#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nm4 n PRO 2 N 0.00 -0.78 0.00 -0.41 -0.04 -1.26 -4.64 135.00 127.86 1nm4 n PRO 2 Ca 0.00 -0.38 0.00 0.00 -0.04 0.00 0.00 63.50 63.08 1nm4 n PRO 2 Cb 0.00 -0.30 0.00 0.00 -0.04 0.00 0.00 33.50 33.16 1nm4 n PRO 2 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1nm4 n LYS 3 N -1.83 0.00 -1.68 0.54 4.01 -1.26 -4.68 118.16 113.26 1nm4 n LYS 3 Ca 0.03 0.00 -0.50 0.00 -0.51 0.00 0.00 58.31 57.33 1nm4 n LYS 3 Cb 0.12 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.58 1nm4 n LYS 3 CO 0.00 0.00 0.00 -0.11 -1.11 0.00 0.00 177.40 176.18 1nm4 n LEU 4 N 0.00 3.05 -0.05 -0.35 0.00 -1.26 -0.55 117.00 117.84 1nm4 n LEU 4 Ca 0.00 1.02 -0.09 0.00 0.00 0.00 0.00 56.01 56.95 1nm4 n LEU 4 Cb 0.00 -1.32 -0.04 0.00 0.00 0.00 0.00 43.42 42.05 1nm4 n LEU 4 CO 0.00 -0.24 -0.84 0.52 0.00 0.00 0.00 177.39 176.83 1nm4 n VAL 5 N 4.56 0.58 -4.10 1.96 0.31 -0.19 -4.70 118.33 116.76 1nm4 n VAL 5 Ca 0.22 -0.20 -0.12 0.00 -0.01 0.00 0.00 64.34 64.24 1nm4 n VAL 5 Cb 0.25 -1.12 -0.11 0.00 -0.91 0.00 0.00 33.84 31.95 1nm4 n VAL 5 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1nm4 s SER 6 N -5.32 0.92 0.07 4.52 0.01 -0.74 -5.05 113.70 108.11 1nm4 s SER 6 Ca -0.14 -0.72 -0.19 0.00 1.31 0.00 0.00 55.95 56.22 1nm4 s SER 6 Cb 0.04 0.06 0.04 0.00 0.21 0.00 0.00 66.02 66.38 1nm4 s SER 6 CO 0.22 -0.31 0.44 -0.94 0.41 0.00 0.00 173.24 173.06 1nm4 s SER 7 N -2.11 -0.31 -0.61 2.44 1.04 -1.26 -0.12 113.70 112.77 1nm4 s SER 7 Ca -0.02 -0.06 0.05 0.00 0.48 0.00 0.00 55.95 56.40 1nm4 s SER 7 Cb -0.04 0.46 0.17 0.00 0.10 0.00 0.00 66.02 66.71 1nm4 s SER 7 CO -0.02 -0.74 0.44 -0.89 0.98 0.00 0.00 173.24 173.01 1nm4 s THR 8 N -2.90 2.07 0.00 2.02 2.01 0.47 -4.98 115.64 114.33 1nm4 s THR 8 Ca -0.03 -3.75 0.00 0.00 0.31 0.00 0.00 61.69 58.23 1nm4 s THR 8 Cb 0.00 -2.37 0.00 0.00 0.01 0.00 0.00 72.50 70.14 1nm4 s THR 8 CO -0.05 -1.08 0.00 -0.81 -0.69 0.00 0.00 174.62 171.99 1nm4 n PRO 9 N 2.26 0.00 0.00 4.92 -0.04 -1.25 -0.67 135.00 140.22 1nm4 n PRO 9 Ca 0.23 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1nm4 n PRO 9 Cb 0.39 -0.34 0.00 0.00 -0.04 0.00 0.00 33.50 33.51 1nm4 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nm4 n ALA 10 N -1.03 0.00 -1.53 0.55 0.00 -1.26 -4.42 120.51 112.81 1nm4 n ALA 10 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1nm4 n ALA 10 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1nm4 n ALA 10 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nm4 n GLU 11 N 0.00 0.46 -2.33 0.00 1.02 -1.26 -0.84 120.64 117.70 1nm4 n GLU 11 Ca 0.00 -0.15 -0.16 0.00 -0.02 0.00 0.00 57.16 56.82 1nm4 n GLU 11 Cb 0.00 -2.50 -0.01 0.00 -0.02 0.00 0.00 31.44 28.91 1nm4 n GLU 11 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nm4 n GLY 12 N 6.23 -0.29 3.76 0.62 0.00 0.11 -4.95 105.19 110.67 1nm4 n GLY 12 Ca 0.53 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.14 1nm4 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nm4 s SER 13 N -2.07 6.43 0.21 1.61 0.01 -0.02 -4.81 113.70 115.06 1nm4 s SER 13 Ca 0.00 2.93 0.09 0.00 1.31 0.00 0.00 55.95 60.29 1nm4 s SER 13 Cb 0.00 -2.65 -0.05 0.00 0.21 0.00 0.00 66.02 63.53 1nm4 s SER 13 CO 0.00 -0.83 -0.17 -1.61 0.41 0.00 0.00 173.24 171.03 1nm4 s GLU 14 N -1.31 1.41 0.00 12.44 2.02 -1.26 -0.49 118.70 131.51 1nm4 s GLU 14 Ca 0.57 -1.57 0.00 0.00 0.02 0.00 0.00 54.97 53.98 1nm4 s GLU 14 Cb -0.46 -1.38 0.00 0.00 0.10 0.00 0.00 34.13 32.39 1nm4 s GLU 14 CO 0.55 0.26 0.00 0.41 0.02 0.00 0.00 175.26 176.49 1nm4 n GLY 15 N -0.20 0.83 3.75 -1.39 0.00 -1.25 -4.98 105.19 101.95 1nm4 n GLY 15 Ca -0.09 -1.41 -0.38 0.00 0.00 0.00 0.00 46.02 44.14 1nm4 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nm4 s ALA 16 N -2.00 2.85 0.47 4.61 0.00 -1.26 -0.14 121.76 126.30 1nm4 s ALA 16 Ca 0.00 1.32 -0.24 0.00 0.00 0.00 0.00 51.96 53.04 1nm4 s ALA 16 Cb 0.00 -3.56 -0.08 0.00 0.00 0.00 0.00 23.12 19.48 1nm4 s ALA 16 CO 0.00 -1.32 1.24 0.00 0.00 0.00 0.00 175.76 175.68 1nm4 n ALA 17 N -0.95 1.17 -1.79 0.00 0.00 -1.26 -4.85 120.51 112.84 1nm4 n ALA 17 Ca 0.10 0.20 -0.41 0.00 0.00 0.00 0.00 53.44 53.33 1nm4 n ALA 17 Cb 0.45 -2.26 -0.02 0.00 0.00 0.00 0.00 19.45 17.62 1nm4 n ALA 17 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1nm4 s PRO 18 N -2.42 4.29 0.05 0.00 0.04 -1.26 -4.94 135.00 130.76 1nm4 s PRO 18 Ca 0.65 2.30 -0.25 0.00 0.04 0.00 0.00 61.00 63.75 1nm4 s PRO 18 Cb -0.48 -3.06 -0.17 0.00 0.04 0.00 0.00 34.50 30.84 1nm4 s PRO 18 CO 0.55 -0.30 1.55 0.00 0.04 0.00 0.00 177.00 178.84 1nm4 h ALA 19 N 3.59 -0.12 -2.98 8.56 0.00 -1.92 -3.47 119.26 122.92 1nm4 h ALA 19 Ca -0.49 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 1nm4 h ALA 19 Cb 1.23 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.03 1nm4 h ALA 19 CO 0.67 -0.49 0.18 -1.59 0.00 0.00 0.00 179.25 178.03 1nm4 s LYS 20 N -5.51 1.95 -0.23 0.00 -2.85 -1.26 -4.77 119.74 107.07 1nm4 s LYS 20 Ca -0.14 -1.25 0.02 0.00 -1.00 0.00 0.00 55.97 53.60 1nm4 s LYS 20 Cb 0.04 0.59 0.04 0.00 -2.06 0.00 0.00 37.83 36.45 1nm4 s LYS 20 CO 0.65 -0.89 -0.15 0.42 0.10 0.00 0.00 175.35 175.48 1nm4 s ILE 21 N -3.24 2.13 -0.12 3.79 1.01 0.28 -4.70 121.20 120.35 1nm4 s ILE 21 Ca 0.15 -1.33 -0.02 0.00 0.00 0.00 0.00 60.65 59.45 1nm4 s ILE 21 Cb -0.05 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 1nm4 s ILE 21 CO 0.10 0.22 -0.04 -1.61 0.00 0.00 0.00 174.94 173.61 1nm4 s GLU 22 N 1.18 3.32 -0.09 2.79 2.02 0.15 -0.31 118.70 127.77 1nm4 s GLU 22 Ca -0.03 -0.51 0.00 0.00 0.02 0.00 0.00 54.97 54.45 1nm4 s GLU 22 Cb -0.17 -2.81 0.02 0.00 0.10 0.00 0.00 34.13 31.28 1nm4 s GLU 22 CO -0.08 0.42 -0.07 -0.51 0.02 0.00 0.00 175.26 175.04 1nm4 s LEU 23 N -0.14 1.23 -0.11 1.80 1.43 -0.02 -0.40 118.68 122.47 1nm4 s LEU 23 Ca 0.03 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 1nm4 s LEU 23 Cb -0.13 -0.75 0.02 0.00 0.03 0.00 0.00 46.19 45.36 1nm4 s LEU 23 CO 0.02 -0.09 -0.12 -1.00 0.23 0.00 0.00 176.35 175.39 1nm4 s HIS 24 N 1.43 1.78 -0.05 0.29 3.76 0.83 -1.34 115.29 121.99 1nm4 s HIS 24 Ca -0.01 -0.85 0.05 0.00 -0.15 0.00 0.00 55.06 54.10 1nm4 s HIS 24 Cb -0.13 -1.33 -0.02 0.00 1.11 0.00 0.00 32.58 32.20 1nm4 s HIS 24 CO -0.04 -0.48 -0.20 -0.06 -0.85 0.00 0.00 174.74 173.10 1nm4 s PHE 25 N 1.20 2.53 0.17 1.40 0.40 -1.23 -1.02 117.98 121.44 1nm4 s PHE 25 Ca -0.03 -0.39 -0.14 0.00 -0.60 0.00 0.00 56.93 55.76 1nm4 s PHE 25 Cb -0.14 -1.60 0.10 0.00 0.51 0.00 0.00 43.02 41.89 1nm4 s PHE 25 CO -0.04 0.01 1.79 0.77 0.70 0.00 0.00 175.22 178.44 1nm4 h SER 26 N 5.63 0.34 -3.67 1.36 0.02 -1.09 -3.43 113.55 112.71 1nm4 h SER 26 Ca -0.41 0.02 -0.50 0.00 -0.84 0.00 0.00 61.79 60.06 1nm4 h SER 26 Cb 1.15 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.63 1nm4 h SER 26 CO 0.49 0.24 0.38 -0.70 -1.14 0.00 0.00 176.83 176.10 1nm4 s GLU 27 N -6.14 4.76 -1.25 3.45 2.56 -1.26 -4.91 118.70 115.91 1nm4 s GLU 27 Ca -0.13 1.53 -0.19 0.00 0.00 0.00 0.00 54.97 56.18 1nm4 s GLU 27 Cb 0.13 -3.30 0.07 0.00 2.00 0.00 0.00 34.13 33.02 1nm4 s GLU 27 CO 0.73 0.34 1.68 1.21 -0.56 0.00 0.00 175.26 178.66 1nm4 s ASN 28 N -0.64 6.80 0.00 -1.70 3.04 -1.26 -4.85 114.94 116.33 1nm4 s ASN 28 Ca 0.44 -2.32 0.00 0.00 0.04 0.00 0.00 52.86 51.02 1nm4 s ASN 28 Cb -0.26 -2.57 0.00 0.00 -1.54 0.00 0.00 41.25 36.88 1nm4 s ASN 28 CO 0.32 -1.20 0.00 0.00 -3.04 0.00 0.00 177.10 173.18 1nm4 n LEU 29 N 8.35 0.00 -1.33 3.21 -0.00 -1.26 -4.90 117.00 121.06 1nm4 n LEU 29 Ca 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.47 1nm4 n LEU 29 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.89 1nm4 n LEU 29 CO 0.75 0.00 0.00 0.52 -0.00 0.00 0.00 177.39 178.66 1nm4 n VAL 30 N 0.00 -0.85 -0.78 1.47 0.31 0.93 -4.55 118.33 114.85 1nm4 n VAL 30 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 1nm4 n VAL 30 Cb 0.00 -2.69 -0.04 0.00 -0.91 0.00 0.00 33.84 30.20 1nm4 n VAL 30 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1nm4 n THR 31 N -1.33 2.51 -2.19 2.52 5.66 -1.12 -4.63 114.28 115.70 1nm4 n THR 31 Ca 0.00 -1.19 -0.10 0.00 -3.05 0.00 0.00 64.05 59.71 1nm4 n THR 31 Cb 0.45 -1.59 -0.00 0.00 -1.55 0.00 0.00 70.33 67.64 1nm4 n THR 31 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1nm4 n GLN 32 N 1.44 -0.80 -2.19 1.09 -0.06 -1.26 -4.92 117.38 110.67 1nm4 n GLN 32 Ca 0.20 0.48 0.00 0.00 -2.00 0.00 0.00 57.00 55.68 1nm4 n GLN 32 Cb 0.62 -4.52 0.04 0.00 -4.06 0.00 0.00 30.24 22.31 1nm4 n GLN 32 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 1nm4 n PHE 33 N -4.01 0.27 -4.44 3.69 3.72 -1.26 -5.10 117.46 110.33 1nm4 n PHE 33 Ca -0.12 -1.38 -0.26 0.00 -0.05 0.00 0.00 57.45 55.64 1nm4 n PHE 33 Cb 0.59 0.12 -0.11 0.00 -0.94 0.00 0.00 39.48 39.13 1nm4 n PHE 33 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1nm4 s SER 34 N -2.57 3.51 -0.08 4.37 0.01 -1.26 -4.03 113.70 113.65 1nm4 s SER 34 Ca 0.24 -0.92 -0.31 0.00 1.31 0.00 0.00 55.95 56.27 1nm4 s SER 34 Cb 0.33 -0.28 0.11 0.00 0.21 0.00 0.00 66.02 66.39 1nm4 s SER 34 CO -0.09 0.09 1.38 -0.83 0.41 0.00 0.00 173.24 174.20 1nm4 s GLY 35 N -2.96 -0.28 0.05 3.44 0.00 -0.04 -5.01 107.32 102.52 1nm4 s GLY 35 Ca 0.24 0.35 -0.22 0.00 0.00 0.00 0.00 44.72 45.09 1nm4 s GLY 35 CO 0.12 5.05 0.52 0.00 0.00 0.00 0.00 173.10 178.79 1nm4 s ALA 36 N -2.02 -1.33 0.20 3.20 0.00 -1.26 -0.50 121.76 120.04 1nm4 s ALA 36 Ca 0.28 0.58 -0.07 0.00 0.00 0.00 0.00 51.96 52.75 1nm4 s ALA 36 Cb 0.02 0.41 -0.02 0.00 0.00 0.00 0.00 23.12 23.53 1nm4 s ALA 36 CO -0.04 -0.52 0.27 0.15 0.00 0.00 0.00 175.76 175.62 1nm4 s LYS 37 N -2.54 1.26 0.01 0.00 1.02 0.12 -4.74 119.74 114.87 1nm4 s LYS 37 Ca -0.05 -1.37 0.08 0.00 0.02 0.00 0.00 55.97 54.65 1nm4 s LYS 37 Cb -0.01 0.35 -0.02 0.00 -0.52 0.00 0.00 37.83 37.64 1nm4 s LYS 37 CO -0.02 -0.46 -0.26 -1.17 -0.92 0.00 0.00 175.35 172.52 1nm4 s LEU 38 N -3.05 2.11 0.03 3.17 2.96 -1.26 -0.74 118.68 121.89 1nm4 s LEU 38 Ca 0.27 -0.52 0.04 0.00 -0.22 0.00 0.00 54.13 53.70 1nm4 s LEU 38 Cb 0.04 -1.28 -0.02 0.00 0.50 0.00 0.00 46.19 45.43 1nm4 s LEU 38 CO 0.07 0.28 -0.12 0.68 -1.32 0.00 0.00 176.35 175.93 1nm4 s VAL 39 N -0.70 0.98 -0.02 1.68 -7.23 -0.17 -0.68 120.40 114.26 1nm4 s VAL 39 Ca 0.10 -0.88 -0.18 0.00 -1.81 0.00 0.00 61.98 59.22 1nm4 s VAL 39 Cb -0.10 -0.89 -0.05 0.00 0.56 0.00 0.00 36.38 35.90 1nm4 s VAL 39 CO 0.01 0.01 0.50 0.00 -0.31 0.00 0.00 175.10 175.31 1nm4 s MET 40 N -0.98 4.19 0.00 4.82 0.23 0.44 -0.60 119.30 127.40 1nm4 s MET 40 Ca 0.01 0.56 0.00 0.00 -1.03 0.00 0.00 55.69 55.23 1nm4 s MET 40 Cb -0.07 -3.32 0.00 0.00 -1.53 0.00 0.00 34.83 29.91 1nm4 s MET 40 CO 0.01 0.44 0.39 -2.37 -2.03 0.00 0.00 175.02 171.46 1nm4 n THR 41 N 2.58 0.00 -3.67 3.16 5.66 0.38 -0.88 114.28 121.51 1nm4 n THR 41 Ca -0.10 -0.45 -0.10 0.00 -3.05 0.00 0.00 64.05 60.36 1nm4 n THR 41 Cb 0.51 1.09 -0.09 0.00 -1.55 0.00 0.00 70.33 70.30 1nm4 n THR 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nm4 s ALA 42 N -0.12 -1.51 0.08 1.79 0.00 -0.88 -4.69 121.76 116.42 1nm4 s ALA 42 Ca 0.00 1.95 -0.10 0.00 0.00 0.00 0.00 51.96 53.81 1nm4 s ALA 42 Cb 0.00 -1.15 0.01 0.00 0.00 0.00 0.00 23.12 21.97 1nm4 s ALA 42 CO 0.00 -0.32 0.23 -1.64 0.00 0.00 0.00 175.76 174.03 1nm4 s MET 43 N 1.22 0.84 1.07 0.00 -1.94 -1.26 -0.53 119.30 118.69 1nm4 s MET 43 Ca -0.07 -0.80 -0.13 0.00 -1.71 0.00 0.00 55.69 52.97 1nm4 s MET 43 Cb -0.06 0.35 0.23 0.00 2.01 0.00 0.00 34.83 37.36 1nm4 s MET 43 CO -0.12 -0.27 1.07 -1.25 -0.01 0.00 0.00 175.02 174.44 1nm4 s PRO 44 N -3.43 -0.17 0.00 2.03 0.04 -1.26 -2.41 135.00 129.79 1nm4 s PRO 44 Ca 0.01 0.52 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1nm4 s PRO 44 Cb 0.03 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.90 1nm4 s PRO 44 CO -0.09 -3.14 0.00 0.41 0.04 0.00 0.00 177.00 174.22 1nm4 n GLY 45 N -0.56 1.32 0.22 0.56 0.00 -1.26 -4.42 105.19 101.05 1nm4 n GLY 45 Ca 0.05 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 1nm4 n GLY 45 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1nm4 n MET 46 N 0.00 0.47 -3.43 1.61 2.81 -1.25 -4.98 117.12 112.35 1nm4 n MET 46 Ca 0.00 0.19 -0.23 0.00 -1.81 0.00 0.00 57.70 55.85 1nm4 n MET 46 Cb 0.00 -1.32 -0.02 0.00 -0.71 0.00 0.00 33.22 31.18 1nm4 n MET 46 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1nm4 n GLU 47 N -4.30 -2.84 -1.54 0.03 1.02 -1.01 -4.98 120.64 107.02 1nm4 n GLU 47 Ca -0.18 0.35 -0.30 0.00 -0.02 0.00 0.00 57.16 57.01 1nm4 n GLU 47 Cb 0.51 -5.00 0.08 0.00 -0.02 0.00 0.00 31.44 27.01 1nm4 n GLU 47 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 1nm4 s HIS 48 N -2.84 2.90 0.51 -0.32 -3.43 -1.26 -4.99 115.29 105.85 1nm4 s HIS 48 Ca 0.41 1.24 -0.19 0.00 -0.80 0.00 0.00 55.06 55.72 1nm4 s HIS 48 Cb -0.23 -3.05 -0.11 0.00 -1.43 0.00 0.00 32.58 27.76 1nm4 s HIS 48 CO 0.51 -1.63 0.37 0.43 -2.00 0.00 0.00 174.74 172.42 1nm4 n SER 49 N -3.36 -1.64 -4.68 7.38 7.64 -1.26 -4.80 113.62 112.90 1nm4 n SER 49 Ca 0.07 0.77 -0.41 0.00 1.01 0.00 0.00 58.87 60.31 1nm4 n SER 49 Cb 0.55 -1.08 0.02 0.00 -1.01 0.00 0.00 64.21 62.69 1nm4 n SER 49 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1nm4 n PRO 50 N 0.51 1.69 -3.75 1.43 -0.04 -1.26 -4.95 135.00 128.63 1nm4 n PRO 50 Ca 0.11 0.61 -0.14 0.00 -0.04 0.00 0.00 63.50 64.04 1nm4 n PRO 50 Cb 0.45 -2.30 -0.08 0.00 -0.04 0.00 0.00 33.50 31.53 1nm4 n PRO 50 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1nm4 s MET 51 N -2.24 0.69 0.18 0.54 1.75 -0.06 -4.98 119.30 115.19 1nm4 s MET 51 Ca 0.63 -0.16 -0.31 0.00 -1.25 0.00 0.00 55.69 54.60 1nm4 s MET 51 Cb -0.51 0.31 -0.10 0.00 2.84 0.00 0.00 34.83 37.37 1nm4 s MET 51 CO 0.56 -0.19 1.54 0.00 -0.65 0.00 0.00 175.02 176.28 1nm4 s ALA 52 N -1.30 3.74 0.33 4.11 0.00 -1.26 -0.42 121.76 126.96 1nm4 s ALA 52 Ca -0.13 1.36 0.09 0.00 0.00 0.00 0.00 51.96 53.27 1nm4 s ALA 52 Cb -0.05 -3.61 -0.05 0.00 0.00 0.00 0.00 23.12 19.42 1nm4 s ALA 52 CO 0.05 -0.77 0.08 0.54 0.00 0.00 0.00 175.76 175.65 1nm4 s VAL 53 N 0.89 2.94 -0.66 0.00 0.11 0.15 -4.79 120.40 119.04 1nm4 s VAL 53 Ca 0.68 -1.81 -0.27 0.00 -2.93 0.00 0.00 61.98 57.64 1nm4 s VAL 53 Cb -0.43 -2.90 0.03 0.00 -1.53 0.00 0.00 36.38 31.55 1nm4 s VAL 53 CO 0.34 -0.21 1.21 -0.54 -3.33 0.00 0.00 175.10 172.57 1nm4 s LYS 54 N -3.78 3.33 0.15 1.54 1.02 -1.26 -4.45 119.74 116.29 1nm4 s LYS 54 Ca 0.36 -0.05 0.07 0.00 0.02 0.00 0.00 55.97 56.37 1nm4 s LYS 54 Cb -0.02 -4.10 -0.04 0.00 -0.52 0.00 0.00 37.83 33.15 1nm4 s LYS 54 CO 0.21 -1.90 -0.17 0.00 -0.92 0.00 0.00 175.35 172.57 1nm4 s ALA 55 N 5.24 1.81 -0.13 5.17 0.00 -1.26 -0.85 121.76 131.74 1nm4 s ALA 55 Ca 0.38 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.94 1nm4 s ALA 55 Cb -0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1nm4 s ALA 55 CO 0.20 0.19 -0.15 0.00 0.00 0.00 0.00 175.76 176.00 1nm4 s ALA 56 N -2.04 2.54 -0.24 0.00 0.00 0.55 -4.75 121.76 117.81 1nm4 s ALA 56 Ca 0.13 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 51.06 1nm4 s ALA 56 Cb -0.06 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.85 1nm4 s ALA 56 CO 0.05 0.22 0.16 0.54 0.00 0.00 0.00 175.76 176.73 1nm4 s VAL 57 N 0.41 5.33 0.42 0.00 0.11 -1.26 -0.55 120.40 124.85 1nm4 s VAL 57 Ca -0.11 0.17 0.04 0.00 -2.93 0.00 0.00 61.98 59.14 1nm4 s VAL 57 Cb -0.16 -3.49 -0.02 0.00 -1.53 0.00 0.00 36.38 31.18 1nm4 s VAL 57 CO 0.06 0.34 0.12 -0.44 -3.33 0.00 0.00 175.10 171.85 1nm4 s SER 58 N 1.10 2.89 0.20 3.54 0.01 0.63 -5.00 113.70 117.07 1nm4 s SER 58 Ca 0.07 -1.68 0.03 0.00 1.31 0.00 0.00 55.95 55.69 1nm4 s SER 58 Cb -0.14 0.52 -0.05 0.00 0.21 0.00 0.00 66.02 66.56 1nm4 s SER 58 CO 0.05 -0.94 -0.03 -0.83 0.41 0.00 0.00 173.24 171.91 1nm4 s GLY 59 N -3.63 1.39 0.00 3.44 0.00 -1.26 -0.62 107.32 106.64 1nm4 s GLY 59 Ca 0.23 -1.68 0.00 0.00 0.00 0.00 0.00 44.72 43.27 1nm4 s GLY 59 CO 0.14 -1.63 0.00 0.61 0.00 0.00 0.00 173.10 172.22 1nm4 n GLY 60 N -0.34 -1.82 0.00 0.20 0.00 0.36 -4.76 105.19 98.83 1nm4 n GLY 60 Ca -0.06 -1.52 0.04 0.00 0.00 0.00 0.00 46.02 44.47 1nm4 n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nm4 n GLY 61 N 3.47 -0.46 3.21 -0.02 0.00 -1.26 -4.53 105.19 105.59 1nm4 n GLY 61 Ca 0.00 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 1nm4 n GLY 61 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nm4 s ASP 62 N -1.76 2.68 0.49 1.61 1.11 -1.26 -5.02 116.67 114.52 1nm4 s ASP 62 Ca 0.11 -0.45 0.19 0.00 0.18 0.00 0.00 52.55 52.58 1nm4 s ASP 62 Cb 0.05 -0.76 1.24 0.00 1.07 0.00 0.00 42.92 44.52 1nm4 s ASP 62 CO 0.08 0.20 2.07 1.55 1.18 0.00 0.00 175.17 180.26 1nm4 h PRO 63 N 6.17 0.00 -0.06 8.23 0.13 -1.93 -1.23 132.00 143.32 1nm4 h PRO 63 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1nm4 h PRO 63 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1nm4 h PRO 63 CO 0.47 0.11 0.00 0.36 -0.23 0.00 0.00 178.00 178.71 1nm4 n LYS 64 N -4.20 1.16 -3.99 0.86 2.85 -1.26 -4.51 118.16 109.07 1nm4 n LYS 64 Ca -0.03 -0.25 -0.31 0.00 -1.05 0.00 0.00 58.31 56.68 1nm4 n LYS 64 Cb 0.19 -1.16 -0.15 0.00 -0.65 0.00 0.00 35.03 33.26 1nm4 n LYS 64 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1nm4 s THR 65 N -1.93 2.41 0.03 0.58 2.01 -0.46 -3.49 115.64 114.79 1nm4 s THR 65 Ca 0.15 -2.66 -0.19 0.00 0.31 0.00 0.00 61.69 59.30 1nm4 s THR 65 Cb 0.07 -2.74 -0.06 0.00 0.01 0.00 0.00 72.50 69.78 1nm4 s THR 65 CO 0.11 -0.67 0.55 -0.32 -0.69 0.00 0.00 174.62 173.60 1nm4 s MET 66 N 0.51 4.21 -0.20 4.92 1.75 -0.45 -0.49 119.30 129.56 1nm4 s MET 66 Ca 0.13 0.67 -0.03 0.00 -1.25 0.00 0.00 55.69 55.21 1nm4 s MET 66 Cb -0.21 -3.28 0.06 0.00 2.84 0.00 0.00 34.83 34.24 1nm4 s MET 66 CO -0.05 0.53 0.06 0.08 -0.65 0.00 0.00 175.02 174.99 1nm4 s VAL 67 N -0.70 0.33 -0.22 10.11 1.01 0.20 -0.84 120.40 130.30 1nm4 s VAL 67 Ca 0.29 -0.50 -0.09 0.00 0.00 0.00 0.00 61.98 61.67 1nm4 s VAL 67 Cb -0.18 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1nm4 s VAL 67 CO 0.17 -0.29 0.11 -0.63 0.00 0.00 0.00 175.10 174.46 1nm4 s ILE 68 N 1.94 4.98 -0.12 2.22 1.09 0.58 -0.27 121.20 131.61 1nm4 s ILE 68 Ca 0.01 0.04 -0.06 0.00 -1.10 0.00 0.00 60.65 59.55 1nm4 s ILE 68 Cb -0.17 -3.30 -0.04 0.00 -1.06 0.00 0.00 42.46 37.90 1nm4 s ILE 68 CO -0.11 0.38 0.09 -0.89 -0.10 0.00 0.00 174.94 174.31 1nm4 s THR 69 N 0.93 5.08 0.38 2.92 2.01 0.29 -0.55 115.64 126.69 1nm4 s THR 69 Ca 0.06 0.05 -0.27 0.00 0.31 0.00 0.00 61.69 61.84 1nm4 s THR 69 Cb -0.13 -3.21 -0.09 0.00 0.01 0.00 0.00 72.50 69.07 1nm4 s THR 69 CO 0.03 0.58 1.31 -2.16 -0.69 0.00 0.00 174.62 173.69 1nm4 s PRO 70 N -0.71 4.08 -0.11 4.92 0.04 -1.26 -0.33 135.00 141.63 1nm4 s PRO 70 Ca 0.12 2.18 0.13 0.00 0.04 0.00 0.00 61.00 63.48 1nm4 s PRO 70 Cb -0.12 -2.85 -0.24 0.00 0.04 0.00 0.00 34.50 31.33 1nm4 s PRO 70 CO 0.03 -0.40 0.40 0.00 0.04 0.00 0.00 177.00 177.06 1nm4 n ALA 71 N 0.33 1.47 -2.88 8.56 0.00 -0.03 -4.72 120.51 123.23 1nm4 n ALA 71 Ca 0.03 -0.99 -0.28 0.00 0.00 0.00 0.00 53.44 52.19 1nm4 n ALA 71 Cb 0.43 -0.56 -0.04 0.00 0.00 0.00 0.00 19.45 19.28 1nm4 n ALA 71 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1nm4 s SER 72 N -5.92 6.37 -0.34 0.00 0.01 -1.17 -5.02 113.70 107.63 1nm4 s SER 72 Ca -0.08 0.28 -0.28 0.00 1.31 0.00 0.00 55.95 57.18 1nm4 s SER 72 Cb 0.07 -1.96 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 1nm4 s SER 72 CO 0.82 0.08 2.06 -2.16 0.41 0.00 0.00 173.24 174.44 1nm4 s PRO 73 N -2.95 2.99 -0.17 12.44 0.04 -1.26 -4.91 135.00 141.18 1nm4 s PRO 73 Ca 0.36 1.57 -0.35 0.00 0.04 0.00 0.00 61.00 62.62 1nm4 s PRO 73 Cb -0.12 -4.34 -0.12 0.00 0.04 0.00 0.00 34.50 29.96 1nm4 s PRO 73 CO 0.28 -2.27 1.93 1.28 0.04 0.00 0.00 177.00 178.27 1nm4 n LEU 74 N 11.96 3.07 -4.92 -3.56 4.77 -1.26 -4.97 117.00 122.08 1nm4 n LEU 74 Ca 0.27 0.85 -0.22 0.00 -0.03 0.00 0.00 56.01 56.89 1nm4 n LEU 74 Cb 0.48 -1.33 -0.00 0.00 -2.33 0.00 0.00 43.42 40.24 1nm4 n LEU 74 CO 0.68 -0.26 0.09 0.28 -1.33 0.00 0.00 177.39 176.85 1nm4 s THR 75 N 4.81 2.34 0.10 -5.08 -1.32 -1.26 -4.79 115.64 110.44 1nm4 s THR 75 Ca 0.97 -1.29 -0.36 0.00 -1.21 0.00 0.00 61.69 59.80 1nm4 s THR 75 Cb -0.76 -2.62 -0.17 0.00 -1.51 0.00 0.00 72.50 67.45 1nm4 s THR 75 CO 0.53 0.00 1.32 0.00 -2.21 0.00 0.00 174.62 174.26 1nm4 n ALA 76 N -1.76 -0.92 0.00 11.08 0.00 -1.26 -4.70 120.51 122.95 1nm4 n ALA 76 Ca 0.05 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1nm4 n ALA 76 Cb 0.62 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 18.00 1nm4 n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nm4 n GLY 77 N 2.47 -0.07 3.15 0.00 0.00 -0.36 -4.41 105.19 105.98 1nm4 n GLY 77 Ca 0.18 -1.40 -0.22 0.00 0.00 0.00 0.00 46.02 44.58 1nm4 n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nm4 s THR 78 N -2.95 1.25 0.13 2.61 2.01 0.30 -0.52 115.64 118.48 1nm4 s THR 78 Ca 0.00 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.13 1nm4 s THR 78 Cb 0.00 -1.08 -0.04 0.00 0.01 0.00 0.00 72.50 71.39 1nm4 s THR 78 CO 0.00 0.18 -0.01 -0.31 -0.69 0.00 0.00 174.62 173.79 1nm4 s TYR 79 N -0.63 1.00 -0.12 4.92 1.51 0.30 -0.47 117.35 123.86 1nm4 s TYR 79 Ca 0.04 -1.03 0.00 0.00 -1.01 0.00 0.00 57.07 55.07 1nm4 s TYR 79 Cb -0.07 -0.58 0.02 0.00 -0.11 0.00 0.00 41.96 41.22 1nm4 s TYR 79 CO 0.01 -0.26 -0.10 0.21 -1.11 0.00 0.00 175.55 174.29 1nm4 s LYS 80 N -3.92 1.81 -0.23 -0.62 2.20 0.23 -1.12 119.74 118.10 1nm4 s LYS 80 Ca 0.19 -0.38 -0.27 0.00 -0.36 0.00 0.00 55.97 55.15 1nm4 s LYS 80 Cb 0.06 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.65 1nm4 s LYS 80 CO -0.00 -0.21 0.95 0.08 -0.36 0.00 0.00 175.35 175.81 1nm4 s VAL 81 N 1.49 4.75 -0.26 4.02 1.01 0.57 -0.99 120.40 130.99 1nm4 s VAL 81 Ca 0.02 1.84 -0.09 0.00 0.00 0.00 0.00 61.98 63.75 1nm4 s VAL 81 Cb -0.13 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 1nm4 s VAL 81 CO -0.07 -0.12 0.14 -1.81 0.00 0.00 0.00 175.10 173.23 1nm4 s ASP 82 N 1.25 5.72 0.06 3.32 1.01 0.08 -0.77 116.67 127.33 1nm4 s ASP 82 Ca 0.40 -0.05 0.07 0.00 0.71 0.00 0.00 52.55 53.69 1nm4 s ASP 82 Cb -0.15 -2.04 -0.03 0.00 1.01 0.00 0.00 42.92 41.70 1nm4 s ASP 82 CO 0.07 -0.01 -0.18 -1.66 0.21 0.00 0.00 175.17 173.61 1nm4 s TRP 83 N 1.48 2.57 -0.17 4.23 1.48 0.28 -0.70 118.94 128.11 1nm4 s TRP 83 Ca 0.06 -0.25 -0.02 0.00 -1.06 0.00 0.00 56.10 54.83 1nm4 s TRP 83 Cb -0.15 -1.44 0.05 0.00 -1.16 0.00 0.00 33.47 30.77 1nm4 s TRP 83 CO 0.07 0.29 0.01 1.03 -4.06 0.00 0.00 176.95 174.29 1nm4 s ARG 84 N -1.62 0.81 -0.11 3.25 0.52 0.34 -0.88 118.95 121.26 1nm4 s ARG 84 Ca 0.16 -0.39 -0.02 0.00 -0.52 0.00 0.00 55.73 54.96 1nm4 s ARG 84 Cb -0.11 -1.95 -0.03 0.00 0.52 0.00 0.00 34.95 33.38 1nm4 s ARG 84 CO 0.07 -0.56 -0.04 0.00 0.02 0.00 0.00 175.30 174.78 1nm4 s ALA 85 N 1.82 3.04 0.06 2.13 0.00 0.74 -0.86 121.76 128.68 1nm4 s ALA 85 Ca -0.00 -0.84 0.06 0.00 0.00 0.00 0.00 51.96 51.17 1nm4 s ALA 85 Cb -0.16 -1.42 -0.03 0.00 0.00 0.00 0.00 23.12 21.52 1nm4 s ALA 85 CO -0.07 0.42 -0.15 0.08 0.00 0.00 0.00 175.76 176.03 1nm4 s VAL 86 N -0.30 1.23 0.37 0.00 1.01 -1.26 -0.63 120.40 120.83 1nm4 s VAL 86 Ca 0.05 -1.18 0.08 0.00 0.00 0.00 0.00 61.98 60.93 1nm4 s VAL 86 Cb -0.13 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 1nm4 s VAL 86 CO 0.02 -0.06 0.28 -0.55 0.00 0.00 0.00 175.10 174.79 1nm4 s SER 87 N -1.42 5.01 0.13 3.32 0.15 0.06 -0.05 113.70 120.91 1nm4 s SER 87 Ca 0.02 -0.68 -0.26 0.00 0.70 0.00 0.00 55.95 55.72 1nm4 s SER 87 Cb -0.09 -0.75 -0.03 0.00 -1.71 0.00 0.00 66.02 63.44 1nm4 s SER 87 CO 0.02 -0.45 1.61 0.28 1.20 0.00 0.00 173.24 175.90 1nm4 h SER 88 N 1.26 -0.98 0.00 5.45 0.02 -1.91 -2.49 113.55 114.89 1nm4 h SER 88 Ca -0.43 0.14 -0.10 0.00 -0.84 0.00 0.00 61.79 60.56 1nm4 h SER 88 Cb 1.26 0.41 -0.04 0.00 0.14 0.00 0.00 62.40 64.17 1nm4 h SER 88 CO 0.60 -0.36 -0.19 0.47 -1.14 0.00 0.00 176.83 176.21 1nm4 n ASP 89 N -5.41 4.83 0.00 3.07 9.92 -1.26 -4.90 116.55 122.80 1nm4 n ASP 89 Ca -0.03 -2.35 0.00 0.00 -0.53 0.00 0.00 54.79 51.87 1nm4 n ASP 89 Cb 0.32 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.61 1nm4 n ASP 89 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1nm4 n THR 90 N 2.13 0.00 -3.87 -3.53 -2.24 -0.94 -4.89 114.28 100.94 1nm4 n THR 90 Ca 0.23 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.71 1nm4 n THR 90 Cb 0.68 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.92 1nm4 n THR 90 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1nm4 n HIS 91 N 0.00 -1.87 -2.22 4.78 -0.00 -1.26 -0.76 115.22 113.89 1nm4 n HIS 91 Ca 0.00 0.63 -0.41 0.00 -0.00 0.00 0.00 57.72 57.95 1nm4 n HIS 91 Cb 0.00 -2.77 -0.03 0.00 -0.00 0.00 0.00 29.99 27.19 1nm4 n HIS 91 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 1nm4 s PRO 92 N -5.60 4.42 -0.18 1.57 0.04 -1.26 -3.99 135.00 130.00 1nm4 s PRO 92 Ca 0.13 2.08 -0.02 0.00 0.04 0.00 0.00 61.00 63.23 1nm4 s PRO 92 Cb -0.07 -3.14 -0.00 0.00 0.04 0.00 0.00 34.50 31.33 1nm4 s PRO 92 CO 0.92 -0.14 -0.10 0.96 0.04 0.00 0.00 177.00 178.68 1nm4 s ILE 93 N -0.68 3.00 -0.05 0.56 -4.36 0.20 -5.01 121.20 114.86 1nm4 s ILE 93 Ca 0.51 -0.64 0.05 0.00 -0.26 0.00 0.00 60.65 60.31 1nm4 s ILE 93 Cb -0.37 -2.32 -0.00 0.00 1.25 0.00 0.00 42.46 41.02 1nm4 s ILE 93 CO 0.45 0.48 -0.20 0.42 0.24 0.00 0.00 174.94 176.33 1nm4 s THR 94 N 1.08 1.66 0.29 8.37 -4.23 -1.26 -0.19 115.64 121.36 1nm4 s THR 94 Ca 0.00 -0.84 -0.20 0.00 -1.18 0.00 0.00 61.69 59.47 1nm4 s THR 94 Cb -0.15 -1.42 0.03 0.00 1.34 0.00 0.00 72.50 72.31 1nm4 s THR 94 CO -0.02 0.47 0.76 -0.83 -0.54 0.00 0.00 174.62 174.46 1nm4 s GLY 95 N 0.01 -0.01 0.03 3.99 0.00 -0.05 -5.01 107.32 106.27 1nm4 s GLY 95 Ca -0.05 -0.36 -0.20 0.00 0.00 0.00 0.00 44.72 44.11 1nm4 s GLY 95 CO 0.03 -0.07 0.45 -0.56 0.00 0.00 0.00 173.10 172.95 1nm4 s SER 96 N -2.96 -0.35 -0.06 1.64 0.01 -1.26 -0.55 113.70 110.17 1nm4 s SER 96 Ca 0.12 0.13 0.01 0.00 1.31 0.00 0.00 55.95 57.52 1nm4 s SER 96 Cb -0.05 0.44 0.02 0.00 0.21 0.00 0.00 66.02 66.64 1nm4 s SER 96 CO 0.07 -0.64 -0.05 -0.69 0.41 0.00 0.00 173.24 172.34 1nm4 s VAL 97 N -2.16 0.65 0.12 3.43 1.01 0.05 -5.00 120.40 118.49 1nm4 s VAL 97 Ca -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 1nm4 s VAL 97 Cb -0.01 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 1nm4 s VAL 97 CO 0.00 0.27 0.29 0.28 0.00 0.00 0.00 175.10 175.94 1nm4 s THR 98 N 1.16 5.30 0.19 3.92 -1.32 -1.26 -0.32 115.64 123.31 1nm4 s THR 98 Ca -0.07 -0.34 -0.12 0.00 -1.21 0.00 0.00 61.69 59.95 1nm4 s THR 98 Cb -0.14 -3.67 -0.00 0.00 -1.51 0.00 0.00 72.50 67.19 1nm4 s THR 98 CO -0.01 0.02 0.38 0.72 -2.21 0.00 0.00 174.62 173.52 1nm4 s PHE 99 N -1.64 0.29 0.22 9.09 -0.12 -0.28 -0.71 117.98 124.84 1nm4 s PHE 99 Ca 0.37 -0.65 0.11 0.00 -0.05 0.00 0.00 56.93 56.71 1nm4 s PHE 99 Cb -0.12 0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 42.31 1nm4 s PHE 99 CO 0.28 -0.82 -0.20 0.15 -0.05 0.00 0.00 175.22 174.57 1nm4 s LYS 100 N -3.96 1.51 0.02 1.99 1.02 0.36 -0.54 119.74 120.14 1nm4 s LYS 100 Ca 0.17 -1.60 0.03 0.00 0.02 0.00 0.00 55.97 54.59 1nm4 s LYS 100 Cb 0.02 -1.64 -0.01 0.00 -0.52 0.00 0.00 37.83 35.67 1nm4 s LYS 100 CO 0.02 0.32 -0.11 0.08 -0.92 0.00 0.00 175.35 174.75 1nm4 s VAL 101 N -2.20 0.82 0.00 3.17 1.01 0.33 -3.96 120.40 119.56 1nm4 s VAL 101 Ca 0.23 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1nm4 s VAL 101 Cb -0.06 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.58 1nm4 s VAL 101 CO 0.11 0.03 0.46 0.29 0.00 0.00 0.00 175.10 175.99