#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 -0.59 -2.21 4.61 0.00 -1.26 -4.98 120.51 116.08 2k4q n ALA 2 Ca 0.00 0.17 -0.36 0.00 0.00 0.00 0.00 53.44 53.24 2k4q n ALA 2 Cb 0.00 -2.23 -0.06 0.00 0.00 0.00 0.00 19.45 17.16 2k4q n ALA 2 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2k4q s MET 3 N -5.02 4.16 0.82 0.00 1.00 -1.26 -5.06 119.30 113.94 2k4q s MET 3 Ca 0.05 0.72 -0.11 0.00 0.00 0.00 0.00 55.69 56.36 2k4q s MET 3 Cb -0.02 -2.96 0.09 0.00 0.00 0.00 0.00 34.83 31.93 2k4q s MET 3 CO 0.06 0.47 1.10 -1.64 0.00 0.00 0.00 175.02 175.00 2k4q s MET 4 N -1.81 1.83 -0.00 2.03 1.00 -1.26 -4.98 119.30 116.10 2k4q s MET 4 Ca 0.39 1.19 -0.24 0.00 0.00 0.00 0.00 55.69 57.02 2k4q s MET 4 Cb -0.17 -1.85 -0.18 0.00 0.00 0.00 0.00 34.83 32.63 2k4q s MET 4 CO 0.20 -1.95 1.29 -1.00 0.00 0.00 0.00 175.02 173.57 2k4q h PRO 5 N -1.35 0.11 -3.01 2.03 0.13 -2.02 -3.45 132.00 124.43 2k4q h PRO 5 Ca -0.45 -0.06 -0.19 0.00 -0.87 0.00 0.00 66.00 64.44 2k4q h PRO 5 Cb 1.25 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.08 2k4q h PRO 5 CO 0.50 0.56 -0.47 0.08 -0.23 0.00 0.00 178.00 178.44 2k4q s VAL 6 N -4.28 -0.04 0.77 1.56 1.01 -1.26 -5.17 120.40 112.99 2k4q s VAL 6 Ca -0.15 0.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.83 2k4q s VAL 6 Cb 0.03 -0.39 0.19 0.00 0.00 0.00 0.00 36.38 36.21 2k4q s VAL 6 CO 0.70 0.06 0.68 -0.81 0.00 0.00 0.00 175.10 175.73 2k4q n PRO 7 N 4.15 -2.35 -3.68 2.72 -0.04 -1.26 -5.10 135.00 129.44 2k4q n PRO 7 Ca -0.25 -1.09 -0.11 0.00 -0.04 0.00 0.00 63.50 62.02 2k4q n PRO 7 Cb 0.53 -1.02 -0.05 0.00 -0.04 0.00 0.00 33.50 32.92 2k4q n PRO 7 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2k4q s ASN 8 N -3.34 -0.18 0.40 3.54 0.01 -1.26 -5.18 114.94 108.93 2k4q s ASN 8 Ca 0.44 -0.31 0.00 0.00 -0.71 0.00 0.00 52.86 52.28 2k4q s ASN 8 Cb -0.04 0.44 0.00 0.00 0.41 0.00 0.00 41.25 42.05 2k4q s ASN 8 CO 0.34 -0.79 0.00 -0.81 -1.51 0.00 0.00 177.10 174.33 2k4q n PRO 9 N -0.03 0.18 -4.47 -0.60 -0.04 -1.26 -4.91 135.00 123.87 2k4q n PRO 9 Ca -0.16 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.07 2k4q n PRO 9 Cb 0.63 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.98 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 -0.40 1.83 -0.11 0.52 -4.23 -1.26 -4.12 115.64 107.86 2k4q s THR 10 Ca 0.00 -2.15 -0.31 0.00 -1.18 0.00 0.00 61.69 58.06 2k4q s THR 10 Cb 0.00 -2.53 0.12 0.00 1.34 0.00 0.00 72.50 71.43 2k4q s THR 10 CO 0.00 -0.26 1.02 0.00 -0.54 0.00 0.00 174.62 174.84 2k4q s MET 11 N -3.69 0.60 0.45 3.99 0.23 -0.91 -4.96 119.30 115.00 2k4q s MET 11 Ca 0.31 -0.09 -0.23 0.00 -1.03 0.00 0.00 55.69 54.64 2k4q s MET 11 Cb 0.03 0.28 -0.08 0.00 -1.53 0.00 0.00 34.83 33.54 2k4q s MET 11 CO 0.14 -0.24 1.17 -1.25 -2.03 0.00 0.00 175.02 172.81 2k4q s PRO 12 N -2.18 3.79 0.60 3.16 0.04 -1.26 -4.74 135.00 134.41 2k4q s PRO 12 Ca 0.04 1.79 -0.20 0.00 0.04 0.00 0.00 61.00 62.67 2k4q s PRO 12 Cb -0.01 -2.44 -0.03 0.00 0.04 0.00 0.00 34.50 32.06 2k4q s PRO 12 CO -0.04 -0.53 1.32 0.08 0.04 0.00 0.00 177.00 177.87 2k4q s VAL 13 N -1.53 2.08 -0.83 -0.36 1.01 -1.26 -4.95 120.40 114.57 2k4q s VAL 13 Ca 0.63 0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.68 2k4q s VAL 13 Cb -0.29 -3.03 0.31 0.00 0.00 0.00 0.00 36.38 33.38 2k4q s VAL 13 CO 0.35 -0.01 1.33 0.29 0.00 0.00 0.00 175.10 177.06 2k4q n LYS 14 N -1.52 4.15 0.00 2.72 5.02 -1.26 -5.02 118.16 122.24 2k4q n LYS 14 Ca 0.13 -4.72 0.00 0.00 -2.02 0.00 0.00 58.31 51.70 2k4q n LYS 14 Cb 0.47 -2.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.11 2k4q n LYS 14 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k4q n GLY 15 N 0.22 -2.23 3.49 0.72 0.00 -1.26 -5.08 105.19 101.06 2k4q n GLY 15 Ca 0.36 -1.47 -0.25 0.00 0.00 0.00 0.00 46.02 44.66 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 -3.09 2.79 0.00 4.61 0.00 -1.26 -5.15 121.76 119.66 2k4q s ALA 16 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.62 2k4q s ALA 16 Cb 0.00 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.93 2k4q s ALA 16 CO 0.00 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.80 2k4q n GLY 17 N -0.87 2.30 3.74 0.00 0.00 -1.26 -5.13 105.19 103.96 2k4q n GLY 17 Ca -0.05 0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 1.34 3.14 -0.15 2.61 2.01 -1.26 -4.94 115.64 118.39 2k4q s THR 18 Ca 0.00 0.93 -0.17 0.00 0.31 0.00 0.00 61.69 62.76 2k4q s THR 18 Cb 0.00 -3.59 0.04 0.00 0.01 0.00 0.00 72.50 68.96 2k4q s THR 18 CO 0.00 0.13 0.45 0.28 -0.69 0.00 0.00 174.62 174.80 2k4q s THR 19 N 0.18 0.01 -0.12 -0.82 -1.32 -1.26 -0.06 115.64 112.24 2k4q s THR 19 Ca 0.58 -0.06 -0.07 0.00 -1.21 0.00 0.00 61.69 60.93 2k4q s THR 19 Cb -0.37 -0.66 -0.04 0.00 -1.51 0.00 0.00 72.50 69.92 2k4q s THR 19 CO 0.38 -0.03 0.14 -1.48 -2.21 0.00 0.00 174.62 171.42 2k4q s LEU 20 N -0.02 4.38 0.12 9.08 2.34 -1.22 -2.85 118.68 130.51 2k4q s LEU 20 Ca -0.02 0.47 0.10 0.00 0.06 0.00 0.00 54.13 54.74 2k4q s LEU 20 Cb -0.03 -2.07 -0.04 0.00 -0.56 0.00 0.00 46.19 43.49 2k4q s LEU 20 CO 0.02 0.41 -0.25 0.26 -1.06 0.00 0.00 176.35 175.73 2k4q s TRP 21 N -1.03 2.12 -0.01 3.48 0.51 0.31 -3.13 118.94 121.20 2k4q s TRP 21 Ca 0.15 -0.39 0.01 0.00 -2.12 0.00 0.00 56.10 53.75 2k4q s TRP 21 Cb -0.12 -1.15 -0.04 0.00 -0.81 0.00 0.00 33.47 31.36 2k4q s TRP 21 CO 0.04 0.30 -0.01 0.54 -0.51 0.00 0.00 176.95 177.31 2k4q s VAL 22 N -1.13 4.08 -0.02 4.03 0.11 0.94 -1.30 120.40 127.11 2k4q s VAL 22 Ca 0.12 -0.60 0.01 0.00 -2.93 0.00 0.00 61.98 58.58 2k4q s VAL 22 Cb -0.10 -2.80 0.01 0.00 -1.53 0.00 0.00 36.38 31.96 2k4q s VAL 22 CO 0.06 0.40 -0.02 -0.72 -3.33 0.00 0.00 175.10 171.49 2k4q s TYR 23 N -1.05 0.33 0.11 1.54 1.13 -1.19 -0.81 117.35 117.40 2k4q s TYR 23 Ca 0.19 -0.04 0.08 0.00 -1.41 0.00 0.00 57.07 55.88 2k4q s TYR 23 Cb -0.11 -0.30 -0.04 0.00 -1.10 0.00 0.00 41.96 40.41 2k4q s TYR 23 CO 0.09 -0.06 -0.13 0.21 -2.51 0.00 0.00 175.55 173.15 2k4q s LYS 24 N 0.40 1.99 0.00 -3.49 2.47 -1.26 -4.71 119.74 115.14 2k4q s LYS 24 Ca -0.04 -1.08 0.00 0.00 -1.56 0.00 0.00 55.97 53.29 2k4q s LYS 24 Cb -0.07 -2.23 0.00 0.00 -1.46 0.00 0.00 37.83 34.07 2k4q s LYS 24 CO -0.01 0.50 0.00 0.41 0.16 0.00 0.00 175.35 176.41 2k4q n GLY 25 N 0.75 2.73 2.98 5.54 0.00 -1.26 -5.07 105.19 110.86 2k4q n GLY 25 Ca -0.14 -0.80 -0.27 0.00 0.00 0.00 0.00 46.02 44.81 2k4q n GLY 25 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k4q s SER 26 N 0.00 2.27 0.00 1.61 1.04 -1.26 -4.83 113.70 112.52 2k4q s SER 26 Ca 0.00 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.06 2k4q s SER 26 Cb 0.00 -0.96 0.00 0.00 0.10 0.00 0.00 66.02 65.16 2k4q s SER 26 CO 0.00 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.78 2k4q n GLY 27 N 4.55 0.14 2.82 7.32 0.00 -1.26 -4.98 105.19 113.78 2k4q n GLY 27 Ca -0.17 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.52 2k4q n GLY 27 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k4q n ASP 28 N 0.00 -6.65 0.00 1.61 8.00 -1.26 -4.89 116.55 113.36 2k4q n ASP 28 Ca 0.00 -0.15 0.07 0.00 0.71 0.00 0.00 54.79 55.42 2k4q n ASP 28 Cb 0.00 -4.55 0.31 0.00 -0.02 0.00 0.00 41.12 36.86 2k4q n ASP 28 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2k4q n PRO 29 N -1.86 0.03 -0.06 -0.24 -0.04 -1.26 -2.41 135.00 129.16 2k4q n PRO 29 Ca -0.01 0.24 -0.02 0.00 -0.04 0.00 0.00 63.50 63.67 2k4q n PRO 29 Cb 0.52 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.32 2k4q n PRO 29 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2k4q n TYR 30 N -1.47 0.03 0.12 0.54 4.02 -1.26 -3.85 117.16 115.29 2k4q n TYR 30 Ca 0.04 0.01 -0.11 0.00 -0.01 0.00 0.00 57.90 57.83 2k4q n TYR 30 Cb 0.16 -0.82 -0.07 0.00 -0.02 0.00 0.00 39.34 38.60 2k4q n TYR 30 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2k4q h ALA 31 N 1.39 -0.91 -0.32 -0.72 0.00 -1.83 -3.41 119.26 113.47 2k4q h ALA 31 Ca -0.33 -0.09 -0.24 0.00 0.00 0.00 0.00 54.91 54.24 2k4q h ALA 31 Cb 1.76 0.68 -0.17 0.00 0.00 0.00 0.00 17.79 20.07 2k4q h ALA 31 CO 0.02 -0.97 -0.55 0.27 0.00 0.00 0.00 179.25 178.02 2k4q n ASN 32 N -4.42 -2.71 0.00 0.00 6.94 -1.26 -4.98 115.26 108.84 2k4q n ASN 32 Ca -0.06 -3.20 0.07 0.00 -0.02 0.00 0.00 54.58 51.37 2k4q n ASN 32 Cb 0.28 1.60 0.34 0.00 -2.36 0.00 0.00 39.78 39.65 2k4q n ASN 32 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 2k4q n PRO 33 N 1.81 0.11 0.12 -0.53 -0.04 -1.25 -2.92 135.00 132.29 2k4q n PRO 33 Ca 0.11 0.20 0.04 0.00 -0.04 0.00 0.00 63.50 63.81 2k4q n PRO 33 Cb 0.61 -1.50 0.46 0.00 -0.04 0.00 0.00 33.50 33.03 2k4q n PRO 33 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2k4q h LEU 34 N 0.00 0.24 -2.00 1.53 6.46 -1.93 -2.06 115.31 117.55 2k4q h LEU 34 Ca 0.00 -0.03 0.23 0.00 -0.12 0.00 0.00 57.88 57.96 2k4q h LEU 34 Cb 0.19 -0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.03 2k4q h LEU 34 CO 0.00 0.28 0.56 0.77 -0.62 0.00 0.00 178.44 179.43 2k4q h SER 35 N 0.26 0.00 -1.84 1.25 4.64 -1.98 -3.40 113.55 112.48 2k4q h SER 35 Ca 0.06 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.78 2k4q h SER 35 Cb 0.16 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2k4q h SER 35 CO 0.00 0.00 1.42 0.47 -0.87 0.00 0.00 176.83 177.86 2k4q n ASP 36 N -4.30 3.14 -0.02 4.97 8.00 -0.78 -4.79 116.55 122.76 2k4q n ASP 36 Ca 0.16 0.37 0.03 0.00 0.71 0.00 0.00 54.79 56.06 2k4q n ASP 36 Cb 0.85 -1.48 -0.11 0.00 -0.02 0.00 0.00 41.12 40.37 2k4q n ASP 36 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2k4q n VAL 37 N 7.23 0.27 -0.46 2.53 0.24 -1.26 -4.44 118.33 122.44 2k4q n VAL 37 Ca 0.31 -0.39 -0.08 0.00 -2.04 0.00 0.00 64.34 62.13 2k4q n VAL 37 Cb 0.39 -0.08 0.19 0.00 -1.47 0.00 0.00 33.84 32.87 2k4q n VAL 37 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2k4q n ASP 38 N -2.14 3.82 -3.22 -1.34 5.75 -1.26 -4.96 116.55 113.20 2k4q n ASP 38 Ca -0.08 -2.94 -0.20 0.00 -0.01 0.00 0.00 54.79 51.55 2k4q n ASP 38 Cb 0.54 -0.70 0.20 0.00 -1.03 0.00 0.00 41.12 40.13 2k4q n ASP 38 CO 0.00 0.00 0.00 -2.67 -0.11 0.00 0.00 177.20 174.42 2k4q n TRP 39 N -0.23 -3.07 -4.42 2.11 2.14 -1.26 -5.02 117.44 107.68 2k4q n TRP 39 Ca 0.33 -0.48 -0.22 0.00 2.07 0.00 0.00 57.50 59.21 2k4q n TRP 39 Cb 1.17 -0.97 -0.13 0.00 -0.81 0.00 0.00 31.31 30.56 2k4q n TRP 39 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 2k4q s SER 40 N -2.60 1.97 0.06 -0.67 0.15 0.01 -5.02 113.70 107.59 2k4q s SER 40 Ca 0.45 -0.51 -0.04 0.00 0.70 0.00 0.00 55.95 56.55 2k4q s SER 40 Cb -0.08 -0.13 -0.05 0.00 -1.71 0.00 0.00 66.02 64.05 2k4q s SER 40 CO 0.37 0.06 0.27 0.00 1.20 0.00 0.00 173.24 175.14 2k4q s ARG 41 N -1.26 3.53 -0.10 5.44 3.03 -1.26 -0.04 118.95 128.29 2k4q s ARG 41 Ca 0.03 -0.22 -0.12 0.00 2.03 0.00 0.00 55.73 57.45 2k4q s ARG 41 Cb -0.08 -3.01 -0.04 0.00 -1.03 0.00 0.00 34.95 30.78 2k4q s ARG 41 CO 0.02 0.59 -0.24 1.28 -1.13 0.00 0.00 175.30 175.83 2k4q n LEU 42 N 0.59 1.51 0.00 -1.89 4.77 -1.18 -4.87 117.00 115.92 2k4q n LEU 42 Ca -0.07 0.25 0.02 0.00 -0.03 0.00 0.00 56.01 56.18 2k4q n LEU 42 Cb 0.52 -0.62 0.01 0.00 -2.33 0.00 0.00 43.42 41.00 2k4q n LEU 42 CO 0.47 -0.39 0.68 0.00 -1.33 0.00 0.00 177.39 176.81 2k4q n ALA 43 N -4.00 -2.23 -2.70 -1.18 0.00 -1.26 -4.43 120.51 104.71 2k4q n ALA 43 Ca -0.09 -0.44 -0.39 0.00 0.00 0.00 0.00 53.44 52.52 2k4q n ALA 43 Cb 0.35 0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 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 -2.00 4.30 -0.61 0.00 -2.85 -1.26 -3.43 119.74 113.88 2k4q s LYS 44 Ca 0.19 0.50 -0.27 0.00 -1.00 0.00 0.00 55.97 55.39 2k4q s LYS 44 Cb -0.00 -3.48 0.03 0.00 -2.06 0.00 0.00 37.83 32.32 2k4q s LYS 44 CO -0.01 0.03 1.15 0.08 0.10 0.00 0.00 175.35 176.70 2k4q s VAL 45 N 1.02 4.05 0.07 1.79 1.01 0.91 -3.72 120.40 125.53 2k4q s VAL 45 Ca 0.27 0.61 -0.25 0.00 0.00 0.00 0.00 61.98 62.60 2k4q s VAL 45 Cb -0.16 -4.73 -0.16 0.00 0.00 0.00 0.00 36.38 31.33 2k4q s VAL 45 CO 0.11 -1.41 1.62 0.50 0.00 0.00 0.00 175.10 175.92 2k4q h LYS 46 N 9.60 -0.20 -4.14 2.72 3.64 -1.23 -3.41 116.57 123.55 2k4q h LYS 46 Ca -0.26 0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 58.98 2k4q h LYS 46 Cb 1.06 0.05 -0.12 0.00 -0.41 0.00 0.00 32.23 32.80 2k4q h LYS 46 CO 1.19 -0.06 -0.40 0.34 -2.27 0.00 0.00 179.45 178.25 2k4q s ASP 47 N -5.08 0.05 -0.02 4.20 2.15 -1.15 -4.94 116.67 111.87 2k4q s ASP 47 Ca -0.14 -1.14 -0.02 0.00 0.43 0.00 0.00 52.55 51.67 2k4q s ASP 47 Cb 0.05 0.46 0.01 0.00 -0.30 0.00 0.00 42.92 43.13 2k4q s ASP 47 CO 0.64 -0.95 0.06 -0.22 -0.17 0.00 0.00 175.17 174.53 2k4q s LEU 48 N -3.08 1.71 -0.40 -1.34 2.96 -1.26 -2.49 118.68 114.78 2k4q s LEU 48 Ca 0.29 0.12 0.01 0.00 -0.22 0.00 0.00 54.13 54.33 2k4q s LEU 48 Cb 0.04 0.19 0.13 0.00 0.50 0.00 0.00 46.19 47.05 2k4q s LEU 48 CO 0.09 -0.03 0.21 -0.89 -1.32 0.00 0.00 176.35 174.41 2k4q s THR 49 N 0.11 1.10 -1.02 3.68 2.01 0.90 -4.98 115.64 117.44 2k4q s THR 49 Ca -0.01 -2.22 -0.24 0.00 0.31 0.00 0.00 61.69 59.54 2k4q s THR 49 Cb -0.01 -1.78 -0.06 0.00 0.01 0.00 0.00 72.50 70.65 2k4q s THR 49 CO -0.00 -0.88 1.94 -2.16 -0.69 0.00 0.00 174.62 172.83 2k4q s PRO 50 N 0.68 2.52 -0.91 4.92 0.04 -1.26 -3.30 135.00 137.69 2k4q s PRO 50 Ca 0.16 -0.66 -0.24 0.00 0.04 0.00 0.00 61.00 60.30 2k4q s PRO 50 Cb -0.23 -5.14 -0.02 0.00 0.04 0.00 0.00 34.50 29.15 2k4q s PRO 50 CO -0.03 -3.64 1.82 0.20 0.04 0.00 0.00 177.00 175.39 2k4q s GLY 51 N 7.39 0.43 -0.12 0.56 0.00 -1.26 -4.93 107.32 109.40 2k4q s GLY 51 Ca 0.69 -1.62 -0.38 0.00 0.00 0.00 0.00 44.72 43.41 2k4q s GLY 51 CO 0.05 3.30 1.65 1.18 0.00 0.00 0.00 173.10 179.28 2k4q n GLU 52 N 8.89 1.42 0.11 2.90 -0.58 -1.26 -4.64 120.64 127.47 2k4q n GLU 52 Ca 0.37 0.52 0.10 0.00 -0.42 0.00 0.00 57.16 57.73 2k4q n GLU 52 Cb 0.48 -2.23 0.45 0.00 -0.57 0.00 0.00 31.44 29.57 2k4q n GLU 52 CO 0.00 0.00 0.00 1.47 -0.48 0.00 0.00 177.13 178.12 2k4q n LEU 53 N 4.72 0.48 -3.95 -4.62 -0.00 -1.26 -4.87 117.00 107.51 2k4q n LEU 53 Ca 0.23 0.65 -0.27 0.00 -0.00 0.00 0.00 56.01 56.62 2k4q n LEU 53 Cb 0.19 -0.63 -0.01 0.00 -0.00 0.00 0.00 43.42 42.97 2k4q n LEU 53 CO 0.73 -0.61 -0.14 0.35 -0.00 0.00 0.00 177.39 177.72 2k4q n THR 54 N -2.07 -2.87 -4.09 1.47 -2.24 -1.26 -4.97 114.28 98.25 2k4q n THR 54 Ca 0.01 -0.37 -0.23 0.00 -2.27 0.00 0.00 64.05 61.19 2k4q n THR 54 Cb 0.15 -2.70 -0.06 0.00 -2.10 0.00 0.00 70.33 65.62 2k4q n THR 54 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k4q s ALA 55 N -3.75 3.50 -0.38 6.98 0.00 -1.26 -5.04 121.76 121.82 2k4q s ALA 55 Ca 0.18 -1.71 0.06 0.00 0.00 0.00 0.00 51.96 50.50 2k4q s ALA 55 Cb -0.10 -0.89 0.58 0.00 0.00 0.00 0.00 23.12 22.71 2k4q s ALA 55 CO 0.88 0.11 1.69 0.39 0.00 0.00 0.00 175.76 178.83 2k4q n GLU 56 N -1.14 2.07 -2.42 0.00 1.02 -1.26 -5.00 120.64 113.92 2k4q n GLU 56 Ca -0.04 -3.13 -0.42 0.00 -0.02 0.00 0.00 57.16 53.55 2k4q n GLU 56 Cb 0.60 -2.01 -0.03 0.00 -0.02 0.00 0.00 31.44 29.98 2k4q n GLU 56 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2k4q s SER 57 N -1.96 7.06 0.35 1.62 0.15 -1.26 -5.03 113.70 114.63 2k4q s SER 57 Ca 0.51 1.98 0.04 0.00 0.70 0.00 0.00 55.95 59.19 2k4q s SER 57 Cb 0.45 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 62.12 2k4q s SER 57 CO 0.05 -0.51 0.05 -0.47 1.20 0.00 0.00 173.24 173.56 2k4q s TYR 58 N 1.37 2.07 0.90 3.44 5.04 -1.26 -5.13 117.35 123.78 2k4q s TYR 58 Ca 0.58 -0.91 -0.13 0.00 -2.44 0.00 0.00 57.07 54.18 2k4q s TYR 58 Cb -0.29 -1.39 0.04 0.00 0.35 0.00 0.00 41.96 40.68 2k4q s TYR 58 CO 0.28 0.09 0.55 -0.40 -1.34 0.00 0.00 175.55 174.72 2k4q n ASP 59 N -0.77 -1.52 -3.87 4.32 5.68 -1.26 -5.03 116.55 114.10 2k4q n ASP 59 Ca -0.03 0.39 -0.09 0.00 -0.50 0.00 0.00 54.79 54.56 2k4q n ASP 59 Cb 0.67 -1.25 -0.07 0.00 -1.14 0.00 0.00 41.12 39.32 2k4q n ASP 59 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 2k4q s ASP 60 N -2.00 0.09 -0.44 -1.12 1.01 -1.26 -5.11 116.67 107.84 2k4q s ASP 60 Ca 0.60 -0.69 0.04 0.00 0.71 0.00 0.00 52.55 53.21 2k4q s ASP 60 Cb -0.24 0.37 0.26 0.00 1.01 0.00 0.00 42.92 44.32 2k4q s ASP 60 CO 0.64 -0.77 1.02 -0.24 0.21 0.00 0.00 175.17 176.03 2k4q n SER 61 N -0.10 -2.40 -4.92 0.27 2.88 -1.26 -5.16 113.62 102.94 2k4q n SER 61 Ca -0.13 -2.93 -0.26 0.00 -1.33 0.00 0.00 58.87 54.21 2k4q n SER 61 Cb 0.63 1.55 0.01 0.00 -0.75 0.00 0.00 64.21 65.65 2k4q n SER 61 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2k4q s TYR 62 N 0.49 3.43 -0.30 0.66 -0.85 -1.26 -5.10 117.35 114.42 2k4q s TYR 62 Ca 0.29 0.65 -0.16 0.00 -0.52 0.00 0.00 57.07 57.33 2k4q s TYR 62 Cb 0.23 -2.39 0.18 0.00 0.38 0.00 0.00 41.96 40.36 2k4q s TYR 62 CO -0.19 -0.41 1.13 -0.48 -1.52 0.00 0.00 175.55 174.09 2k4q s LEU 63 N -4.75 -0.28 -0.07 -3.49 2.34 -1.26 -5.18 118.68 105.98 2k4q s LEU 63 Ca 0.49 0.43 -0.30 0.00 0.06 0.00 0.00 54.13 54.81 2k4q s LEU 63 Cb -0.10 1.38 0.11 0.00 -0.56 0.00 0.00 46.19 47.02 2k4q s LEU 63 CO 0.43 -0.07 0.96 -0.62 -1.06 0.00 0.00 176.35 176.00 2k4q s ASP 64 N 1.50 -0.33 -1.25 1.48 2.15 -1.26 -5.00 116.67 113.97 2k4q s ASP 64 Ca -0.06 0.09 -0.00 0.00 0.43 0.00 0.00 52.55 53.00 2k4q s ASP 64 Cb -0.03 0.33 0.00 0.00 -0.30 0.00 0.00 42.92 42.92 2k4q s ASP 64 CO -0.14 -0.50 0.88 0.47 -0.17 0.00 0.00 175.17 175.72 2k4q n ASP 65 N -0.01 -1.76 -0.05 -0.34 8.00 -1.26 -4.92 116.55 116.22 2k4q n ASP 65 Ca -0.08 -0.70 -0.12 0.00 0.71 0.00 0.00 54.79 54.60 2k4q n ASP 65 Cb 0.60 -4.70 -0.07 0.00 -0.02 0.00 0.00 41.12 36.94 2k4q n ASP 65 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2k4q h GLU 66 N -1.90 0.27 -2.17 -1.24 4.39 -1.99 -3.35 114.58 108.59 2k4q h GLU 66 Ca -0.60 -0.11 -0.57 0.00 0.34 0.00 0.00 59.36 58.42 2k4q h GLU 66 Cb 1.35 -0.01 -0.41 0.00 -0.10 0.00 0.00 28.75 29.57 2k4q h GLU 66 CO 0.53 0.59 -0.79 -0.40 -1.16 0.00 0.00 179.01 177.78 2k4q n ASP 67 N -4.69 3.11 -4.76 1.42 5.75 -1.26 -5.08 116.55 111.03 2k4q n ASP 67 Ca -0.06 -3.38 -0.22 0.00 -0.01 0.00 0.00 54.79 51.12 2k4q n ASP 67 Cb 0.27 -0.61 -0.05 0.00 -1.03 0.00 0.00 41.12 39.70 2k4q n ASP 67 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k4q s ALA 68 N -2.75 3.52 0.38 2.12 0.00 -1.26 -5.01 121.76 118.76 2k4q s ALA 68 Ca 0.43 -1.64 0.24 0.00 0.00 0.00 0.00 51.96 51.00 2k4q s ALA 68 Cb 0.25 -0.99 1.27 0.00 0.00 0.00 0.00 23.12 23.64 2k4q s ALA 68 CO -0.09 0.14 2.01 -0.44 0.00 0.00 0.00 175.76 177.38 2k4q h ASP 69 N 1.54 0.00 -4.05 0.00 5.19 -1.98 -3.43 116.42 113.69 2k4q h ASP 69 Ca -0.45 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 55.87 2k4q h ASP 69 Cb 1.25 0.00 -0.22 0.00 0.18 0.00 0.00 39.33 40.53 2k4q h ASP 69 CO 0.61 0.17 -0.07 -1.66 -3.12 0.00 0.00 179.24 175.16 2k4q s TRP 70 N -4.16 -0.58 -0.09 4.55 -2.14 -1.26 -5.05 118.94 110.21 2k4q s TRP 70 Ca -0.02 1.38 0.07 0.00 2.66 0.00 0.00 56.10 60.19 2k4q s TRP 70 Cb 0.13 0.21 -0.10 0.00 -3.10 0.00 0.00 33.47 30.61 2k4q s TRP 70 CO 0.61 -0.31 0.01 2.41 -2.66 0.00 0.00 176.95 177.01 2k4q n THR 71 N 2.60 0.62 -3.69 0.66 -1.04 -1.26 -5.03 114.28 107.14 2k4q n THR 71 Ca -0.14 -0.36 -0.23 0.00 -2.04 0.00 0.00 64.05 61.28 2k4q n THR 71 Cb 0.56 -0.78 0.05 0.00 -1.82 0.00 0.00 70.33 68.33 2k4q n THR 71 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k4q n ALA 72 N -2.41 -1.79 -2.32 2.41 0.00 -1.26 -4.99 120.51 110.15 2k4q n ALA 72 Ca -0.15 -0.01 -0.18 0.00 0.00 0.00 0.00 53.44 53.09 2k4q n ALA 72 Cb 0.78 -2.92 -0.09 0.00 0.00 0.00 0.00 19.45 17.21 2k4q n ALA 72 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2k4q s THR 73 N -3.50 0.31 0.00 0.00 -1.32 -1.26 -5.15 115.64 104.72 2k4q s THR 73 Ca 0.20 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.68 2k4q s THR 73 Cb -0.10 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 68.37 2k4q s THR 73 CO 0.79 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.81 2k4q n GLY 74 N -0.54 3.14 2.59 6.08 0.00 -1.26 -5.14 105.19 110.06 2k4q n GLY 74 Ca 0.01 -0.14 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 2k4q n GLY 74 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k4q s GLN 75 N 2.86 0.16 0.17 1.61 0.74 -1.26 -5.15 119.66 118.80 2k4q s GLN 75 Ca 0.00 -0.31 -0.03 0.00 0.05 0.00 0.00 55.36 55.07 2k4q s GLN 75 Cb 0.00 -1.56 0.04 0.00 1.10 0.00 0.00 33.01 32.59 2k4q s GLN 75 CO 0.00 -0.82 0.19 0.41 -0.55 0.00 0.00 175.29 174.51 2k4q n GLY 76 N 5.25 -1.93 3.00 2.59 0.00 -1.26 -5.10 105.19 107.74 2k4q n GLY 76 Ca -0.07 -1.55 -0.10 0.00 0.00 0.00 0.00 46.02 44.30 2k4q n GLY 76 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k4q s GLN 77 N -3.42 0.36 -0.30 1.61 -2.07 -1.26 -5.15 119.66 109.44 2k4q s GLN 77 Ca 0.11 -0.62 -0.07 0.00 -1.82 0.00 0.00 55.36 52.96 2k4q s GLN 77 Cb -0.01 -0.00 0.15 0.00 -1.09 0.00 0.00 33.01 32.06 2k4q s GLN 77 CO 0.08 -0.02 0.64 0.21 -1.32 0.00 0.00 175.29 174.88 2k4q s LYS 78 N -1.42 0.57 -0.14 9.60 2.36 -1.26 -5.15 119.74 124.30 2k4q s LYS 78 Ca -0.14 1.29 -0.07 0.00 -2.55 0.00 0.00 55.97 54.49 2k4q s LYS 78 Cb -0.10 0.76 0.06 0.00 -1.05 0.00 0.00 37.83 37.50 2k4q s LYS 78 CO -0.01 -0.35 0.34 -1.12 1.55 0.00 0.00 175.35 175.76 2k4q s SER 79 N 2.88 -0.37 -0.30 1.43 0.01 -1.26 -5.10 113.70 110.99 2k4q s SER 79 Ca 0.04 0.74 -0.16 0.00 1.31 0.00 0.00 55.95 57.88 2k4q s SER 79 Cb -0.13 0.65 0.18 0.00 0.21 0.00 0.00 66.02 66.93 2k4q s SER 79 CO -0.20 -0.19 1.09 0.00 0.41 0.00 0.00 173.24 174.35 2k4q s ALA 80 N 1.44 -3.09 0.00 1.44 0.00 -1.26 -4.15 121.76 116.14 2k4q s ALA 80 Ca -0.09 1.79 0.00 0.00 0.00 0.00 0.00 51.96 53.66 2k4q s ALA 80 Cb -0.09 -2.26 0.00 0.00 0.00 0.00 0.00 23.12 20.77 2k4q s ALA 80 CO -0.11 -1.12 0.00 0.41 0.00 0.00 0.00 175.76 174.94 2k4q n GLY 81 N 5.02 -0.50 3.51 0.00 0.00 -1.26 -4.98 105.19 106.98 2k4q n GLY 81 Ca -0.08 0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 -0.61 -3.55 1.61 5.68 -1.26 -4.82 116.55 113.59 2k4q n ASP 82 Ca 0.00 0.64 -0.16 0.00 -0.50 0.00 0.00 54.79 54.76 2k4q n ASP 82 Cb 0.00 -1.27 -0.13 0.00 -1.14 0.00 0.00 41.12 38.58 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 -1.84 -0.35 -0.21 2.12 2.01 0.94 -4.16 115.64 114.14 2k4q s THR 83 Ca 0.69 0.05 -0.11 0.00 0.31 0.00 0.00 61.69 62.63 2k4q s THR 83 Cb -0.36 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.53 2k4q s THR 83 CO 0.55 -0.07 0.16 -0.55 -0.69 0.00 0.00 174.62 174.02 2k4q s SER 84 N 2.36 6.20 -0.09 3.53 0.15 -1.21 -0.94 113.70 123.69 2k4q s SER 84 Ca 0.05 0.21 -0.06 0.00 0.70 0.00 0.00 55.95 56.85 2k4q s SER 84 Cb -0.14 -2.10 0.03 0.00 -1.71 0.00 0.00 66.02 62.10 2k4q s SER 84 CO -0.10 0.13 0.23 0.72 1.20 0.00 0.00 173.24 175.41 2k4q s PHE 85 N 0.64 -0.28 0.35 3.44 -0.71 -0.33 -0.07 117.98 121.03 2k4q s PHE 85 Ca 0.09 0.67 -0.21 0.00 -1.04 0.00 0.00 56.93 56.44 2k4q s PHE 85 Cb -0.12 0.06 -0.10 0.00 -1.21 0.00 0.00 43.02 41.65 2k4q s PHE 85 CO 0.01 -0.17 0.88 0.99 -1.34 0.00 0.00 175.22 175.59 2k4q s THR 86 N 0.67 4.41 0.28 -4.49 2.01 -1.04 -0.94 115.64 116.54 2k4q s THR 86 Ca -0.04 1.47 0.12 0.00 0.31 0.00 0.00 61.69 63.54 2k4q s THR 86 Cb -0.06 -3.75 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 2k4q s THR 86 CO -0.04 -0.10 -0.17 -0.76 -0.69 0.00 0.00 174.62 172.86 2k4q s LEU 87 N -2.67 2.67 -0.18 4.42 2.01 0.91 -0.80 118.68 125.04 2k4q s LEU 87 Ca 0.55 -0.99 -0.12 0.00 0.01 0.00 0.00 54.13 53.58 2k4q s LEU 87 Cb -0.13 -1.17 0.06 0.00 0.01 0.00 0.00 46.19 44.95 2k4q s LEU 87 CO 0.18 0.03 0.45 0.00 1.01 0.00 0.00 176.35 178.01 2k4q s ALA 88 N -2.49 -1.14 0.11 4.21 0.00 -1.24 -1.39 121.76 119.82 2k4q s ALA 88 Ca 0.30 1.51 0.08 0.00 0.00 0.00 0.00 51.96 53.85 2k4q s ALA 88 Cb -0.05 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 2k4q s ALA 88 CO 0.16 -0.26 -0.19 -1.58 0.00 0.00 0.00 175.76 173.89 2k4q s TRP 89 N 1.01 1.70 0.28 0.00 0.51 0.02 -4.47 118.94 117.99 2k4q s TRP 89 Ca -0.06 -0.44 0.10 0.00 -2.12 0.00 0.00 56.10 53.58 2k4q s TRP 89 Cb -0.06 -0.91 -0.05 0.00 -0.81 0.00 0.00 33.47 31.64 2k4q s TRP 89 CO -0.09 0.20 -0.07 -1.64 -0.51 0.00 0.00 176.95 174.85 2k4q s MET 90 N -2.09 2.05 -0.31 4.98 -1.94 -1.26 -0.01 119.30 120.71 2k4q s MET 90 Ca 0.07 -1.58 -0.29 0.00 -1.71 0.00 0.00 55.69 52.18 2k4q s MET 90 Cb -0.09 -1.99 -0.02 0.00 2.01 0.00 0.00 34.83 34.74 2k4q s MET 90 CO 0.04 0.33 1.67 -1.25 -0.01 0.00 0.00 175.02 175.80 2k4q s PRO 91 N -3.62 3.51 0.00 2.03 0.04 -1.26 -2.46 135.00 133.24 2k4q s PRO 91 Ca 0.31 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.76 2k4q s PRO 91 Cb -0.05 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.37 2k4q s PRO 91 CO 0.18 -1.64 0.00 0.41 0.04 0.00 0.00 177.00 175.99 2k4q n GLY 92 N 5.15 1.14 4.00 0.56 0.00 -1.26 -2.14 105.19 112.64 2k4q n GLY 92 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.61 2.31 0.03 1.61 2.02 -1.03 -4.89 118.70 118.15 2k4q s GLU 93 Ca 0.00 -1.73 0.03 0.00 0.02 0.00 0.00 54.97 53.29 2k4q s GLU 93 Cb 0.00 -2.51 -0.02 0.00 0.10 0.00 0.00 34.13 31.70 2k4q s GLU 93 CO 0.00 -0.78 -0.10 -0.65 0.02 0.00 0.00 175.26 173.75 2k4q s GLN 94 N -4.56 0.68 0.00 1.61 -0.21 -1.26 -4.91 119.66 111.01 2k4q s GLN 94 Ca 0.54 -0.66 0.00 0.00 0.02 0.00 0.00 55.36 55.26 2k4q s GLN 94 Cb -0.05 -0.60 0.00 0.00 1.00 0.00 0.00 33.01 33.36 2k4q s GLN 94 CO 0.34 0.14 0.00 0.41 -2.12 0.00 0.00 175.29 174.06 2k4q n GLY 95 N 1.91 0.24 0.29 3.09 0.00 -1.26 -4.86 105.19 104.60 2k4q n GLY 95 Ca -0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.90 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 0.50 -0.62 1.61 4.20 -1.91 0.23 115.11 119.12 2k4q h GLN 96 Ca 0.00 -0.03 0.18 0.00 0.06 0.00 0.00 58.65 58.86 2k4q h GLN 96 Cb 0.00 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 2k4q h GLN 96 CO 0.00 0.33 0.51 -0.56 -0.67 0.00 0.00 178.83 178.44 2k4q h GLN 97 N 0.52 0.00 0.54 1.46 3.07 -1.95 -1.03 115.11 117.72 2k4q h GLN 97 Ca 0.44 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 59.16 2k4q h GLN 97 Cb 0.66 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.23 2k4q h GLN 97 CO -0.39 0.00 -0.26 0.00 0.09 0.00 0.00 178.83 178.27 2k4q h ALA 98 N 1.57 -0.72 -0.30 0.06 0.00 -0.82 0.39 119.26 119.43 2k4q h ALA 98 Ca 0.30 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2k4q h ALA 98 Cb 1.31 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.37 2k4q h ALA 98 CO -0.00 -0.85 -0.15 1.37 0.00 0.00 0.00 179.25 179.62 2k4q h LEU 99 N -0.83 0.51 -0.04 0.00 8.10 -1.35 -0.98 115.31 120.72 2k4q h LEU 99 Ca -0.07 -0.14 -0.00 0.00 0.11 0.00 0.00 57.88 57.77 2k4q h LEU 99 Cb 0.60 -0.14 -0.00 0.00 -0.44 0.00 0.00 40.66 40.68 2k4q h LEU 99 CO 0.12 0.68 0.01 0.25 -4.11 0.00 0.00 178.44 175.39 2k4q h LEU 100 N 0.48 0.06 -0.58 0.17 5.85 -1.12 -1.39 115.31 118.78 2k4q h LEU 100 Ca 0.08 -0.20 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 2k4q h LEU 100 Cb 0.54 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2k4q h LEU 100 CO 0.03 0.25 -0.02 0.00 -0.34 0.00 0.00 178.44 178.36 2k4q h ALA 101 N 0.82 0.79 0.29 1.25 0.00 -0.82 -1.15 119.26 120.43 2k4q h ALA 101 Ca 0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2k4q h ALA 101 Cb 0.21 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2k4q h ALA 101 CO -0.00 0.64 -0.19 2.35 0.00 0.00 0.00 179.25 182.05 2k4q h TRP 102 N 0.93 -0.49 0.27 0.00 2.91 -1.09 0.24 115.95 118.72 2k4q h TRP 102 Ca 0.16 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.16 2k4q h TRP 102 Cb 0.58 0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.41 2k4q h TRP 102 CO 0.04 -0.29 -0.13 0.35 -1.03 0.00 0.00 178.44 177.38 2k4q h PHE 103 N -0.46 -0.34 -0.36 2.65 3.57 -1.24 0.75 116.94 121.51 2k4q h PHE 103 Ca -0.03 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.55 2k4q h PHE 103 Cb 0.39 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.23 2k4q h PHE 103 CO -0.10 -0.14 0.25 -0.97 -2.23 0.00 0.00 178.31 175.13 2k4q h ASN 104 N -0.47 0.08 0.00 0.41 -0.73 -1.16 -2.29 115.58 111.43 2k4q h ASN 104 Ca -0.04 0.00 -0.05 0.00 1.87 0.00 0.00 56.30 58.09 2k4q h ASN 104 Cb 0.35 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.93 2k4q h ASN 104 CO 0.06 0.05 -0.19 -0.08 -0.37 0.00 0.00 177.43 176.91 2k4q h GLU 105 N 0.09 0.12 -6.12 6.67 4.57 -0.10 -3.48 114.58 116.33 2k4q h GLU 105 Ca 0.17 -0.13 -0.43 0.00 -1.18 0.00 0.00 59.36 57.79 2k4q h GLU 105 Cb 0.56 0.04 0.04 0.00 -0.16 0.00 0.00 28.75 29.22 2k4q h GLU 105 CO -0.02 0.89 -0.82 0.41 -1.18 0.00 0.00 179.01 178.30 2k4q n GLY 106 N 1.08 -0.32 3.28 1.92 0.00 0.22 -4.99 105.19 106.39 2k4q n GLY 106 Ca -0.10 0.14 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 2k4q n GLY 106 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k4q s ASP 107 N -4.22 1.04 0.05 1.61 1.01 -1.26 -5.04 116.67 109.87 2k4q s ASP 107 Ca 0.09 -1.34 -0.31 0.00 0.71 0.00 0.00 52.55 51.71 2k4q s ASP 107 Cb -0.05 0.18 -0.06 0.00 1.01 0.00 0.00 42.92 44.00 2k4q s ASP 107 CO 0.82 -0.72 1.37 -0.89 0.21 0.00 0.00 175.17 175.96 2k4q s THR 108 N -3.79 3.61 0.26 -1.27 2.01 -1.26 -4.18 115.64 111.00 2k4q s THR 108 Ca 0.35 1.08 0.06 0.00 0.31 0.00 0.00 61.69 63.50 2k4q s THR 108 Cb 0.07 -3.70 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 2k4q s THR 108 CO 0.11 0.04 -0.07 -0.13 -0.69 0.00 0.00 174.62 173.89 2k4q s ARG 109 N 1.74 1.47 -0.22 4.92 1.81 -0.40 -4.89 118.95 123.39 2k4q s ARG 109 Ca 0.63 -1.73 0.01 0.00 -1.72 0.00 0.00 55.73 52.93 2k4q s ARG 109 Cb -0.33 -1.07 0.05 0.00 -0.45 0.00 0.00 34.95 33.15 2k4q s ARG 109 CO 0.28 0.05 -0.07 0.00 -0.68 0.00 0.00 175.30 174.88 2k4q s ALA 110 N -3.06 1.97 0.13 2.13 0.00 -1.26 -0.97 121.76 120.70 2k4q s ALA 110 Ca 0.28 -1.29 0.03 0.00 0.00 0.00 0.00 51.96 50.98 2k4q s ALA 110 Cb 0.03 -1.37 -0.04 0.00 0.00 0.00 0.00 23.12 21.74 2k4q s ALA 110 CO 0.10 -1.04 -0.08 1.52 0.00 0.00 0.00 175.76 176.26 2k4q s TYR 111 N 1.40 1.09 0.04 0.00 1.13 -0.07 -3.20 117.35 117.74 2k4q s TYR 111 Ca -0.04 -0.84 0.01 0.00 -1.41 0.00 0.00 57.07 54.79 2k4q s TYR 111 Cb -0.18 -0.59 -0.02 0.00 -1.10 0.00 0.00 41.96 40.07 2k4q s TYR 111 CO -0.07 -0.03 -0.06 -1.59 -2.51 0.00 0.00 175.55 171.29 2k4q s LYS 112 N -3.79 0.48 -0.12 -3.49 0.00 -0.42 -0.09 119.74 112.30 2k4q s LYS 112 Ca 0.15 -0.76 -0.01 0.00 0.00 0.00 0.00 55.97 55.35 2k4q s LYS 112 Cb 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 37.83 37.72 2k4q s LYS 112 CO -0.02 0.01 -0.11 0.42 0.00 0.00 0.00 175.35 175.65 2k4q s ILE 113 N -1.65 3.29 -0.36 3.79 1.09 -0.31 -0.53 121.20 126.52 2k4q s ILE 113 Ca -0.10 -0.59 -0.20 0.00 -1.10 0.00 0.00 60.65 58.67 2k4q s ILE 113 Cb -0.08 -2.39 0.00 0.00 -1.06 0.00 0.00 42.46 38.93 2k4q s ILE 113 CO -0.01 0.53 0.61 -0.60 -0.10 0.00 0.00 174.94 175.37 2k4q s ARG 114 N 0.16 3.63 0.63 2.79 3.52 -1.13 -0.77 118.95 127.78 2k4q s ARG 114 Ca -0.06 -0.04 -0.11 0.00 -0.13 0.00 0.00 55.73 55.39 2k4q s ARG 114 Cb -0.15 -3.82 -0.03 0.00 -1.56 0.00 0.00 34.95 29.39 2k4q s ARG 114 CO 0.04 -0.74 1.04 -0.06 -0.81 0.00 0.00 175.30 174.77 2k4q s PHE 115 N 2.64 3.56 -0.32 5.12 0.40 -0.86 -4.25 117.98 124.28 2k4q s PHE 115 Ca 0.23 1.27 0.26 0.00 -0.60 0.00 0.00 56.93 58.09 2k4q s PHE 115 Cb -0.15 -2.77 1.10 0.00 0.51 0.00 0.00 43.02 41.72 2k4q s PHE 115 CO 0.15 -0.78 1.78 -1.00 0.70 0.00 0.00 175.22 176.08 2k4q h PRO 116 N -0.38 0.00 0.00 0.24 0.13 -1.94 -2.50 132.00 127.54 2k4q h PRO 116 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2k4q h PRO 116 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k4q h PRO 116 CO 0.62 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.48 2k4q n ASN 117 N -2.45 0.21 0.00 1.44 4.13 -1.26 -4.87 115.26 112.45 2k4q n ASN 117 Ca 0.02 0.53 0.00 0.00 1.68 0.00 0.00 54.58 56.81 2k4q n ASN 117 Cb 0.24 -0.58 0.00 0.00 -1.54 0.00 0.00 39.78 37.90 2k4q n ASN 117 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2k4q n GLY 118 N 0.91 0.73 0.47 7.41 0.00 -0.94 -5.09 105.19 108.68 2k4q n GLY 118 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 2k4q n GLY 118 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2k4q n THR 119 N -1.88 0.00 -3.73 2.61 5.66 -1.25 -4.94 114.28 110.75 2k4q n THR 119 Ca 0.00 -0.23 -0.13 0.00 -3.05 0.00 0.00 64.05 60.64 2k4q n THR 119 Cb 0.00 -1.00 -0.09 0.00 -1.55 0.00 0.00 70.33 67.69 2k4q n THR 119 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2k4q s VAL 120 N 0.46 0.01 -0.26 1.08 0.11 -1.26 -2.02 120.40 118.53 2k4q s VAL 120 Ca 0.07 -0.11 -0.01 0.00 -2.93 0.00 0.00 61.98 59.00 2k4q s VAL 120 Cb -0.01 -0.61 0.03 0.00 -1.53 0.00 0.00 36.38 34.26 2k4q s VAL 120 CO 0.05 -0.06 -0.06 -0.62 -3.33 0.00 0.00 175.10 171.08 2k4q s ASP 121 N -0.23 4.39 0.03 3.54 -1.08 0.05 -4.94 116.67 118.43 2k4q s ASP 121 Ca -0.04 -0.95 -0.27 0.00 -0.52 0.00 0.00 52.55 50.78 2k4q s ASP 121 Cb -0.03 -1.66 -0.05 0.00 -1.46 0.00 0.00 42.92 39.71 2k4q s ASP 121 CO 0.02 -0.15 0.83 -0.69 0.52 0.00 0.00 175.17 175.70 2k4q s VAL 122 N 1.30 4.76 0.01 1.11 1.01 -1.26 -1.17 120.40 126.16 2k4q s VAL 122 Ca -0.01 1.77 0.00 0.00 0.00 0.00 0.00 61.98 63.74 2k4q s VAL 122 Cb -0.17 -4.18 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 2k4q s VAL 122 CO -0.04 0.30 -0.02 -0.36 0.00 0.00 0.00 175.10 174.98 2k4q s PHE 123 N 0.28 0.20 0.10 5.22 0.08 0.87 -4.98 117.98 119.74 2k4q s PHE 123 Ca 0.42 -0.25 0.03 0.00 0.12 0.00 0.00 56.93 57.25 2k4q s PHE 123 Cb -0.21 -0.13 -0.04 0.00 -0.57 0.00 0.00 43.02 42.07 2k4q s PHE 123 CO 0.24 -0.08 -0.08 1.03 -0.10 0.00 0.00 175.22 176.24 2k4q s ARG 124 N -0.70 0.85 0.00 0.44 0.52 -1.26 -0.89 118.95 117.91 2k4q s ARG 124 Ca -0.07 -1.27 0.00 0.00 -0.52 0.00 0.00 55.73 53.87 2k4q s ARG 124 Cb -0.05 -0.35 0.00 0.00 0.52 0.00 0.00 34.95 35.08 2k4q s ARG 124 CO -0.00 0.02 0.00 0.41 0.02 0.00 0.00 175.30 175.75 2k4q n GLY 125 N 0.17 1.19 3.60 -3.53 0.00 -0.14 -4.95 105.19 101.53 2k4q n GLY 125 Ca -0.13 -2.07 -0.31 0.00 0.00 0.00 0.00 46.02 43.50 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 -1.11 2.86 0.23 1.61 -2.14 -1.26 -1.27 118.94 117.86 2k4q s TRP 126 Ca 0.00 -0.07 -0.30 0.00 2.66 0.00 0.00 56.10 58.39 2k4q s TRP 126 Cb 0.00 -1.56 -0.09 0.00 -3.10 0.00 0.00 33.47 28.73 2k4q s TRP 126 CO 0.00 0.39 0.99 0.08 -2.66 0.00 0.00 176.95 175.76 2k4q s VAL 127 N -1.08 3.96 0.00 -0.66 1.01 -1.26 -3.84 120.40 118.53 2k4q s VAL 127 Ca 0.19 1.91 0.00 0.00 0.00 0.00 0.00 61.98 64.08 2k4q s VAL 127 Cb -0.11 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2k4q s VAL 127 CO 0.10 0.43 0.20 -0.24 0.00 0.00 0.00 175.10 175.59 2k4q n SER 128 N 1.64 0.41 -3.90 3.32 2.88 -1.20 -4.91 113.62 111.87 2k4q n SER 128 Ca -0.01 -0.70 -0.30 0.00 -1.33 0.00 0.00 58.87 56.53 2k4q n SER 128 Cb 0.47 0.49 -0.15 0.00 -0.75 0.00 0.00 64.21 64.27 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 -0.49 4.43 -0.14 -3.46 0.15 -1.04 -5.03 113.70 108.12 2k4q s SER 129 Ca 0.00 -2.07 -0.07 0.00 0.70 0.00 0.00 55.95 54.50 2k4q s SER 129 Cb 0.00 -1.34 0.06 0.00 -1.71 0.00 0.00 66.02 63.03 2k4q s SER 129 CO 0.00 -0.37 0.34 -0.63 1.20 0.00 0.00 173.24 173.77 2k4q s ILE 130 N 1.02 -0.10 0.00 6.45 1.01 -1.26 -3.43 121.20 124.89 2k4q s ILE 130 Ca 0.11 0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.90 2k4q s ILE 130 Cb -0.19 -0.51 0.00 0.00 0.01 0.00 0.00 42.46 41.77 2k4q s ILE 130 CO -0.13 0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.48 2k4q n GLY 131 N 4.41 4.98 3.84 6.18 0.00 -1.26 -5.10 105.19 118.24 2k4q n GLY 131 Ca -0.22 -1.24 -0.30 0.00 0.00 0.00 0.00 46.02 44.26 2k4q n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k4q s LYS 132 N 1.34 2.81 0.04 1.61 -0.14 -1.26 -5.04 119.74 119.10 2k4q s LYS 132 Ca 0.00 0.68 -0.21 0.00 -1.36 0.00 0.00 55.97 55.08 2k4q s LYS 132 Cb 0.00 -2.00 -0.06 0.00 -1.68 0.00 0.00 37.83 34.09 2k4q s LYS 132 CO 0.00 -1.12 0.62 0.00 -0.76 0.00 0.00 175.35 174.09 2k4q s ALA 133 N -3.19 3.51 -0.34 5.17 0.00 -1.26 -4.93 121.76 120.71 2k4q s ALA 133 Ca 0.58 0.08 -0.21 0.00 0.00 0.00 0.00 51.96 52.41 2k4q s ALA 133 Cb -0.13 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.25 2k4q s ALA 133 CO 0.54 0.24 0.69 0.08 0.00 0.00 0.00 175.76 177.30 2k4q s VAL 134 N -0.55 4.85 -0.18 0.00 1.01 -0.08 -4.90 120.40 120.56 2k4q s VAL 134 Ca 0.31 0.79 -0.18 0.00 0.00 0.00 0.00 61.98 62.90 2k4q s VAL 134 Cb -0.19 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 2k4q s VAL 134 CO 0.19 -0.29 0.48 -0.89 0.00 0.00 0.00 175.10 174.59 2k4q s THR 135 N 2.80 5.15 -0.23 3.92 2.01 -1.26 -0.41 115.64 127.62 2k4q s THR 135 Ca 0.27 0.90 -0.09 0.00 0.31 0.00 0.00 61.69 63.08 2k4q s THR 135 Cb -0.14 -3.81 0.09 0.00 0.01 0.00 0.00 72.50 68.65 2k4q s THR 135 CO 0.14 0.23 0.52 0.00 -0.69 0.00 0.00 174.62 174.82 2k4q s ALA 136 N 1.29 -1.48 -1.23 7.40 0.00 0.82 -4.94 121.76 123.62 2k4q s ALA 136 Ca 0.23 1.86 -0.01 0.00 0.00 0.00 0.00 51.96 54.04 2k4q s ALA 136 Cb -0.15 -1.40 -0.00 0.00 0.00 0.00 0.00 23.12 21.57 2k4q s ALA 136 CO 0.09 -0.68 0.87 1.63 0.00 0.00 0.00 175.76 177.67 2k4q n LYS 137 N 5.09 -5.52 -2.26 0.00 4.01 -1.26 -1.36 118.16 116.85 2k4q n LYS 137 Ca -0.13 0.75 -0.14 0.00 -0.51 0.00 0.00 58.31 58.27 2k4q n LYS 137 Cb 0.51 -5.54 -0.02 0.00 -0.51 0.00 0.00 35.03 29.47 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 -4.13 -1.98 -4.06 1.97 1.02 -1.26 -4.94 120.64 107.26 2k4q n GLU 138 Ca -0.28 0.71 -0.16 0.00 -0.02 0.00 0.00 57.16 57.41 2k4q n GLU 138 Cb 0.67 -5.26 -0.15 0.00 -0.02 0.00 0.00 31.44 26.68 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 0.30 -0.03 2.62 1.01 -0.47 -4.29 120.40 116.93 2k4q s VAL 139 Ca 0.00 -0.11 -0.11 0.00 0.00 0.00 0.00 61.98 61.76 2k4q s VAL 139 Cb 0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 36.38 36.04 2k4q s VAL 139 CO 0.00 0.11 0.31 -0.63 0.00 0.00 0.00 175.10 174.89 2k4q s ILE 140 N 0.21 5.21 -0.04 2.22 1.01 0.98 -0.13 121.20 130.66 2k4q s ILE 140 Ca -0.02 0.54 -0.10 0.00 0.00 0.00 0.00 60.65 61.07 2k4q s ILE 140 Cb -0.05 -3.59 0.02 0.00 0.01 0.00 0.00 42.46 38.84 2k4q s ILE 140 CO -0.00 0.54 0.24 0.42 0.00 0.00 0.00 174.94 176.14 2k4q s THR 141 N -1.12 0.04 0.30 2.92 -4.23 0.45 -0.80 115.64 113.21 2k4q s THR 141 Ca 0.22 -0.33 -0.15 0.00 -1.18 0.00 0.00 61.69 60.25 2k4q s THR 141 Cb -0.15 -0.46 0.06 0.00 1.34 0.00 0.00 72.50 73.29 2k4q s THR 141 CO 0.11 -0.18 0.78 0.54 -0.54 0.00 0.00 174.62 175.33 2k4q n ARG 142 N 2.02 0.91 -3.81 3.99 5.12 -0.49 -0.90 116.66 123.50 2k4q n ARG 142 Ca -0.18 -1.83 -0.20 0.00 -1.93 0.00 0.00 57.85 53.70 2k4q n ARG 142 Cb 0.57 2.33 -0.17 0.00 -1.16 0.00 0.00 32.46 34.02 2k4q n ARG 142 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2k4q s THR 143 N -2.16 0.20 -0.16 0.55 -1.32 -1.26 -0.06 115.64 111.43 2k4q s THR 143 Ca 0.16 0.18 -0.02 0.00 -1.21 0.00 0.00 61.69 60.81 2k4q s THR 143 Cb -0.04 -0.36 -0.02 0.00 -1.51 0.00 0.00 72.50 70.57 2k4q s THR 143 CO 0.09 0.21 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.93 2k4q s VAL 144 N 1.72 3.29 -0.12 5.08 1.01 -0.12 -4.75 120.40 126.51 2k4q s VAL 144 Ca 0.00 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2k4q s VAL 144 Cb -0.13 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.84 2k4q s VAL 144 CO -0.03 0.49 -0.16 -0.75 0.00 0.00 0.00 175.10 174.65 2k4q s LYS 145 N 0.65 2.37 -0.36 2.72 2.47 -1.22 -1.19 119.74 125.18 2k4q s LYS 145 Ca -0.05 -0.61 -0.09 0.00 -1.56 0.00 0.00 55.97 53.66 2k4q s LYS 145 Cb -0.15 -2.01 0.03 0.00 -1.46 0.00 0.00 37.83 34.23 2k4q s LYS 145 CO 0.02 -0.08 0.17 0.08 0.16 0.00 0.00 175.35 175.70 2k4q s VAL 146 N 1.03 4.30 -0.08 4.02 1.01 -0.12 -2.49 120.40 128.07 2k4q s VAL 146 Ca -0.05 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.05 2k4q s VAL 146 Cb -0.15 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.85 2k4q s VAL 146 CO -0.03 -0.18 -0.18 0.28 0.00 0.00 0.00 175.10 174.98 2k4q s THR 147 N 1.51 1.60 0.62 3.92 -1.32 -1.25 -0.04 115.64 120.68 2k4q s THR 147 Ca 0.01 -0.75 -0.09 0.00 -1.21 0.00 0.00 61.69 59.65 2k4q s THR 147 Cb -0.19 -1.42 -0.01 0.00 -1.51 0.00 0.00 72.50 69.37 2k4q s THR 147 CO 0.05 0.46 0.98 0.20 -2.21 0.00 0.00 174.62 174.11 2k4q s ASN 148 N 0.53 5.86 -0.21 8.08 0.02 -1.26 -4.64 114.94 123.33 2k4q s ASN 148 Ca -0.16 1.11 -0.10 0.00 -1.02 0.00 0.00 52.86 52.69 2k4q s ASN 148 Cb -0.17 -2.11 -0.05 0.00 0.02 0.00 0.00 41.25 38.94 2k4q s ASN 148 CO 0.06 -1.01 0.13 -0.69 0.02 0.00 0.00 177.10 175.61 2k4q s VAL 149 N -3.12 5.31 0.00 1.60 1.01 -1.26 -4.84 120.40 119.09 2k4q s VAL 149 Ca 0.54 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.68 2k4q s VAL 149 Cb -0.11 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.84 2k4q s VAL 149 CO 0.50 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.63 2k4q n GLY 150 N 3.70 -0.03 3.91 4.51 0.00 -1.26 -4.34 105.19 111.68 2k4q n GLY 150 Ca -0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 2k4q n GLY 150 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k4q s ARG 151 N -0.32 3.47 0.48 1.61 3.00 -1.26 -5.02 118.95 120.90 2k4q s ARG 151 Ca 0.00 0.17 -0.22 0.00 0.00 0.00 0.00 55.73 55.68 2k4q s ARG 151 Cb 0.00 -2.36 -0.07 0.00 0.00 0.00 0.00 34.95 32.51 2k4q s ARG 151 CO 0.00 -0.26 1.16 -1.25 0.00 0.00 0.00 175.30 174.95 2k4q s PRO 152 N -4.77 3.68 0.22 3.54 0.04 -1.26 -5.06 135.00 131.38 2k4q s PRO 152 Ca 0.48 1.74 0.01 0.00 0.04 0.00 0.00 61.00 63.27 2k4q s PRO 152 Cb -0.10 -2.32 -0.00 0.00 0.04 0.00 0.00 34.50 32.11 2k4q s PRO 152 CO 0.45 -0.61 0.03 -1.13 0.04 0.00 0.00 177.00 175.77 2k4q n SER 153 N -0.65 2.03 -2.75 6.66 3.41 -1.26 -5.18 113.62 115.88 2k4q n SER 153 Ca 0.08 -2.02 -0.14 0.00 -0.26 0.00 0.00 58.87 56.53 2k4q n SER 153 Cb 0.49 0.29 -0.04 0.00 -0.26 0.00 0.00 64.21 64.69 2k4q n SER 153 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 2k4q n MET 154 N -0.52 0.68 -3.86 4.33 0.00 -1.26 -5.13 117.12 111.35 2k4q n MET 154 Ca -0.07 -1.92 -0.30 0.00 0.00 0.00 0.00 57.70 55.41 2k4q n MET 154 Cb 0.29 1.10 -0.15 0.00 0.00 0.00 0.00 33.22 34.46 2k4q n MET 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2k4q s ALA 155 N -2.63 2.24 -1.57 3.17 0.00 -1.26 -5.34 121.76 116.37 2k4q s ALA 155 Ca 0.13 -2.19 0.00 0.00 0.00 0.00 0.00 51.96 49.90 2k4q s ALA 155 Cb 0.01 -1.82 0.00 0.00 0.00 0.00 0.00 23.12 21.31 2k4q s ALA 155 CO 0.09 -1.73 0.39 -0.85 0.00 0.00 0.00 175.76 173.67