#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pi2 s ARG 42 N 0.00 0.27 0.23 0.00 3.52 -1.26 -5.17 118.95 116.54 2pi2 s ARG 42 Ca 0.00 0.30 -0.30 0.00 -0.13 0.00 0.00 55.73 55.60 2pi2 s ARG 42 Cb 0.00 0.13 -0.09 0.00 -1.56 0.00 0.00 34.95 33.43 2pi2 s ARG 42 CO 0.00 -0.04 1.24 0.00 -0.81 0.00 0.00 175.30 175.69 2pi2 s ALA 43 N 0.04 3.47 -0.30 6.12 0.00 -1.26 -5.04 121.76 124.80 2pi2 s ALA 43 Ca 0.05 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.07 2pi2 s ALA 43 Cb -0.05 -3.43 0.09 0.00 0.00 0.00 0.00 23.12 19.73 2pi2 s ALA 43 CO -0.11 -0.44 0.07 -1.14 0.00 0.00 0.00 175.76 174.14 2pi2 s GLN 44 N -0.70 0.96 0.39 0.00 2.00 -1.26 -5.13 119.66 115.92 2pi2 s GLN 44 Ca 0.52 -1.19 -0.11 0.00 -2.00 0.00 0.00 55.36 52.58 2pi2 s GLN 44 Cb -0.35 -2.30 -0.07 0.00 0.80 0.00 0.00 33.01 31.09 2pi2 s GLN 44 CO 0.41 -0.92 0.75 -1.01 -0.50 0.00 0.00 175.29 174.03 2pi2 s HIS 45 N 1.46 3.46 -0.60 1.67 3.76 -1.26 -5.02 115.29 118.76 2pi2 s HIS 45 Ca 0.08 1.04 -0.20 0.00 -0.15 0.00 0.00 55.06 55.82 2pi2 s HIS 45 Cb -0.18 -2.43 0.08 0.00 1.11 0.00 0.00 32.58 31.17 2pi2 s HIS 45 CO -0.19 -0.06 0.80 0.42 -0.85 0.00 0.00 174.74 174.85 2pi2 s ILE 46 N -2.30 4.64 -0.19 0.60 1.01 -1.26 -4.45 121.20 119.24 2pi2 s ILE 46 Ca 0.51 -0.67 -0.21 0.00 0.00 0.00 0.00 60.65 60.28 2pi2 s ILE 46 Cb -0.10 -4.54 -0.03 0.00 0.01 0.00 0.00 42.46 37.80 2pi2 s ILE 46 CO 0.29 -1.21 0.63 -0.69 0.00 0.00 0.00 174.94 173.97 2pi2 s VAL 47 N 3.21 5.02 0.14 2.92 1.01 -0.48 -4.73 120.40 127.48 2pi2 s VAL 47 Ca 0.16 1.19 -0.30 0.00 0.00 0.00 0.00 61.98 63.03 2pi2 s VAL 47 Cb -0.21 -3.95 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 2pi2 s VAL 47 CO 0.09 0.12 1.20 -2.16 0.00 0.00 0.00 175.10 174.35 2pi2 s PRO 48 N 1.83 4.47 0.18 2.72 0.04 -1.26 -1.80 135.00 141.17 2pi2 s PRO 48 Ca 0.29 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.17 2pi2 s PRO 48 Cb -0.16 -3.28 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 2pi2 s PRO 48 CO 0.11 -0.15 0.05 0.00 0.04 0.00 0.00 177.00 177.04 2pi2 s THR 50 N -3.85 4.50 0.28 0.00 -4.23 -1.26 -4.46 115.64 106.62 2pi2 s THR 50 Ca 0.28 -0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 60.01 2pi2 s THR 50 Cb 0.07 -3.61 0.21 0.00 1.34 0.00 0.00 72.50 70.51 2pi2 s THR 50 CO 0.06 -0.32 1.89 0.40 -0.54 0.00 0.00 174.62 176.11 2pi2 h ILE 51 N 0.78 1.23 -0.74 2.99 2.04 -1.95 -2.37 117.51 119.49 2pi2 h ILE 51 Ca -0.48 -0.59 0.04 0.00 1.00 0.00 0.00 64.86 64.83 2pi2 h ILE 51 Cb 1.24 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 2pi2 h ILE 51 CO 0.57 0.26 0.49 0.77 0.00 0.00 0.00 178.15 180.24 2pi2 h SER 52 N 1.04 0.74 -0.41 1.72 4.64 -1.94 0.62 113.55 119.96 2pi2 h SER 52 Ca 0.26 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.51 2pi2 h SER 52 Cb 0.06 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 2pi2 h SER 52 CO -0.04 0.50 0.02 1.56 -0.87 0.00 0.00 176.83 178.00 2pi2 h GLN 53 N 0.86 0.72 -0.80 4.77 4.20 -1.84 -2.31 115.11 120.70 2pi2 h GLN 53 Ca 0.30 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2pi2 h GLN 53 Cb 0.12 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 2pi2 h GLN 53 CO -0.09 0.79 0.33 -0.07 -0.67 0.00 0.00 178.83 179.11 2pi2 h LEU 54 N 0.55 1.10 -0.80 1.46 3.38 -0.82 -1.63 115.31 118.55 2pi2 h LEU 54 Ca 0.12 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 2pi2 h LEU 54 Cb 0.45 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2pi2 h LEU 54 CO 0.02 0.97 -0.54 -0.07 0.09 0.00 0.00 178.44 178.91 2pi2 h LEU 55 N 1.16 0.19 0.00 1.67 3.38 -0.91 -3.10 115.31 117.71 2pi2 h LEU 55 Ca 0.27 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2pi2 h LEU 55 Cb 0.21 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2pi2 h LEU 55 CO -0.02 0.70 -0.31 -1.20 0.09 0.00 0.00 178.44 177.69 2pi2 n SER 56 N -3.92 0.71 -4.77 -0.43 7.64 -0.87 -4.93 113.62 107.05 2pi2 n SER 56 Ca -0.02 0.32 -0.41 0.00 1.01 0.00 0.00 58.87 59.77 2pi2 n SER 56 Cb 0.56 -0.29 -0.00 0.00 -1.01 0.00 0.00 64.21 63.47 2pi2 n SER 56 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2pi2 n ALA 57 N -1.78 2.28 -2.40 -0.43 0.00 -0.63 -4.92 120.51 112.63 2pi2 n ALA 57 Ca 0.05 0.34 -0.29 0.00 0.00 0.00 0.00 53.44 53.54 2pi2 n ALA 57 Cb 0.43 -2.41 -0.14 0.00 0.00 0.00 0.00 19.45 17.34 2pi2 n ALA 57 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2pi2 s THR 58 N -1.07 2.13 -0.24 0.00 -4.23 -0.55 -4.85 115.64 106.82 2pi2 s THR 58 Ca 0.54 -1.59 -0.29 0.00 -1.18 0.00 0.00 61.69 59.16 2pi2 s THR 58 Cb -0.49 -1.87 -0.01 0.00 1.34 0.00 0.00 72.50 71.48 2pi2 s THR 58 CO 0.63 0.16 1.31 -0.22 -0.54 0.00 0.00 174.62 175.96 2pi2 s LEU 59 N -1.75 4.01 -0.13 4.79 2.96 -1.26 -1.30 118.68 126.00 2pi2 s LEU 59 Ca 0.12 1.43 0.01 0.00 -0.22 0.00 0.00 54.13 55.47 2pi2 s LEU 59 Cb -0.10 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.07 2pi2 s LEU 59 CO 0.04 -0.96 -0.13 -0.69 -1.32 0.00 0.00 176.35 173.29 2pi2 s VAL 60 N 4.06 1.43 -1.45 1.68 1.01 0.31 -4.75 120.40 122.69 2pi2 s VAL 60 Ca 0.57 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 2pi2 s VAL 60 Cb -0.19 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 34.86 2pi2 s VAL 60 CO 0.20 0.43 0.50 0.47 0.00 0.00 0.00 175.10 176.70 2pi2 n ASP 61 N 4.66 -0.91 0.00 3.32 8.00 -1.26 -1.98 116.55 128.38 2pi2 n ASP 61 Ca -0.17 -0.99 0.00 0.00 0.71 0.00 0.00 54.79 54.34 2pi2 n ASP 61 Cb 0.50 -3.08 0.00 0.00 -0.02 0.00 0.00 41.12 38.52 2pi2 n ASP 61 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2pi2 n GLU 62 N -4.41 -1.03 -4.71 -1.24 -0.58 -1.26 -5.00 120.64 102.41 2pi2 n GLU 62 Ca -0.25 0.26 -0.23 0.00 -0.42 0.00 0.00 57.16 56.52 2pi2 n GLU 62 Cb 0.65 -4.05 -0.15 0.00 -0.57 0.00 0.00 31.44 27.32 2pi2 n GLU 62 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2pi2 s VAL 63 N -1.51 1.21 0.32 2.62 1.01 -0.84 -5.09 120.40 118.14 2pi2 s VAL 63 Ca 0.00 -0.64 -0.28 0.00 0.00 0.00 0.00 61.98 61.05 2pi2 s VAL 63 Cb 0.00 -1.01 -0.10 0.00 0.00 0.00 0.00 36.38 35.27 2pi2 s VAL 63 CO 0.00 0.34 1.23 -0.36 0.00 0.00 0.00 175.10 176.31 2pi2 s PHE 64 N -0.29 3.21 -0.01 5.22 2.99 -1.25 -0.53 117.98 127.32 2pi2 s PHE 64 Ca 0.04 1.52 0.00 0.00 0.00 0.00 0.00 56.93 58.50 2pi2 s PHE 64 Cb -0.07 -3.52 0.02 0.00 0.00 0.00 0.00 43.02 39.45 2pi2 s PHE 64 CO -0.00 -1.39 0.01 0.50 -0.00 0.00 0.00 175.22 174.34 2pi2 s ARG 65 N -1.75 0.06 -0.18 0.44 3.52 -0.42 -1.04 118.95 119.58 2pi2 s ARG 65 Ca 0.49 0.09 0.00 0.00 -0.13 0.00 0.00 55.73 56.18 2pi2 s ARG 65 Cb -0.36 -0.22 0.01 0.00 -1.56 0.00 0.00 34.95 32.81 2pi2 s ARG 65 CO 0.48 -0.09 -0.17 -1.50 -0.81 0.00 0.00 175.30 173.20 2pi2 s ILE 66 N 0.67 2.38 0.00 4.11 1.10 0.22 -1.49 121.20 128.19 2pi2 s ILE 66 Ca -0.06 -0.84 0.00 0.00 -0.51 0.00 0.00 60.65 59.24 2pi2 s ILE 66 Cb -0.09 -2.02 0.00 0.00 0.15 0.00 0.00 42.46 40.51 2pi2 s ILE 66 CO -0.02 0.52 0.00 0.61 -2.11 0.00 0.00 174.94 173.94 2pi2 n GLY 67 N 4.54 3.36 1.55 1.50 0.00 -1.26 -1.29 105.19 113.59 2pi2 n GLY 67 Ca -0.20 -0.18 0.09 0.00 0.00 0.00 0.00 46.02 45.73 2pi2 n GLY 67 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2pi2 n ASN 68 N 4.36 4.76 -4.63 1.61 6.94 -1.26 -4.93 115.26 122.11 2pi2 n ASN 68 Ca 0.00 -2.50 -0.38 0.00 -0.02 0.00 0.00 54.58 51.68 2pi2 n ASN 68 Cb 0.00 -0.58 -0.09 0.00 -2.36 0.00 0.00 39.78 36.75 2pi2 n ASN 68 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2pi2 s VAL 69 N -1.95 5.24 0.09 3.53 1.01 -0.41 -4.87 120.40 123.04 2pi2 s VAL 69 Ca 0.50 0.47 -0.30 0.00 0.00 0.00 0.00 61.98 62.66 2pi2 s VAL 69 Cb 0.33 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 33.01 2pi2 s VAL 69 CO 0.23 0.23 0.95 -1.61 0.00 0.00 0.00 175.10 174.90 2pi2 s GLU 70 N 1.63 4.66 -0.03 2.72 2.02 -1.26 -0.61 118.70 127.83 2pi2 s GLU 70 Ca 0.13 1.41 0.03 0.00 0.02 0.00 0.00 54.97 56.57 2pi2 s GLU 70 Cb -0.15 -3.39 0.00 0.00 0.10 0.00 0.00 34.13 30.69 2pi2 s GLU 70 CO 0.08 0.18 -0.11 0.96 0.02 0.00 0.00 175.26 176.40 2pi2 s ILE 71 N 0.13 0.95 0.23 -1.63 -4.36 -0.21 -4.95 121.20 111.35 2pi2 s ILE 71 Ca 0.47 -0.45 0.00 0.00 -0.26 0.00 0.00 60.65 60.41 2pi2 s ILE 71 Cb -0.23 -0.83 0.00 0.00 1.25 0.00 0.00 42.46 42.65 2pi2 s ILE 71 CO 0.29 0.29 0.00 -0.24 0.24 0.00 0.00 174.94 175.52 2pi2 n SER 72 N 3.28 0.14 -4.75 4.36 2.88 -1.26 -3.75 113.62 114.52 2pi2 n SER 72 Ca -0.18 0.38 -0.37 0.00 -1.33 0.00 0.00 58.87 57.36 2pi2 n SER 72 Cb 0.54 0.21 -0.07 0.00 -0.75 0.00 0.00 64.21 64.14 2pi2 n SER 72 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2pi2 s GLN 73 N -2.00 4.21 0.08 -1.46 -0.21 -1.26 -1.37 119.66 117.65 2pi2 s GLN 73 Ca 0.00 0.25 -0.05 0.00 0.02 0.00 0.00 55.36 55.58 2pi2 s GLN 73 Cb 0.00 -3.39 -0.02 0.00 1.00 0.00 0.00 33.01 30.60 2pi2 s GLN 73 CO 0.00 0.29 0.09 0.14 -2.12 0.00 0.00 175.29 173.70 2pi2 s VAL 74 N 0.26 0.17 0.05 1.09 -7.23 -0.28 -1.39 120.40 113.07 2pi2 s VAL 74 Ca 0.20 -1.50 0.09 0.00 -1.81 0.00 0.00 61.98 58.97 2pi2 s VAL 74 Cb -0.14 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.29 2pi2 s VAL 74 CO 0.07 -0.77 -0.26 0.42 -0.31 0.00 0.00 175.10 174.25 2pi2 s THR 75 N -3.90 2.08 0.12 5.32 -4.23 -0.75 -1.16 115.64 113.11 2pi2 s THR 75 Ca 0.07 -1.38 0.04 0.00 -1.18 0.00 0.00 61.69 59.24 2pi2 s THR 75 Cb 0.06 -1.78 -0.04 0.00 1.34 0.00 0.00 72.50 72.08 2pi2 s THR 75 CO -0.09 0.33 -0.10 0.27 -0.54 0.00 0.00 174.62 174.49 2pi2 s ILE 76 N -0.81 1.00 -0.09 2.99 -4.36 -0.43 -0.73 121.20 118.78 2pi2 s ILE 76 Ca 0.11 -1.85 0.02 0.00 -0.26 0.00 0.00 60.65 58.66 2pi2 s ILE 76 Cb -0.10 -1.61 0.01 0.00 1.25 0.00 0.00 42.46 42.02 2pi2 s ILE 76 CO 0.02 -0.68 -0.13 -0.69 0.24 0.00 0.00 174.94 173.70 2pi2 s VAL 77 N -2.97 1.30 0.19 8.37 1.01 -1.26 -0.38 120.40 126.66 2pi2 s VAL 77 Ca 0.11 -0.54 -0.12 0.00 0.00 0.00 0.00 61.98 61.44 2pi2 s VAL 77 Cb 0.00 -1.19 0.04 0.00 0.00 0.00 0.00 36.38 35.23 2pi2 s VAL 77 CO -0.00 0.40 0.58 0.61 0.00 0.00 0.00 175.10 176.68 2pi2 n GLY 78 N 4.10 1.12 3.61 4.51 0.00 -0.85 -4.57 105.19 113.12 2pi2 n GLY 78 Ca -0.20 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 2pi2 n GLY 78 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2pi2 s ILE 79 N -2.34 4.20 -0.07 -0.61 2.07 0.63 -1.25 121.20 123.82 2pi2 s ILE 79 Ca 0.12 -0.27 -0.30 0.00 -1.41 0.00 0.00 60.65 58.79 2pi2 s ILE 79 Cb -0.03 -2.80 -0.04 0.00 0.13 0.00 0.00 42.46 39.72 2pi2 s ILE 79 CO 0.06 0.56 1.50 -0.63 -1.91 0.00 0.00 174.94 174.51 2pi2 s ILE 80 N -0.36 3.79 -0.15 2.00 1.01 -0.31 -1.18 121.20 126.00 2pi2 s ILE 80 Ca 0.07 1.01 0.19 0.00 0.00 0.00 0.00 60.65 61.92 2pi2 s ILE 80 Cb -0.12 -3.65 -0.27 0.00 0.01 0.00 0.00 42.46 38.42 2pi2 s ILE 80 CO 0.02 -0.07 0.20 0.54 0.00 0.00 0.00 174.94 175.63 2pi2 n ARG 81 N 6.63 0.68 -3.58 2.79 5.12 0.09 -0.24 116.66 128.15 2pi2 n ARG 81 Ca 0.16 -0.06 -0.16 0.00 -1.93 0.00 0.00 57.85 55.85 2pi2 n ARG 81 Cb 0.43 -1.52 -0.07 0.00 -1.16 0.00 0.00 32.46 30.14 2pi2 n ARG 81 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2pi2 s HIS 82 N -2.79 -0.64 -0.06 -1.55 2.46 -1.22 -4.87 115.29 106.61 2pi2 s HIS 82 Ca -0.09 1.26 0.00 0.00 0.47 0.00 0.00 55.06 56.70 2pi2 s HIS 82 Cb 0.08 0.34 0.02 0.00 -0.13 0.00 0.00 32.58 32.90 2pi2 s HIS 82 CO 0.85 -0.52 -0.04 0.00 -2.47 0.00 0.00 174.74 172.56 2pi2 s ALA 83 N -0.75 0.83 -0.36 1.58 0.00 -1.26 -1.41 121.76 120.39 2pi2 s ALA 83 Ca -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 51.96 51.68 2pi2 s ALA 83 Cb -0.02 -0.60 0.09 0.00 0.00 0.00 0.00 23.12 22.59 2pi2 s ALA 83 CO 0.07 -0.18 0.11 -2.00 0.00 0.00 0.00 175.76 173.76 2pi2 s GLU 84 N 1.30 2.12 -0.18 0.00 2.56 0.55 -4.98 118.70 120.07 2pi2 s GLU 84 Ca -0.05 -1.61 -0.21 0.00 0.00 0.00 0.00 54.97 53.11 2pi2 s GLU 84 Cb -0.14 -3.39 -0.03 0.00 2.00 0.00 0.00 34.13 32.57 2pi2 s GLU 84 CO -0.02 -0.88 0.62 0.21 -0.56 0.00 0.00 175.26 174.63 2pi2 s LYS 85 N 1.16 4.25 0.31 4.30 2.47 -1.26 -1.41 119.74 129.55 2pi2 s LYS 85 Ca 0.03 0.63 0.04 0.00 -1.56 0.00 0.00 55.97 55.12 2pi2 s LYS 85 Cb -0.21 -3.55 -0.06 0.00 -1.46 0.00 0.00 37.83 32.54 2pi2 s LYS 85 CO -0.03 -0.18 0.02 0.00 0.16 0.00 0.00 175.35 175.33 2pi2 s ALA 86 N 1.69 2.32 0.27 3.13 0.00 -0.30 -5.03 121.76 123.83 2pi2 s ALA 86 Ca 0.29 -2.00 0.07 0.00 0.00 0.00 0.00 51.96 50.32 2pi2 s ALA 86 Cb -0.16 0.52 0.35 0.00 0.00 0.00 0.00 23.12 23.83 2pi2 s ALA 86 CO 0.11 -0.25 1.62 -1.00 0.00 0.00 0.00 175.76 176.25 2pi2 h PRO 87 N 2.18 0.18 0.00 0.00 0.13 -1.98 -3.22 132.00 129.29 2pi2 h PRO 87 Ca -0.40 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2pi2 h PRO 87 Cb 1.24 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2pi2 h PRO 87 CO 0.69 0.68 -1.46 -2.37 -0.23 0.00 0.00 178.00 175.31 2pi2 n THR 88 N -3.91 0.26 -3.55 1.56 5.66 -1.26 -4.69 114.28 108.35 2pi2 n THR 88 Ca -0.02 -0.47 -0.12 0.00 -3.05 0.00 0.00 64.05 60.39 2pi2 n THR 88 Cb 0.57 -0.07 -0.04 0.00 -1.55 0.00 0.00 70.33 69.24 2pi2 n THR 88 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2pi2 s ASN 89 N -4.71 -0.41 -0.11 1.09 4.22 -1.22 -0.47 114.94 113.33 2pi2 s ASN 89 Ca -0.03 -0.03 -0.01 0.00 -2.14 0.00 0.00 52.86 50.65 2pi2 s ASN 89 Cb 0.12 0.52 -0.03 0.00 1.28 0.00 0.00 41.25 43.14 2pi2 s ASN 89 CO 0.85 -0.83 -0.06 -0.63 -2.04 0.00 0.00 177.10 174.39 2pi2 s ILE 90 N -3.24 3.72 -0.25 0.54 1.01 0.42 -1.15 121.20 122.24 2pi2 s ILE 90 Ca -0.01 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.16 2pi2 s ILE 90 Cb 0.00 -2.57 0.01 0.00 0.01 0.00 0.00 42.46 39.91 2pi2 s ILE 90 CO -0.08 0.55 -0.01 -0.69 0.00 0.00 0.00 174.94 174.70 2pi2 s VAL 91 N -0.22 3.33 -0.08 2.92 1.01 -0.50 -0.07 120.40 126.79 2pi2 s VAL 91 Ca 0.03 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 2pi2 s VAL 91 Cb -0.13 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 2pi2 s VAL 91 CO 0.03 0.22 0.16 -0.31 0.00 0.00 0.00 175.10 175.19 2pi2 s TYR 92 N 1.42 3.58 -0.37 5.22 2.02 0.39 -0.33 117.35 129.26 2pi2 s TYR 92 Ca 0.02 0.46 -0.20 0.00 -0.37 0.00 0.00 57.07 56.99 2pi2 s TYR 92 Cb -0.16 -1.90 0.01 0.00 -0.40 0.00 0.00 41.96 39.51 2pi2 s TYR 92 CO -0.02 0.70 0.60 0.15 -1.57 0.00 0.00 175.55 175.41 2pi2 s LYS 93 N -1.38 3.55 -0.11 -0.62 -0.14 -0.50 -0.12 119.74 120.43 2pi2 s LYS 93 Ca 0.20 -0.13 0.00 0.00 -1.36 0.00 0.00 55.97 54.68 2pi2 s LYS 93 Cb -0.12 -3.85 -0.02 0.00 -1.68 0.00 0.00 37.83 32.16 2pi2 s LYS 93 CO 0.10 -0.77 -0.11 0.42 -0.76 0.00 0.00 175.35 174.22 2pi2 s ILE 94 N 2.62 3.30 -0.14 2.17 1.01 0.09 -0.73 121.20 129.52 2pi2 s ILE 94 Ca 0.22 -0.59 0.02 0.00 0.00 0.00 0.00 60.65 60.29 2pi2 s ILE 94 Cb -0.15 -2.37 0.01 0.00 0.01 0.00 0.00 42.46 39.96 2pi2 s ILE 94 CO 0.15 0.54 -0.20 -0.62 0.00 0.00 0.00 174.94 174.82 2pi2 s ASP 95 N -0.05 2.96 -0.10 3.58 2.15 -0.32 -0.44 116.67 124.45 2pi2 s ASP 95 Ca -0.02 -0.57 0.14 0.00 0.43 0.00 0.00 52.55 52.53 2pi2 s ASP 95 Cb -0.14 -1.37 0.27 0.00 -0.30 0.00 0.00 42.92 41.39 2pi2 s ASP 95 CO 0.03 0.04 1.18 -0.90 -0.17 0.00 0.00 175.17 175.36 2pi2 n ASP 96 N 4.25 2.63 0.00 -0.34 5.75 -1.26 -0.27 116.55 127.30 2pi2 n ASP 96 Ca -0.20 -2.74 0.00 0.00 -0.01 0.00 0.00 54.79 51.84 2pi2 n ASP 96 Cb 0.51 -0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 2pi2 n ASP 96 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 2pi2 n MET 97 N -0.88 0.00 0.22 0.11 2.81 -1.26 -4.83 117.12 113.29 2pi2 n MET 97 Ca 0.13 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.14 2pi2 n MET 97 Cb 0.59 -1.02 0.23 0.00 -0.71 0.00 0.00 33.22 32.30 2pi2 n MET 97 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 2pi2 h THR 98 N 0.00 0.05 -1.95 2.03 1.35 -1.99 -3.47 112.91 108.93 2pi2 h THR 98 Ca 0.00 -1.00 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 2pi2 h THR 98 Cb 0.00 1.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2pi2 h THR 98 CO 0.00 0.03 0.00 0.00 -0.25 0.00 0.00 175.52 175.30 2pi2 n ALA 99 N -2.11 0.00 -1.20 6.62 0.00 -1.26 -4.58 120.51 117.98 2pi2 n ALA 99 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.14 2pi2 n ALA 99 Cb 0.51 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.07 2pi2 n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pi2 s ALA 100 N -1.02 1.96 0.52 0.00 0.00 -1.26 -4.72 121.76 117.25 2pi2 s ALA 100 Ca 0.00 0.81 -0.22 0.00 0.00 0.00 0.00 51.96 52.56 2pi2 s ALA 100 Cb 0.00 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 2pi2 s ALA 100 CO 0.00 -2.11 1.15 -2.30 0.00 0.00 0.00 175.76 172.51 2pi2 n PRO 101 N -3.11 1.40 -4.02 0.00 -0.02 -1.26 -4.88 135.00 123.11 2pi2 n PRO 101 Ca 0.13 0.52 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 2pi2 n PRO 101 Cb 0.51 -2.32 -0.06 0.00 -0.02 0.00 0.00 33.50 31.61 2pi2 n PRO 101 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2pi2 s MET 102 N -2.58 3.26 0.05 -0.52 1.75 0.42 -4.80 119.30 116.88 2pi2 s MET 102 Ca 0.70 -0.33 -0.31 0.00 -1.25 0.00 0.00 55.69 54.50 2pi2 s MET 102 Cb -0.46 -3.01 -0.07 0.00 2.84 0.00 0.00 34.83 34.14 2pi2 s MET 102 CO 0.51 0.70 1.48 -0.51 -0.65 0.00 0.00 175.02 176.55 2pi2 s ASP 103 N -1.48 6.76 -0.14 1.11 1.01 -1.26 -0.73 116.67 121.93 2pi2 s ASP 103 Ca 0.21 2.30 0.00 0.00 0.71 0.00 0.00 52.55 55.77 2pi2 s ASP 103 Cb -0.12 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.26 2pi2 s ASP 103 CO 0.11 -0.76 -0.13 -0.69 0.21 0.00 0.00 175.17 173.91 2pi2 s VAL 104 N 2.12 1.47 -0.20 -1.27 1.01 0.83 -1.42 120.40 122.94 2pi2 s VAL 104 Ca 0.67 -0.57 -0.07 0.00 0.00 0.00 0.00 61.98 62.01 2pi2 s VAL 104 Cb -0.36 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 2pi2 s VAL 104 CO 0.29 0.44 0.06 -0.60 0.00 0.00 0.00 175.10 175.29 2pi2 s ARG 105 N 1.51 3.85 -0.07 2.72 3.52 -0.10 -0.47 118.95 129.92 2pi2 s ARG 105 Ca 0.04 -0.40 0.05 0.00 -0.13 0.00 0.00 55.73 55.30 2pi2 s ARG 105 Cb -0.13 -3.23 -0.01 0.00 -1.56 0.00 0.00 34.95 30.03 2pi2 s ARG 105 CO -0.10 0.12 -0.23 -1.14 -0.81 0.00 0.00 175.30 173.14 2pi2 s GLN 106 N 0.77 2.58 0.03 5.12 0.74 0.90 -1.09 119.66 128.71 2pi2 s GLN 106 Ca 0.03 -0.85 -0.30 0.00 0.05 0.00 0.00 55.36 54.29 2pi2 s GLN 106 Cb -0.14 -2.11 -0.05 0.00 1.10 0.00 0.00 33.01 31.82 2pi2 s GLN 106 CO 0.02 0.30 1.20 -1.58 -0.55 0.00 0.00 175.29 174.68 2pi2 s TRP 107 N 0.03 3.36 0.45 1.67 0.52 -1.26 -0.44 118.94 123.27 2pi2 s TRP 107 Ca -0.08 1.27 0.03 0.00 0.02 0.00 0.00 56.10 57.34 2pi2 s TRP 107 Cb -0.15 -3.42 0.01 0.00 -1.15 0.00 0.00 33.47 28.76 2pi2 s TRP 107 CO 0.05 -1.28 0.65 0.08 0.02 0.00 0.00 176.95 176.46 2pi2 s VAL 108 N 1.40 3.43 -0.03 4.03 1.01 0.38 -4.90 120.40 125.73 2pi2 s VAL 108 Ca 0.58 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 2pi2 s VAL 108 Cb -0.28 -3.24 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 2pi2 s VAL 108 CO 0.27 -0.14 0.48 0.44 0.00 0.00 0.00 175.10 176.15 2pi2 h ASP 109 N 0.43 -0.25 -1.63 3.32 3.32 -1.83 -3.45 116.42 116.33 2pi2 h ASP 109 Ca -0.44 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2pi2 h ASP 109 Cb 1.27 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2pi2 h ASP 109 CO 0.53 0.02 0.00 0.59 -1.72 0.00 0.00 179.24 178.66 2pi2 n ASN 117 N -3.90 0.00 -4.95 6.45 3.02 -1.26 -4.83 115.26 109.79 2pi2 n ASN 117 Ca -0.04 0.09 -0.22 0.00 -0.03 0.00 0.00 54.58 54.38 2pi2 n ASN 117 Cb 0.12 -1.15 0.05 0.00 -0.61 0.00 0.00 39.78 38.18 2pi2 n ASN 117 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2pi2 s THR 118 N -2.11 2.55 0.11 3.41 -1.32 -1.26 -5.03 115.64 111.98 2pi2 s THR 118 Ca 0.00 -0.56 -0.36 0.00 -1.21 0.00 0.00 61.69 59.56 2pi2 s THR 118 Cb 0.00 -2.99 -0.17 0.00 -1.51 0.00 0.00 72.50 67.84 2pi2 s THR 118 CO 0.00 0.00 1.27 0.55 -2.21 0.00 0.00 174.62 174.23 2pi2 n VAL 119 N -2.51 0.28 -2.21 5.08 3.14 -1.26 -4.92 118.33 115.94 2pi2 n VAL 119 Ca 0.08 -0.07 -0.42 0.00 -2.96 0.00 0.00 64.34 60.97 2pi2 n VAL 119 Cb 0.60 -0.78 -0.03 0.00 -1.06 0.00 0.00 33.84 32.57 2pi2 n VAL 119 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2pi2 s VAL 120 N 0.25 3.63 0.61 1.55 1.01 -1.26 -4.98 120.40 121.21 2pi2 s VAL 120 Ca 0.81 1.06 -0.19 0.00 0.00 0.00 0.00 61.98 63.66 2pi2 s VAL 120 Cb -0.94 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 31.73 2pi2 s VAL 120 CO 0.49 0.01 1.31 -2.84 0.00 0.00 0.00 175.10 174.07 2pi2 s PRO 121 N 2.17 2.80 0.87 2.72 0.02 -1.26 -4.93 135.00 137.38 2pi2 s PRO 121 Ca 0.64 2.10 -0.11 0.00 0.02 0.00 0.00 61.00 63.65 2pi2 s PRO 121 Cb -0.32 -1.99 0.12 0.00 0.02 0.00 0.00 34.50 32.32 2pi2 s PRO 121 CO 0.27 -1.42 1.17 -2.14 -0.33 0.00 0.00 177.00 174.56 2pi2 s PRO 122 N -3.21 1.26 -1.33 5.54 0.02 -1.26 -2.99 135.00 133.03 2pi2 s PRO 122 Ca 0.78 1.64 0.00 0.00 0.02 0.00 0.00 61.00 63.44 2pi2 s PRO 122 Cb -0.38 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.40 2pi2 s PRO 122 CO 0.42 -2.47 0.00 0.39 -0.33 0.00 0.00 177.00 175.01 2pi2 n GLU 123 N -3.86 -1.14 -3.73 5.54 -0.58 0.66 -4.97 120.64 112.56 2pi2 n GLU 123 Ca 0.13 0.91 -0.35 0.00 -0.42 0.00 0.00 57.16 57.43 2pi2 n GLU 123 Cb 0.51 -5.05 -0.08 0.00 -0.57 0.00 0.00 31.44 26.25 2pi2 n GLU 123 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2pi2 s THR 124 N -2.33 5.41 0.07 2.62 2.01 -1.16 -4.87 115.64 117.39 2pi2 s THR 124 Ca 0.00 0.23 -0.30 0.00 0.31 0.00 0.00 61.69 61.93 2pi2 s THR 124 Cb 0.00 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.98 2pi2 s THR 124 CO 0.00 0.46 1.15 -0.31 -0.69 0.00 0.00 174.62 175.23 2pi2 s TYR 125 N 0.15 3.49 0.10 4.92 1.51 -1.26 -1.16 117.35 125.10 2pi2 s TYR 125 Ca 0.10 1.41 0.06 0.00 -1.01 0.00 0.00 57.07 57.63 2pi2 s TYR 125 Cb -0.11 -3.35 -0.03 0.00 -0.11 0.00 0.00 41.96 38.35 2pi2 s TYR 125 CO -0.00 -0.98 -0.16 0.14 -1.11 0.00 0.00 175.55 173.44 2pi2 s VAL 126 N 0.89 1.36 -0.19 0.71 -7.23 -0.38 -0.71 120.40 114.85 2pi2 s VAL 126 Ca 0.56 -1.55 -0.11 0.00 -1.81 0.00 0.00 61.98 59.07 2pi2 s VAL 126 Cb -0.28 -1.40 -0.05 0.00 0.56 0.00 0.00 36.38 35.21 2pi2 s VAL 126 CO 0.30 -0.28 0.18 -0.75 -0.31 0.00 0.00 175.10 174.24 2pi2 s LYS 127 N -2.21 4.21 -0.10 4.82 2.20 -0.05 -2.01 119.74 126.60 2pi2 s LYS 127 Ca 0.05 -0.13 0.01 0.00 -0.36 0.00 0.00 55.97 55.54 2pi2 s LYS 127 Cb -0.08 -3.42 -0.02 0.00 -1.51 0.00 0.00 37.83 32.80 2pi2 s LYS 127 CO 0.03 0.28 -0.12 0.08 -0.36 0.00 0.00 175.35 175.26 2pi2 s VAL 128 N 0.40 3.18 -0.09 4.02 1.01 0.49 -1.19 120.40 128.23 2pi2 s VAL 128 Ca 0.10 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.47 2pi2 s VAL 128 Cb -0.12 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 2pi2 s VAL 128 CO -0.00 0.55 -0.17 0.00 0.00 0.00 0.00 175.10 175.48 2pi2 s ALA 129 N -0.13 2.50 0.27 5.51 0.00 -0.01 -1.31 121.76 128.59 2pi2 s ALA 129 Ca -0.01 -0.95 -0.20 0.00 0.00 0.00 0.00 51.96 50.80 2pi2 s ALA 129 Cb -0.13 -1.00 0.07 0.00 0.00 0.00 0.00 23.12 22.05 2pi2 s ALA 129 CO 0.03 0.38 0.92 0.20 0.00 0.00 0.00 175.76 177.29 2pi2 s GLY 130 N -0.07 0.19 -0.21 0.00 0.00 -0.31 -1.09 107.32 105.84 2pi2 s GLY 130 Ca -0.04 -0.48 -0.09 0.00 0.00 0.00 0.00 44.72 44.11 2pi2 s GLY 130 CO 0.04 1.08 0.12 0.30 0.00 0.00 0.00 173.10 174.64 2pi2 s HIS 131 N -2.35 3.34 -0.02 1.90 3.76 0.10 -1.13 115.29 120.88 2pi2 s HIS 131 Ca 0.18 0.22 -0.30 0.00 -0.15 0.00 0.00 55.06 55.02 2pi2 s HIS 131 Cb -0.04 -2.17 -0.04 0.00 1.11 0.00 0.00 32.58 31.44 2pi2 s HIS 131 CO 0.08 0.19 1.22 -1.17 -0.85 0.00 0.00 174.74 174.21 2pi2 s LEU 132 N 0.56 4.30 0.17 0.89 2.96 -0.47 -0.96 118.68 126.14 2pi2 s LEU 132 Ca 0.07 1.89 0.09 0.00 -0.22 0.00 0.00 54.13 55.96 2pi2 s LEU 132 Cb -0.12 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 2pi2 s LEU 132 CO 0.00 -0.57 -0.19 -0.13 -1.32 0.00 0.00 176.35 174.14 2pi2 s ARG 133 N 1.99 1.33 -0.33 1.98 1.81 0.13 -4.98 118.95 120.89 2pi2 s ARG 133 Ca 0.57 -1.45 -0.02 0.00 -1.72 0.00 0.00 55.73 53.12 2pi2 s ARG 133 Cb -0.26 -1.43 0.11 0.00 -0.45 0.00 0.00 34.95 32.92 2pi2 s ARG 133 CO 0.24 0.29 0.15 0.45 -0.68 0.00 0.00 175.30 175.75 2pi2 s SER 134 N -2.71 3.56 -0.34 0.23 0.15 -1.26 -1.05 113.70 112.27 2pi2 s SER 134 Ca 0.17 -1.73 -0.14 0.00 0.70 0.00 0.00 55.95 54.95 2pi2 s SER 134 Cb -0.06 -0.58 -0.01 0.00 -1.71 0.00 0.00 66.02 63.66 2pi2 s SER 134 CO 0.07 -0.39 0.31 -0.36 1.20 0.00 0.00 173.24 174.08 2pi2 s PHE 135 N 1.54 3.22 -0.92 3.44 0.08 -1.03 -4.29 117.98 120.02 2pi2 s PHE 135 Ca 0.12 -0.11 -0.02 0.00 0.12 0.00 0.00 56.93 57.05 2pi2 s PHE 135 Cb -0.19 -2.59 0.00 0.00 -0.57 0.00 0.00 43.02 39.68 2pi2 s PHE 135 CO -0.21 -0.40 0.78 1.04 -0.10 0.00 0.00 175.22 176.33 2pi2 n GLN 136 N 5.26 -5.18 -1.37 0.44 6.02 -1.26 -2.93 117.38 118.37 2pi2 n GLN 136 Ca -0.11 0.62 -0.13 0.00 -0.01 0.00 0.00 57.00 57.37 2pi2 n GLN 136 Cb 0.49 -5.00 -0.06 0.00 1.02 0.00 0.00 30.24 26.70 2pi2 n GLN 136 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2pi2 n ASN 137 N -2.37 -3.91 -4.25 1.08 5.15 -1.26 -4.96 115.26 104.73 2pi2 n ASN 137 Ca -0.15 0.33 -0.35 0.00 -0.60 0.00 0.00 54.58 53.81 2pi2 n ASN 137 Cb 0.60 -3.49 -0.14 0.00 -0.53 0.00 0.00 39.78 36.22 2pi2 n ASN 137 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2pi2 s LYS 138 N -3.09 3.05 0.34 1.20 2.20 -1.15 -5.08 119.74 117.22 2pi2 s LYS 138 Ca 0.00 -0.84 -0.28 0.00 -0.36 0.00 0.00 55.97 54.49 2pi2 s LYS 138 Cb 0.00 -3.03 -0.10 0.00 -1.51 0.00 0.00 37.83 33.20 2pi2 s LYS 138 CO 0.00 -0.33 1.25 0.15 -0.36 0.00 0.00 175.35 176.05 2pi2 s LYS 139 N 1.40 4.30 0.19 4.03 -0.14 -1.26 -2.46 119.74 125.80 2pi2 s LYS 139 Ca 0.03 2.07 -0.19 0.00 -1.36 0.00 0.00 55.97 56.52 2pi2 s LYS 139 Cb -0.16 -2.98 0.03 0.00 -1.68 0.00 0.00 37.83 33.05 2pi2 s LYS 139 CO -0.04 -0.18 0.55 -1.54 -0.76 0.00 0.00 175.35 173.38 2pi2 s SER 140 N -0.70 -0.31 -0.02 2.83 1.04 -0.22 -4.55 113.70 111.77 2pi2 s SER 140 Ca 0.51 -0.40 0.03 0.00 0.48 0.00 0.00 55.95 56.56 2pi2 s SER 140 Cb -0.37 0.59 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 2pi2 s SER 140 CO 0.48 -1.05 -0.08 -0.76 0.98 0.00 0.00 173.24 172.81 2pi2 s LEU 141 N -2.85 3.12 -0.35 2.42 1.43 -0.51 -0.69 118.68 121.25 2pi2 s LEU 141 Ca 0.08 -0.12 -0.07 0.00 -1.03 0.00 0.00 54.13 52.98 2pi2 s LEU 141 Cb -0.01 -1.75 0.04 0.00 0.03 0.00 0.00 46.19 44.50 2pi2 s LEU 141 CO -0.04 0.31 0.13 -0.69 0.23 0.00 0.00 176.35 176.29 2pi2 s VAL 142 N -0.92 3.89 -0.06 -1.59 1.01 -0.14 -0.92 120.40 121.68 2pi2 s VAL 142 Ca 0.15 -1.15 -0.28 0.00 0.00 0.00 0.00 61.98 60.71 2pi2 s VAL 142 Cb -0.11 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2pi2 s VAL 142 CO 0.05 -0.22 0.89 0.00 0.00 0.00 0.00 175.10 175.82 2pi2 s ALA 143 N 1.41 3.30 -0.64 5.51 0.00 -0.25 -0.72 121.76 130.37 2pi2 s ALA 143 Ca -0.01 0.34 0.22 0.00 0.00 0.00 0.00 51.96 52.51 2pi2 s ALA 143 Cb -0.20 -3.24 -0.15 0.00 0.00 0.00 0.00 23.12 19.53 2pi2 s ALA 143 CO 0.03 -0.32 0.85 1.97 0.00 0.00 0.00 175.76 178.29 2pi2 n PHE 144 N 4.24 0.08 -3.76 0.00 -1.74 -0.25 -4.61 117.46 111.43 2pi2 n PHE 144 Ca 0.04 0.02 -0.14 0.00 -0.56 0.00 0.00 57.45 56.82 2pi2 n PHE 144 Cb 0.50 -0.26 -0.15 0.00 1.52 0.00 0.00 39.48 41.09 2pi2 n PHE 144 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 2pi2 s LYS 145 N -3.19 0.04 -0.18 3.97 1.02 -0.91 -4.99 119.74 115.50 2pi2 s LYS 145 Ca 0.03 0.30 -0.01 0.00 0.02 0.00 0.00 55.97 56.31 2pi2 s LYS 145 Cb 0.15 -0.21 0.05 0.00 -0.52 0.00 0.00 37.83 37.30 2pi2 s LYS 145 CO 0.85 -0.17 -0.02 0.42 -0.92 0.00 0.00 175.35 175.51 2pi2 s ILE 146 N 1.15 0.97 -0.20 2.17 1.01 -1.26 -0.83 121.20 124.21 2pi2 s ILE 146 Ca -0.09 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 59.89 2pi2 s ILE 146 Cb -0.12 -1.26 0.04 0.00 0.01 0.00 0.00 42.46 41.13 2pi2 s ILE 146 CO -0.05 -0.01 -0.11 -0.32 0.00 0.00 0.00 174.94 174.46 2pi2 s MET 147 N 1.67 2.06 0.38 2.79 1.75 -0.33 -4.99 119.30 122.64 2pi2 s MET 147 Ca -0.01 -0.84 -0.26 0.00 -1.25 0.00 0.00 55.69 53.32 2pi2 s MET 147 Cb -0.16 -2.42 -0.11 0.00 2.84 0.00 0.00 34.83 34.98 2pi2 s MET 147 CO -0.07 -0.42 1.24 -2.30 -0.65 0.00 0.00 175.02 172.81 2pi2 n PRO 148 N 4.68 1.92 -2.96 4.11 -0.02 -1.26 -0.87 135.00 140.59 2pi2 n PRO 148 Ca -0.15 0.68 -0.41 0.00 -2.02 0.00 0.00 63.50 61.60 2pi2 n PRO 148 Cb 0.47 -2.30 -0.05 0.00 -0.02 0.00 0.00 33.50 31.60 2pi2 n PRO 148 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2pi2 s LEU 149 N -1.19 4.19 -0.15 2.45 1.02 0.11 -4.84 118.68 120.26 2pi2 s LEU 149 Ca 0.59 1.11 0.15 0.00 0.02 0.00 0.00 54.13 55.99 2pi2 s LEU 149 Cb -0.55 -3.14 -0.24 0.00 0.02 0.00 0.00 46.19 42.29 2pi2 s LEU 149 CO 0.60 -0.32 0.24 -0.62 0.02 0.00 0.00 176.35 176.27 2pi2 n GLU 150 N 4.94 0.67 -3.80 1.70 4.71 -1.26 -4.82 120.64 122.79 2pi2 n GLU 150 Ca 0.02 0.10 -0.37 0.00 -0.01 0.00 0.00 57.16 56.90 2pi2 n GLU 150 Cb 0.49 -1.61 -0.13 0.00 -1.01 0.00 0.00 31.44 29.19 2pi2 n GLU 150 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2pi2 s ASP 151 N -5.77 5.16 0.00 1.62 -1.08 -1.26 -4.98 116.67 110.35 2pi2 s ASP 151 Ca -0.10 -1.11 0.17 0.00 -0.52 0.00 0.00 52.55 50.99 2pi2 s ASP 151 Cb 0.07 -1.83 0.76 0.00 -1.46 0.00 0.00 42.92 40.47 2pi2 s ASP 151 CO 0.81 -0.29 1.53 0.23 0.52 0.00 0.00 175.17 177.97 2pi2 n MET 152 N 4.77 0.08 0.29 4.34 2.81 -1.26 -1.66 117.12 126.48 2pi2 n MET 152 Ca -0.13 0.18 0.17 0.00 -1.81 0.00 0.00 57.70 56.11 2pi2 n MET 152 Cb 0.45 -1.50 0.88 0.00 -0.71 0.00 0.00 33.22 32.34 2pi2 n MET 152 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2pi2 h ASN 153 N 0.00 0.00 0.43 7.83 2.35 -2.00 -1.98 115.58 122.21 2pi2 h ASN 153 Ca 0.00 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 2pi2 h ASN 153 Cb 0.25 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 2pi2 h ASN 153 CO 0.00 0.05 -0.37 -0.33 -1.65 0.00 0.00 177.43 175.13 2pi2 h GLU 154 N 0.00 0.00 -0.11 0.81 5.08 -1.75 -0.85 114.58 117.76 2pi2 h GLU 154 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2pi2 h GLU 154 Cb 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 2pi2 h GLU 154 CO 0.01 0.37 -0.10 0.35 -1.00 0.00 0.00 179.01 178.64 2pi2 h PHE 155 N 0.00 0.31 -0.73 4.33 3.57 -1.53 -2.07 116.94 120.82 2pi2 h PHE 155 Ca -0.00 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.43 2pi2 h PHE 155 Cb 0.68 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.32 2pi2 h PHE 155 CO 0.00 0.66 0.47 1.15 -2.23 0.00 0.00 178.31 178.36 2pi2 h THR 156 N -0.13 1.14 -0.79 4.41 2.02 -1.42 -2.78 112.91 115.36 2pi2 h THR 156 Ca 0.02 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 2pi2 h THR 156 Cb 0.60 0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2pi2 h THR 156 CO 0.02 0.17 0.38 0.74 0.37 0.00 0.00 175.52 177.21 2pi2 h THR 157 N 0.93 1.24 -0.88 3.16 2.02 -1.18 -2.59 112.91 115.62 2pi2 h THR 157 Ca 0.28 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 2pi2 h THR 157 Cb -0.04 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 66.56 2pi2 h THR 157 CO -0.09 0.29 0.52 -0.74 0.37 0.00 0.00 175.52 175.88 2pi2 h HIS 158 N 1.12 1.17 -0.09 3.16 6.17 -1.10 0.13 115.15 125.71 2pi2 h HIS 158 Ca 0.27 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.36 2pi2 h HIS 158 Cb 0.10 -0.38 -0.01 0.00 2.52 0.00 0.00 27.41 29.64 2pi2 h HIS 158 CO 0.01 0.79 -0.01 0.82 0.71 0.00 0.00 177.93 180.25 2pi2 h ILE 159 N 1.22 0.93 -0.69 6.26 2.04 -1.29 0.14 117.51 126.11 2pi2 h ILE 159 Ca 0.31 -0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.20 2pi2 h ILE 159 Cb -0.03 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 2pi2 h ILE 159 CO -0.06 0.00 0.44 -0.07 0.00 0.00 0.00 178.15 178.46 2pi2 h LEU 160 N 0.01 0.73 -0.68 1.44 3.38 -1.09 -2.72 115.31 116.38 2pi2 h LEU 160 Ca 0.04 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2pi2 h LEU 160 Cb 0.05 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2pi2 h LEU 160 CO -0.08 0.51 0.14 -0.33 0.09 0.00 0.00 178.44 178.77 2pi2 h GLU 161 N 0.86 1.11 -0.07 1.13 5.08 -0.22 -1.28 114.58 121.19 2pi2 h GLU 161 Ca 0.27 -0.28 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2pi2 h GLU 161 Cb -0.00 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 2pi2 h GLU 161 CO -0.10 1.00 -0.12 0.28 -1.00 0.00 0.00 179.01 179.07 2pi2 h VAL 162 N 1.04 0.68 -0.36 3.13 2.07 -0.57 0.15 116.25 122.38 2pi2 h VAL 162 Ca 0.21 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.61 2pi2 h VAL 162 Cb 0.41 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2pi2 h VAL 162 CO 0.01 0.00 -0.26 0.40 0.02 0.00 0.00 177.57 177.74 2pi2 h ILE 163 N -0.17 1.28 -0.25 4.57 2.04 -1.36 -1.49 117.51 122.13 2pi2 h ILE 163 Ca 0.07 -1.42 -0.17 0.00 1.00 0.00 0.00 64.86 64.34 2pi2 h ILE 163 Cb 0.26 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 2pi2 h ILE 163 CO -0.17 0.47 -0.49 -1.13 0.00 0.00 0.00 178.15 176.82 2pi2 h ASN 164 N 0.60 0.87 -0.31 1.72 -1.24 -1.13 -1.68 115.58 114.41 2pi2 h ASN 164 Ca 0.07 -0.54 0.00 0.00 0.71 0.00 0.00 56.30 56.54 2pi2 h ASN 164 Cb 0.83 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.62 2pi2 h ASN 164 CO 0.07 1.25 0.19 0.00 -1.29 0.00 0.00 177.43 177.65 2pi2 h ALA 165 N 0.64 0.39 -0.37 1.57 0.00 -0.69 -1.20 119.26 119.61 2pi2 h ALA 165 Ca 0.01 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2pi2 h ALA 165 Cb 1.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2pi2 h ALA 165 CO 0.11 -0.12 -0.24 0.45 0.00 0.00 0.00 179.25 179.45 2pi2 h HIS 166 N 0.40 0.85 0.04 0.00 3.86 -1.27 0.49 115.15 119.53 2pi2 h HIS 166 Ca 0.11 -0.20 -0.00 0.00 -1.16 0.00 0.00 60.37 59.12 2pi2 h HIS 166 Cb -0.01 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.26 2pi2 h HIS 166 CO -0.05 0.91 -0.02 1.98 0.86 0.00 0.00 177.93 181.62 2pi2 h MET 167 N 0.65 -0.05 -0.10 2.45 -1.53 -1.21 -1.66 114.93 113.47 2pi2 h MET 167 Ca 0.09 0.00 -0.21 0.00 -3.44 0.00 0.00 59.70 56.14 2pi2 h MET 167 Cb 0.75 0.01 0.01 0.00 -0.55 0.00 0.00 31.60 31.82 2pi2 h MET 167 CO 0.06 0.04 -0.77 0.28 0.14 0.00 0.00 176.91 176.66 2pi2 h VAL 168 N -0.13 1.30 -0.56 -5.77 2.07 -1.14 -2.68 116.25 109.34 2pi2 h VAL 168 Ca -0.01 -2.01 -0.05 0.00 0.82 0.00 0.00 66.70 65.46 2pi2 h VAL 168 Cb 0.11 2.14 -0.03 0.00 -1.52 0.00 0.00 31.29 32.00 2pi2 h VAL 168 CO 0.01 0.62 0.15 -0.07 0.02 0.00 0.00 177.57 178.31 2pi2 h LEU 169 N 0.39 0.80 -0.38 2.57 3.38 -0.96 -1.51 115.31 119.60 2pi2 h LEU 169 Ca -0.07 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 2pi2 h LEU 169 Cb 1.42 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2pi2 h LEU 169 CO 0.16 0.77 0.05 0.77 0.09 0.00 0.00 178.44 180.28 2pi2 h SER 170 N 0.83 0.61 -0.98 -0.43 4.64 -1.30 -1.97 113.55 114.96 2pi2 h SER 170 Ca 0.18 -0.27 0.02 0.00 -0.47 0.00 0.00 61.79 61.26 2pi2 h SER 170 Cb 0.28 -0.16 -0.05 0.00 -0.31 0.00 0.00 62.40 62.15 2pi2 h SER 170 CO -0.00 0.73 0.65 0.11 -0.87 0.00 0.00 176.83 177.44 2pi2 h LYS 171 N 0.48 1.26 -0.47 4.77 1.57 -1.34 -2.08 116.57 120.76 2pi2 h LYS 171 Ca 0.11 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 2pi2 h LYS 171 Cb 0.38 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2pi2 h LYS 171 CO 0.01 0.83 -0.04 0.00 -0.57 0.00 0.00 179.45 179.68 2pi2 h ALA 172 N 1.40 1.03 -0.00 3.86 0.00 -1.10 -2.89 119.26 121.56 2pi2 h ALA 172 Ca 0.37 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2pi2 h ALA 172 Cb -0.10 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.50 2pi2 h ALA 172 CO -0.09 0.59 -0.03 0.09 0.00 0.00 0.00 179.25 179.81 2pi2 n ASN 173 N -4.19 0.13 -3.77 0.00 3.02 -0.75 -4.70 115.26 105.00 2pi2 n ASN 173 Ca 0.02 -0.38 -0.29 0.00 -0.03 0.00 0.00 54.58 53.90 2pi2 n ASN 173 Cb 0.33 -0.19 -0.16 0.00 -0.61 0.00 0.00 39.78 39.16 2pi2 n ASN 173 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2pi2 s SER 174 N -2.47 3.52 0.65 6.41 1.04 -0.81 -4.02 113.70 118.02 2pi2 s SER 174 Ca 0.31 -1.20 0.00 0.00 0.48 0.00 0.00 55.95 55.54 2pi2 s SER 174 Cb 0.20 -0.81 0.00 0.00 0.10 0.00 0.00 66.02 65.51 2pi2 s SER 174 CO 0.45 -0.33 0.00 0.00 0.98 0.00 0.00 173.24 174.34 2pi2 n GLN 175 N 4.90 0.00 0.00 4.02 1.13 -1.26 -4.79 117.38 121.38 2pi2 n GLN 175 Ca -0.07 0.00 0.15 0.00 -1.94 0.00 0.00 57.00 55.15 2pi2 n GLN 175 Cb 0.45 0.00 0.84 0.00 0.11 0.00 0.00 30.24 31.63 2pi2 n GLN 175 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27