 2cp3 n SER 82 N -3.82 -2.46 -3.61 1.44 2.88 -1.26 -5.17 113.62 101.61 2cp3 n SER 82 Ca -0.01 0.72 -0.04 0.00 -1.33 0.00 0.00 58.87 58.21 2cp3 n SER 82 Cb 0.44 2.39 -0.02 0.00 -0.75 0.00 0.00 64.21 66.26 2cp3 n SER 82 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cp3 s SER 83 N -3.27 -0.09 0.00 -3.46 0.15 -1.26 -5.29 113.70 100.47 2cp3 s SER 83 Ca 0.00 -0.00 0.24 0.00 0.70 0.00 0.00 55.95 56.89 2cp3 s SER 83 Cb 0.00 0.10 1.45 0.00 -1.71 0.00 0.00 66.02 65.86 2cp3 s SER 83 CO 0.00 -0.16 1.82 0.61 1.20 0.00 0.00 173.24 176.71