#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1q n GLY 23 N 0.00 2.97 3.94 1.09 0.00 -1.26 -4.88 105.19 107.05 2k1q n GLY 23 Ca 0.00 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 2k1q n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k1q n ARG 24 N 13.72 -5.41 -0.17 1.61 1.74 -1.26 -4.86 116.66 122.03 2k1q n ARG 24 Ca 0.00 0.58 -0.10 0.00 -0.77 0.00 0.00 57.85 57.56 2k1q n ARG 24 Cb 0.00 -5.47 0.02 0.00 -1.02 0.00 0.00 32.46 25.99 2k1q n ARG 24 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 2k1q h ASP 25 N -2.06 1.01 -2.17 0.55 2.03 -2.06 -3.49 116.42 110.23 2k1q h ASP 25 Ca -0.58 -0.36 0.26 0.00 -0.73 0.00 0.00 57.03 55.62 2k1q h ASP 25 Cb 1.38 -0.28 -0.07 0.00 -0.83 0.00 0.00 39.33 39.53 2k1q h ASP 25 CO 0.68 1.15 -0.37 0.29 -1.03 0.00 0.00 179.24 179.96 2k1q n LYS 26 N -4.13 -1.95 -3.82 4.15 5.02 -1.26 -4.70 118.16 111.47 2k1q n LYS 26 Ca 0.01 1.30 -0.36 0.00 -2.02 0.00 0.00 58.31 57.24 2k1q n LYS 26 Cb 0.43 -2.39 -0.13 0.00 -0.02 0.00 0.00 35.03 32.92 2k1q n LYS 26 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2k1q s ASN 27 N -5.14 4.75 0.24 4.39 3.84 -1.26 -4.99 114.94 116.78 2k1q s ASN 27 Ca 0.00 -0.29 -0.06 0.00 0.21 0.00 0.00 52.86 52.71 2k1q s ASN 27 Cb 0.00 -1.84 0.24 0.00 -0.55 0.00 0.00 41.25 39.10 2k1q s ASN 27 CO 0.00 -0.03 1.90 1.56 -2.79 0.00 0.00 177.10 177.74 2k1q h GLN 28 N 8.18 1.30 -5.06 0.43 4.20 -1.86 -3.40 115.11 118.91 2k1q h GLN 28 Ca -0.40 -0.11 -0.67 0.00 0.06 0.00 0.00 58.65 57.54 2k1q h GLN 28 Cb 1.17 -0.28 -0.33 0.00 0.30 0.00 0.00 27.48 28.34 2k1q h GLN 28 CO 0.59 0.90 -0.82 0.08 -0.67 0.00 0.00 178.83 178.91 2k1q s VAL 29 N -6.01 2.47 -0.06 -0.54 1.01 -1.26 -4.71 120.40 111.30 2k1q s VAL 29 Ca -0.13 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.12 2k1q s VAL 29 Cb 0.18 -2.07 -0.11 0.00 0.00 0.00 0.00 36.38 34.38 2k1q s VAL 29 CO 0.82 0.51 0.07 -0.62 0.00 0.00 0.00 175.10 175.88 2k1q n GLU 30 N 4.59 2.02 0.00 2.72 1.02 -1.26 -5.02 120.64 124.72 2k1q n GLU 30 Ca -0.20 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 56.92 2k1q n GLU 30 Cb 0.50 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.72 2k1q n GLU 30 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k1q n GLY 31 N 2.37 1.42 2.30 0.62 0.00 -1.26 -4.59 105.19 106.05 2k1q n GLY 31 Ca -0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 2k1q n GLY 31 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k1q n GLU 32 N -0.56 -1.41 -3.73 1.61 1.02 -1.26 -4.92 120.64 111.39 2k1q n GLU 32 Ca 0.00 0.99 -0.12 0.00 -0.02 0.00 0.00 57.16 58.00 2k1q n GLU 32 Cb 0.00 -5.32 -0.12 0.00 -0.02 0.00 0.00 31.44 25.98 2k1q n GLU 32 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2k1q s VAL 33 N -2.46 -0.03 0.17 2.62 1.01 -1.26 -3.26 120.40 117.19 2k1q s VAL 33 Ca 0.00 0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.18 2k1q s VAL 33 Cb 0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 2k1q s VAL 33 CO 0.00 0.04 -0.19 -1.10 0.00 0.00 0.00 175.10 173.86 2k1q s GLN 34 N 1.08 1.29 -0.25 2.72 -0.21 -1.20 -5.03 119.66 118.06 2k1q s GLN 34 Ca -0.08 -1.42 -0.09 0.00 0.02 0.00 0.00 55.36 53.80 2k1q s GLN 34 Cb -0.08 -1.36 -0.04 0.00 1.00 0.00 0.00 33.01 32.52 2k1q s GLN 34 CO -0.08 0.28 0.12 0.08 -2.12 0.00 0.00 175.29 173.57 2k1q s VAL 35 N -2.03 4.85 0.05 1.09 1.01 -1.26 -2.69 120.40 121.42 2k1q s VAL 35 Ca 0.16 0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.23 2k1q s VAL 35 Cb -0.06 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2k1q s VAL 35 CO 0.07 0.33 -0.20 0.68 0.00 0.00 0.00 175.10 175.97 2k1q s VAL 36 N 1.42 2.64 0.26 2.92 -7.23 -1.08 -4.09 120.40 115.25 2k1q s VAL 36 Ca 0.06 -1.25 0.03 0.00 -1.81 0.00 0.00 61.98 59.00 2k1q s VAL 36 Cb -0.15 -2.10 -0.05 0.00 0.56 0.00 0.00 36.38 34.64 2k1q s VAL 36 CO 0.06 0.33 0.05 -0.55 -0.31 0.00 0.00 175.10 174.68 2k1q s SER 37 N -1.43 1.68 0.25 4.85 0.15 -0.67 -1.77 113.70 116.77 2k1q s SER 37 Ca 0.14 -1.33 -0.00 0.00 0.70 0.00 0.00 55.95 55.46 2k1q s SER 37 Cb -0.10 0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.23 2k1q s SER 37 CO 0.05 -0.63 0.24 -0.89 1.20 0.00 0.00 173.24 173.20 2k1q s THR 38 N -3.54 0.00 -0.68 6.45 2.01 -0.11 -2.52 115.64 117.25 2k1q s THR 38 Ca 0.34 -1.90 0.19 0.00 0.31 0.00 0.00 61.69 60.63 2k1q s THR 38 Cb 0.07 -2.48 0.19 0.00 0.01 0.00 0.00 72.50 70.29 2k1q s THR 38 CO 0.12 0.00 1.58 0.00 -0.69 0.00 0.00 174.62 175.64 2k1q n ALA 39 N -0.40 1.59 -0.06 7.40 0.00 -1.26 -3.59 120.51 124.19 2k1q n ALA 39 Ca 0.03 0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.42 2k1q n ALA 39 Cb 0.64 -1.31 -0.05 0.00 0.00 0.00 0.00 19.45 18.73 2k1q n ALA 39 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2k1q n THR 40 N -1.93 0.66 -3.83 0.00 -2.24 -1.26 -5.10 114.28 100.58 2k1q n THR 40 Ca 0.02 -0.24 -0.08 0.00 -2.27 0.00 0.00 64.05 61.48 2k1q n THR 40 Cb 0.18 -1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 67.36 2k1q n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k1q s GLN 41 N -2.23 1.62 0.17 -0.78 -2.07 -1.24 -5.18 119.66 109.96 2k1q s GLN 41 Ca -0.16 -0.98 0.11 0.00 -1.82 0.00 0.00 55.36 52.52 2k1q s GLN 41 Cb 0.04 0.56 -0.04 0.00 -1.09 0.00 0.00 33.01 32.48 2k1q s GLN 41 CO 0.26 -0.72 -0.25 -1.54 -1.32 0.00 0.00 175.29 171.72 2k1q s SER 42 N -2.92 3.41 0.31 12.60 1.04 -1.26 -0.94 113.70 125.95 2k1q s SER 42 Ca 0.12 -0.82 -0.07 0.00 0.48 0.00 0.00 55.95 55.67 2k1q s SER 42 Cb -0.04 -0.25 0.03 0.00 0.10 0.00 0.00 66.02 65.86 2k1q s SER 42 CO 0.04 0.14 0.54 2.22 0.98 0.00 0.00 173.24 177.16 2k1q n PHE 43 N 0.50 -1.72 -4.26 5.02 -1.74 -0.73 -4.59 117.46 109.93 2k1q n PHE 43 Ca -0.15 -1.78 -0.27 0.00 -0.56 0.00 0.00 57.45 54.69 2k1q n PHE 43 Cb 0.55 0.62 -0.09 0.00 1.52 0.00 0.00 39.48 42.08 2k1q n PHE 43 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2k1q s LEU 44 N 0.00 3.05 0.18 5.98 1.43 -1.14 -2.62 118.68 125.56 2k1q s LEU 44 Ca 0.19 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.82 2k1q s LEU 44 Cb -0.02 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.40 2k1q s LEU 44 CO 0.14 0.11 -0.07 0.00 0.23 0.00 0.00 176.35 176.76 2k1q s ALA 45 N -1.63 1.63 0.03 4.21 0.00 -1.09 -3.27 121.76 121.63 2k1q s ALA 45 Ca 0.25 -1.61 0.07 0.00 0.00 0.00 0.00 51.96 50.67 2k1q s ALA 45 Cb -0.09 0.21 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 2k1q s ALA 45 CO 0.16 -0.15 -0.21 -0.08 0.00 0.00 0.00 175.76 175.48 2k1q s THR 46 N -3.34 1.66 -0.44 0.00 -1.32 -0.93 -3.22 115.64 108.06 2k1q s THR 46 Ca 0.22 -1.12 -0.17 0.00 -1.21 0.00 0.00 61.69 59.40 2k1q s THR 46 Cb 0.04 -1.43 0.03 0.00 -1.51 0.00 0.00 72.50 69.63 2k1q s THR 46 CO 0.04 0.27 0.47 0.00 -2.21 0.00 0.00 174.62 173.19 2k1q s VAL 48 N 2.18 1.71 -1.44 0.00 1.01 0.15 -1.79 120.40 122.22 2k1q s VAL 48 Ca 0.12 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.16 2k1q s VAL 48 Cb -0.18 -1.46 0.05 0.00 0.00 0.00 0.00 36.38 34.78 2k1q s VAL 48 CO 0.13 0.48 0.68 0.59 0.00 0.00 0.00 175.10 176.98 2k1q n ASN 49 N 3.22 -5.01 -0.80 3.32 3.02 -1.26 -0.64 115.26 117.10 2k1q n ASN 49 Ca -0.19 -0.43 -0.10 0.00 -0.03 0.00 0.00 54.58 53.83 2k1q n ASN 49 Cb 0.53 -4.06 -0.04 0.00 -0.61 0.00 0.00 39.78 35.60 2k1q n ASN 49 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k1q n GLY 50 N -1.46 1.19 2.85 7.41 0.00 -1.26 -5.00 105.19 108.92 2k1q n GLY 50 Ca -0.04 -0.55 -0.18 0.00 0.00 0.00 0.00 46.02 45.25 2k1q n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k1q s VAL 51 N -2.39 0.32 0.48 1.61 1.01 0.18 -3.27 120.40 118.34 2k1q s VAL 51 Ca 0.00 -0.00 -0.21 0.00 0.00 0.00 0.00 61.98 61.77 2k1q s VAL 51 Cb 0.00 -0.39 -0.08 0.00 0.00 0.00 0.00 36.38 35.91 2k1q s VAL 51 CO 0.00 0.18 1.06 0.00 0.00 0.00 0.00 175.10 176.33 2k1q s TRP 53 N -1.89 0.70 0.16 0.00 0.52 0.66 -2.66 118.94 116.43 2k1q s TRP 53 Ca 0.66 -0.58 -0.18 0.00 0.02 0.00 0.00 56.10 56.02 2k1q s TRP 53 Cb -0.19 -0.42 0.07 0.00 -1.15 0.00 0.00 33.47 31.78 2k1q s TRP 53 CO 0.22 -0.10 0.89 -2.37 0.02 0.00 0.00 176.95 175.61 2k1q n THR 54 N 1.19 0.00 -2.08 2.01 5.66 -0.83 -2.19 114.28 118.04 2k1q n THR 54 Ca -0.21 -0.49 -0.30 0.00 -3.05 0.00 0.00 64.05 60.00 2k1q n THR 54 Cb 0.56 0.67 0.02 0.00 -1.55 0.00 0.00 70.33 70.02 2k1q n THR 54 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2k1q s VAL 55 N -2.13 4.43 -0.00 1.08 0.11 -1.26 -1.67 120.40 120.95 2k1q s VAL 55 Ca 0.20 0.59 0.00 0.00 -2.93 0.00 0.00 61.98 59.83 2k1q s VAL 55 Cb -0.02 -3.76 -0.26 0.00 -1.53 0.00 0.00 36.38 30.81 2k1q s VAL 55 CO 0.05 -0.93 0.82 0.22 -3.33 0.00 0.00 175.10 171.93 2k1q h TYR 56 N -0.26 0.34 0.00 1.54 3.20 -0.78 -3.30 116.97 117.71 2k1q h TYR 56 Ca -0.45 -0.25 -0.00 0.00 3.14 0.00 0.00 58.73 61.17 2k1q h TYR 56 Cb 1.21 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.47 2k1q h TYR 56 CO 0.60 1.32 -0.00 1.12 -1.64 0.00 0.00 178.16 179.55 2k1q h HIS 57 N 0.05 0.00 0.01 -3.82 2.07 -1.95 0.94 115.15 112.45 2k1q h HIS 57 Ca -0.24 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.28 2k1q h HIS 57 Cb 1.99 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.97 2k1q h HIS 57 CO 0.05 0.00 -0.01 0.78 -3.07 0.00 0.00 177.93 175.69 2k1q h GLY 58 N 2.00 -0.01 0.00 6.13 0.00 -1.96 -3.41 103.07 105.82 2k1q h GLY 58 Ca -0.00 0.01 -0.34 0.00 0.00 0.00 0.00 47.33 46.99 2k1q h GLY 58 CO 0.00 -0.01 -1.89 0.00 0.00 0.00 0.00 176.54 174.65 2k1q n ALA 59 N -2.59 0.99 -1.91 3.60 0.00 -1.20 -4.88 120.51 114.53 2k1q n ALA 59 Ca -0.09 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.55 2k1q n ALA 59 Cb 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.66 2k1q n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k1q n GLY 60 N 1.35 0.52 3.75 0.00 0.00 0.33 -3.70 105.19 107.42 2k1q n GLY 60 Ca -0.43 -0.82 -0.27 0.00 0.00 0.00 0.00 46.02 44.51 2k1q n GLY 60 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2k1q n SER 61 N 1.83 -5.68 -4.82 1.61 2.88 -1.26 -4.99 113.62 103.19 2k1q n SER 61 Ca 0.00 -0.65 -0.31 0.00 -1.33 0.00 0.00 58.87 56.58 2k1q n SER 61 Cb 0.47 -4.50 -0.05 0.00 -0.75 0.00 0.00 64.21 59.38 2k1q n SER 61 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2k1q s LYS 62 N -6.46 2.22 0.32 -1.46 1.02 -1.24 -5.01 119.74 109.13 2k1q s LYS 62 Ca 0.63 -2.26 -0.29 0.00 0.02 0.00 0.00 55.97 54.07 2k1q s LYS 62 Cb -0.30 -1.75 -0.10 0.00 -0.52 0.00 0.00 37.83 35.16 2k1q s LYS 62 CO 0.78 -0.47 1.37 0.99 -0.92 0.00 0.00 175.35 177.10 2k1q s THR 63 N -2.84 2.59 0.01 2.17 2.01 -1.26 -4.84 115.64 113.48 2k1q s THR 63 Ca 0.16 0.57 0.08 0.00 0.31 0.00 0.00 61.69 62.80 2k1q s THR 63 Cb -0.00 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 2k1q s THR 63 CO 0.10 0.13 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.71 2k1q s LEU 64 N -1.50 2.32 -0.33 4.42 1.98 -1.24 -4.96 118.68 119.36 2k1q s LEU 64 Ca 0.52 -0.46 -0.13 0.00 -2.89 0.00 0.00 54.13 51.17 2k1q s LEU 64 Cb -0.41 -1.40 -0.02 0.00 0.66 0.00 0.00 46.19 45.02 2k1q s LEU 64 CO 0.52 0.29 0.24 0.00 -1.89 0.00 0.00 176.35 175.51 2k1q s ALA 65 N -0.77 3.51 0.46 5.97 0.00 -1.05 -1.55 121.76 128.34 2k1q s ALA 65 Ca 0.12 -1.34 0.04 0.00 0.00 0.00 0.00 51.96 50.78 2k1q s ALA 65 Cb -0.10 -2.65 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 2k1q s ALA 65 CO 0.02 -0.92 0.05 0.20 0.00 0.00 0.00 175.76 175.11 2k1q s GLY 66 N 1.73 2.71 0.42 0.00 0.00 -0.37 -1.67 107.32 110.13 2k1q s GLY 66 Ca 0.06 -1.36 0.11 0.00 0.00 0.00 0.00 44.72 43.53 2k1q s GLY 66 CO 0.11 -2.11 1.99 -0.56 0.00 0.00 0.00 173.10 172.52 2k1q h PRO 67 N 1.47 0.22 -0.03 2.90 0.13 -1.98 -1.93 132.00 132.78 2k1q h PRO 67 Ca -0.43 -0.04 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 2k1q h PRO 67 Cb 1.28 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 2k1q h PRO 67 CO 0.75 0.29 -0.60 0.87 -0.23 0.00 0.00 178.00 179.08 2k1q h LYS 68 N 0.22 0.11 0.00 0.86 1.79 -1.95 -3.49 116.57 114.11 2k1q h LYS 68 Ca 0.05 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2k1q h LYS 68 Cb 0.23 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 2k1q h LYS 68 CO 0.01 0.68 0.00 0.41 -1.08 0.00 0.00 179.45 179.47 2k1q n GLY 69 N 0.22 0.49 3.78 3.86 0.00 -0.73 -5.09 105.19 107.72 2k1q n GLY 69 Ca -0.02 -1.39 -0.34 0.00 0.00 0.00 0.00 46.02 44.26 2k1q n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k1q s PRO 70 N -2.00 3.29 -0.10 1.61 0.04 -1.26 -1.24 135.00 135.34 2k1q s PRO 70 Ca 0.00 1.51 0.04 0.00 0.04 0.00 0.00 61.00 62.59 2k1q s PRO 70 Cb 0.00 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2k1q s PRO 70 CO 0.00 -0.88 -0.24 0.42 0.04 0.00 0.00 177.00 176.34 2k1q s ILE 71 N -1.95 2.06 0.11 0.56 1.01 -0.59 -4.87 121.20 117.52 2k1q s ILE 71 Ca 0.70 -1.02 -0.13 0.00 0.00 0.00 0.00 60.65 60.21 2k1q s ILE 71 Cb -0.22 -1.78 -0.06 0.00 0.01 0.00 0.00 42.46 40.41 2k1q s ILE 71 CO 0.30 0.56 0.50 0.42 0.00 0.00 0.00 174.94 176.71 2k1q s THR 72 N 0.37 4.93 -0.01 2.92 -4.23 -1.26 -3.69 115.64 114.68 2k1q s THR 72 Ca -0.18 0.74 -0.21 0.00 -1.18 0.00 0.00 61.69 60.85 2k1q s THR 72 Cb -0.18 -3.71 -0.05 0.00 1.34 0.00 0.00 72.50 69.90 2k1q s THR 72 CO 0.08 0.29 0.63 -1.10 -0.54 0.00 0.00 174.62 173.99 2k1q s GLN 73 N -1.85 4.36 -0.04 3.99 1.11 -1.26 -2.59 119.66 123.39 2k1q s GLN 73 Ca 0.35 0.80 0.02 0.00 0.01 0.00 0.00 55.36 56.54 2k1q s GLN 73 Cb -0.15 -3.36 -0.04 0.00 -1.01 0.00 0.00 33.01 28.45 2k1q s GLN 73 CO 0.18 0.31 -0.00 -1.33 0.01 0.00 0.00 175.29 174.46 2k1q n MET 74 N 2.89 2.36 -4.48 2.91 2.81 -0.96 -4.86 117.12 117.80 2k1q n MET 74 Ca -0.05 0.01 -0.21 0.00 -1.81 0.00 0.00 57.70 55.63 2k1q n MET 74 Cb 0.51 -1.09 -0.15 0.00 -0.71 0.00 0.00 33.22 31.78 2k1q n MET 74 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 2k1q s TYR 75 N -2.09 1.04 -0.02 2.03 2.02 -1.12 -4.90 117.35 114.32 2k1q s TYR 75 Ca -0.03 -0.24 0.00 0.00 -0.37 0.00 0.00 57.07 56.43 2k1q s TYR 75 Cb 0.01 -0.71 0.03 0.00 -0.40 0.00 0.00 41.96 40.89 2k1q s TYR 75 CO 0.13 -0.07 0.03 0.99 -1.57 0.00 0.00 175.55 175.06 2k1q s THR 76 N -0.03 -0.05 -0.29 -0.71 2.01 -1.26 -1.26 115.64 114.05 2k1q s THR 76 Ca 0.00 0.20 -0.03 0.00 0.31 0.00 0.00 61.69 62.18 2k1q s THR 76 Cb -0.07 -0.08 0.10 0.00 0.01 0.00 0.00 72.50 72.46 2k1q s THR 76 CO 0.00 0.09 0.11 0.21 -0.69 0.00 0.00 174.62 174.34 2k1q s ASN 77 N 1.01 3.66 0.22 3.53 3.84 -0.06 -4.99 114.94 122.16 2k1q s ASN 77 Ca -0.08 -1.38 -0.01 0.00 0.21 0.00 0.00 52.86 51.60 2k1q s ASN 77 Cb -0.12 -0.54 0.21 0.00 -0.55 0.00 0.00 41.25 40.24 2k1q s ASN 77 CO -0.03 -0.42 1.58 0.58 -2.79 0.00 0.00 177.10 176.01 2k1q h VAL 78 N 6.44 1.31 -0.21 -5.21 2.07 -1.96 -0.99 116.25 117.70 2k1q h VAL 78 Ca -0.17 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.70 2k1q h VAL 78 Cb 1.02 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 2k1q h VAL 78 CO 0.44 0.51 0.14 -0.78 0.02 0.00 0.00 177.57 177.91 2k1q h ASP 79 N 0.42 0.25 -0.12 0.57 1.82 -1.95 -2.36 116.42 115.04 2k1q h ASP 79 Ca 0.03 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 2k1q h ASP 79 Cb 0.96 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.90 2k1q h ASP 79 CO 0.08 0.18 0.00 0.00 -1.61 0.00 0.00 179.24 177.89 2k1q n GLN 80 N -4.94 1.72 -3.70 0.28 1.13 -1.21 -4.94 117.38 105.72 2k1q n GLN 80 Ca -0.03 -1.08 -0.22 0.00 -1.94 0.00 0.00 57.00 53.74 2k1q n GLN 80 Cb 0.03 -1.42 0.03 0.00 0.11 0.00 0.00 30.24 28.99 2k1q n GLN 80 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2k1q n ASP 81 N 0.30 -1.38 -3.87 1.08 2.03 -0.48 -4.86 116.55 109.36 2k1q n ASP 81 Ca 0.17 -0.81 -0.12 0.00 0.52 0.00 0.00 54.79 54.55 2k1q n ASP 81 Cb 0.34 -4.08 -0.13 0.00 -0.72 0.00 0.00 41.12 36.53 2k1q n ASP 81 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2k1q s LEU 82 N -6.70 1.90 0.00 -2.67 1.43 -0.61 -0.09 118.68 111.94 2k1q s LEU 82 Ca 0.04 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 2k1q s LEU 82 Cb -0.02 0.13 -0.00 0.00 0.03 0.00 0.00 46.19 46.33 2k1q s LEU 82 CO 0.81 -0.05 -0.01 0.54 0.23 0.00 0.00 176.35 177.87 2k1q s VAL 83 N -0.16 0.09 0.19 -1.59 0.11 -0.67 -0.88 120.40 117.49 2k1q s VAL 83 Ca -0.02 -0.09 0.08 0.00 -2.93 0.00 0.00 61.98 59.02 2k1q s VAL 83 Cb -0.01 -0.09 -0.04 0.00 -1.53 0.00 0.00 36.38 34.70 2k1q s VAL 83 CO -0.00 -0.00 -0.16 -0.83 -3.33 0.00 0.00 175.10 170.78 2k1q s GLY 84 N -0.10 1.43 0.37 6.54 0.00 -0.39 -1.97 107.32 113.21 2k1q s GLY 84 Ca -0.00 -1.60 0.08 0.00 0.00 0.00 0.00 44.72 43.20 2k1q s GLY 84 CO -0.00 -1.68 -0.05 -0.98 0.00 0.00 0.00 173.10 170.40 2k1q s TRP 85 N -2.58 2.46 -0.22 1.90 0.51 -1.09 -2.26 118.94 117.66 2k1q s TRP 85 Ca 0.20 -0.57 -0.29 0.00 -2.12 0.00 0.00 56.10 53.32 2k1q s TRP 85 Cb -0.03 -1.56 -0.02 0.00 -0.81 0.00 0.00 33.47 31.05 2k1q s TRP 85 CO 0.07 0.52 1.52 -1.14 -0.51 0.00 0.00 176.95 177.42 2k1q s GLN 86 N -3.66 3.89 0.46 4.98 0.74 -1.07 -2.40 119.66 122.61 2k1q s GLN 86 Ca 0.34 1.62 -0.23 0.00 0.05 0.00 0.00 55.36 57.14 2k1q s GLN 86 Cb 0.06 -3.97 -0.07 0.00 1.10 0.00 0.00 33.01 30.12 2k1q s GLN 86 CO 0.17 -1.16 1.16 0.00 -0.55 0.00 0.00 175.29 174.91 2k1q s ALA 87 N 4.77 2.98 0.77 1.58 0.00 -1.20 -4.86 121.76 125.79 2k1q s ALA 87 Ca 0.67 0.92 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 2k1q s ALA 87 Cb -0.24 -3.38 0.05 0.00 0.00 0.00 0.00 23.12 19.56 2k1q s ALA 87 CO 0.27 -0.63 1.09 -1.25 0.00 0.00 0.00 175.76 175.24 2k1q s PRO 88 N -2.68 2.29 0.56 0.00 0.04 -1.26 -4.97 135.00 128.97 2k1q s PRO 88 Ca 0.63 1.17 -0.19 0.00 0.04 0.00 0.00 61.00 62.66 2k1q s PRO 88 Cb -0.28 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 2k1q s PRO 88 CO 0.34 -1.62 1.10 -1.25 0.04 0.00 0.00 177.00 175.62 2k1q s PRO 89 N -4.88 3.34 -0.91 0.56 0.04 -1.26 -3.27 135.00 128.62 2k1q s PRO 89 Ca 0.61 1.50 0.00 0.00 0.04 0.00 0.00 61.00 63.15 2k1q s PRO 89 Cb -0.17 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2k1q s PRO 89 CO 0.55 -0.84 0.00 0.41 0.04 0.00 0.00 177.00 177.17 2k1q n GLY 90 N -0.11 0.00 3.78 0.56 0.00 -1.26 -5.01 105.19 103.15 2k1q n GLY 90 Ca 0.11 -0.45 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 2k1q n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k1q s ALA 91 N -2.51 3.60 0.14 4.61 0.00 -1.20 -4.77 121.76 121.63 2k1q s ALA 91 Ca 0.00 -0.72 -0.17 0.00 0.00 0.00 0.00 51.96 51.07 2k1q s ALA 91 Cb 0.00 -1.76 -0.07 0.00 0.00 0.00 0.00 23.12 21.29 2k1q s ALA 91 CO 0.00 0.58 0.60 0.50 0.00 0.00 0.00 175.76 177.44 2k1q s ARG 92 N -0.89 4.11 0.17 0.00 3.52 -1.26 -4.90 118.95 119.70 2k1q s ARG 92 Ca 0.14 0.66 0.06 0.00 -0.13 0.00 0.00 55.73 56.45 2k1q s ARG 92 Cb -0.12 -3.01 -0.04 0.00 -1.56 0.00 0.00 34.95 30.22 2k1q s ARG 92 CO 0.03 0.50 -0.13 -1.54 -0.81 0.00 0.00 175.30 173.36 2k1q s SER 93 N -1.53 2.19 0.62 -2.12 1.04 -1.26 -4.19 113.70 108.45 2k1q s SER 93 Ca 0.36 -1.00 -0.11 0.00 0.48 0.00 0.00 55.95 55.68 2k1q s SER 93 Cb -0.17 -0.08 -0.04 0.00 0.10 0.00 0.00 66.02 65.84 2k1q s SER 93 CO 0.20 -0.24 1.03 -0.76 0.98 0.00 0.00 173.24 174.45 2k1q s LEU 94 N -3.19 3.23 0.08 2.42 2.01 -0.74 -4.88 118.68 117.61 2k1q s LEU 94 Ca 0.19 1.42 0.02 0.00 0.01 0.00 0.00 54.13 55.77 2k1q s LEU 94 Cb 0.00 -4.47 -0.04 0.00 0.01 0.00 0.00 46.19 41.69 2k1q s LEU 94 CO 0.04 -0.88 0.14 0.42 1.01 0.00 0.00 176.35 177.08 2k1q s THR 95 N -3.18 4.91 0.41 5.49 -4.23 -1.26 -4.32 115.64 113.46 2k1q s THR 95 Ca 0.55 -0.62 -0.27 0.00 -1.18 0.00 0.00 61.69 60.17 2k1q s THR 95 Cb -0.11 -3.39 -0.10 0.00 1.34 0.00 0.00 72.50 70.25 2k1q s THR 95 CO 0.54 0.12 1.46 -2.16 -0.54 0.00 0.00 174.62 174.04 2k1q s PRO 96 N -2.49 3.91 0.28 3.99 0.04 -1.26 0.88 135.00 140.35 2k1q s PRO 96 Ca 0.32 2.50 -0.30 0.00 0.04 0.00 0.00 61.00 63.56 2k1q s PRO 96 Cb -0.12 -2.82 -0.12 0.00 0.04 0.00 0.00 34.50 31.48 2k1q s PRO 96 CO 0.25 -0.67 1.64 0.00 0.04 0.00 0.00 177.00 178.25 2k1q n THR 98 N 2.58 0.63 -0.30 0.00 5.66 -1.26 -4.84 114.28 116.76 2k1q n THR 98 Ca 0.10 -4.38 0.00 0.00 -3.05 0.00 0.00 64.05 56.72 2k1q n THR 98 Cb 0.37 -0.24 0.00 0.00 -1.55 0.00 0.00 70.33 68.90 2k1q n THR 98 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k1q n GLY 100 N 0.00 -0.46 3.55 0.00 0.00 -1.26 -4.98 105.19 102.03 2k1q n GLY 100 Ca 0.00 0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2k1q n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k1q s SER 101 N -3.75 4.93 0.26 1.61 0.01 -1.26 -4.99 113.70 110.51 2k1q s SER 101 Ca 0.35 -0.05 0.13 0.00 1.31 0.00 0.00 55.95 57.69 2k1q s SER 101 Cb -0.16 -1.69 0.21 0.00 0.21 0.00 0.00 66.02 64.59 2k1q s SER 101 CO 0.74 0.22 1.51 0.28 0.41 0.00 0.00 173.24 176.40 2k1q h SER 102 N 6.30 0.00 -2.91 2.44 0.02 -1.94 -3.45 113.55 114.02 2k1q h SER 102 Ca -0.37 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.06 2k1q h SER 102 Cb 1.19 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.76 2k1q h SER 102 CO 0.61 0.61 0.80 -1.81 -1.14 0.00 0.00 176.83 175.90 2k1q s ASP 103 N -6.57 6.71 0.02 3.07 1.01 -1.26 0.08 116.67 119.74 2k1q s ASP 103 Ca 0.01 2.47 0.02 0.00 0.71 0.00 0.00 52.55 55.76 2k1q s ASP 103 Cb 0.10 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.42 2k1q s ASP 103 CO 0.75 -0.74 -0.08 -0.76 0.21 0.00 0.00 175.17 174.56 2k1q s LEU 104 N 1.13 2.15 -0.16 1.23 1.43 0.19 -4.70 118.68 119.95 2k1q s LEU 104 Ca 0.67 -0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 53.36 2k1q s LEU 104 Cb -0.40 -0.26 -0.03 0.00 0.03 0.00 0.00 46.19 45.52 2k1q s LEU 104 CO 0.31 -0.07 0.00 -0.31 0.23 0.00 0.00 176.35 176.51 2k1q s TYR 105 N -0.83 3.12 -0.03 0.29 2.02 -0.18 -0.68 117.35 121.06 2k1q s TYR 105 Ca -0.04 -0.12 0.01 0.00 -0.37 0.00 0.00 57.07 56.55 2k1q s TYR 105 Cb -0.07 -1.99 -0.03 0.00 -0.40 0.00 0.00 41.96 39.47 2k1q s TYR 105 CO 0.00 0.08 -0.02 -1.17 -1.57 0.00 0.00 175.55 172.87 2k1q s LEU 106 N 0.26 3.43 -0.15 -1.29 2.96 -1.13 -0.23 118.68 122.52 2k1q s LEU 106 Ca -0.00 -0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 53.88 2k1q s LEU 106 Cb -0.13 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 2k1q s LEU 106 CO 0.02 0.31 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.61 2k1q s VAL 107 N -1.00 3.73 0.54 1.68 1.01 -1.22 -2.92 120.40 122.22 2k1q s VAL 107 Ca 0.17 -0.42 0.08 0.00 0.00 0.00 0.00 61.98 61.82 2k1q s VAL 107 Cb -0.11 -2.62 0.06 0.00 0.00 0.00 0.00 36.38 33.70 2k1q s VAL 107 CO 0.07 0.50 0.65 0.42 0.00 0.00 0.00 175.10 176.74 2k1q s THR 108 N 0.35 2.20 0.14 3.92 -4.23 -0.96 -4.57 115.64 112.48 2k1q s THR 108 Ca -0.05 -1.13 0.34 0.00 -1.18 0.00 0.00 61.69 59.67 2k1q s THR 108 Cb -0.15 -2.32 0.39 0.00 1.34 0.00 0.00 72.50 71.76 2k1q s THR 108 CO 0.03 0.00 2.02 -0.09 -0.54 0.00 0.00 174.62 176.04 2k1q h ARG 109 N 0.42 0.00 -0.85 3.99 2.43 -1.90 -2.78 114.38 115.70 2k1q h ARG 109 Ca -0.33 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 58.71 2k1q h ARG 109 Cb 1.29 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.76 2k1q h ARG 109 CO 0.46 0.00 0.17 0.72 -1.51 0.00 0.00 179.97 179.80 2k1q n HIS 110 N -3.00 1.55 -3.76 2.20 8.25 -1.26 -4.88 115.22 114.31 2k1q n HIS 110 Ca 0.00 -0.81 -0.28 0.00 -0.26 0.00 0.00 57.72 56.37 2k1q n HIS 110 Cb 0.26 -0.49 0.03 0.00 1.12 0.00 0.00 29.99 30.91 2k1q n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2k1q n ALA 111 N 0.02 -1.25 -2.60 -1.41 0.00 -1.05 -4.98 120.51 109.24 2k1q n ALA 111 Ca 0.25 0.23 -0.24 0.00 0.00 0.00 0.00 53.44 53.69 2k1q n ALA 111 Cb 1.00 -4.53 -0.08 0.00 0.00 0.00 0.00 19.45 15.84 2k1q n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k1q s ASP 112 N -3.22 4.34 -0.03 0.00 1.01 -1.26 -4.95 116.67 112.57 2k1q s ASP 112 Ca 0.61 -0.71 0.03 0.00 0.71 0.00 0.00 52.55 53.20 2k1q s ASP 112 Cb -0.30 -0.73 -0.00 0.00 1.01 0.00 0.00 42.92 42.90 2k1q s ASP 112 CO 0.76 0.02 -0.12 0.54 0.21 0.00 0.00 175.17 176.57 2k1q s VAL 113 N -2.30 1.02 -0.05 -1.27 0.11 -1.26 -2.26 120.40 114.39 2k1q s VAL 113 Ca 0.31 -0.50 0.02 0.00 -2.93 0.00 0.00 61.98 58.87 2k1q s VAL 113 Cb -0.06 -0.89 0.01 0.00 -1.53 0.00 0.00 36.38 33.91 2k1q s VAL 113 CO 0.19 0.30 -0.11 -0.51 -3.33 0.00 0.00 175.10 171.64 2k1q s ILE 114 N 0.05 1.01 0.03 7.04 2.07 -1.15 -4.96 121.20 125.30 2k1q s ILE 114 Ca -0.02 -0.42 -0.30 0.00 -1.41 0.00 0.00 60.65 58.49 2k1q s ILE 114 Cb -0.09 -0.93 -0.06 0.00 0.13 0.00 0.00 42.46 41.51 2k1q s ILE 114 CO 0.01 0.32 1.43 -2.16 -1.91 0.00 0.00 174.94 172.63 2k1q s PRO 115 N 0.59 4.28 -0.08 3.50 0.04 -1.26 -2.84 135.00 139.22 2k1q s PRO 115 Ca -0.12 2.03 0.03 0.00 0.04 0.00 0.00 61.00 62.99 2k1q s PRO 115 Cb -0.14 -3.52 0.01 0.00 0.04 0.00 0.00 34.50 30.89 2k1q s PRO 115 CO 0.03 -0.57 -0.18 0.08 0.04 0.00 0.00 177.00 176.39 2k1q s VAL 116 N 2.19 1.62 0.05 -0.36 1.01 0.15 -4.11 120.40 120.96 2k1q s VAL 116 Ca 0.65 -0.76 -0.23 0.00 0.00 0.00 0.00 61.98 61.64 2k1q s VAL 116 Cb -0.33 -1.43 -0.06 0.00 0.00 0.00 0.00 36.38 34.55 2k1q s VAL 116 CO 0.28 0.46 0.68 -0.60 0.00 0.00 0.00 175.10 175.92 2k1q s ARG 117 N 0.50 4.40 -0.21 2.72 6.06 -0.50 -0.64 118.95 131.28 2k1q s ARG 117 Ca -0.17 0.92 -0.25 0.00 -2.50 0.00 0.00 55.73 53.73 2k1q s ARG 117 Cb -0.17 -3.32 -0.01 0.00 0.06 0.00 0.00 34.95 31.52 2k1q s ARG 117 CO 0.06 0.42 0.85 0.50 -2.50 0.00 0.00 175.30 174.63 2k1q s ARG 118 N -0.47 4.23 -0.19 5.12 3.52 0.11 -0.14 118.95 131.14 2k1q s ARG 118 Ca 0.34 1.00 0.16 0.00 -0.13 0.00 0.00 55.73 57.11 2k1q s ARG 118 Cb -0.20 -3.62 0.56 0.00 -1.56 0.00 0.00 34.95 30.13 2k1q s ARG 118 CO 0.21 -0.45 1.45 0.54 -0.81 0.00 0.00 175.30 176.24 2k1q n ARG 119 N 5.73 3.10 -3.76 5.12 5.12 -0.61 -4.88 116.66 126.48 2k1q n ARG 119 Ca 0.06 -2.88 0.00 0.00 -1.93 0.00 0.00 57.85 53.09 2k1q n ARG 119 Cb 0.48 -1.89 0.00 0.00 -1.16 0.00 0.00 32.46 29.89 2k1q n ARG 119 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k1q n GLY 120 N -0.41 -2.50 0.27 -0.13 0.00 -1.00 -4.81 105.19 96.60 2k1q n GLY 120 Ca 0.22 -1.25 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 2k1q n GLY 120 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2k1q h ASP 121 N 0.00 1.01 0.00 1.61 2.03 -1.96 -3.29 116.42 115.81 2k1q h ASP 121 Ca 0.00 -0.46 -0.00 0.00 -0.73 0.00 0.00 57.03 55.84 2k1q h ASP 121 Cb 0.00 -0.28 -0.00 0.00 -0.83 0.00 0.00 39.33 38.22 2k1q h ASP 121 CO 0.00 1.26 -0.10 -1.54 -1.03 0.00 0.00 179.24 177.83 2k1q n SER 122 N -4.07 2.20 -4.01 4.15 3.41 -1.26 -4.23 113.62 109.82 2k1q n SER 122 Ca -0.02 -3.23 -0.18 0.00 -0.26 0.00 0.00 58.87 55.18 2k1q n SER 122 Cb 0.54 -0.45 -0.15 0.00 -0.26 0.00 0.00 64.21 63.90 2k1q n SER 122 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2k1q s ARG 123 N -2.91 0.66 0.10 4.33 6.06 -1.24 -2.65 118.95 123.29 2k1q s ARG 123 Ca 0.33 -0.30 -0.01 0.00 -2.50 0.00 0.00 55.73 53.25 2k1q s ARG 123 Cb 0.29 -0.63 -0.04 0.00 0.06 0.00 0.00 34.95 34.63 2k1q s ARG 123 CO 0.01 0.17 0.02 0.20 -2.50 0.00 0.00 175.30 173.20 2k1q s GLY 124 N -0.22 0.80 0.04 8.12 0.00 0.08 -1.57 107.32 114.57 2k1q s GLY 124 Ca 0.03 -1.38 0.06 0.00 0.00 0.00 0.00 44.72 43.44 2k1q s GLY 124 CO -0.00 -1.35 -0.18 -1.35 0.00 0.00 0.00 173.10 170.21 2k1q s SER 125 N -3.01 2.16 -0.20 1.64 1.04 0.80 -1.11 113.70 115.02 2k1q s SER 125 Ca 0.18 -0.49 -0.10 0.00 0.48 0.00 0.00 55.95 56.02 2k1q s SER 125 Cb 0.08 -0.17 -0.05 0.00 0.10 0.00 0.00 66.02 65.98 2k1q s SER 125 CO -0.03 0.12 0.13 -0.76 0.98 0.00 0.00 173.24 173.68 2k1q s LEU 126 N -1.13 4.21 0.15 2.42 1.02 0.29 -1.41 118.68 124.23 2k1q s LEU 126 Ca 0.05 0.23 -0.10 0.00 0.02 0.00 0.00 54.13 54.33 2k1q s LEU 126 Cb -0.08 -2.09 -0.01 0.00 0.02 0.00 0.00 46.19 44.03 2k1q s LEU 126 CO 0.01 0.18 1.52 -0.07 0.02 0.00 0.00 176.35 178.02 2k1q h LEU 127 N 6.68 1.03 -8.29 1.79 4.07 -1.85 -3.40 115.31 115.33 2k1q h LEU 127 Ca -0.41 -0.42 -0.69 0.00 0.08 0.00 0.00 57.88 56.45 2k1q h LEU 127 Cb 1.15 -0.28 -0.27 0.00 1.08 0.00 0.00 40.66 42.33 2k1q h LEU 127 CO 0.76 1.22 -0.62 -0.44 -1.08 0.00 0.00 178.44 178.28 2k1q s SER 128 N -6.76 5.18 0.28 -0.43 0.01 -1.26 -5.07 113.70 105.64 2k1q s SER 128 Ca -0.11 -0.91 -0.29 0.00 1.31 0.00 0.00 55.95 55.95 2k1q s SER 128 Cb 0.12 -1.87 -0.10 0.00 0.21 0.00 0.00 66.02 64.38 2k1q s SER 128 CO 0.88 -0.25 1.42 -2.16 0.41 0.00 0.00 173.24 173.54 2k1q s PRO 129 N 1.45 4.26 0.17 12.44 0.04 -1.26 -4.98 135.00 147.12 2k1q s PRO 129 Ca 0.01 2.32 0.06 0.00 0.04 0.00 0.00 61.00 63.43 2k1q s PRO 129 Cb -0.18 -3.08 -0.05 0.00 0.04 0.00 0.00 34.50 31.23 2k1q s PRO 129 CO 0.02 -0.39 -0.12 1.03 0.04 0.00 0.00 177.00 177.59 2k1q s ARG 130 N -0.91 1.15 0.65 4.56 1.81 -1.16 -4.92 118.95 120.14 2k1q s ARG 130 Ca 0.56 -1.50 -0.17 0.00 -1.72 0.00 0.00 55.73 52.90 2k1q s ARG 130 Cb -0.42 -0.80 -0.00 0.00 -0.45 0.00 0.00 34.95 33.28 2k1q s ARG 130 CO 0.48 0.11 1.19 -1.25 -0.68 0.00 0.00 175.30 175.15 2k1q s PRO 131 N -3.71 2.66 0.51 3.54 0.04 -1.26 -0.64 135.00 136.14 2k1q s PRO 131 Ca 0.19 1.73 0.25 0.00 0.04 0.00 0.00 61.00 63.21 2k1q s PRO 131 Cb 0.01 -1.90 1.36 0.00 0.04 0.00 0.00 34.50 34.01 2k1q s PRO 131 CO 0.03 -1.42 2.05 -0.39 0.04 0.00 0.00 177.00 177.30 2k1q h VAL 132 N 0.35 0.66 -1.01 -0.36 -1.51 -1.31 -2.72 116.25 110.35 2k1q h VAL 132 Ca -0.49 -0.59 0.01 0.00 -1.23 0.00 0.00 66.70 64.41 2k1q h VAL 132 Cb 1.29 1.37 -0.05 0.00 -2.13 0.00 0.00 31.29 31.77 2k1q h VAL 132 CO 0.53 0.14 0.67 0.28 -1.23 0.00 0.00 177.57 177.95 2k1q h SER 133 N 0.00 1.16 -0.58 4.19 0.02 -1.90 -1.73 113.55 114.70 2k1q h SER 133 Ca -0.00 -0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.81 2k1q h SER 133 Cb 0.36 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 2k1q h SER 133 CO 0.02 0.84 -0.05 0.22 -1.14 0.00 0.00 176.83 176.72 2k1q h TYR 134 N 1.36 1.18 -0.30 3.45 3.20 -1.86 -2.86 116.97 121.14 2k1q h TYR 134 Ca 0.37 -0.22 -0.07 0.00 3.14 0.00 0.00 58.73 61.95 2k1q h TYR 134 Cb -0.16 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 37.80 2k1q h TYR 134 CO -0.00 1.05 -0.09 -0.07 -1.64 0.00 0.00 178.16 177.41 2k1q h LEU 135 N 0.96 0.48-10.00 2.82 -0.00 -1.46 -3.43 115.31 104.68 2k1q h LEU 135 Ca 0.16 -0.12 -0.55 0.00 -0.00 0.00 0.00 57.88 57.38 2k1q h LEU 135 Cb 0.62 -0.13 0.12 0.00 -0.00 0.00 0.00 40.66 41.27 2k1q h LEU 135 CO 0.04 0.62 0.71 -0.54 -0.00 0.00 0.00 178.44 179.27 2k1q s LYS 136 N -4.79 3.63 0.00 1.13 -0.14 -0.70 -1.98 119.74 116.89 2k1q s LYS 136 Ca -0.07 2.44 0.00 0.00 -1.36 0.00 0.00 55.97 56.98 2k1q s LYS 136 Cb 0.15 -2.63 0.00 0.00 -1.68 0.00 0.00 37.83 33.67 2k1q s LYS 136 CO 0.77 -0.87 0.00 0.41 -0.76 0.00 0.00 175.35 174.90 2k1q n GLY 137 N 0.58 0.51 0.05 -3.33 0.00 -1.26 -4.86 105.19 96.87 2k1q n GLY 137 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.09 2k1q n GLY 137 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k1q n SER 138 N -0.00 0.51 -4.78 1.61 7.64 -0.84 -4.39 113.62 113.37 2k1q n SER 138 Ca 0.00 -0.75 -0.41 0.00 1.01 0.00 0.00 58.87 58.72 2k1q n SER 138 Cb 0.00 0.69 -0.00 0.00 -1.01 0.00 0.00 64.21 63.89 2k1q n SER 138 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2k1q s SER 139 N -1.00 6.31 0.00 6.43 0.15 -1.26 -2.17 113.70 122.16 2k1q s SER 139 Ca 0.02 3.08 0.00 0.00 0.70 0.00 0.00 55.95 59.75 2k1q s SER 139 Cb 0.03 -2.67 0.00 0.00 -1.71 0.00 0.00 66.02 61.67 2k1q s SER 139 CO 0.11 -0.90 0.00 0.61 1.20 0.00 0.00 173.24 174.26 2k1q n GLY 140 N 0.45 2.68 3.73 9.45 0.00 -0.35 -2.88 105.19 118.28 2k1q n GLY 140 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2k1q n GLY 140 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k1q s GLY 141 N -2.76 2.65 0.05 -0.02 0.00 -0.92 -4.00 107.32 102.32 2k1q s GLY 141 Ca 0.00 1.06 -0.08 0.00 0.00 0.00 0.00 44.72 45.69 2k1q s GLY 141 CO 0.00 1.47 0.34 2.56 0.00 0.00 0.00 173.10 177.47 2k1q s PRO 142 N -3.56 3.68 -0.53 2.90 0.04 -1.26 -1.83 135.00 134.45 2k1q s PRO 142 Ca 0.79 0.06 -0.18 0.00 0.04 0.00 0.00 61.00 61.71 2k1q s PRO 142 Cb -0.33 -3.03 0.08 0.00 0.04 0.00 0.00 34.50 31.26 2k1q s PRO 142 CO 0.40 0.60 0.59 -0.51 0.04 0.00 0.00 177.00 178.12 2k1q s LEU 143 N -1.85 5.37 0.56 -3.56 1.02 0.49 -3.39 118.68 117.32 2k1q s LEU 143 Ca 0.31 -1.26 -0.09 0.00 0.02 0.00 0.00 54.13 53.11 2k1q s LEU 143 Cb -0.14 -2.32 -0.04 0.00 0.02 0.00 0.00 46.19 43.71 2k1q s LEU 143 CO 0.17 -0.90 0.94 -0.76 0.02 0.00 0.00 176.35 175.82 2k1q s LEU 144 N 2.32 3.40 0.39 1.79 1.02 0.68 -0.12 118.68 128.16 2k1q s LEU 144 Ca 0.10 1.25 0.03 0.00 0.02 0.00 0.00 54.13 55.53 2k1q s LEU 144 Cb -0.23 -4.26 -0.01 0.00 0.02 0.00 0.00 46.19 41.71 2k1q s LEU 144 CO 0.08 -0.75 0.57 0.00 0.02 0.00 0.00 176.35 176.28 2k1q h PRO 146 N 0.64 0.06 -0.25 0.00 0.13 -1.89 -2.05 132.00 128.64 2k1q h PRO 146 Ca -0.46 -0.02 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 2k1q h PRO 146 Cb 1.25 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2k1q h PRO 146 CO 0.56 0.33 -0.44 0.77 -0.23 0.00 0.00 178.00 178.99 2k1q h SER 147 N 0.06 0.68 0.00 1.44 0.02 -1.98 -3.47 113.55 110.30 2k1q h SER 147 Ca 0.01 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2k1q h SER 147 Cb 0.51 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.85 2k1q h SER 147 CO 0.04 1.02 0.00 0.61 -1.14 0.00 0.00 176.83 177.36 2k1q n GLY 148 N 0.08 1.00 3.14 -3.77 0.00 -0.77 -5.15 105.19 99.73 2k1q n GLY 148 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 2k1q n GLY 148 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k1q s HIS 149 N -1.60 1.23 0.32 1.61 3.76 -1.26 -4.41 115.29 114.94 2k1q s HIS 149 Ca 0.00 -0.35 -0.29 0.00 -0.15 0.00 0.00 55.06 54.27 2k1q s HIS 149 Cb 0.00 -0.73 -0.10 0.00 1.11 0.00 0.00 32.58 32.86 2k1q s HIS 149 CO 0.00 0.03 1.22 0.00 -0.85 0.00 0.00 174.74 175.14 2k1q s ALA 150 N -0.85 3.44 -0.10 -1.40 0.00 0.26 -0.17 121.76 122.94 2k1q s ALA 150 Ca 0.02 1.10 -0.02 0.00 0.00 0.00 0.00 51.96 53.06 2k1q s ALA 150 Cb -0.08 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.58 2k1q s ALA 150 CO 0.01 -0.45 -0.10 0.28 0.00 0.00 0.00 175.76 175.50 2k1q n VAL 151 N 0.89 0.53 -3.95 0.00 0.31 0.83 -1.90 118.33 115.03 2k1q n VAL 151 Ca -0.00 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2k1q n VAL 151 Cb 0.43 -1.18 0.02 0.00 -0.91 0.00 0.00 33.84 32.20 2k1q n VAL 151 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2k1q n GLY 152 N 2.76 0.39 3.23 2.92 0.00 -1.24 -1.82 105.19 111.42 2k1q n GLY 152 Ca -0.18 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 2k1q n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k1q s ILE 153 N -2.04 2.06 0.32 -0.61 1.01 -1.12 -0.38 121.20 120.43 2k1q s ILE 153 Ca 0.26 -1.03 -0.29 0.00 0.00 0.00 0.00 60.65 59.59 2k1q s ILE 153 Cb -0.02 -1.77 -0.11 0.00 0.01 0.00 0.00 42.46 40.57 2k1q s ILE 153 CO 0.02 0.56 1.58 0.12 0.00 0.00 0.00 174.94 177.22 2k1q s PHE 154 N 0.27 2.68 -0.04 3.97 5.36 -0.76 -2.93 117.98 126.54 2k1q s PHE 154 Ca -0.17 0.87 -0.03 0.00 -0.96 0.00 0.00 56.93 56.63 2k1q s PHE 154 Cb -0.17 -4.08 -0.02 0.00 -0.34 0.00 0.00 43.02 38.40 2k1q s PHE 154 CO 0.08 -3.51 -0.08 -2.13 -1.46 0.00 0.00 175.22 168.12 2k1q n ARG 155 N 1.68 0.13 -3.73 10.12 0.63 -0.94 -1.21 116.66 123.35 2k1q n ARG 155 Ca 0.06 0.06 -0.10 0.00 -0.92 0.00 0.00 57.85 56.94 2k1q n ARG 155 Cb 0.38 -0.72 -0.06 0.00 0.45 0.00 0.00 32.46 32.51 2k1q n ARG 155 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2k1q s ALA 156 N -2.14 -0.68 0.07 5.13 0.00 -1.17 -4.84 121.76 118.13 2k1q s ALA 156 Ca -0.08 -0.18 0.05 0.00 0.00 0.00 0.00 51.96 51.74 2k1q s ALA 156 Cb 0.03 0.53 -0.04 0.00 0.00 0.00 0.00 23.12 23.64 2k1q s ALA 156 CO 0.11 -0.55 -0.03 0.00 0.00 0.00 0.00 175.76 175.29 2k1q s ALA 157 N -3.49 3.17 -0.23 0.00 0.00 -1.26 -2.16 121.76 117.80 2k1q s ALA 157 Ca 0.01 -1.11 -0.05 0.00 0.00 0.00 0.00 51.96 50.82 2k1q s ALA 157 Cb 0.02 -1.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.99 2k1q s ALA 157 CO -0.09 0.67 -0.01 0.08 0.00 0.00 0.00 175.76 176.41 2k1q s VAL 158 N -1.21 3.68 0.06 0.00 1.01 0.21 -4.97 120.40 119.17 2k1q s VAL 158 Ca 0.23 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.86 2k1q s VAL 158 Cb -0.11 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 2k1q s VAL 158 CO 0.15 0.39 -0.13 0.00 0.00 0.00 0.00 175.10 175.51 2k1q h THR 160 N 4.39 1.36 0.00 0.00 2.02 -1.89 -3.42 112.91 115.37 2k1q h THR 160 Ca -0.39 -1.30 -0.19 0.00 0.77 0.00 0.00 66.41 65.30 2k1q h THR 160 Cb 1.19 1.96 -0.14 0.00 -1.74 0.00 0.00 68.15 69.43 2k1q h THR 160 CO 0.41 0.37 -0.23 -2.11 0.37 0.00 0.00 175.52 174.33 2k1q n ARG 161 N -4.61 0.87 0.00 6.66 1.85 -1.26 -4.94 116.66 115.24 2k1q n ARG 161 Ca -0.07 -1.54 0.00 0.00 -1.00 0.00 0.00 57.85 55.24 2k1q n ARG 161 Cb 0.35 -0.29 0.00 0.00 -1.05 0.00 0.00 32.46 31.47 2k1q n ARG 161 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2k1q n GLY 162 N -0.25 2.24 3.34 2.89 0.00 -1.26 -5.07 105.19 107.08 2k1q n GLY 162 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 2k1q n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k1q s VAL 163 N -2.17 3.58 -0.19 1.61 1.01 -1.26 -0.76 120.40 122.21 2k1q s VAL 163 Ca 0.00 -0.42 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 2k1q s VAL 163 Cb 0.00 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 2k1q s VAL 163 CO 0.00 0.40 0.49 0.00 0.00 0.00 0.00 175.10 176.00 2k1q s ALA 164 N 1.51 3.54 -0.06 5.51 0.00 0.19 -2.40 121.76 130.04 2k1q s ALA 164 Ca 0.06 -0.41 0.06 0.00 0.00 0.00 0.00 51.96 51.67 2k1q s ALA 164 Cb -0.14 -2.76 -0.08 0.00 0.00 0.00 0.00 23.12 20.13 2k1q s ALA 164 CO -0.02 -0.37 0.03 1.63 0.00 0.00 0.00 175.76 177.03 2k1q n LYS 165 N 4.62 2.72 -4.19 0.00 5.02 -0.90 -2.97 118.16 122.46 2k1q n LYS 165 Ca -0.06 -0.01 -0.19 0.00 -2.02 0.00 0.00 58.31 56.03 2k1q n LYS 165 Cb 0.51 -1.16 -0.12 0.00 -0.02 0.00 0.00 35.03 34.23 2k1q n LYS 165 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2k1q s ALA 166 N -2.18 1.27 0.16 7.82 0.00 -1.22 0.11 121.76 127.72 2k1q s ALA 166 Ca -0.03 -1.04 0.05 0.00 0.00 0.00 0.00 51.96 50.94 2k1q s ALA 166 Cb 0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 2k1q s ALA 166 CO 0.26 0.19 -0.11 0.14 0.00 0.00 0.00 175.76 176.24 2k1q s VAL 167 N -1.29 1.34 -0.07 0.00 -7.23 -0.27 -0.62 120.40 112.27 2k1q s VAL 167 Ca -0.01 -2.11 0.04 0.00 -1.81 0.00 0.00 61.98 58.10 2k1q s VAL 167 Cb -0.10 -1.91 -0.00 0.00 0.56 0.00 0.00 36.38 34.93 2k1q s VAL 167 CO 0.03 -0.70 -0.21 -0.62 -0.31 0.00 0.00 175.10 173.29 2k1q s ASP 168 N -3.21 2.64 0.05 4.85 -1.08 -0.92 -0.74 116.67 118.26 2k1q s ASP 168 Ca 0.18 -0.45 -0.01 0.00 -0.52 0.00 0.00 52.55 51.75 2k1q s ASP 168 Cb 0.02 -0.95 -0.04 0.00 -1.46 0.00 0.00 42.92 40.48 2k1q s ASP 168 CO 0.02 0.16 -0.03 0.72 0.52 0.00 0.00 175.17 176.57 2k1q s PHE 169 N 0.17 0.53 -0.22 -5.34 -0.71 -1.09 -2.20 117.98 109.12 2k1q s PHE 169 Ca -0.10 -1.07 -0.16 0.00 -1.04 0.00 0.00 56.93 54.56 2k1q s PHE 169 Cb -0.15 -0.39 -0.04 0.00 -1.21 0.00 0.00 43.02 41.23 2k1q s PHE 169 CO 0.05 -0.38 0.42 0.08 -1.34 0.00 0.00 175.22 174.05 2k1q s VAL 170 N -3.92 5.17 0.70 -2.49 1.01 -1.15 -4.36 120.40 115.36 2k1q s VAL 170 Ca 0.07 0.72 -0.16 0.00 0.00 0.00 0.00 61.98 62.61 2k1q s VAL 170 Cb 0.08 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.74 2k1q s VAL 170 CO -0.10 0.21 1.21 -2.16 0.00 0.00 0.00 175.10 174.26 2k1q s PRO 171 N 1.59 2.31 0.61 2.72 0.04 -1.26 -2.79 135.00 138.23 2k1q s PRO 171 Ca 0.19 1.79 0.31 0.00 0.04 0.00 0.00 61.00 63.33 2k1q s PRO 171 Cb -0.15 -1.85 1.82 0.00 0.04 0.00 0.00 34.50 34.36 2k1q s PRO 171 CO 0.09 -1.71 2.18 0.28 0.04 0.00 0.00 177.00 177.87 2k1q h VAL 172 N -0.04 0.39 -1.00 -0.36 2.07 -1.71 -2.05 116.25 113.55 2k1q h VAL 172 Ca -0.48 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.05 2k1q h VAL 172 Cb 1.30 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 31.92 2k1q h VAL 172 CO 0.51 0.00 0.66 -0.08 0.02 0.00 0.00 177.57 178.68 2k1q h GLU 173 N 0.00 1.32 -0.95 1.57 4.81 -1.89 -1.73 114.58 117.72 2k1q h GLU 173 Ca 0.04 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2k1q h GLU 173 Cb 0.27 -0.30 -0.05 0.00 0.63 0.00 0.00 28.75 29.30 2k1q h GLU 173 CO -0.00 0.88 0.62 0.77 -0.73 0.00 0.00 179.01 180.55 2k1q h SER 174 N 1.36 1.10 -0.37 1.04 0.02 -1.72 -2.09 113.55 112.89 2k1q h SER 174 Ca 0.37 -0.04 -0.17 0.00 -0.84 0.00 0.00 61.79 61.12 2k1q h SER 174 Cb -0.15 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.11 2k1q h SER 174 CO -0.08 0.81 -0.42 0.24 -1.14 0.00 0.00 176.83 176.24 2k1q h MET 175 N 1.29 0.94 -0.98 3.45 2.86 -1.54 -2.98 114.93 117.97 2k1q h MET 175 Ca 0.35 -0.51 0.01 0.00 -2.06 0.00 0.00 59.70 57.48 2k1q h MET 175 Cb -0.13 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.50 2k1q h MET 175 CO -0.07 1.17 0.65 1.49 1.06 0.00 0.00 176.91 181.20 2k1q h GLU 176 N 0.75 1.29 -0.75 1.72 4.81 -0.92 -0.24 114.58 121.24 2k1q h GLU 176 Ca 0.05 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 2k1q h GLU 176 Cb 1.02 -0.29 -0.03 0.00 0.63 0.00 0.00 28.75 30.08 2k1q h GLU 176 CO 0.10 0.85 0.27 1.15 -0.73 0.00 0.00 179.01 180.65 2k1q h THR 177 N 1.33 1.26 -0.37 0.32 2.02 -1.33 -2.17 112.91 113.97 2k1q h THR 177 Ca 0.36 -0.86 -0.16 0.00 0.77 0.00 0.00 66.41 66.52 2k1q h THR 177 Cb -0.16 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 2k1q h THR 177 CO -0.08 0.34 -0.40 0.74 0.37 0.00 0.00 175.52 176.50 2k1q h THR 178 N 1.10 1.27 -0.96 3.16 2.02 -1.26 -3.11 112.91 115.12 2k1q h THR 178 Ca 0.25 -1.57 0.00 0.00 0.77 0.00 0.00 66.41 65.85 2k1q h THR 178 Cb 0.26 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 68.04 2k1q h THR 178 CO -0.01 0.53 0.61 -0.03 0.37 0.00 0.00 175.52 176.98 2k1q h MET 179 N 0.74 1.29 -1.00 6.66 -1.53 -0.82 -1.88 114.93 118.39 2k1q h MET 179 Ca 0.06 -0.10 0.01 0.00 -3.44 0.00 0.00 59.70 56.23 2k1q h MET 179 Cb 1.00 -0.28 -0.05 0.00 -0.55 0.00 0.00 31.60 31.72 2k1q h MET 179 CO 0.10 0.88 0.66 -0.09 0.14 0.00 0.00 176.91 178.59 2k1q h ARG 180 N 1.32 1.32 -0.42 0.39 2.43 -1.33 -2.50 114.38 115.58 2k1q h ARG 180 Ca 0.35 -0.08 -0.15 0.00 -0.81 0.00 0.00 59.98 59.29 2k1q h ARG 180 Cb -0.11 -0.30 -0.01 0.00 -0.42 0.00 0.00 29.97 29.14 2k1q h ARG 180 CO -0.07 0.88 -0.33 0.00 -1.51 0.00 0.00 179.97 178.94 2k1q h ALA 181 N 1.36 0.60 -6.55 2.80 0.00 -1.38 -3.47 119.26 112.64 2k1q h ALA 181 Ca 0.37 -0.43 -0.52 0.00 0.00 0.00 0.00 54.91 54.32 2k1q h ALA 181 Cb -0.15 -0.14 -0.14 0.00 0.00 0.00 0.00 17.79 17.37 2k1q h ALA 181 CO -0.08 0.67 -0.80 -1.13 0.00 0.00 0.00 179.25 177.92 2k1q n SER 182 N -4.08 -4.01 -4.59 0.00 3.41 -0.76 -4.93 113.62 98.66 2k1q n SER 182 Ca -0.01 -0.91 -0.38 0.00 -0.26 0.00 0.00 58.87 57.31 2k1q n SER 182 Cb 0.52 -3.24 -0.11 0.00 -0.26 0.00 0.00 64.21 61.12 2k1q n SER 182 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2k1q s LYS 183 N -6.80 3.95 -0.12 4.33 2.20 -1.26 -4.94 119.74 117.10 2k1q s LYS 183 Ca 0.72 -0.32 0.17 0.00 -0.36 0.00 0.00 55.97 56.17 2k1q s LYS 183 Cb -0.38 -3.65 0.41 0.00 -1.51 0.00 0.00 37.83 32.69 2k1q s LYS 183 CO 0.88 -0.18 1.19 0.36 -0.36 0.00 0.00 175.35 177.25 2k1q n LYS 184 N 5.05 0.92 -0.38 4.03 2.85 -1.26 -4.82 118.16 124.55 2k1q n LYS 184 Ca -0.14 -2.71 -0.02 0.00 -1.05 0.00 0.00 58.31 54.39 2k1q n LYS 184 Cb 0.52 -0.96 0.11 0.00 -0.65 0.00 0.00 35.03 34.05 2k1q n LYS 184 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2k1q h LYS 185 N 0.93 1.33 0.00 -1.58 1.63 -2.00 -3.52 116.57 113.36 2k1q h LYS 185 Ca -0.09 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.63 2k1q h LYS 185 Cb 1.36 -0.30 0.00 0.00 -0.60 0.00 0.00 32.23 32.69 2k1q h LYS 185 CO 0.04 0.88 0.00 1.17 -3.45 0.00 0.00 179.45 178.09