#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4q n ALA 2 N 0.00 1.62 -2.77 4.61 0.00 -1.26 -5.02 120.51 117.69 2k4q n ALA 2 Ca 0.00 -0.84 -0.28 0.00 0.00 0.00 0.00 53.44 52.32 2k4q n ALA 2 Cb 0.00 0.19 -0.06 0.00 0.00 0.00 0.00 19.45 19.58 2k4q n ALA 2 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2k4q s MET 3 N -2.39 2.82 0.32 0.00 1.75 -1.26 -5.13 119.30 115.42 2k4q s MET 3 Ca -0.29 -0.84 0.02 0.00 -1.25 0.00 0.00 55.69 53.34 2k4q s MET 3 Cb 0.10 -2.64 -0.03 0.00 2.84 0.00 0.00 34.83 35.11 2k4q s MET 3 CO 0.39 0.51 0.50 -1.64 -0.65 0.00 0.00 175.02 174.13 2k4q s MET 4 N -2.82 3.44 0.27 4.11 1.00 -1.26 -5.02 119.30 119.02 2k4q s MET 4 Ca 0.30 -0.49 0.04 0.00 0.00 0.00 0.00 55.69 55.54 2k4q s MET 4 Cb -0.11 -2.73 0.36 0.00 0.00 0.00 0.00 34.83 32.35 2k4q s MET 4 CO 0.22 0.21 1.65 -1.00 0.00 0.00 0.00 175.02 176.10 2k4q h PRO 5 N 0.86 0.31 -5.30 2.03 0.13 -2.05 -3.45 132.00 124.53 2k4q h PRO 5 Ca -0.50 -0.16 -0.39 0.00 -0.87 0.00 0.00 66.00 64.08 2k4q h PRO 5 Cb 1.22 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.19 2k4q h PRO 5 CO 0.61 0.70 -0.74 0.14 -0.23 0.00 0.00 178.00 178.48 2k4q s VAL 6 N -4.08 1.28 1.18 1.56 -7.23 -1.26 -5.16 120.40 106.69 2k4q s VAL 6 Ca -0.05 -1.82 -0.18 0.00 -1.81 0.00 0.00 61.98 58.12 2k4q s VAL 6 Cb 0.13 -1.61 0.28 0.00 0.56 0.00 0.00 36.38 35.73 2k4q s VAL 6 CO 0.79 -0.52 1.11 -2.16 -0.31 0.00 0.00 175.10 174.01 2k4q s PRO 7 N -2.98 -1.04 0.23 4.82 0.04 -1.26 -5.09 135.00 129.72 2k4q s PRO 7 Ca 0.11 0.00 0.09 0.00 0.04 0.00 0.00 61.00 61.25 2k4q s PRO 7 Cb -0.03 -1.61 -0.05 0.00 0.04 0.00 0.00 34.50 32.85 2k4q s PRO 7 CO 0.02 -3.60 -0.17 0.54 0.04 0.00 0.00 177.00 173.83 2k4q s ASN 8 N -3.84 2.98 0.31 6.66 4.22 -1.26 -5.16 114.94 118.86 2k4q s ASN 8 Ca 0.70 -1.01 0.00 0.00 -2.14 0.00 0.00 52.86 50.41 2k4q s ASN 8 Cb -0.11 -0.20 0.00 0.00 1.28 0.00 0.00 41.25 42.22 2k4q s ASN 8 CO 0.56 -0.08 0.00 -0.81 -2.04 0.00 0.00 177.10 174.73 2k4q n PRO 9 N -0.42 0.36 -3.44 3.55 -0.04 -1.26 -5.08 135.00 128.67 2k4q n PRO 9 Ca -0.07 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.17 2k4q n PRO 9 Cb 0.60 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.07 2k4q n PRO 9 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2k4q s THR 10 N -0.31 2.24 0.17 0.52 -4.23 -1.26 -5.15 115.64 107.62 2k4q s THR 10 Ca 0.00 -1.25 0.08 0.00 -1.18 0.00 0.00 61.69 59.34 2k4q s THR 10 Cb 0.00 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 2k4q s THR 10 CO 0.00 0.00 -0.17 0.00 -0.54 0.00 0.00 174.62 173.91 2k4q s MET 11 N -4.36 1.27 0.20 3.99 0.23 -1.26 -5.12 119.30 114.25 2k4q s MET 11 Ca 0.49 -1.43 -0.30 0.00 -1.03 0.00 0.00 55.69 53.41 2k4q s MET 11 Cb -0.04 -1.25 -0.09 0.00 -1.53 0.00 0.00 34.83 31.91 2k4q s MET 11 CO 0.30 0.24 1.30 -1.25 -2.03 0.00 0.00 175.02 173.58 2k4q s PRO 12 N -2.96 4.40 0.34 3.16 0.04 -1.26 -4.99 135.00 133.73 2k4q s PRO 12 Ca 0.17 2.04 -0.28 0.00 0.04 0.00 0.00 61.00 62.97 2k4q s PRO 12 Cb -0.05 -3.19 -0.09 0.00 0.04 0.00 0.00 34.50 31.21 2k4q s PRO 12 CO 0.06 -0.23 1.20 0.08 0.04 0.00 0.00 177.00 178.16 2k4q s VAL 13 N 0.03 3.06 0.33 -0.36 1.01 -1.26 -5.05 120.40 118.17 2k4q s VAL 13 Ca 0.56 1.00 0.09 0.00 0.00 0.00 0.00 61.98 63.63 2k4q s VAL 13 Cb -0.36 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 2k4q s VAL 13 CO 0.39 0.19 0.07 -0.54 0.00 0.00 0.00 175.10 175.21 2k4q s LYS 14 N -1.89 2.24 0.00 2.72 1.02 -1.26 -5.07 119.74 117.49 2k4q s LYS 14 Ca 0.51 -1.63 0.00 0.00 0.02 0.00 0.00 55.97 54.87 2k4q s LYS 14 Cb -0.34 -2.07 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 2k4q s LYS 14 CO 0.45 0.14 0.00 0.41 -0.92 0.00 0.00 175.35 175.43 2k4q n GLY 15 N -1.04 3.44 3.60 -3.33 0.00 -1.10 -5.04 105.19 101.71 2k4q n GLY 15 Ca -0.04 -0.66 -0.06 0.00 0.00 0.00 0.00 46.02 45.26 2k4q n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k4q s ALA 16 N 0.00 -2.02 -1.20 4.61 0.00 -1.12 -4.95 121.76 117.07 2k4q s ALA 16 Ca 0.00 1.63 -0.04 0.00 0.00 0.00 0.00 51.96 53.55 2k4q s ALA 16 Cb 0.00 -0.64 0.20 0.00 0.00 0.00 0.00 23.12 22.69 2k4q s ALA 16 CO 0.00 -0.42 2.15 0.41 0.00 0.00 0.00 175.76 177.90 2k4q n GLY 17 N 0.30 5.57 3.36 0.00 0.00 -1.26 -4.73 105.19 108.43 2k4q n GLY 17 Ca -0.03 -2.27 -0.28 0.00 0.00 0.00 0.00 46.02 43.43 2k4q n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k4q s THR 18 N -2.39 2.12 -0.18 2.61 2.01 -1.26 -4.61 115.64 113.94 2k4q s THR 18 Ca 0.48 -1.62 -0.14 0.00 0.31 0.00 0.00 61.69 60.72 2k4q s THR 18 Cb 0.18 -1.87 0.05 0.00 0.01 0.00 0.00 72.50 70.88 2k4q s THR 18 CO -0.10 0.13 0.46 0.28 -0.69 0.00 0.00 174.62 174.70 2k4q s THR 19 N -1.00 -0.01 -0.10 -0.82 -1.32 -1.26 0.06 115.64 111.19 2k4q s THR 19 Ca 0.12 0.03 -0.08 0.00 -1.21 0.00 0.00 61.69 60.55 2k4q s THR 19 Cb -0.10 -0.65 -0.04 0.00 -1.51 0.00 0.00 72.50 70.20 2k4q s THR 19 CO 0.05 0.01 0.19 -1.48 -2.21 0.00 0.00 174.62 171.18 2k4q s LEU 20 N 0.73 4.40 0.12 9.08 2.34 -1.23 -2.43 118.68 131.70 2k4q s LEU 20 Ca -0.04 0.54 0.10 0.00 0.06 0.00 0.00 54.13 54.79 2k4q s LEU 20 Cb -0.05 -2.16 -0.04 0.00 -0.56 0.00 0.00 46.19 43.38 2k4q s LEU 20 CO -0.05 0.38 -0.24 0.26 -1.06 0.00 0.00 176.35 175.64 2k4q s TRP 21 N -0.97 2.08 -0.12 3.48 0.51 0.37 -2.77 118.94 121.52 2k4q s TRP 21 Ca 0.16 -0.40 -0.04 0.00 -2.12 0.00 0.00 56.10 53.70 2k4q s TRP 21 Cb -0.13 -1.13 -0.04 0.00 -0.81 0.00 0.00 33.47 31.37 2k4q s TRP 21 CO 0.05 0.29 0.04 0.54 -0.51 0.00 0.00 176.95 177.36 2k4q s VAL 22 N -1.16 4.60 -0.00 4.03 0.11 0.11 -1.23 120.40 126.86 2k4q s VAL 22 Ca 0.11 -0.12 -0.14 0.00 -2.93 0.00 0.00 61.98 58.89 2k4q s VAL 22 Cb -0.10 -2.99 -0.06 0.00 -1.53 0.00 0.00 36.38 31.70 2k4q s VAL 22 CO 0.05 0.56 0.40 -0.72 -3.33 0.00 0.00 175.10 172.06 2k4q s TYR 23 N -0.44 3.73 0.23 1.54 -0.85 -1.26 -1.22 117.35 119.08 2k4q s TYR 23 Ca 0.09 0.98 -0.32 0.00 -0.52 0.00 0.00 57.07 57.30 2k4q s TYR 23 Cb -0.12 -2.28 -0.12 0.00 0.38 0.00 0.00 41.96 39.82 2k4q s TYR 23 CO 0.02 0.65 1.68 1.17 -1.52 0.00 0.00 175.55 177.55 2k4q n LYS 24 N 1.81 2.73 -0.08 -3.49 4.81 -1.26 -4.85 118.16 117.83 2k4q n LYS 24 Ca -0.14 0.98 0.25 0.00 -0.87 0.00 0.00 58.31 58.53 2k4q n LYS 24 Cb 0.52 -2.81 0.72 0.00 0.02 0.00 0.00 35.03 33.48 2k4q n LYS 24 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2k4q h GLY 25 N 6.17 0.00 -7.47 3.14 0.00 -1.97 -3.34 103.07 99.59 2k4q h GLY 25 Ca -0.44 0.00 -0.72 0.00 0.00 0.00 0.00 47.33 46.17 2k4q h GLY 25 CO 0.91 0.00 -0.47 -0.45 0.00 0.00 0.00 176.54 176.53 2k4q s SER 26 N -5.74 5.67 0.00 0.19 0.15 -1.26 -4.82 113.70 107.89 2k4q s SER 26 Ca -0.05 -1.39 0.00 0.00 0.70 0.00 0.00 55.95 55.21 2k4q s SER 26 Cb 0.20 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2k4q s SER 26 CO 0.72 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 175.26 2k4q n GLY 27 N 4.94 -2.05 3.10 9.45 0.00 -1.26 -5.05 105.19 114.33 2k4q n GLY 27 Ca -0.11 0.80 -0.07 0.00 0.00 0.00 0.00 46.02 46.64 2k4q n GLY 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k4q s ASP 28 N -4.00 0.46 1.02 1.61 1.11 -1.26 -4.93 116.67 110.69 2k4q s ASP 28 Ca 0.00 -1.01 -0.02 0.00 0.18 0.00 0.00 52.55 51.70 2k4q s ASP 28 Cb 0.00 0.21 0.03 0.00 1.07 0.00 0.00 42.92 44.23 2k4q s ASP 28 CO 0.00 -0.61 0.11 -0.81 1.18 0.00 0.00 175.17 175.03 2k4q n PRO 29 N 0.09 -1.23 0.19 8.23 -0.04 -1.26 -4.57 135.00 136.41 2k4q n PRO 29 Ca -0.13 -0.17 0.06 0.00 -0.04 0.00 0.00 63.50 63.21 2k4q n PRO 29 Cb 0.61 -0.16 0.29 0.00 -0.04 0.00 0.00 33.50 34.20 2k4q n PRO 29 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2k4q h TYR 30 N -1.63 0.00 -0.52 0.54 -1.99 -2.02 -2.00 116.97 109.35 2k4q h TYR 30 Ca -0.04 0.00 0.09 0.00 2.00 0.00 0.00 58.73 60.78 2k4q h TYR 30 Cb 0.12 0.00 -0.07 0.00 2.00 0.00 0.00 36.73 38.78 2k4q h TYR 30 CO 0.00 0.36 0.11 0.00 -0.00 0.00 0.00 178.16 178.63 2k4q h ALA 31 N 1.64 0.59 -0.28 3.88 0.00 -2.06 -3.37 119.26 119.65 2k4q h ALA 31 Ca -0.00 0.11 -0.26 0.00 0.00 0.00 0.00 54.91 54.76 2k4q h ALA 31 Cb 0.98 0.15 -0.17 0.00 0.00 0.00 0.00 17.79 18.75 2k4q h ALA 31 CO 0.05 -0.30 -0.56 -1.71 0.00 0.00 0.00 179.25 176.72 2k4q n ASN 32 N -5.11 -2.57 0.06 0.00 5.15 -1.22 -4.98 115.26 106.59 2k4q n ASN 32 Ca 0.06 -3.22 0.09 0.00 -0.60 0.00 0.00 54.58 50.92 2k4q n ASN 32 Cb 0.26 1.54 0.39 0.00 -0.53 0.00 0.00 39.78 41.45 2k4q n ASN 32 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2k4q n PRO 33 N 1.69 0.09 0.32 1.20 -0.04 -0.75 -2.87 135.00 134.64 2k4q n PRO 33 Ca 0.11 0.34 0.20 0.00 -0.04 0.00 0.00 63.50 64.11 2k4q n PRO 33 Cb 0.61 -1.68 1.09 0.00 -0.04 0.00 0.00 33.50 33.48 2k4q n PRO 33 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2k4q h LEU 34 N 0.00 0.00 -1.96 1.53 4.07 -1.93 -1.90 115.31 115.12 2k4q h LEU 34 Ca 0.00 0.00 0.24 0.00 0.08 0.00 0.00 57.88 58.20 2k4q h LEU 34 Cb 0.30 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.00 2k4q h LEU 34 CO 0.00 0.00 0.61 -1.28 -1.08 0.00 0.00 178.44 176.69 2k4q h SER 35 N 0.00 0.03 -3.15 -0.43 0.87 -1.93 -3.39 113.55 105.55 2k4q h SER 35 Ca 0.01 0.00 -0.60 0.00 -1.23 0.00 0.00 61.79 59.97 2k4q h SER 35 Cb 0.11 -0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 61.99 2k4q h SER 35 CO -0.00 0.01 -0.22 -0.62 -0.53 0.00 0.00 176.83 175.48 2k4q s ASP 36 N -5.70 6.69 -0.04 6.23 2.15 -0.72 -4.97 116.67 120.31 2k4q s ASP 36 Ca -0.05 0.81 0.17 0.00 0.43 0.00 0.00 52.55 53.91 2k4q s ASP 36 Cb 0.21 -2.24 0.54 0.00 -0.30 0.00 0.00 42.92 41.13 2k4q s ASP 36 CO 0.77 0.18 1.46 1.33 -0.17 0.00 0.00 175.17 178.74 2k4q n VAL 37 N 2.73 1.31 -0.20 1.11 0.24 -1.26 -4.37 118.33 117.89 2k4q n VAL 37 Ca -0.12 -1.12 0.05 0.00 -2.04 0.00 0.00 64.34 61.11 2k4q n VAL 37 Cb 0.52 0.35 0.27 0.00 -1.47 0.00 0.00 33.84 33.51 2k4q n VAL 37 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2k4q n ASP 38 N 0.97 4.04 -4.47 -1.34 8.00 -1.26 -4.98 116.55 117.52 2k4q n ASP 38 Ca 0.20 -2.56 -0.35 0.00 0.71 0.00 0.00 54.79 52.79 2k4q n ASP 38 Cb 0.65 -0.60 0.09 0.00 -0.02 0.00 0.00 41.12 41.24 2k4q n ASP 38 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 2k4q n TRP 39 N 0.47 -0.83 -4.42 1.24 -0.00 -1.26 -4.55 117.44 108.09 2k4q n TRP 39 Ca 0.18 0.32 -0.22 0.00 -0.00 0.00 0.00 57.50 57.78 2k4q n TRP 39 Cb 0.84 -1.89 -0.16 0.00 -0.00 0.00 0.00 31.31 30.10 2k4q n TRP 39 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 2k4q s SER 40 N -1.66 1.37 -0.14 5.87 0.15 -0.36 -4.98 113.70 113.95 2k4q s SER 40 Ca 0.64 -0.22 -0.24 0.00 0.70 0.00 0.00 55.95 56.83 2k4q s SER 40 Cb -0.31 -0.56 -0.03 0.00 -1.71 0.00 0.00 66.02 63.42 2k4q s SER 40 CO 0.60 0.02 0.74 -0.13 1.20 0.00 0.00 173.24 175.67 2k4q s ARG 41 N 0.58 4.33 -0.06 5.44 3.00 -1.26 0.06 118.95 131.03 2k4q s ARG 41 Ca -0.10 0.87 -0.05 0.00 0.00 0.00 0.00 55.73 56.45 2k4q s ARG 41 Cb -0.13 -3.53 -0.03 0.00 0.00 0.00 0.00 34.95 31.26 2k4q s ARG 41 CO 0.02 -0.16 0.24 -0.07 0.00 0.00 0.00 175.30 175.33 2k4q h LEU 42 N 7.71 -0.16 0.00 2.53 3.38 -1.86 -3.47 115.31 123.44 2k4q h LEU 42 Ca -0.34 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2k4q h LEU 42 Cb 1.16 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2k4q h LEU 42 CO 0.79 0.23 0.00 0.00 0.09 0.00 0.00 178.44 179.55 2k4q n ALA 43 N -2.63 0.00 -2.68 1.53 0.00 -1.24 -4.46 120.51 111.03 2k4q n ALA 43 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.05 2k4q n ALA 43 Cb 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.43 2k4q n ALA 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2k4q s LYS 44 N -1.83 4.06 -0.53 0.00 -2.85 -1.26 -3.50 119.74 113.83 2k4q s LYS 44 Ca 0.00 -0.28 -0.27 0.00 -1.00 0.00 0.00 55.97 54.42 2k4q s LYS 44 Cb 0.00 -3.52 0.03 0.00 -2.06 0.00 0.00 37.83 32.28 2k4q s LYS 44 CO 0.00 0.07 1.10 0.08 0.10 0.00 0.00 175.35 176.70 2k4q s VAL 45 N 1.02 4.19 0.06 1.79 1.01 0.11 -3.62 120.40 124.97 2k4q s VAL 45 Ca 0.07 0.85 -0.26 0.00 0.00 0.00 0.00 61.98 62.65 2k4q s VAL 45 Cb -0.13 -4.62 -0.17 0.00 0.00 0.00 0.00 36.38 31.46 2k4q s VAL 45 CO 0.04 -1.15 1.60 0.11 0.00 0.00 0.00 175.10 175.70 2k4q h LYS 46 N 9.36 -0.24 -4.47 2.72 1.57 -0.77 -3.36 116.57 121.38 2k4q h LYS 46 Ca -0.25 0.02 -0.24 0.00 -1.87 0.00 0.00 60.65 58.31 2k4q h LYS 46 Cb 1.06 0.05 -0.14 0.00 0.08 0.00 0.00 32.23 33.29 2k4q h LYS 46 CO 1.13 -0.08 -0.52 0.34 -0.57 0.00 0.00 179.45 179.75 2k4q s ASP 47 N -5.06 0.28 -0.07 0.86 2.15 -1.24 -2.70 116.67 110.89 2k4q s ASP 47 Ca -0.14 -1.36 -0.03 0.00 0.43 0.00 0.00 52.55 51.44 2k4q s ASP 47 Cb 0.04 0.43 0.04 0.00 -0.30 0.00 0.00 42.92 43.14 2k4q s ASP 47 CO 0.64 -0.92 0.15 -0.22 -0.17 0.00 0.00 175.17 174.65 2k4q s LEU 48 N -3.16 0.61 -0.44 -1.34 2.96 -1.26 -2.23 118.68 113.82 2k4q s LEU 48 Ca 0.37 0.31 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 2k4q s LEU 48 Cb 0.05 0.36 0.13 0.00 0.50 0.00 0.00 46.19 47.23 2k4q s LEU 48 CO 0.13 -0.16 0.21 -0.89 -1.32 0.00 0.00 176.35 174.33 2k4q s THR 49 N 1.32 1.68 -0.27 3.68 2.01 0.95 -5.00 115.64 120.00 2k4q s THR 49 Ca -0.08 -2.59 -0.29 0.00 0.31 0.00 0.00 61.69 59.04 2k4q s THR 49 Cb -0.12 -2.19 -0.02 0.00 0.01 0.00 0.00 72.50 70.19 2k4q s THR 49 CO -0.06 -0.83 1.65 -2.16 -0.69 0.00 0.00 174.62 172.53 2k4q s PRO 50 N 0.38 3.63 0.00 4.92 0.04 -1.26 -3.26 135.00 139.45 2k4q s PRO 50 Ca 0.16 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2k4q s PRO 50 Cb -0.24 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.22 2k4q s PRO 50 CO -0.03 -1.49 0.00 0.41 0.04 0.00 0.00 177.00 175.93 2k4q n GLY 51 N 4.94 1.20 3.21 0.56 0.00 -1.26 -5.06 105.19 108.77 2k4q n GLY 51 Ca 0.20 -1.51 -0.12 0.00 0.00 0.00 0.00 46.02 44.59 2k4q n GLY 51 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k4q s GLU 52 N 1.44 1.09 -0.02 1.61 -1.05 -1.26 -5.06 118.70 115.45 2k4q s GLU 52 Ca 0.00 -1.54 0.04 0.00 -0.15 0.00 0.00 54.97 53.32 2k4q s GLU 52 Cb 0.00 0.04 -0.06 0.00 -0.44 0.00 0.00 34.13 33.67 2k4q s GLU 52 CO 0.00 -0.25 0.06 1.47 0.95 0.00 0.00 175.26 177.49 2k4q n LEU 53 N -0.22 0.00 -4.14 1.83 -0.00 -1.26 -4.43 117.00 108.79 2k4q n LEU 53 Ca -0.04 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.63 2k4q n LEU 53 Cb 0.64 0.05 -0.08 0.00 -0.00 0.00 0.00 43.42 44.03 2k4q n LEU 53 CO 0.33 0.05 -0.23 1.07 -0.00 0.00 0.00 177.39 178.60 2k4q n THR 54 N -1.88 -0.30 -2.82 1.47 5.66 -1.26 -4.79 114.28 110.37 2k4q n THR 54 Ca -0.04 -0.15 -0.11 0.00 -3.05 0.00 0.00 64.05 60.71 2k4q n THR 54 Cb 0.35 -0.58 0.05 0.00 -1.55 0.00 0.00 70.33 68.59 2k4q n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k4q n ALA 55 N -3.78 0.46 -0.43 1.79 0.00 -1.26 -5.05 120.51 112.24 2k4q n ALA 55 Ca -0.03 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.33 2k4q n ALA 55 Cb 0.47 0.26 0.00 0.00 0.00 0.00 0.00 19.45 20.17 2k4q n ALA 55 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2k4q n GLU 56 N -1.78 0.00 -2.53 0.00 1.02 -1.26 -4.83 120.64 111.26 2k4q n GLU 56 Ca 0.09 0.48 -0.18 0.00 -0.02 0.00 0.00 57.16 57.53 2k4q n GLU 56 Cb 0.32 -1.29 -0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2k4q n GLU 56 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2k4q n SER 57 N -1.67 -5.06 -4.73 1.62 2.88 -1.26 -4.93 113.62 100.47 2k4q n SER 57 Ca 0.00 0.02 -0.41 0.00 -1.33 0.00 0.00 58.87 57.15 2k4q n SER 57 Cb 0.00 -4.22 -0.05 0.00 -0.75 0.00 0.00 64.21 59.19 2k4q n SER 57 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 2k4q s TYR 58 N -2.89 3.80 0.44 0.66 5.04 -1.26 -5.06 117.35 118.08 2k4q s TYR 58 Ca 0.05 1.78 0.06 0.00 -2.44 0.00 0.00 57.07 56.52 2k4q s TYR 58 Cb -0.02 -3.09 -0.05 0.00 0.35 0.00 0.00 41.96 39.15 2k4q s TYR 58 CO 0.06 0.08 0.06 0.16 -1.34 0.00 0.00 175.55 174.58 2k4q s ASP 59 N -0.22 4.09 -0.20 4.32 -4.77 -1.26 -5.13 116.67 113.50 2k4q s ASP 59 Ca 0.46 -1.38 -0.08 0.00 -3.30 0.00 0.00 52.55 48.26 2k4q s ASP 59 Cb -0.25 -0.14 -0.04 0.00 -1.09 0.00 0.00 42.92 41.39 2k4q s ASP 59 CO 0.31 -0.60 0.09 -1.81 0.70 0.00 0.00 175.17 173.86 2k4q s ASP 60 N -3.82 5.72 -0.36 2.11 1.11 -1.26 -5.00 116.67 115.18 2k4q s ASP 60 Ca 0.29 0.06 0.14 0.00 0.18 0.00 0.00 52.55 53.22 2k4q s ASP 60 Cb 0.06 -2.00 0.45 0.00 1.07 0.00 0.00 42.92 42.50 2k4q s ASP 60 CO 0.15 0.12 1.01 -1.54 1.18 0.00 0.00 175.17 176.10 2k4q n SER 61 N 3.87 2.60 -4.23 0.27 3.41 -1.26 -5.10 113.62 113.19 2k4q n SER 61 Ca -0.16 -3.05 -0.28 0.00 -0.26 0.00 0.00 58.87 55.12 2k4q n SER 61 Cb 0.52 -0.50 0.17 0.00 -0.26 0.00 0.00 64.21 64.14 2k4q n SER 61 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2k4q s TYR 62 N -3.29 1.49 0.10 7.33 1.51 -1.26 -5.00 117.35 118.24 2k4q s TYR 62 Ca 0.34 0.13 -0.29 0.00 -1.01 0.00 0.00 57.07 56.25 2k4q s TYR 62 Cb 0.44 -3.86 -0.13 0.00 -0.11 0.00 0.00 41.96 38.30 2k4q s TYR 62 CO -0.04 -2.47 1.65 1.25 -1.11 0.00 0.00 175.55 174.83 2k4q h LEU 63 N -1.40 -0.68 -2.46 -1.29 5.85 -2.03 -3.47 115.31 109.83 2k4q h LEU 63 Ca -0.42 0.06 -0.25 0.00 0.84 0.00 0.00 57.88 58.11 2k4q h LEU 63 Cb 1.24 0.23 0.19 0.00 0.37 0.00 0.00 40.66 42.69 2k4q h LEU 63 CO 0.37 -0.38 -0.83 -0.67 -0.34 0.00 0.00 178.44 176.59 2k4q n ASP 64 N -5.38 -6.67 -3.65 1.25 -0.08 -1.26 -4.89 116.55 95.87 2k4q n ASP 64 Ca -0.09 -0.69 -0.41 0.00 -1.51 0.00 0.00 54.79 52.08 2k4q n ASP 64 Cb 0.29 -5.19 -0.00 0.00 2.34 0.00 0.00 41.12 38.55 2k4q n ASP 64 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2k4q n ASP 65 N -3.17 6.57 -1.67 1.67 5.68 -1.26 -4.55 116.55 119.81 2k4q n ASP 65 Ca -0.07 -3.06 -0.20 0.00 -0.50 0.00 0.00 54.79 50.96 2k4q n ASP 65 Cb 0.62 -1.45 -0.08 0.00 -1.14 0.00 0.00 41.12 39.07 2k4q n ASP 65 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2k4q n GLU 66 N 3.09 -1.47 -2.11 0.11 4.71 -1.26 -4.85 120.64 118.86 2k4q n GLU 66 Ca 0.53 1.18 -0.27 0.00 -0.01 0.00 0.00 57.16 58.60 2k4q n GLU 66 Cb 0.30 -5.59 0.02 0.00 -1.01 0.00 0.00 31.44 25.16 2k4q n GLU 66 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2k4q n ASP 67 N -1.39 5.20 -4.73 1.62 2.03 -1.26 -5.07 116.55 112.96 2k4q n ASP 67 Ca -0.21 -3.75 -0.36 0.00 0.52 0.00 0.00 54.79 51.00 2k4q n ASP 67 Cb 0.67 -0.46 0.07 0.00 -0.72 0.00 0.00 41.12 40.68 2k4q n ASP 67 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k4q s ALA 68 N -3.62 2.29 -0.13 -1.67 0.00 -1.26 -4.95 121.76 112.42 2k4q s ALA 68 Ca 0.51 1.08 0.17 0.00 0.00 0.00 0.00 51.96 53.72 2k4q s ALA 68 Cb 0.42 -3.51 -0.24 0.00 0.00 0.00 0.00 23.12 19.79 2k4q s ALA 68 CO -0.06 -1.66 0.39 -0.25 0.00 0.00 0.00 175.76 174.18 2k4q n ASP 69 N -2.17 0.34 -3.64 0.00 8.00 -1.26 -4.99 116.55 112.83 2k4q n ASP 69 Ca 0.15 0.16 -0.07 0.00 0.71 0.00 0.00 54.79 55.73 2k4q n ASP 69 Cb 0.49 0.75 -0.07 0.00 -0.02 0.00 0.00 41.12 42.27 2k4q n ASP 69 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2k4q s TRP 70 N -2.73 -0.47 0.26 1.24 -0.00 -1.26 -5.04 118.94 110.95 2k4q s TRP 70 Ca -0.07 1.08 -0.01 0.00 -0.00 0.00 0.00 56.10 57.09 2k4q s TRP 70 Cb 0.08 0.37 0.35 0.00 -0.00 0.00 0.00 33.47 34.26 2k4q s TRP 70 CO 0.84 -0.23 1.75 1.15 -0.00 0.00 0.00 176.95 180.46 2k4q h THR 71 N 3.86 1.24 -4.24 5.86 2.02 -2.04 -3.44 112.91 116.17 2k4q h THR 71 Ca -0.28 -1.04 -0.50 0.00 0.77 0.00 0.00 66.41 65.36 2k4q h THR 71 Cb 1.18 0.95 0.14 0.00 -1.74 0.00 0.00 68.15 68.67 2k4q h THR 71 CO 0.13 0.36 0.30 0.00 0.37 0.00 0.00 175.52 176.68 2k4q s ALA 72 N -4.91 2.02 0.28 6.16 0.00 -1.26 -5.07 121.76 118.98 2k4q s ALA 72 Ca -0.09 0.16 0.06 0.00 0.00 0.00 0.00 51.96 52.09 2k4q s ALA 72 Cb 0.14 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 2k4q s ALA 72 CO 0.81 -1.96 0.21 0.25 0.00 0.00 0.00 175.76 175.06 2k4q n THR 73 N -3.64 0.00 -1.26 0.00 -2.24 -1.26 -5.09 114.28 100.78 2k4q n THR 73 Ca 0.08 -1.98 -0.29 0.00 -2.27 0.00 0.00 64.05 59.59 2k4q n THR 73 Cb 0.54 0.94 0.19 0.00 -2.10 0.00 0.00 70.33 69.90 2k4q n THR 73 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2k4q s GLY 74 N -2.93 1.59 -0.21 3.38 0.00 -1.26 -5.07 107.32 102.81 2k4q s GLY 74 Ca 0.30 -0.68 -0.04 0.00 0.00 0.00 0.00 44.72 44.30 2k4q s GLY 74 CO 0.21 0.04 0.28 1.20 0.00 0.00 0.00 173.10 174.83 2k4q s GLN 75 N -5.25 0.24 0.00 2.90 -0.21 -1.26 -5.12 119.66 110.96 2k4q s GLN 75 Ca 0.68 0.39 0.00 0.00 0.02 0.00 0.00 55.36 56.45 2k4q s GLN 75 Cb -0.14 -0.80 0.00 0.00 1.00 0.00 0.00 33.01 33.07 2k4q s GLN 75 CO 0.56 -0.61 0.00 0.41 -2.12 0.00 0.00 175.29 173.53 2k4q n GLY 76 N 5.34 -0.40 3.26 3.09 0.00 -1.26 -4.91 105.19 110.31 2k4q n GLY 76 Ca -0.05 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 2k4q n GLY 76 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k4q n GLN 77 N 0.00 -6.12 -3.01 1.61 1.13 -1.26 -5.02 117.38 104.71 2k4q n GLN 77 Ca 0.00 0.79 -0.18 0.00 -1.94 0.00 0.00 57.00 55.67 2k4q n GLN 77 Cb 0.00 -5.64 0.03 0.00 0.11 0.00 0.00 30.24 24.74 2k4q n GLN 77 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2k4q s LYS 78 N -5.25 2.61 -0.78 -1.09 1.02 -1.26 -5.03 119.74 109.96 2k4q s LYS 78 Ca 0.01 -1.39 -0.26 0.00 0.02 0.00 0.00 55.97 54.34 2k4q s LYS 78 Cb -0.00 -2.71 0.02 0.00 -0.52 0.00 0.00 37.83 34.62 2k4q s LYS 78 CO 0.68 -0.52 1.42 -1.12 -0.92 0.00 0.00 175.35 174.89 2k4q s SER 79 N -4.48 6.05 -0.20 2.83 0.01 -1.26 -4.89 113.70 111.76 2k4q s SER 79 Ca 0.58 -0.52 -0.36 0.00 1.31 0.00 0.00 55.95 56.96 2k4q s SER 79 Cb -0.08 -2.56 0.15 0.00 0.21 0.00 0.00 66.02 63.74 2k4q s SER 79 CO 0.36 -1.90 1.35 0.00 0.41 0.00 0.00 173.24 173.46 2k4q s ALA 80 N 6.27 -2.24 0.00 1.44 0.00 -1.26 -3.59 121.76 122.38 2k4q s ALA 80 Ca 0.43 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.92 2k4q s ALA 80 Cb -0.07 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.91 2k4q s ALA 80 CO 0.11 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 175.56 2k4q n GLY 81 N -0.17 0.85 3.46 0.00 0.00 -1.26 -4.90 105.19 103.16 2k4q n GLY 81 Ca -0.00 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 2k4q n GLY 81 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2k4q n ASP 82 N -0.74 -1.32 -3.94 1.61 5.68 -1.26 -4.88 116.55 111.71 2k4q n ASP 82 Ca 0.00 0.57 -0.22 0.00 -0.50 0.00 0.00 54.79 54.64 2k4q n ASP 82 Cb 0.26 -1.21 -0.16 0.00 -1.14 0.00 0.00 41.12 38.87 2k4q n ASP 82 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2k4q s THR 83 N -1.96 0.75 -0.18 2.12 2.01 -0.17 -4.25 115.64 113.97 2k4q s THR 83 Ca 0.64 -0.25 -0.04 0.00 0.31 0.00 0.00 61.69 62.35 2k4q s THR 83 Cb -0.34 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.41 2k4q s THR 83 CO 0.59 0.27 -0.02 -0.55 -0.69 0.00 0.00 174.62 174.22 2k4q s SER 84 N 0.86 4.76 -0.10 3.53 0.15 -1.20 -1.18 113.70 120.52 2k4q s SER 84 Ca -0.12 -0.19 -0.15 0.00 0.70 0.00 0.00 55.95 56.20 2k4q s SER 84 Cb -0.15 -1.80 0.04 0.00 -1.71 0.00 0.00 66.02 62.40 2k4q s SER 84 CO 0.01 0.11 0.39 0.72 1.20 0.00 0.00 173.24 175.66 2k4q s PHE 85 N 0.75 -0.37 0.17 3.44 -0.12 -0.57 -0.04 117.98 121.24 2k4q s PHE 85 Ca -0.01 0.82 -0.12 0.00 -0.05 0.00 0.00 56.93 57.57 2k4q s PHE 85 Cb -0.14 0.15 -0.07 0.00 -0.63 0.00 0.00 43.02 42.32 2k4q s PHE 85 CO 0.02 -0.29 0.54 0.99 -0.05 0.00 0.00 175.22 176.43 2k4q s THR 86 N -0.35 4.90 0.15 -4.49 2.01 -0.94 -0.79 115.64 116.12 2k4q s THR 86 Ca -0.05 0.67 0.05 0.00 0.31 0.00 0.00 61.69 62.67 2k4q s THR 86 Cb -0.03 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 2k4q s THR 86 CO 0.02 0.13 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.21 2k4q s LEU 87 N -2.28 2.52 -0.03 4.42 2.01 0.11 -0.12 118.68 125.31 2k4q s LEU 87 Ca 0.41 -0.99 -0.06 0.00 0.01 0.00 0.00 54.13 53.50 2k4q s LEU 87 Cb -0.13 -0.40 0.01 0.00 0.01 0.00 0.00 46.19 45.67 2k4q s LEU 87 CO 0.20 -0.29 0.14 0.00 1.01 0.00 0.00 176.35 177.41 2k4q s ALA 88 N -3.16 -0.34 -0.28 4.21 0.00 -1.24 -0.39 121.76 120.56 2k4q s ALA 88 Ca 0.17 0.18 -0.04 0.00 0.00 0.00 0.00 51.96 52.27 2k4q s ALA 88 Cb 0.01 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 23.06 2k4q s ALA 88 CO 0.02 -0.13 0.01 -0.46 0.00 0.00 0.00 175.76 175.20 2k4q s TRP 89 N -0.52 3.14 0.40 0.00 -0.00 0.79 -4.49 118.94 118.26 2k4q s TRP 89 Ca -0.06 -1.40 -0.01 0.00 -0.00 0.00 0.00 56.10 54.63 2k4q s TRP 89 Cb -0.04 -2.15 -0.03 0.00 -0.00 0.00 0.00 33.47 31.25 2k4q s TRP 89 CO 0.01 -0.69 0.63 -1.64 -0.00 0.00 0.00 176.95 175.26 2k4q s MET 90 N 1.38 3.45 -0.58 5.86 -1.94 -1.26 -1.04 119.30 125.16 2k4q s MET 90 Ca -0.00 -0.20 -0.27 0.00 -1.71 0.00 0.00 55.69 53.51 2k4q s MET 90 Cb -0.18 -2.57 -0.02 0.00 2.01 0.00 0.00 34.83 34.08 2k4q s MET 90 CO -0.01 -0.00 1.85 -1.25 -0.01 0.00 0.00 175.02 175.60 2k4q s PRO 91 N -4.47 2.70 0.00 2.03 0.04 -1.26 -2.34 135.00 131.71 2k4q s PRO 91 Ca 0.43 0.69 0.00 0.00 0.04 0.00 0.00 61.00 62.16 2k4q s PRO 91 Cb -0.10 -4.37 0.00 0.00 0.04 0.00 0.00 34.50 30.08 2k4q s PRO 91 CO 0.39 -2.64 0.00 0.41 0.04 0.00 0.00 177.00 175.20 2k4q n GLY 92 N 5.66 1.45 3.87 0.56 0.00 -1.26 -5.13 105.19 110.34 2k4q n GLY 92 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 2k4q n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k4q s GLU 93 N -0.12 2.35 0.23 1.61 2.02 -0.99 -5.15 118.70 118.64 2k4q s GLU 93 Ca 0.00 -1.81 0.09 0.00 0.02 0.00 0.00 54.97 53.27 2k4q s GLU 93 Cb 0.00 -2.18 -0.05 0.00 0.10 0.00 0.00 34.13 32.00 2k4q s GLU 93 CO 0.00 -0.38 -0.17 -0.65 0.02 0.00 0.00 175.26 174.08 2k4q s GLN 94 N -4.17 1.44 0.00 1.61 -0.21 -1.26 -4.91 119.66 112.16 2k4q s GLN 94 Ca 0.41 -1.64 0.00 0.00 0.02 0.00 0.00 55.36 54.15 2k4q s GLN 94 Cb -0.01 -1.36 0.00 0.00 1.00 0.00 0.00 33.01 32.64 2k4q s GLN 94 CO 0.24 0.24 0.00 0.41 -2.12 0.00 0.00 175.29 174.06 2k4q n GLY 95 N -0.41 0.37 0.05 3.09 0.00 -1.26 -4.70 105.19 102.33 2k4q n GLY 95 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 2k4q n GLY 95 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2k4q h GLN 96 N 0.00 -0.07 -0.83 1.61 4.20 -1.93 -0.19 115.11 117.90 2k4q h GLN 96 Ca 0.00 0.00 0.24 0.00 0.06 0.00 0.00 58.65 58.96 2k4q h GLN 96 Cb 0.00 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 2k4q h GLN 96 CO 0.00 -0.05 0.60 -0.56 -0.67 0.00 0.00 178.83 178.16 2k4q h GLN 97 N -0.07 0.00 0.43 1.46 3.07 -1.98 -0.99 115.11 117.03 2k4q h GLN 97 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 2k4q h GLN 97 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.64 2k4q h GLN 97 CO -0.03 0.00 -0.21 0.00 0.09 0.00 0.00 178.83 178.69 2k4q h ALA 98 N 1.58 -0.58 -0.26 0.06 0.00 -1.66 0.22 119.26 118.62 2k4q h ALA 98 Ca 0.40 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2k4q h ALA 98 Cb 1.60 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2k4q h ALA 98 CO -0.00 -0.75 0.10 -0.07 0.00 0.00 0.00 179.25 178.53 2k4q h LEU 99 N -0.73 0.36 -0.11 0.00 4.07 0.09 -0.38 115.31 118.61 2k4q h LEU 99 Ca -0.06 -0.17 0.01 0.00 0.08 0.00 0.00 57.88 57.74 2k4q h LEU 99 Cb 0.52 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 2k4q h LEU 99 CO 0.10 0.43 0.05 0.25 -1.08 0.00 0.00 178.44 178.19 2k4q h LEU 100 N 0.27 0.08 -0.98 1.67 7.12 -1.24 -0.79 115.31 121.44 2k4q h LEU 100 Ca 0.09 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.09 2k4q h LEU 100 Cb 0.18 -0.01 -0.04 0.00 -0.53 0.00 0.00 40.66 40.26 2k4q h LEU 100 CO -0.01 0.06 0.49 0.00 -0.13 0.00 0.00 178.44 178.86 2k4q h ALA 101 N 1.06 1.22 -0.48 1.25 0.00 -0.48 -1.19 119.26 120.64 2k4q h ALA 101 Ca 0.04 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2k4q h ALA 101 Cb 0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2k4q h ALA 101 CO -0.03 0.64 0.18 -1.49 0.00 0.00 0.00 179.25 178.54 2k4q h TRP 102 N 1.21 0.75 -0.15 0.00 6.55 -0.67 0.25 115.95 123.88 2k4q h TRP 102 Ca 0.31 -0.06 -0.01 0.00 0.95 0.00 0.00 58.89 60.07 2k4q h TRP 102 Cb 0.00 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.08 2k4q h TRP 102 CO 0.01 0.64 0.04 0.35 -1.05 0.00 0.00 178.44 178.42 2k4q h PHE 103 N 0.64 0.26 -0.13 0.49 3.57 -0.81 0.23 116.94 121.19 2k4q h PHE 103 Ca 0.16 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2k4q h PHE 103 Cb 0.22 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 2k4q h PHE 103 CO 0.01 0.39 0.03 -0.97 -2.23 0.00 0.00 178.31 175.54 2k4q h ASN 104 N 0.05 0.20 -0.72 0.41 -0.73 -1.13 -3.07 115.58 110.60 2k4q h ASN 104 Ca 0.05 -0.24 -0.04 0.00 1.87 0.00 0.00 56.30 57.94 2k4q h ASN 104 Cb 0.26 -0.05 -0.03 0.00 0.27 0.00 0.00 38.32 38.76 2k4q h ASN 104 CO 0.00 0.39 0.29 -0.08 -0.37 0.00 0.00 177.43 177.66 2k4q h GLU 105 N 0.01 1.06 -4.59 6.67 4.57 -0.49 -3.46 114.58 118.35 2k4q h GLU 105 Ca 0.04 -0.19 -0.33 0.00 -1.18 0.00 0.00 59.36 57.70 2k4q h GLU 105 Cb 0.26 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 2k4q h GLU 105 CO 0.00 0.87 -0.47 0.41 -1.18 0.00 0.00 179.01 178.65 2k4q n GLY 106 N -0.87 -0.50 3.82 1.92 0.00 0.81 -4.95 105.19 105.42 2k4q n GLY 106 Ca 0.06 0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 2k4q n GLY 106 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k4q s ASP 107 N -2.42 5.19 0.05 1.61 -4.77 -1.26 -4.85 116.67 110.21 2k4q s ASP 107 Ca 0.21 -0.52 -0.31 0.00 -3.30 0.00 0.00 52.55 48.64 2k4q s ASP 107 Cb -0.11 -0.98 -0.07 0.00 -1.09 0.00 0.00 42.92 40.68 2k4q s ASP 107 CO 0.26 -0.29 1.38 -0.89 0.70 0.00 0.00 175.17 176.33 2k4q s THR 108 N -2.31 3.57 0.05 2.11 2.01 -1.26 -4.05 115.64 115.77 2k4q s THR 108 Ca 0.39 1.06 0.09 0.00 0.31 0.00 0.00 61.69 63.54 2k4q s THR 108 Cb -0.05 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.75 2k4q s THR 108 CO 0.25 0.04 -0.25 -0.13 -0.69 0.00 0.00 174.62 173.85 2k4q s ARG 109 N 1.74 1.66 -0.01 4.92 1.81 -0.43 -4.83 118.95 123.80 2k4q s ARG 109 Ca 0.64 -1.06 0.02 0.00 -1.72 0.00 0.00 55.73 53.60 2k4q s ARG 109 Cb -0.33 -1.83 -0.03 0.00 -0.45 0.00 0.00 34.95 32.30 2k4q s ARG 109 CO 0.28 0.47 -0.03 0.00 -0.68 0.00 0.00 175.30 175.35 2k4q s ALA 110 N -0.81 3.18 0.22 2.13 0.00 -1.26 -0.37 121.76 124.84 2k4q s ALA 110 Ca 0.10 -0.95 -0.23 0.00 0.00 0.00 0.00 51.96 50.88 2k4q s ALA 110 Cb -0.10 -1.28 0.04 0.00 0.00 0.00 0.00 23.12 21.79 2k4q s ALA 110 CO 0.02 0.63 0.82 1.52 0.00 0.00 0.00 175.76 178.74 2k4q s TYR 111 N -1.02 -0.18 -0.01 0.00 -0.85 -0.51 -4.41 117.35 110.37 2k4q s TYR 111 Ca 0.18 -0.20 0.03 0.00 -0.52 0.00 0.00 57.07 56.56 2k4q s TYR 111 Cb -0.11 0.67 -0.01 0.00 0.38 0.00 0.00 41.96 42.89 2k4q s TYR 111 CO 0.08 -1.05 -0.11 0.15 -1.52 0.00 0.00 175.55 173.11 2k4q s LYS 112 N -3.64 0.89 -0.16 -3.49 1.02 -0.36 -1.58 119.74 112.42 2k4q s LYS 112 Ca 0.11 -0.38 -0.05 0.00 0.02 0.00 0.00 55.97 55.68 2k4q s LYS 112 Cb -0.04 -0.86 -0.03 0.00 -0.52 0.00 0.00 37.83 36.38 2k4q s LYS 112 CO 0.04 0.22 -0.01 0.42 -0.92 0.00 0.00 175.35 175.10 2k4q s ILE 113 N -0.21 4.13 -0.62 2.17 1.01 -0.36 -0.48 121.20 126.85 2k4q s ILE 113 Ca 0.03 -0.27 -0.21 0.00 0.00 0.00 0.00 60.65 60.20 2k4q s ILE 113 Cb -0.05 -2.82 0.08 0.00 0.01 0.00 0.00 42.46 39.68 2k4q s ILE 113 CO -0.00 0.49 0.85 -0.60 0.00 0.00 0.00 174.94 175.68 2k4q s ARG 114 N 0.30 3.11 0.90 2.79 3.52 -1.02 -1.27 118.95 127.28 2k4q s ARG 114 Ca -0.02 -0.95 -0.10 0.00 -0.13 0.00 0.00 55.73 54.53 2k4q s ARG 114 Cb -0.14 -4.22 0.14 0.00 -1.56 0.00 0.00 34.95 29.17 2k4q s ARG 114 CO 0.02 -1.66 1.13 -0.06 -0.81 0.00 0.00 175.30 173.92 2k4q s PHE 115 N 3.51 1.80 -0.53 5.12 0.40 -0.51 -4.12 117.98 123.65 2k4q s PHE 115 Ca 0.19 1.71 0.22 0.00 -0.60 0.00 0.00 56.93 58.45 2k4q s PHE 115 Cb -0.19 -3.27 0.94 0.00 0.51 0.00 0.00 43.02 41.01 2k4q s PHE 115 CO 0.10 -2.67 1.68 -0.35 0.70 0.00 0.00 175.22 174.68 2k4q n PRO 116 N -4.13 0.17 0.00 0.24 -0.04 -1.26 -2.04 135.00 127.94 2k4q n PRO 116 Ca 0.11 0.41 0.14 0.00 -0.04 0.00 0.00 63.50 64.11 2k4q n PRO 116 Cb 0.52 -1.83 0.56 0.00 -0.04 0.00 0.00 33.50 32.71 2k4q n PRO 116 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2k4q n ASN 117 N -2.16 0.58 0.00 3.54 2.85 -1.26 -4.90 115.26 113.91 2k4q n ASN 117 Ca 0.02 -0.62 0.00 0.00 -0.11 0.00 0.00 54.58 53.87 2k4q n ASN 117 Cb 0.22 -0.03 0.00 0.00 1.24 0.00 0.00 39.78 41.21 2k4q n ASN 117 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k4q n GLY 118 N 1.30 1.84 3.79 8.20 0.00 -0.86 -5.07 105.19 114.38 2k4q n GLY 118 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2k4q n GLY 118 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k4q s THR 119 N -2.50 1.82 -0.04 2.61 -4.23 -1.26 -4.82 115.64 107.22 2k4q s THR 119 Ca 0.00 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.46 2k4q s THR 119 Cb 0.00 -2.79 0.01 0.00 1.34 0.00 0.00 72.50 71.06 2k4q s THR 119 CO 0.00 0.00 0.14 0.54 -0.54 0.00 0.00 174.62 174.76 2k4q s VAL 120 N -3.55 0.02 -0.20 2.29 0.11 -1.26 -1.42 120.40 116.39 2k4q s VAL 120 Ca 0.74 -0.15 0.01 0.00 -2.93 0.00 0.00 61.98 59.65 2k4q s VAL 120 Cb -0.05 -0.24 0.03 0.00 -1.53 0.00 0.00 36.38 34.58 2k4q s VAL 120 CO 0.54 -0.08 -0.17 -0.62 -3.33 0.00 0.00 175.10 171.44 2k4q s ASP 121 N -0.22 3.48 -0.24 3.54 2.15 -0.39 -4.94 116.67 120.04 2k4q s ASP 121 Ca -0.03 -0.79 -0.13 0.00 0.43 0.00 0.00 52.55 52.03 2k4q s ASP 121 Cb -0.02 -1.51 -0.04 0.00 -0.30 0.00 0.00 42.92 41.04 2k4q s ASP 121 CO 0.00 -0.04 0.29 0.54 -0.17 0.00 0.00 175.17 175.79 2k4q s VAL 122 N 1.26 5.26 0.11 1.11 0.11 -1.26 -1.22 120.40 125.78 2k4q s VAL 122 Ca 0.02 0.44 -0.12 0.00 -2.93 0.00 0.00 61.98 59.38 2k4q s VAL 122 Cb -0.15 -3.62 0.02 0.00 -1.53 0.00 0.00 36.38 31.10 2k4q s VAL 122 CO -0.11 0.26 0.30 0.72 -3.33 0.00 0.00 175.10 172.95 2k4q s PHE 123 N 1.47 -0.00 0.37 1.54 -0.71 -0.61 -5.02 117.98 115.01 2k4q s PHE 123 Ca 0.13 -0.37 0.03 0.00 -1.04 0.00 0.00 56.93 55.68 2k4q s PHE 123 Cb -0.15 0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 2k4q s PHE 123 CO 0.08 -0.64 0.09 1.03 -1.34 0.00 0.00 175.22 174.44 2k4q s ARG 124 N -3.84 1.79 0.00 1.99 0.52 -1.26 -1.43 118.95 116.72 2k4q s ARG 124 Ca 0.05 -2.05 0.00 0.00 -0.52 0.00 0.00 55.73 53.21 2k4q s ARG 124 Cb 0.03 -0.73 0.00 0.00 0.52 0.00 0.00 34.95 34.78 2k4q s ARG 124 CO -0.10 -0.34 0.00 0.41 0.02 0.00 0.00 175.30 175.29 2k4q n GLY 125 N -0.80 3.98 3.73 -3.53 0.00 0.50 -4.92 105.19 104.15 2k4q n GLY 125 Ca -0.04 -0.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.81 2k4q n GLY 125 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2k4q s TRP 126 N -2.00 3.46 0.45 1.61 1.48 -1.26 -1.32 118.94 121.37 2k4q s TRP 126 Ca 0.00 0.59 -0.23 0.00 -1.06 0.00 0.00 56.10 55.40 2k4q s TRP 126 Cb 0.00 -2.34 -0.07 0.00 -1.16 0.00 0.00 33.47 29.90 2k4q s TRP 126 CO 0.00 0.23 1.18 0.08 -4.06 0.00 0.00 176.95 174.38 2k4q s VAL 127 N 0.48 3.05 0.00 -0.66 1.01 -1.26 -3.88 120.40 119.14 2k4q s VAL 127 Ca 0.16 0.81 0.02 0.00 0.00 0.00 0.00 61.98 62.97 2k4q s VAL 127 Cb -0.13 -3.42 0.04 0.00 0.00 0.00 0.00 36.38 32.87 2k4q s VAL 127 CO 0.04 0.01 0.80 -0.24 0.00 0.00 0.00 175.10 175.71 2k4q n SER 128 N -0.41 -0.00 -3.07 3.32 2.88 -1.24 -4.67 113.62 110.42 2k4q n SER 128 Ca 0.07 -1.58 -0.14 0.00 -1.33 0.00 0.00 58.87 55.89 2k4q n SER 128 Cb 0.48 -0.08 -0.04 0.00 -0.75 0.00 0.00 64.21 63.81 2k4q n SER 128 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2k4q s SER 129 N -0.66 -0.13 -0.14 -3.46 0.15 -1.13 -4.89 113.70 103.43 2k4q s SER 129 Ca 0.03 -2.21 -0.01 0.00 0.70 0.00 0.00 55.95 54.46 2k4q s SER 129 Cb 0.03 0.89 0.04 0.00 -1.71 0.00 0.00 66.02 65.27 2k4q s SER 129 CO -0.01 -0.12 -0.03 -0.63 1.20 0.00 0.00 173.24 173.65 2k4q s ILE 130 N 0.64 0.85 0.00 6.45 1.01 -1.26 -3.13 121.20 125.75 2k4q s ILE 130 Ca 0.30 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.53 2k4q s ILE 130 Cb 0.00 -1.05 0.00 0.00 0.01 0.00 0.00 42.46 41.42 2k4q s ILE 130 CO -0.11 0.13 0.00 0.61 0.00 0.00 0.00 174.94 175.58 2k4q n GLY 131 N 4.97 2.65 3.67 6.18 0.00 -1.26 -5.08 105.19 116.32 2k4q n GLY 131 Ca -0.10 -1.84 -0.35 0.00 0.00 0.00 0.00 46.02 43.73 2k4q n GLY 131 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k4q s LYS 132 N 3.89 4.07 0.24 1.61 2.36 -1.26 -5.08 119.74 125.57 2k4q s LYS 132 Ca 0.00 -0.29 -0.30 0.00 -2.55 0.00 0.00 55.97 52.84 2k4q s LYS 132 Cb 0.00 -3.35 -0.09 0.00 -1.05 0.00 0.00 37.83 33.34 2k4q s LYS 132 CO 0.00 0.24 1.21 0.00 1.55 0.00 0.00 175.35 178.35 2k4q s ALA 133 N 0.50 3.46 -0.21 3.13 0.00 -1.26 -4.94 121.76 122.43 2k4q s ALA 133 Ca 0.06 1.02 -0.14 0.00 0.00 0.00 0.00 51.96 52.90 2k4q s ALA 133 Cb -0.12 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2k4q s ALA 133 CO -0.00 -0.39 0.30 0.08 0.00 0.00 0.00 175.76 175.75 2k4q s VAL 134 N -0.54 5.27 -0.09 0.00 1.01 -0.33 -4.87 120.40 120.85 2k4q s VAL 134 Ca 0.50 0.49 -0.16 0.00 0.00 0.00 0.00 61.98 62.81 2k4q s VAL 134 Cb -0.34 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 2k4q s VAL 134 CO 0.41 0.30 0.41 -0.89 0.00 0.00 0.00 175.10 175.33 2k4q s THR 135 N 1.13 5.17 -0.22 3.92 2.01 -1.26 -0.86 115.64 125.52 2k4q s THR 135 Ca 0.14 0.82 -0.12 0.00 0.31 0.00 0.00 61.69 62.84 2k4q s THR 135 Cb -0.14 -3.74 0.07 0.00 0.01 0.00 0.00 72.50 68.70 2k4q s THR 135 CO 0.06 0.42 0.53 0.00 -0.69 0.00 0.00 174.62 174.94 2k4q s ALA 136 N 0.05 -1.41 -1.33 7.40 0.00 0.98 -4.94 121.76 122.50 2k4q s ALA 136 Ca 0.23 1.92 -0.00 0.00 0.00 0.00 0.00 51.96 54.11 2k4q s ALA 136 Cb -0.15 -1.15 -0.00 0.00 0.00 0.00 0.00 23.12 21.81 2k4q s ALA 136 CO 0.10 -0.32 0.61 1.63 0.00 0.00 0.00 175.76 177.77 2k4q n LYS 137 N 4.31 -4.28 -1.82 0.00 4.01 -1.26 -0.11 118.16 119.02 2k4q n LYS 137 Ca -0.22 0.55 -0.18 0.00 -0.51 0.00 0.00 58.31 57.95 2k4q n LYS 137 Cb 0.57 -4.94 -0.05 0.00 -0.51 0.00 0.00 35.03 30.09 2k4q n LYS 137 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 2k4q n GLU 138 N -4.31 -1.56 -3.75 1.97 1.02 -1.26 -4.94 120.64 107.82 2k4q n GLU 138 Ca -0.30 0.98 -0.21 0.00 -0.02 0.00 0.00 57.16 57.60 2k4q n GLU 138 Cb 0.68 -5.41 -0.18 0.00 -0.02 0.00 0.00 31.44 26.51 2k4q n GLU 138 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2k4q s VAL 139 N -2.62 0.19 0.11 2.62 1.01 0.85 -4.13 120.40 118.43 2k4q s VAL 139 Ca 0.00 0.23 -0.06 0.00 0.00 0.00 0.00 61.98 62.15 2k4q s VAL 139 Cb 0.00 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 35.95 2k4q s VAL 139 CO 0.00 0.22 0.36 -0.63 0.00 0.00 0.00 175.10 175.06 2k4q s ILE 140 N 1.96 5.18 0.00 2.22 1.01 -0.21 -0.02 121.20 131.34 2k4q s ILE 140 Ca 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 60.65 60.78 2k4q s ILE 140 Cb -0.12 -3.62 -0.01 0.00 0.01 0.00 0.00 42.46 38.72 2k4q s ILE 140 CO -0.04 0.12 0.02 0.42 0.00 0.00 0.00 174.94 175.46 2k4q s THR 141 N -1.57 0.05 -0.28 2.92 -4.23 -0.04 -0.15 115.64 112.34 2k4q s THR 141 Ca 0.38 -0.42 -0.20 0.00 -1.18 0.00 0.00 61.69 60.27 2k4q s THR 141 Cb -0.13 -0.18 0.10 0.00 1.34 0.00 0.00 72.50 73.63 2k4q s THR 141 CO 0.23 -0.23 0.81 -0.60 -0.54 0.00 0.00 174.62 174.28 2k4q s ARG 142 N -0.70 0.66 -0.17 3.99 6.06 0.47 -1.18 118.95 128.07 2k4q s ARG 142 Ca -0.08 0.96 -0.18 0.00 -2.50 0.00 0.00 55.73 53.93 2k4q s ARG 142 Cb -0.05 0.23 -0.04 0.00 0.06 0.00 0.00 34.95 35.15 2k4q s ARG 142 CO -0.00 -0.11 0.50 -0.08 -2.50 0.00 0.00 175.30 173.11 2k4q s THR 143 N 0.98 5.14 -0.12 4.11 -1.32 -1.26 0.05 115.64 123.21 2k4q s THR 143 Ca -0.05 0.94 -0.03 0.00 -1.21 0.00 0.00 61.69 61.35 2k4q s THR 143 Cb -0.05 -3.83 -0.03 0.00 -1.51 0.00 0.00 72.50 67.08 2k4q s THR 143 CO -0.11 0.23 -0.01 -0.69 -2.21 0.00 0.00 174.62 171.84 2k4q s VAL 144 N 1.28 4.21 -0.06 5.08 1.01 0.03 -4.72 120.40 127.22 2k4q s VAL 144 Ca 0.24 -0.27 -0.00 0.00 0.00 0.00 0.00 61.98 61.95 2k4q s VAL 144 Cb -0.15 -2.80 0.02 0.00 0.00 0.00 0.00 36.38 33.45 2k4q s VAL 144 CO 0.10 0.55 -0.03 -0.75 0.00 0.00 0.00 175.10 174.97 2k4q s LYS 145 N -0.35 0.84 -0.36 2.72 2.47 -1.19 -1.51 119.74 122.36 2k4q s LYS 145 Ca 0.07 -0.04 -0.12 0.00 -1.56 0.00 0.00 55.97 54.32 2k4q s LYS 145 Cb -0.12 -1.00 0.01 0.00 -1.46 0.00 0.00 37.83 35.26 2k4q s LYS 145 CO 0.02 -0.19 0.22 0.08 0.16 0.00 0.00 175.35 175.63 2k4q s VAL 146 N 1.45 4.82 -0.35 4.02 1.01 -0.32 -2.86 120.40 128.16 2k4q s VAL 146 Ca -0.02 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.26 2k4q s VAL 146 Cb -0.13 -3.61 0.05 0.00 0.00 0.00 0.00 36.38 32.70 2k4q s VAL 146 CO -0.03 -0.15 0.13 0.42 0.00 0.00 0.00 175.10 175.47 2k4q s THR 147 N 1.62 3.73 1.02 3.92 -4.23 -1.25 -1.00 115.64 119.45 2k4q s THR 147 Ca 0.04 -1.29 -0.14 0.00 -1.18 0.00 0.00 61.69 59.12 2k4q s THR 147 Cb -0.18 -3.19 0.20 0.00 1.34 0.00 0.00 72.50 70.67 2k4q s THR 147 CO 0.08 -0.27 1.11 0.20 -0.54 0.00 0.00 174.62 175.19 2k4q s ASN 148 N 1.55 2.45 -0.22 3.99 0.02 -1.26 -4.68 114.94 116.79 2k4q s ASN 148 Ca -0.00 1.01 -0.06 0.00 -1.02 0.00 0.00 52.86 52.79 2k4q s ASN 148 Cb -0.20 -1.58 -0.03 0.00 0.02 0.00 0.00 41.25 39.46 2k4q s ASN 148 CO 0.02 -3.22 0.04 0.54 0.02 0.00 0.00 177.10 174.50 2k4q s VAL 149 N -3.06 4.17 0.00 1.60 0.11 -1.26 -4.64 120.40 117.33 2k4q s VAL 149 Ca 0.66 -0.23 0.00 0.00 -2.93 0.00 0.00 61.98 59.48 2k4q s VAL 149 Cb -0.16 -2.91 0.00 0.00 -1.53 0.00 0.00 36.38 31.77 2k4q s VAL 149 CO 0.56 0.39 0.00 0.61 -3.33 0.00 0.00 175.10 173.33 2k4q n GLY 150 N 4.52 2.09 3.95 6.54 0.00 -1.24 -4.41 105.19 116.65 2k4q n GLY 150 Ca -0.17 -0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.42 2k4q n GLY 150 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k4q s ARG 151 N 0.00 3.45 0.00 1.61 1.70 -1.26 -5.08 118.95 119.37 2k4q s ARG 151 Ca 0.00 -0.49 0.00 0.00 -0.47 0.00 0.00 55.73 54.77 2k4q s ARG 151 Cb 0.00 -2.73 0.00 0.00 -0.57 0.00 0.00 34.95 31.65 2k4q s ARG 151 CO 0.00 0.22 0.00 -0.35 -1.08 0.00 0.00 175.30 174.09 2k4q n PRO 152 N -1.67 -0.80 -4.35 3.89 -0.04 -1.26 -5.10 135.00 125.68 2k4q n PRO 152 Ca -0.06 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.11 2k4q n PRO 152 Cb 0.57 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.98 2k4q n PRO 152 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2k4q n SER 153 N -2.66 3.17 -3.77 3.54 3.41 -1.26 -5.17 113.62 110.89 2k4q n SER 153 Ca 0.00 -3.05 -0.09 0.00 -0.26 0.00 0.00 58.87 55.47 2k4q n SER 153 Cb 0.00 0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 64.15 2k4q n SER 153 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k4q s MET 154 N -3.87 1.48 -0.28 4.33 0.23 -1.26 -5.16 119.30 114.77 2k4q s MET 154 Ca 0.08 -0.91 -0.03 0.00 -1.03 0.00 0.00 55.69 53.80 2k4q s MET 154 Cb -0.01 0.54 0.16 0.00 -1.53 0.00 0.00 34.83 33.99 2k4q s MET 154 CO 0.05 -0.64 0.55 0.00 -2.03 0.00 0.00 175.02 172.95 2k4q s ALA 155 N -3.89 -1.91 -1.75 3.16 0.00 -1.26 -5.36 121.76 110.75 2k4q s ALA 155 Ca 0.11 1.72 0.14 0.00 0.00 0.00 0.00 51.96 53.92 2k4q s ALA 155 Cb -0.02 -1.94 0.11 0.00 0.00 0.00 0.00 23.12 21.27 2k4q s ALA 155 CO 0.00 -1.21 0.94 -1.91 0.00 0.00 0.00 175.76 173.59