#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nrp s VAL 17 N 0.00 4.29 -0.31 1.39 1.01 0.15 -4.34 120.40 122.59 1nrp s VAL 17 Ca 0.00 1.71 -0.24 0.00 0.00 0.00 0.00 61.98 63.44 1nrp s VAL 17 Cb 0.00 -4.09 0.04 0.00 0.00 0.00 0.00 36.38 32.32 1nrp s VAL 17 CO 0.00 0.17 0.43 -0.62 0.00 0.00 0.00 175.10 175.08 1nrp n GLU 18 N 3.58 -1.52 -0.26 2.72 -0.58 -1.26 -0.13 120.64 123.19 1nrp n GLU 18 Ca 0.07 1.33 0.00 0.00 -0.42 0.00 0.00 57.16 58.14 1nrp n GLU 18 Cb 0.48 -2.10 0.00 0.00 -0.57 0.00 0.00 31.44 29.25 1nrp n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nrp n GLY 19 N 0.29 3.86 3.21 0.62 0.00 -1.26 -4.17 105.19 107.74 1nrp n GLY 19 Ca -0.04 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.77 1nrp n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nrp s SER 20 N 1.08 0.18 0.16 1.61 1.04 -0.59 -4.96 113.70 112.22 1nrp s SER 20 Ca 0.00 -0.82 -0.31 0.00 0.48 0.00 0.00 55.95 55.30 1nrp s SER 20 Cb 0.00 0.34 -0.09 0.00 0.10 0.00 0.00 66.02 66.36 1nrp s SER 20 CO 0.00 -0.75 1.49 -1.81 0.98 0.00 0.00 173.24 173.15 1nrp s ASP 21 N -2.92 6.68 0.52 7.02 1.11 -1.26 -1.43 116.67 126.40 1nrp s ASP 21 Ca 0.10 2.52 0.00 0.00 0.18 0.00 0.00 52.55 55.35 1nrp s ASP 21 Cb 0.05 -2.59 0.00 0.00 1.07 0.00 0.00 42.92 41.45 1nrp s ASP 21 CO -0.07 -0.75 0.00 0.00 1.18 0.00 0.00 175.17 175.53 1nrp n ALA 22 N 3.74 0.00 -3.37 5.23 0.00 0.31 -4.89 120.51 121.53 1nrp n ALA 22 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.43 1nrp n ALA 22 Cb 0.40 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.76 1nrp n ALA 22 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1nrp s GLU 23 N -1.57 0.59 -0.74 0.00 2.02 -1.26 -5.00 118.70 112.74 1nrp s GLU 23 Ca 0.00 0.57 -0.11 0.00 0.02 0.00 0.00 54.97 55.45 1nrp s GLU 23 Cb 0.00 0.28 -0.22 0.00 0.10 0.00 0.00 34.13 34.29 1nrp s GLU 23 CO 0.00 -0.09 1.92 -0.89 0.02 0.00 0.00 175.26 176.22 1nrp n ILE 24 N 2.60 0.00 0.00 -1.63 2.08 -1.26 -2.18 119.36 118.97 1nrp n ILE 24 Ca -0.14 -0.47 0.00 0.00 0.56 0.00 0.00 62.75 62.70 1nrp n ILE 24 Cb 0.57 -0.43 0.00 0.00 -0.75 0.00 0.00 39.64 39.02 1nrp n ILE 24 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1nrp n GLY 25 N 5.50 1.26 0.00 7.39 0.00 -1.26 -5.03 105.19 113.06 1nrp n GLY 25 Ca 0.47 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.52 1nrp n GLY 25 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1nrp n MET 26 N -0.07 0.78 -2.56 1.61 0.00 -0.93 -3.96 117.12 112.00 1nrp n MET 26 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 57.70 57.67 1nrp n MET 26 Cb 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 33.22 32.08 1nrp n MET 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1nrp n SER 27 N -0.64 -1.07 -0.11 6.12 2.88 -1.26 -4.99 113.62 114.55 1nrp n SER 27 Ca 0.05 -1.62 0.00 0.00 -1.33 0.00 0.00 58.87 55.97 1nrp n SER 27 Cb 0.02 0.91 0.00 0.00 -0.75 0.00 0.00 64.21 64.39 1nrp n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1nrp n PRO 28 N -0.49 0.00 -0.01 -1.46 -0.04 -1.25 -0.21 135.00 131.53 1nrp n PRO 28 Ca -0.24 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.23 1nrp n PRO 28 Cb 0.64 -1.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.12 1nrp n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1nrp n TRP 29 N -0.28 0.00 -3.53 0.54 2.14 -1.13 0.77 117.44 115.96 1nrp n TRP 29 Ca 0.00 -0.48 -0.37 0.00 2.07 0.00 0.00 57.50 58.72 1nrp n TRP 29 Cb 0.00 -0.05 -0.07 0.00 -0.81 0.00 0.00 31.31 30.38 1nrp n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1nrp s GLN 30 N -1.04 4.24 0.07 -2.67 0.74 0.70 -1.76 119.66 119.94 1nrp s GLN 30 Ca 0.03 0.13 0.10 0.00 0.05 0.00 0.00 55.36 55.66 1nrp s GLN 30 Cb 0.02 -3.42 -0.03 0.00 1.10 0.00 0.00 33.01 30.69 1nrp s GLN 30 CO 0.00 0.26 -0.26 0.54 -0.55 0.00 0.00 175.29 175.28 1nrp s VAL 31 N 0.40 2.10 -0.23 1.34 0.11 -0.82 -4.47 120.40 118.83 1nrp s VAL 31 Ca 0.17 -1.49 -0.12 0.00 -2.93 0.00 0.00 61.98 57.62 1nrp s VAL 31 Cb -0.13 -1.83 -0.05 0.00 -1.53 0.00 0.00 36.38 32.84 1nrp s VAL 31 CO 0.05 0.25 0.21 -0.32 -3.33 0.00 0.00 175.10 171.95 1nrp s MET 32 N -1.51 4.10 -1.24 1.54 1.75 0.83 0.04 119.30 124.80 1nrp s MET 32 Ca 0.12 -0.17 -0.12 0.00 -1.25 0.00 0.00 55.69 54.26 1nrp s MET 32 Cb -0.10 -3.53 0.17 0.00 2.84 0.00 0.00 34.83 34.21 1nrp s MET 32 CO 0.03 0.05 1.61 1.28 -0.65 0.00 0.00 175.02 177.35 1nrp n LEU 33 N 4.28 5.75 -4.50 4.11 4.77 0.68 -2.57 117.00 129.52 1nrp n LEU 33 Ca -0.14 -4.52 -0.43 0.00 -0.03 0.00 0.00 56.01 50.90 1nrp n LEU 33 Cb 0.52 -1.57 -0.08 0.00 -2.33 0.00 0.00 43.42 39.96 1nrp n LEU 33 CO 0.36 0.96 0.17 0.12 -1.33 0.00 0.00 177.39 177.67 1nrp s PHE 34 N 1.18 3.15 0.44 -1.77 5.36 -1.16 -0.35 117.98 124.84 1nrp s PHE 34 Ca 0.42 -0.24 -0.23 0.00 -0.96 0.00 0.00 56.93 55.92 1nrp s PHE 34 Cb 0.02 -2.98 -0.08 0.00 -0.34 0.00 0.00 43.02 39.65 1nrp s PHE 34 CO 0.00 -0.70 1.12 -0.98 -1.46 0.00 0.00 175.22 173.20 1nrp s ARG 35 N 2.29 3.90 0.12 10.12 1.70 0.63 -2.59 118.95 135.13 1nrp s ARG 35 Ca 0.15 1.68 -0.23 0.00 -0.47 0.00 0.00 55.73 56.85 1nrp s ARG 35 Cb -0.16 -2.45 -0.07 0.00 -0.57 0.00 0.00 34.95 31.70 1nrp s ARG 35 CO 0.15 -0.41 1.69 0.87 -1.08 0.00 0.00 175.30 176.52 1nrp h LYS 36 N 2.20 -0.17 -1.19 3.89 1.57 -1.80 0.36 116.57 121.43 1nrp h LYS 36 Ca -0.49 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.46 1nrp h LYS 36 Cb 1.24 0.04 -0.25 0.00 0.08 0.00 0.00 32.23 33.33 1nrp h LYS 36 CO 0.61 -0.12 0.28 -1.54 -0.57 0.00 0.00 179.45 178.12 1nrp s SER 36 N -5.05 -0.55 -0.90 0.86 1.04 -1.26 -3.11 113.70 104.72 1nrp s SER 36 Ca -0.14 0.80 -0.23 0.00 0.48 0.00 0.00 55.95 56.86 1nrp s SER 36 Cb 0.09 1.50 -0.23 0.00 0.10 0.00 0.00 66.02 67.48 1nrp s SER 36 CO 0.67 -0.12 2.45 -2.65 0.98 0.00 0.00 173.24 174.57 1nrp n PRO 37 N 4.53 0.21 -1.44 4.02 -0.02 -1.26 -4.98 135.00 136.06 1nrp n PRO 37 Ca -0.12 -0.10 -0.46 0.00 -2.02 0.00 0.00 63.50 60.80 1nrp n PRO 37 Cb 0.54 -1.86 -0.13 0.00 -0.02 0.00 0.00 33.50 32.03 1nrp n PRO 37 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1nrp n GLN 38 N 7.64 0.18 -3.32 -0.52 7.27 -1.18 -4.74 117.38 122.70 1nrp n GLN 38 Ca 0.60 0.02 -0.04 0.00 0.07 0.00 0.00 57.00 57.65 1nrp n GLN 38 Cb 0.18 -1.76 0.02 0.00 2.41 0.00 0.00 30.24 31.10 1nrp n GLN 38 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 1nrp n GLU 39 N 8.29 0.67 -3.87 3.69 0.28 0.12 -5.01 120.64 124.81 1nrp n GLU 39 Ca 0.59 -1.42 -0.36 0.00 -0.16 0.00 0.00 57.16 55.81 1nrp n GLU 39 Cb 0.08 1.85 -0.13 0.00 1.43 0.00 0.00 31.44 34.66 1nrp n GLU 39 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1nrp s LEU 40 N 0.00 3.69 -0.13 -1.84 0.20 -1.26 0.23 118.68 119.56 1nrp s LEU 40 Ca 0.16 -0.98 0.11 0.00 0.69 0.00 0.00 54.13 54.11 1nrp s LEU 40 Cb -0.03 -1.75 -0.23 0.00 -0.43 0.00 0.00 46.19 43.74 1nrp s LEU 40 CO 0.06 -0.21 0.31 0.00 -0.29 0.00 0.00 176.35 176.23 1nrp n LEU 41 N 4.72 1.06 0.00 -0.68 -0.00 0.53 -4.95 117.00 117.68 1nrp n LEU 41 Ca -0.15 0.18 0.00 0.00 -0.00 0.00 0.00 56.01 56.04 1nrp n LEU 41 Cb 0.46 -0.02 0.00 0.00 -0.00 0.00 0.00 43.42 43.86 1nrp n LEU 41 CO 0.28 0.56 0.00 0.00 -0.00 0.00 0.00 177.39 178.23 1nrp s GLY 43 N -0.28 0.43 0.00 0.00 0.00 -1.13 0.25 107.32 106.59 1nrp s GLY 43 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 44.72 43.58 1nrp s GLY 43 CO 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 173.10 171.84 1nrp n ALA 44 N 0.16 0.00 -2.96 3.20 0.00 0.11 -1.54 120.51 119.47 1nrp n ALA 44 Ca -0.14 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.19 1nrp n ALA 44 Cb 0.61 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.94 1nrp n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nrp s SER 45 N 0.03 0.13 -0.67 0.00 1.04 -1.15 -1.95 113.70 111.13 1nrp s SER 45 Ca 0.00 -0.29 -0.27 0.00 0.48 0.00 0.00 55.95 55.87 1nrp s SER 45 Cb 0.00 0.09 0.02 0.00 0.10 0.00 0.00 66.02 66.23 1nrp s SER 45 CO 0.00 -0.21 1.36 -0.22 0.98 0.00 0.00 173.24 175.15 1nrp s LEU 46 N -0.96 3.26 -0.19 2.42 2.96 -0.72 -2.72 118.68 122.73 1nrp s LEU 46 Ca -0.10 -0.16 0.15 0.00 -0.22 0.00 0.00 54.13 53.79 1nrp s LEU 46 Cb -0.06 -2.72 0.41 0.00 0.50 0.00 0.00 46.19 44.31 1nrp s LEU 46 CO -0.00 -1.83 1.28 2.30 -1.32 0.00 0.00 176.35 176.77 1nrp n ILE 47 N 6.60 2.17 -4.03 6.68 -6.64 -0.97 -0.96 119.36 122.22 1nrp n ILE 47 Ca 0.07 -2.53 0.04 0.00 -1.77 0.00 0.00 62.75 58.57 1nrp n ILE 47 Cb 0.49 -0.26 0.01 0.00 -1.44 0.00 0.00 39.64 38.45 1nrp n ILE 47 CO 0.00 0.00 0.00 -0.24 -1.77 0.00 0.00 176.55 174.54 1nrp n SER 48 N -1.12 -0.97 0.14 7.28 2.88 -1.21 -4.83 113.62 115.79 1nrp n SER 48 Ca 0.21 -1.07 0.04 0.00 -1.33 0.00 0.00 58.87 56.71 1nrp n SER 48 Cb 0.78 1.47 0.44 0.00 -0.75 0.00 0.00 64.21 66.14 1nrp n SER 48 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1nrp h ASP 49 N 1.81 0.19 -0.31 -3.46 3.58 -1.95 -3.32 116.42 112.96 1nrp h ASP 49 Ca -0.18 -0.03 -0.24 0.00 0.42 0.00 0.00 57.03 57.00 1nrp h ASP 49 Cb 1.07 -0.05 -0.27 0.00 1.72 0.00 0.00 39.33 41.80 1nrp h ASP 49 CO 0.27 0.30 -0.70 -2.11 -2.88 0.00 0.00 179.24 174.12 1nrp n ARG 50 N -4.34 1.39 -3.79 0.28 1.85 -1.26 -0.33 116.66 110.47 1nrp n ARG 50 Ca -0.01 -2.37 -0.13 0.00 -1.00 0.00 0.00 57.85 54.35 1nrp n ARG 50 Cb 0.22 -0.56 -0.13 0.00 -1.05 0.00 0.00 32.46 30.94 1nrp n ARG 50 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1nrp s TRP 51 N -1.57 -0.21 -0.02 2.89 0.52 -1.25 -2.26 118.94 117.04 1nrp s TRP 51 Ca 0.20 0.52 0.01 0.00 0.02 0.00 0.00 56.10 56.85 1nrp s TRP 51 Cb 0.41 0.03 0.01 0.00 -1.15 0.00 0.00 33.47 32.76 1nrp s TRP 51 CO -0.06 -0.13 -0.04 0.08 0.02 0.00 0.00 176.95 176.81 1nrp s VAL 52 N 0.50 0.41 0.17 4.03 1.01 -0.97 -2.28 120.40 123.28 1nrp s VAL 52 Ca -0.03 -0.15 0.10 0.00 0.00 0.00 0.00 61.98 61.90 1nrp s VAL 52 Cb -0.05 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 1nrp s VAL 52 CO -0.02 0.15 -0.23 -1.48 0.00 0.00 0.00 175.10 173.52 1nrp s LEU 53 N 0.31 2.42 0.00 3.92 0.05 -1.10 0.88 118.68 125.15 1nrp s LEU 53 Ca -0.03 -0.84 -0.04 0.00 0.05 0.00 0.00 54.13 53.26 1nrp s LEU 53 Cb -0.07 -1.07 0.02 0.00 -2.05 0.00 0.00 46.19 43.02 1nrp s LEU 53 CO -0.00 0.08 0.20 1.07 -0.55 0.00 0.00 176.35 177.15 1nrp n THR 54 N 0.38 0.00 -1.55 5.48 5.66 0.42 -2.95 114.28 121.72 1nrp n THR 54 Ca -0.14 -0.21 -0.33 0.00 -3.05 0.00 0.00 64.05 60.32 1nrp n THR 54 Cb 0.56 0.23 0.07 0.00 -1.55 0.00 0.00 70.33 69.63 1nrp n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nrp s ALA 55 N -1.26 2.33 -0.06 1.79 0.00 -1.26 0.11 121.76 123.41 1nrp s ALA 55 Ca 0.04 0.52 -0.01 0.00 0.00 0.00 0.00 51.96 52.52 1nrp s ALA 55 Cb -0.01 -3.33 -0.26 0.00 0.00 0.00 0.00 23.12 19.52 1nrp s ALA 55 CO 0.03 -1.53 0.61 0.00 0.00 0.00 0.00 175.76 174.87 1nrp h ALA 56 N -0.36 0.46 -0.91 0.00 0.00 -1.76 -3.25 119.26 113.44 1nrp h ALA 56 Ca -0.46 -1.31 0.25 0.00 0.00 0.00 0.00 54.91 53.39 1nrp h ALA 56 Cb 1.25 0.51 -0.05 0.00 0.00 0.00 0.00 17.79 19.50 1nrp h ALA 56 CO 0.52 1.32 0.64 1.12 0.00 0.00 0.00 179.25 182.85 1nrp h HIS 57 N 0.05 0.16 0.00 0.00 2.07 -1.92 1.97 115.15 117.48 1nrp h HIS 57 Ca -0.33 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.20 1nrp h HIS 57 Cb 2.03 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 31.96 1nrp h HIS 57 CO 0.05 0.03 0.00 0.00 -3.07 0.00 0.00 177.93 174.95 1nrp n LEU 59 N -1.53 0.00 -3.37 0.00 4.32 0.62 -4.92 117.00 112.13 1nrp n LEU 59 Ca 0.04 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 55.78 1nrp n LEU 59 Cb 0.18 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 41.89 1nrp n LEU 59 CO 0.15 0.00 -0.27 -0.22 -1.22 0.00 0.00 177.39 175.82 1nrp s LEU 60 N -2.57 0.91 0.28 2.23 0.20 0.14 -2.22 118.68 117.65 1nrp s LEU 60 Ca 0.00 -2.54 0.11 0.00 0.69 0.00 0.00 54.13 52.39 1nrp s LEU 60 Cb 0.00 -0.15 -0.05 0.00 -0.43 0.00 0.00 46.19 45.55 1nrp s LEU 60 CO 0.00 -0.22 -0.17 -0.47 -0.29 0.00 0.00 176.35 175.20 1nrp s TYR 60 N 0.59 2.24 0.00 5.38 5.04 0.73 -4.70 117.35 126.63 1nrp s TYR 60 Ca 0.26 -0.40 0.00 0.00 -2.44 0.00 0.00 57.07 54.49 1nrp s TYR 60 Cb -0.07 -1.04 0.00 0.00 0.35 0.00 0.00 41.96 41.20 1nrp s TYR 60 CO -0.10 0.64 0.00 -2.30 -1.34 0.00 0.00 175.55 172.45 1nrp n PRO 60 N -0.62 0.00 -0.25 4.97 -0.02 -1.26 0.40 135.00 138.22 1nrp n PRO 60 Ca -0.05 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.44 1nrp n PRO 60 Cb 0.61 -0.08 0.02 0.00 -0.02 0.00 0.00 33.50 34.03 1nrp n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1nrp n TRP 60 N 0.08 0.00 -3.76 6.00 8.01 -1.26 -5.02 117.44 121.49 1nrp n TRP 60 Ca 0.00 -0.17 -0.18 0.00 -1.31 0.00 0.00 57.50 55.84 1nrp n TRP 60 Cb 0.00 -0.05 -0.00 0.00 -2.01 0.00 0.00 31.31 29.25 1nrp n TRP 60 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1nrp n ASP 60 N -0.22 -1.30 -4.72 -0.99 2.03 -0.51 -4.90 116.55 105.95 1nrp n ASP 60 Ca 0.02 -0.54 -0.37 0.00 0.52 0.00 0.00 54.79 54.43 1nrp n ASP 60 Cb 0.59 -0.65 -0.07 0.00 -0.72 0.00 0.00 41.12 40.27 1nrp n ASP 60 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1nrp s LYS 60 N -5.81 4.24 -0.30 -0.67 2.20 1.31 -4.96 119.74 115.75 1nrp s LYS 60 Ca 0.17 0.09 -0.15 0.00 -0.36 0.00 0.00 55.97 55.72 1nrp s LYS 60 Cb -0.09 -3.45 0.18 0.00 -1.51 0.00 0.00 37.83 32.96 1nrp s LYS 60 CO 0.40 0.19 1.13 1.21 -0.36 0.00 0.00 175.35 177.93 1nrp s ASN 60 N 0.58 -0.26 0.40 1.43 3.84 -1.25 0.26 114.94 119.95 1nrp s ASN 60 Ca 0.16 0.12 0.05 0.00 0.21 0.00 0.00 52.86 53.41 1nrp s ASN 60 Cb -0.13 1.20 -0.07 0.00 -0.55 0.00 0.00 41.25 41.71 1nrp s ASN 60 CO 0.04 -0.05 0.02 -0.36 -2.79 0.00 0.00 177.10 173.97 1nrp s PHE 60 N 2.97 2.28 0.05 0.43 0.08 -0.94 -5.04 117.98 117.81 1nrp s PHE 60 Ca 0.04 -0.80 -0.01 0.00 0.12 0.00 0.00 56.93 56.28 1nrp s PHE 60 Cb -0.07 -1.62 -0.04 0.00 -0.57 0.00 0.00 43.02 40.72 1nrp s PHE 60 CO -0.13 0.29 -0.03 -0.08 -0.10 0.00 0.00 175.22 175.18 1nrp s THR 60 N -2.89 0.22 0.13 0.64 -1.32 -1.26 -4.95 115.64 106.21 1nrp s THR 60 Ca 0.31 -1.79 -0.15 0.00 -1.21 0.00 0.00 61.69 58.85 1nrp s THR 60 Cb 0.08 -1.50 0.07 0.00 -1.51 0.00 0.00 72.50 69.65 1nrp s THR 60 CO 0.15 -0.99 1.00 -1.84 -2.21 0.00 0.00 174.62 170.74 1nrp n GLU 61 N 0.13 -0.21 -0.11 7.08 0.00 -1.26 0.13 120.64 126.41 1nrp n GLU 61 Ca -0.14 0.99 -0.06 0.00 0.00 0.00 0.00 57.16 57.95 1nrp n GLU 61 Cb 0.61 -1.46 0.02 0.00 0.00 0.00 0.00 31.44 30.61 1nrp n GLU 61 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 1nrp h ASN 62 N 0.00 0.03 -0.54 -1.84 2.35 -1.98 -2.10 115.58 111.50 1nrp h ASN 62 Ca 0.18 0.06 0.05 0.00 -0.55 0.00 0.00 56.30 56.04 1nrp h ASN 62 Cb 0.34 0.07 -0.08 0.00 0.05 0.00 0.00 38.32 38.70 1nrp h ASN 62 CO -0.63 0.05 -0.49 0.44 -1.65 0.00 0.00 177.43 175.15 1nrp h ASP 63 N 0.21 -1.70 -1.74 5.81 5.19 0.64 -3.43 116.42 121.40 1nrp h ASP 63 Ca 0.17 0.24 -0.43 0.00 -0.62 0.00 0.00 57.03 56.39 1nrp h ASP 63 Cb 0.19 0.72 0.02 0.00 0.18 0.00 0.00 39.33 40.44 1nrp h ASP 63 CO -0.22 -0.29 -0.27 -1.48 -3.12 0.00 0.00 179.24 173.86 1nrp s LEU 64 N -9.72 3.76 -0.05 1.55 0.05 -0.79 -3.48 118.68 110.01 1nrp s LEU 64 Ca -0.12 -0.26 -0.04 0.00 0.05 0.00 0.00 54.13 53.77 1nrp s LEU 64 Cb 0.08 -2.74 0.01 0.00 -2.05 0.00 0.00 46.19 41.49 1nrp s LEU 64 CO 0.53 -0.65 0.13 -0.22 -0.55 0.00 0.00 176.35 175.59 1nrp s LEU 65 N -4.32 1.46 -0.06 1.48 2.96 -1.07 -4.43 118.68 114.70 1nrp s LEU 65 Ca 0.51 0.26 0.03 0.00 -0.22 0.00 0.00 54.13 54.71 1nrp s LEU 65 Cb -0.10 0.43 -0.02 0.00 0.50 0.00 0.00 46.19 47.00 1nrp s LEU 65 CO 0.33 -0.05 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.47 1nrp s VAL 66 N 0.15 2.97 0.01 1.68 1.01 0.21 -2.97 120.40 123.46 1nrp s VAL 66 Ca -0.01 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.26 1nrp s VAL 66 Cb -0.02 -2.17 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1nrp s VAL 66 CO -0.00 0.58 -0.10 -0.13 0.00 0.00 0.00 175.10 175.45 1nrp s ARG 67 N -0.52 0.75 0.09 2.72 0.52 -1.06 -1.06 118.95 120.39 1nrp s ARG 67 Ca 0.07 -0.47 0.03 0.00 -0.52 0.00 0.00 55.73 54.83 1nrp s ARG 67 Cb -0.12 -0.71 -0.04 0.00 0.52 0.00 0.00 34.95 34.60 1nrp s ARG 67 CO 0.01 0.19 -0.08 0.42 0.02 0.00 0.00 175.30 175.86 1nrp s ILE 68 N -0.50 0.78 0.00 1.52 1.01 -0.71 -0.12 121.20 123.18 1nrp s ILE 68 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 60.65 58.98 1nrp s ILE 68 Cb -0.05 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 41.03 1nrp s ILE 68 CO 0.00 -0.67 0.00 0.61 0.00 0.00 0.00 174.94 174.88 1nrp n GLY 69 N 0.43 0.76 3.59 6.18 0.00 -1.26 0.91 105.19 115.80 1nrp n GLY 69 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1nrp n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nrp s LYS 70 N -0.64 3.06 0.00 1.61 -0.14 -1.26 -4.16 119.74 118.21 1nrp s LYS 70 Ca 0.00 1.71 0.00 0.00 -1.36 0.00 0.00 55.97 56.32 1nrp s LYS 70 Cb 0.00 -4.34 0.00 0.00 -1.68 0.00 0.00 37.83 31.81 1nrp s LYS 70 CO 0.00 -2.18 0.00 1.58 -0.76 0.00 0.00 175.35 173.99 1nrp n HIS 71 N 11.75 0.00 -2.20 3.18 -0.00 -1.26 -4.91 115.22 121.77 1nrp n HIS 71 Ca 0.28 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.58 1nrp n HIS 71 Cb 0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.43 1nrp n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1nrp s SER 72 N -1.99 6.81 0.00 0.26 0.15 -1.26 -3.09 113.70 114.58 1nrp s SER 72 Ca 0.00 2.05 0.20 0.00 0.70 0.00 0.00 55.95 58.90 1nrp s SER 72 Cb 0.00 -2.55 1.05 0.00 -1.71 0.00 0.00 66.02 62.82 1nrp s SER 72 CO 0.00 -0.80 1.61 -1.14 1.20 0.00 0.00 173.24 174.11 1nrp n ARG 73 N 6.29 0.37 0.00 5.44 0.63 0.17 -4.20 116.66 125.36 1nrp n ARG 73 Ca 0.15 0.07 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 1nrp n ARG 73 Cb 0.44 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.85 1nrp n ARG 73 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1nrp n THR 74 N -1.21 0.00 -0.07 5.15 -1.04 -1.24 -5.04 114.28 110.83 1nrp n THR 74 Ca 0.11 0.34 0.00 0.00 -2.04 0.00 0.00 64.05 62.46 1nrp n THR 74 Cb 0.13 -1.25 0.00 0.00 -1.82 0.00 0.00 70.33 67.40 1nrp n THR 74 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1nrp n ARG 75 N -1.99 0.33 -3.99 -2.82 3.00 -1.26 -5.05 116.66 104.88 1nrp n ARG 75 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.85 57.53 1nrp n ARG 75 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.31 1nrp n ARG 75 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.63 177.16 1nrp s TYR 76 N -0.27 3.53 -1.10 -1.55 5.04 -1.26 -5.04 117.35 116.71 1nrp s TYR 76 Ca 0.00 -3.07 -0.25 0.00 -2.44 0.00 0.00 57.07 51.31 1nrp s TYR 76 Cb 0.00 -2.89 -0.16 0.00 0.35 0.00 0.00 41.96 39.26 1nrp s TYR 76 CO 0.00 -0.87 2.05 -1.21 -1.34 0.00 0.00 175.55 174.19 1nrp s GLU 77 N 0.42 1.78 0.09 4.97 0.41 -1.26 -4.84 118.70 120.27 1nrp s GLU 77 Ca 0.13 -0.66 -0.21 0.00 -0.41 0.00 0.00 54.97 53.83 1nrp s GLU 77 Cb -0.22 -5.08 -0.06 0.00 -1.78 0.00 0.00 34.13 27.00 1nrp s GLU 77 CO -0.05 -4.76 1.35 -0.09 -0.49 0.00 0.00 175.26 171.22 1nrp h ARG 77 N 10.92 -0.14 -1.21 1.61 2.43 -1.96 -2.99 114.38 123.04 1nrp h ARG 77 Ca 0.10 0.01 -0.45 0.00 -0.81 0.00 0.00 59.98 58.82 1nrp h ARG 77 Cb 0.97 0.03 -0.41 0.00 -0.42 0.00 0.00 29.97 30.15 1nrp h ARG 77 CO 1.11 -0.09 -1.01 0.27 -1.51 0.00 0.00 179.97 178.73 1nrp n ASN 78 N -4.42 2.74 0.00 -3.80 2.04 -1.26 -4.58 115.26 105.97 1nrp n ASN 78 Ca -0.01 -3.11 0.00 0.00 -0.44 0.00 0.00 54.58 51.02 1nrp n ASN 78 Cb 0.20 -0.50 0.00 0.00 -2.53 0.00 0.00 39.78 36.94 1nrp n ASN 78 CO 0.00 0.00 0.00 2.30 -0.44 0.00 0.00 177.26 179.12 1nrp n ILE 79 N -0.22 0.00 -2.17 1.53 -5.35 -1.25 -5.10 119.36 106.80 1nrp n ILE 79 Ca 0.21 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.40 1nrp n ILE 79 Cb 0.75 0.00 0.03 0.00 -1.74 0.00 0.00 39.64 38.69 1nrp n ILE 79 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1nrp s GLU 80 N -0.39 3.05 0.25 6.28 2.12 -1.13 -4.05 118.70 124.83 1nrp s GLU 80 Ca 0.00 0.28 0.01 0.00 0.36 0.00 0.00 54.97 55.62 1nrp s GLU 80 Cb 0.00 -2.17 -0.05 0.00 0.26 0.00 0.00 34.13 32.17 1nrp s GLU 80 CO 0.00 -0.75 0.09 0.21 -0.54 0.00 0.00 175.26 174.27 1nrp s LYS 81 N -5.12 1.37 -0.30 4.30 2.47 5.55 -4.80 119.74 123.21 1nrp s LYS 81 Ca 0.55 -1.73 -0.20 0.00 -1.56 0.00 0.00 55.97 53.02 1nrp s LYS 81 Cb -0.11 -0.21 0.21 0.00 -1.46 0.00 0.00 37.83 36.26 1nrp s LYS 81 CO 0.49 -0.29 1.38 -1.50 0.16 0.00 0.00 175.35 175.58 1nrp s ILE 82 N -3.79 0.00 0.15 5.43 2.07 -1.23 -1.73 121.20 122.10 1nrp s ILE 82 Ca 0.37 0.00 -0.23 0.00 -1.41 0.00 0.00 60.65 59.37 1nrp s ILE 82 Cb 0.08 -1.00 0.07 0.00 0.13 0.00 0.00 42.46 41.74 1nrp s ILE 82 CO 0.13 0.00 0.62 -0.55 -1.91 0.00 0.00 174.94 173.22 1nrp s SER 83 N 0.54 -0.56 0.11 4.50 0.15 -0.22 -4.99 113.70 113.23 1nrp s SER 83 Ca -0.01 0.02 0.06 0.00 0.70 0.00 0.00 55.95 56.72 1nrp s SER 83 Cb -0.03 0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 64.82 1nrp s SER 83 CO -0.13 -0.94 -0.02 -0.32 1.20 0.00 0.00 173.24 173.03 1nrp s MET 84 N -3.66 2.41 0.72 5.44 1.75 -1.26 -0.62 119.30 124.08 1nrp s MET 84 Ca 0.01 -0.94 -0.16 0.00 -1.25 0.00 0.00 55.69 53.35 1nrp s MET 84 Cb -0.01 -2.45 0.00 0.00 2.84 0.00 0.00 34.83 35.22 1nrp s MET 84 CO -0.12 0.51 0.94 1.28 -0.65 0.00 0.00 175.02 176.98 1nrp n LEU 85 N 0.45 3.34 -0.07 4.11 4.77 -1.26 -1.46 117.00 126.88 1nrp n LEU 85 Ca -0.11 0.67 -0.05 0.00 -0.03 0.00 0.00 56.01 56.48 1nrp n LEU 85 Cb 0.53 -1.39 -0.15 0.00 -2.33 0.00 0.00 43.42 40.08 1nrp n LEU 85 CO 0.38 -2.10 -1.02 1.21 -1.33 0.00 0.00 177.39 174.52 1nrp n GLU 86 N -1.76 0.91 -3.65 3.23 2.13 -0.83 -4.13 120.64 116.54 1nrp n GLU 86 Ca 0.13 -0.05 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1nrp n GLU 86 Cb 0.49 -1.47 -0.06 0.00 0.27 0.00 0.00 31.44 30.67 1nrp n GLU 86 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1nrp s LYS 87 N -2.64 0.08 0.41 5.31 2.20 -1.23 -4.89 119.74 118.98 1nrp s LYS 87 Ca -0.09 0.12 -0.09 0.00 -0.36 0.00 0.00 55.97 55.55 1nrp s LYS 87 Cb 0.07 0.03 -0.06 0.00 -1.51 0.00 0.00 37.83 36.36 1nrp s LYS 87 CO 0.77 -0.01 0.76 0.42 -0.36 0.00 0.00 175.35 176.93 1nrp s ILE 88 N 0.70 4.81 -0.19 5.43 1.01 -1.26 0.16 121.20 131.85 1nrp s ILE 88 Ca -0.03 0.54 -0.05 0.00 0.00 0.00 0.00 60.65 61.11 1nrp s ILE 88 Cb -0.03 -3.75 0.10 0.00 0.01 0.00 0.00 42.46 38.78 1nrp s ILE 88 CO -0.12 -0.56 0.36 -0.31 0.00 0.00 0.00 174.94 174.31 1nrp s TYR 89 N -2.41 -0.69 0.55 3.97 2.02 0.42 -4.85 117.35 116.36 1nrp s TYR 89 Ca 0.50 1.15 0.09 0.00 -0.37 0.00 0.00 57.07 58.44 1nrp s TYR 89 Cb -0.10 0.12 0.07 0.00 -0.40 0.00 0.00 41.96 41.64 1nrp s TYR 89 CO 0.33 -0.52 0.68 0.42 -1.57 0.00 0.00 175.55 174.90 1nrp s ILE 90 N 2.54 2.17 -0.38 2.71 1.01 -1.26 0.38 121.20 128.36 1nrp s ILE 90 Ca 0.03 -1.10 -0.08 0.00 0.00 0.00 0.00 60.65 59.50 1nrp s ILE 90 Cb -0.13 -2.27 0.06 0.00 0.01 0.00 0.00 42.46 40.13 1nrp s ILE 90 CO -0.12 0.00 0.19 -2.28 0.00 0.00 0.00 174.94 172.72 1nrp s HIS 91 N -2.64 3.32 -0.93 3.97 5.65 -1.18 -4.89 115.29 118.59 1nrp s HIS 91 Ca 0.56 -1.51 0.00 0.00 0.25 0.00 0.00 55.06 54.35 1nrp s HIS 91 Cb -0.05 -2.66 0.00 0.00 -1.18 0.00 0.00 32.58 28.68 1nrp s HIS 91 CO 0.35 -0.80 0.00 -2.30 -0.65 0.00 0.00 174.74 171.34 1nrp n PRO 92 N 4.86 0.00 -1.21 2.88 -0.02 -1.26 -1.60 135.00 138.65 1nrp n PRO 92 Ca -0.11 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.42 1nrp n PRO 92 Cb 0.44 -0.93 0.06 0.00 -0.02 0.00 0.00 33.50 33.05 1nrp n PRO 92 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1nrp n ARG 93 N -0.11 0.39 -2.40 -0.52 5.12 -1.26 -5.10 116.66 112.77 1nrp n ARG 93 Ca 0.00 -2.26 -0.42 0.00 -1.93 0.00 0.00 57.85 53.25 1nrp n ARG 93 Cb 0.00 -0.43 -0.03 0.00 -1.16 0.00 0.00 32.46 30.84 1nrp n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1nrp s TYR 94 N -0.80 3.44 -0.91 -1.55 5.04 -0.63 -4.73 117.35 117.21 1nrp s TYR 94 Ca 0.33 1.33 -0.02 0.00 -2.44 0.00 0.00 57.07 56.27 1nrp s TYR 94 Cb 0.36 -3.43 0.29 0.00 0.35 0.00 0.00 41.96 39.53 1nrp s TYR 94 CO -0.13 -1.28 2.06 0.09 -1.34 0.00 0.00 175.55 174.95 1nrp n ASN 95 N 3.51 7.41 0.31 4.32 4.13 -0.03 -4.67 115.26 130.24 1nrp n ASN 95 Ca 0.08 -3.66 0.19 0.00 1.68 0.00 0.00 54.58 52.87 1nrp n ASN 95 Cb 0.46 -1.15 0.99 0.00 -1.54 0.00 0.00 39.78 38.54 1nrp n ASN 95 CO 0.00 0.00 0.00 4.11 0.28 0.00 0.00 177.26 181.65 1nrp h TRP 96 N 3.58 0.00 -0.02 3.10 5.08 -1.91 0.53 115.95 126.31 1nrp h TRP 96 Ca 0.55 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.51 1nrp h TRP 96 Cb 0.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.39 1nrp h TRP 96 CO 1.31 0.00 -0.05 -0.09 -1.28 0.00 0.00 178.44 178.33 1nrp h ARG 97 N 0.00 0.07 0.00 0.12 2.43 -1.99 -3.42 114.38 111.59 1nrp h ARG 97 Ca 0.02 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1nrp h ARG 97 Cb 0.34 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1nrp h ARG 97 CO -0.00 0.64 -0.85 0.39 -1.51 0.00 0.00 179.97 178.65 1nrp n GLU 97 N -4.74 0.50 0.00 0.20 -0.58 -0.60 -4.92 120.64 110.50 1nrp n GLU 97 Ca -0.08 0.29 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 1nrp n GLU 97 Cb 0.33 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.72 1nrp n GLU 97 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1nrp n ASN 98 N -4.45 0.00 -2.34 1.62 0.23 -0.99 -4.91 115.26 104.42 1nrp n ASN 98 Ca -0.12 -1.00 -0.00 0.00 -0.53 0.00 0.00 54.58 52.93 1nrp n ASN 98 Cb 0.44 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.14 1nrp n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1nrp n LEU 99 N 0.00 -4.55 -4.82 -4.53 4.77 0.18 -5.00 117.00 103.04 1nrp n LEU 99 Ca 0.00 -0.05 -0.22 0.00 -0.03 0.00 0.00 56.01 55.71 1nrp n LEU 99 Cb 0.40 -2.23 -0.04 0.00 -2.33 0.00 0.00 43.42 39.22 1nrp n LEU 99 CO 0.00 -0.58 -0.10 1.51 -1.33 0.00 0.00 177.39 176.89 1nrp s ASP 100 N -2.56 5.04 -1.67 -1.43 1.47 -1.25 -4.07 116.67 112.19 1nrp s ASP 100 Ca 0.01 -0.65 -0.18 0.00 1.18 0.00 0.00 52.55 52.91 1nrp s ASP 100 Cb -0.00 -0.80 0.15 0.00 -0.34 0.00 0.00 42.92 41.93 1nrp s ASP 100 CO 0.40 -0.41 0.79 0.54 0.68 0.00 0.00 175.17 177.17 1nrp n ARG 101 N -1.34 -3.27 -1.81 2.11 1.74 -1.26 -0.85 116.66 111.98 1nrp n ARG 101 Ca -0.01 0.38 -0.20 0.00 -0.77 0.00 0.00 57.85 57.25 1nrp n ARG 101 Cb 0.61 -5.13 -0.08 0.00 -1.02 0.00 0.00 32.46 26.84 1nrp n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1nrp s ASP 102 N -3.24 4.23 -0.10 0.55 2.15 -1.26 -4.73 116.67 114.28 1nrp s ASP 102 Ca 0.73 -1.02 -0.13 0.00 0.43 0.00 0.00 52.55 52.56 1nrp s ASP 102 Cb -0.40 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 39.67 1nrp s ASP 102 CO 0.90 -3.84 0.35 -0.51 -0.17 0.00 0.00 175.17 171.90 1nrp s ILE 103 N 13.90 0.02 -0.03 4.11 2.07 -1.26 -4.07 121.20 135.93 1nrp s ILE 103 Ca 0.77 -0.14 -0.22 0.00 -1.41 0.00 0.00 60.65 59.66 1nrp s ILE 103 Cb -0.05 -0.54 0.04 0.00 0.13 0.00 0.00 42.46 42.04 1nrp s ILE 103 CO 0.13 -0.08 0.47 0.00 -1.91 0.00 0.00 174.94 173.55 1nrp s ALA 104 N -0.27 -1.21 0.06 1.50 0.00 0.12 -3.10 121.76 118.86 1nrp s ALA 104 Ca -0.04 0.77 -0.00 0.00 0.00 0.00 0.00 51.96 52.69 1nrp s ALA 104 Cb -0.03 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1nrp s ALA 104 CO 0.02 -0.31 -0.04 -1.17 0.00 0.00 0.00 175.76 174.26 1nrp s LEU 105 N -1.23 2.49 -0.10 0.00 2.96 1.20 0.16 118.68 124.17 1nrp s LEU 105 Ca -0.12 -1.00 -0.03 0.00 -0.22 0.00 0.00 54.13 52.76 1nrp s LEU 105 Cb -0.03 0.12 0.05 0.00 0.50 0.00 0.00 46.19 46.83 1nrp s LEU 105 CO 0.07 -0.56 0.13 -0.04 -1.32 0.00 0.00 176.35 174.62 1nrp s MET 106 N -3.89 0.03 -1.13 1.98 -1.94 0.25 0.16 119.30 114.76 1nrp s MET 106 Ca 0.08 0.36 -0.23 0.00 -1.71 0.00 0.00 55.69 54.19 1nrp s MET 106 Cb 0.07 -0.72 -0.06 0.00 2.01 0.00 0.00 34.83 36.13 1nrp s MET 106 CO -0.09 -0.42 1.90 0.21 -0.01 0.00 0.00 175.02 176.62 1nrp s LYS 107 N 2.24 2.68 -0.41 2.03 2.36 0.12 -2.28 119.74 126.48 1nrp s LYS 107 Ca 0.04 -1.07 -0.21 0.00 -2.55 0.00 0.00 55.97 52.18 1nrp s LYS 107 Cb -0.13 -5.24 -0.11 0.00 -1.05 0.00 0.00 37.83 31.30 1nrp s LYS 107 CO -0.06 -3.64 1.33 1.28 1.55 0.00 0.00 175.35 175.80 1nrp n LEU 108 N 13.56 0.29 -0.22 5.43 4.77 -0.96 -1.97 117.00 137.90 1nrp n LEU 108 Ca 0.44 0.24 0.19 0.00 -0.03 0.00 0.00 56.01 56.85 1nrp n LEU 108 Cb 0.47 -0.50 0.33 0.00 -2.33 0.00 0.00 43.42 41.38 1nrp n LEU 108 CO 0.67 -0.41 0.59 1.17 -1.33 0.00 0.00 177.39 178.08 1nrp n LYS 109 N 4.41 -0.02 -4.13 3.23 4.81 -0.54 -4.18 118.16 121.73 1nrp n LYS 109 Ca 0.33 0.63 -0.11 0.00 -0.87 0.00 0.00 58.31 58.29 1nrp n LYS 109 Cb -0.00 -1.22 -0.09 0.00 0.02 0.00 0.00 35.03 33.74 1nrp n LYS 109 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1nrp s LYS 110 N -4.46 1.18 -0.12 1.64 1.02 -1.26 -4.74 119.74 112.99 1nrp s LYS 110 Ca -0.04 -1.48 -0.09 0.00 0.02 0.00 0.00 55.97 54.39 1nrp s LYS 110 Cb 0.15 0.30 -0.04 0.00 -0.52 0.00 0.00 37.83 37.73 1nrp s LYS 110 CO 0.40 -0.40 0.17 -1.25 -0.92 0.00 0.00 175.35 173.35 1nrp s PRO 111 N -4.09 3.64 0.18 -1.68 0.05 -1.26 -4.83 135.00 127.01 1nrp s PRO 111 Ca 0.31 -0.08 -0.18 0.00 0.05 0.00 0.00 61.00 61.10 1nrp s PRO 111 Cb 0.06 -3.24 -0.08 0.00 0.05 0.00 0.00 34.50 31.29 1nrp s PRO 111 CO 0.08 0.67 0.65 0.08 0.05 0.00 0.00 177.00 178.53 1nrp s VAL 112 N -0.75 4.68 -0.22 -0.36 1.01 0.56 -4.97 120.40 120.35 1nrp s VAL 112 Ca 0.15 1.14 -0.03 0.00 0.00 0.00 0.00 61.98 63.23 1nrp s VAL 112 Cb -0.12 -3.83 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 1nrp s VAL 112 CO 0.04 0.28 -0.06 0.00 0.00 0.00 0.00 175.10 175.36 1nrp s ALA 113 N -1.44 2.76 1.01 5.51 0.00 -1.26 -4.70 121.76 123.65 1nrp s ALA 113 Ca 0.39 -1.20 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 1nrp s ALA 113 Cb -0.17 -1.66 0.06 0.00 0.00 0.00 0.00 23.12 21.35 1nrp s ALA 113 CO 0.20 -0.46 0.24 1.19 0.00 0.00 0.00 175.76 176.93 1nrp n PHE 114 N 4.77 -1.51 -3.57 0.00 3.72 -1.26 -5.00 117.46 114.60 1nrp n PHE 114 Ca -0.18 0.20 0.03 0.00 -0.05 0.00 0.00 57.45 57.44 1nrp n PHE 114 Cb 0.50 -1.70 -0.00 0.00 -0.94 0.00 0.00 39.48 37.34 1nrp n PHE 114 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1nrp s SER 115 N -1.94 -0.01 0.28 4.37 0.15 0.44 -4.90 113.70 112.10 1nrp s SER 115 Ca 0.56 -0.02 0.17 0.00 0.70 0.00 0.00 55.95 57.37 1nrp s SER 115 Cb -0.18 0.02 0.59 0.00 -1.71 0.00 0.00 66.02 64.74 1nrp s SER 115 CO 0.67 -0.04 0.67 0.47 1.20 0.00 0.00 173.24 176.22 1nrp n ASP 116 N -0.42 0.00 -0.03 5.45 9.92 -1.26 0.35 116.55 130.55 1nrp n ASP 116 Ca -0.08 0.41 0.01 0.00 -0.53 0.00 0.00 54.79 54.61 1nrp n ASP 116 Cb 0.63 -0.17 -0.11 0.00 -0.64 0.00 0.00 41.12 40.83 1nrp n ASP 116 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1nrp n TYR 117 N -2.49 0.00 -4.06 1.24 4.01 -1.26 -4.60 117.16 110.00 1nrp n TYR 117 Ca 0.15 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.62 1nrp n TYR 117 Cb 0.83 -0.46 -0.17 0.00 -0.31 0.00 0.00 39.34 39.24 1nrp n TYR 117 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 1nrp s ILE 118 N -2.70 1.20 -0.24 -0.72 -5.25 1.08 -4.23 121.20 110.33 1nrp s ILE 118 Ca -0.06 -0.42 -0.23 0.00 -0.99 0.00 0.00 60.65 58.96 1nrp s ILE 118 Cb 0.07 -1.17 0.06 0.00 2.95 0.00 0.00 42.46 44.38 1nrp s ILE 118 CO 0.56 0.39 0.66 -2.28 -1.79 0.00 0.00 174.94 172.49 1nrp s HIS 119 N 1.48 -0.72 0.87 1.37 2.46 0.23 0.17 115.29 121.15 1nrp s HIS 119 Ca 0.02 1.74 -0.11 0.00 0.47 0.00 0.00 55.06 57.18 1nrp s HIS 119 Cb -0.13 0.25 0.11 0.00 -0.13 0.00 0.00 32.58 32.68 1nrp s HIS 119 CO -0.07 -0.36 1.09 -1.25 -2.47 0.00 0.00 174.74 171.69 1nrp s PRO 120 N 0.29 1.45 0.12 2.88 0.04 -1.26 -2.84 135.00 135.68 1nrp s PRO 120 Ca -0.00 0.85 0.07 0.00 0.04 0.00 0.00 61.00 61.96 1nrp s PRO 120 Cb -0.04 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.63 1nrp s PRO 120 CO 0.01 -2.12 -0.09 0.08 0.04 0.00 0.00 177.00 174.92 1nrp s VAL 121 N -2.95 3.36 0.08 -0.36 1.01 -0.13 -4.88 120.40 116.53 1nrp s VAL 121 Ca 0.63 -1.34 0.07 0.00 0.00 0.00 0.00 61.98 61.34 1nrp s VAL 121 Cb -0.18 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 1nrp s VAL 121 CO 0.57 0.07 -0.12 0.00 0.00 0.00 0.00 175.10 175.61 1nrp s LEU 123 N -1.95 4.36 1.19 0.00 1.02 -1.26 -1.46 118.68 120.57 1nrp s LEU 123 Ca 0.19 1.42 -0.14 0.00 0.02 0.00 0.00 54.13 55.62 1nrp s LEU 123 Cb -0.11 -3.54 0.29 0.00 0.02 0.00 0.00 46.19 42.85 1nrp s LEU 123 CO 0.11 0.05 1.02 -2.16 0.02 0.00 0.00 176.35 175.39 1nrp s PRO 124 N -1.90 -1.10 -0.02 1.29 0.04 -1.26 -4.95 135.00 127.11 1nrp s PRO 124 Ca 0.42 0.69 0.01 0.00 0.04 0.00 0.00 61.00 62.17 1nrp s PRO 124 Cb -0.17 -1.54 0.01 0.00 0.04 0.00 0.00 34.50 32.83 1nrp s PRO 124 CO 0.21 -3.81 -0.04 0.16 0.04 0.00 0.00 177.00 173.57 1nrp s ASP 125 N -2.67 0.60 0.30 6.66 1.47 -1.26 -4.99 116.67 116.77 1nrp s ASP 125 Ca 0.68 -0.08 0.14 0.00 1.18 0.00 0.00 52.55 54.47 1nrp s ASP 125 Cb -0.23 -0.17 1.01 0.00 -0.34 0.00 0.00 42.92 43.19 1nrp s ASP 125 CO 0.64 0.01 1.32 -1.14 0.68 0.00 0.00 175.17 176.67 1nrp n ARG 126 N 3.40 -0.05 0.10 2.11 0.63 -1.26 0.18 116.66 121.77 1nrp n ARG 126 Ca -0.18 1.18 -0.15 0.00 -0.92 0.00 0.00 57.85 57.77 1nrp n ARG 126 Cb 0.55 -2.06 -0.09 0.00 0.45 0.00 0.00 32.46 31.31 1nrp n ARG 126 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1nrp h GLU 127 N 0.00 -0.68 -2.06 -0.14 4.81 -2.03 1.73 114.58 116.20 1nrp h GLU 127 Ca 0.66 0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.89 1nrp h GLU 127 Cb 1.67 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 31.19 1nrp h GLU 127 CO -0.68 -0.46 -0.06 2.41 -0.73 0.00 0.00 179.01 179.49 1nrp n THR 128 N -5.29 1.85 0.00 0.32 -1.04 0.47 -0.41 114.28 110.18 1nrp n THR 128 Ca -0.08 -0.64 0.00 0.00 -2.04 0.00 0.00 64.05 61.29 1nrp n THR 128 Cb 0.39 -1.55 0.00 0.00 -1.82 0.00 0.00 70.33 67.35 1nrp n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nrp n ALA 129 N 1.90 0.00 0.01 2.41 0.00 0.59 -3.25 120.51 122.18 1nrp n ALA 129 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.36 1nrp n ALA 129 Cb 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 1nrp n ALA 129 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1nrp h SER 129 N 0.00 0.80 0.05 0.00 0.02 -0.93 -3.40 113.55 110.09 1nrp h SER 129 Ca 0.00 -0.71 -0.20 0.00 -0.84 0.00 0.00 61.79 60.04 1nrp h SER 129 Cb 0.00 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 1nrp h SER 129 CO 0.00 1.40 -1.05 -0.07 -1.14 0.00 0.00 176.83 175.97 1nrp h LEU 129 N 0.28 0.16 -7.68 5.07 3.38 -1.80 -3.43 115.31 111.28 1nrp h LEU 129 Ca -0.09 -0.76 -0.35 0.00 0.09 0.00 0.00 57.88 56.76 1nrp h LEU 129 Cb 1.49 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.18 1nrp h LEU 129 CO 0.17 1.44 1.14 0.18 0.09 0.00 0.00 178.44 181.45 1nrp n LEU 130 N -4.25 2.88 -3.92 1.67 4.77 -1.26 -4.76 117.00 112.13 1nrp n LEU 130 Ca -0.24 -2.94 -0.11 0.00 -0.03 0.00 0.00 56.01 52.69 1nrp n LEU 130 Cb 0.73 -1.57 -0.13 0.00 -2.33 0.00 0.00 43.42 40.13 1nrp n LEU 130 CO 0.32 -1.87 -0.36 -1.10 -1.33 0.00 0.00 177.39 173.05 1nrp s GLN 131 N 6.56 0.14 0.16 3.23 -0.21 -1.26 -4.95 119.66 123.33 1nrp s GLN 131 Ca 0.69 -0.28 -0.25 0.00 0.02 0.00 0.00 55.36 55.54 1nrp s GLN 131 Cb 0.02 0.05 -0.15 0.00 1.00 0.00 0.00 33.01 33.93 1nrp s GLN 131 CO 0.15 -0.02 0.48 0.00 -2.12 0.00 0.00 175.29 173.78 1nrp n ALA 132 N 2.40 -2.66 0.00 6.09 0.00 -1.26 0.12 120.51 125.20 1nrp n ALA 132 Ca -0.17 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1nrp n ALA 132 Cb 0.58 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1nrp n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nrp n GLY 133 N 1.68 0.46 3.57 0.00 0.00 -0.74 -4.79 105.19 105.38 1nrp n GLY 133 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1nrp n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nrp s TYR 134 N -1.30 2.97 0.79 1.61 1.51 0.12 -4.44 117.35 118.60 1nrp s TYR 134 Ca 0.00 0.46 -0.13 0.00 -1.01 0.00 0.00 57.07 56.39 1nrp s TYR 134 Cb 0.00 -3.85 0.08 0.00 -0.11 0.00 0.00 41.96 38.07 1nrp s TYR 134 CO 0.00 -1.02 1.20 0.15 -1.11 0.00 0.00 175.55 174.78 1nrp s LYS 135 N 3.63 1.72 0.07 -0.62 1.02 -1.26 -3.52 119.74 120.79 1nrp s LYS 135 Ca 0.37 1.75 0.03 0.00 0.02 0.00 0.00 55.97 58.13 1nrp s LYS 135 Cb -0.11 -1.79 -0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1nrp s LYS 135 CO 0.24 -2.15 -0.08 0.20 -0.92 0.00 0.00 175.35 172.63 1nrp s GLY 136 N -2.16 0.70 -0.11 -3.33 0.00 0.26 -4.81 107.32 97.87 1nrp s GLY 136 Ca 0.73 -1.06 0.02 0.00 0.00 0.00 0.00 44.72 44.41 1nrp s GLY 136 CO 0.50 -1.13 -0.19 -1.60 0.00 0.00 0.00 173.10 170.68 1nrp s ARG 137 N -2.55 3.18 -0.19 2.90 3.52 -1.06 0.18 118.95 124.92 1nrp s ARG 137 Ca 0.01 -0.79 -0.07 0.00 -0.13 0.00 0.00 55.73 54.75 1nrp s ARG 137 Cb -0.04 -2.44 -0.04 0.00 -1.56 0.00 0.00 34.95 30.87 1nrp s ARG 137 CO -0.01 0.20 0.04 0.54 -0.81 0.00 0.00 175.30 175.27 1nrp s VAL 138 N 0.32 4.49 0.47 7.11 0.11 0.16 -3.31 120.40 129.75 1nrp s VAL 138 Ca -0.15 -0.14 0.04 0.00 -2.93 0.00 0.00 61.98 58.81 1nrp s VAL 138 Cb -0.17 -3.03 -0.04 0.00 -1.53 0.00 0.00 36.38 31.61 1nrp s VAL 138 CO 0.07 0.44 0.04 0.42 -3.33 0.00 0.00 175.10 172.75 1nrp s THR 139 N 0.60 1.60 -5.00 5.04 -4.23 -1.24 -1.68 115.64 110.73 1nrp s THR 139 Ca 0.02 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1nrp s THR 139 Cb -0.13 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.16 1nrp s THR 139 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 1nrp n GLY 140 N -1.17 -0.06 0.00 3.99 0.00 0.15 -4.56 105.19 103.53 1nrp n GLY 140 Ca -0.11 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1nrp n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1nrp n TRP 141 N 6.91 0.00 -0.44 1.61 8.01 -1.26 0.44 117.44 132.71 1nrp n TRP 141 Ca 0.00 -0.16 -0.04 0.00 -1.31 0.00 0.00 57.50 55.99 1nrp n TRP 141 Cb 0.00 -0.02 0.04 0.00 -2.01 0.00 0.00 31.31 29.32 1nrp n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1nrp n GLY 142 N -0.16 -0.71 3.56 6.99 0.00 -1.25 -4.10 105.19 109.51 1nrp n GLY 142 Ca 0.00 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 1nrp n GLY 142 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1nrp s ASN 143 N -1.32 5.91 0.20 1.61 2.47 0.21 -3.68 114.94 120.35 1nrp s ASN 143 Ca 0.08 -0.06 0.00 0.00 0.42 0.00 0.00 52.86 53.31 1nrp s ASN 143 Cb -0.01 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.24 1nrp s ASN 143 CO 0.07 -1.95 0.64 0.18 -3.72 0.00 0.00 177.10 172.32 1nrp n LEU 144 N 10.33 0.00 -3.65 3.21 4.32 -1.24 -4.41 117.00 125.56 1nrp n LEU 144 Ca 0.10 0.15 -0.10 0.00 -0.02 0.00 0.00 56.01 56.14 1nrp n LEU 144 Cb 0.50 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.26 1nrp n LEU 144 CO 0.71 -0.15 0.21 -0.54 -1.22 0.00 0.00 177.39 176.40 1nrp s LYS 145 N -2.56 1.17 0.30 3.23 1.02 -1.26 -4.49 119.74 117.15 1nrp s LYS 145 Ca 0.00 -0.74 -0.27 0.00 0.02 0.00 0.00 55.97 54.99 1nrp s LYS 145 Cb 0.00 0.49 -0.14 0.00 -0.52 0.00 0.00 37.83 37.66 1nrp s LYS 145 CO 0.00 -0.48 0.80 -1.91 -0.92 0.00 0.00 175.35 172.84 1nrp n GLU 146 N -0.27 0.87 -0.29 1.68 2.13 -1.26 -4.28 120.64 119.22 1nrp n GLU 146 Ca -0.14 0.31 -0.11 0.00 0.66 0.00 0.00 57.16 57.88 1nrp n GLU 146 Cb 0.64 -1.58 -0.03 0.00 0.27 0.00 0.00 31.44 30.74 1nrp n GLU 146 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1nrp n THR 147 N -0.08 0.00 -1.55 6.31 5.66 -1.26 -4.74 114.28 118.63 1nrp n THR 147 Ca 0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.12 1nrp n THR 147 Cb 0.32 -0.10 0.00 0.00 -1.55 0.00 0.00 70.33 69.00 1nrp n THR 147 CO 0.00 0.00 0.00 -2.67 -3.05 0.00 0.00 175.07 169.35 1nrp n TRP 148 N 1.86 0.00 0.00 1.09 4.27 -1.26 -5.16 117.44 118.24 1nrp n TRP 148 Ca 0.13 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.74 1nrp n TRP 148 Cb -0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 1nrp n TRP 148 CO 0.00 0.00 0.00 2.41 -2.29 0.00 0.00 177.69 177.81 1nrp n THR 149 N 0.00 0.00 0.00 -1.67 -1.04 -1.26 -4.98 114.28 105.33 1nrp n THR 149 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1nrp n THR 149 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1nrp n THR 149 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nrp n ALA 149 N -0.06 0.00 0.19 2.41 0.00 -1.26 -4.89 120.51 116.90 1nrp n ALA 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1nrp n ALA 149 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1nrp n ALA 149 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1nrp n VAL 149 N 0.00 0.10 -3.80 0.00 0.24 -1.26 -4.98 118.33 108.64 1nrp n VAL 149 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.17 1nrp n VAL 149 Cb 0.00 -0.36 -0.10 0.00 -1.47 0.00 0.00 33.84 31.90 1nrp n VAL 149 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1nrp s GLY 149 N 0.15 -0.13 -0.68 7.63 0.00 -1.26 -4.61 107.32 108.43 1nrp s GLY 149 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 44.72 45.13 1nrp s GLY 149 CO 0.00 0.27 0.00 0.58 0.00 0.00 0.00 173.10 173.95 1nrp n LYS 149 N 2.09 -1.76 0.00 2.90 -0.00 -1.26 -4.56 118.16 115.57 1nrp n LYS 149 Ca -0.18 0.63 0.00 0.00 -0.00 0.00 0.00 58.31 58.76 1nrp n LYS 149 Cb 0.57 -4.81 0.00 0.00 -0.00 0.00 0.00 35.03 30.79 1nrp n LYS 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nrp n GLY 150 N 0.37 -0.00 3.41 2.58 0.00 -1.26 -4.26 105.19 106.03 1nrp n GLY 150 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 1nrp n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nrp s GLN 151 N -2.00 1.09 0.59 1.61 -1.52 -1.26 -3.71 119.66 114.47 1nrp s GLN 151 Ca 0.00 -0.24 -0.06 0.00 -1.95 0.00 0.00 55.36 53.11 1nrp s GLN 151 Cb 0.00 0.50 0.01 0.00 -0.22 0.00 0.00 33.01 33.30 1nrp s GLN 151 CO 0.00 -0.41 0.90 -1.25 -0.25 0.00 0.00 175.29 174.28 1nrp s PRO 152 N -2.62 2.89 -0.07 2.91 0.04 -1.26 -3.98 135.00 132.91 1nrp s PRO 152 Ca -0.04 -0.03 -0.25 0.00 0.04 0.00 0.00 61.00 60.72 1nrp s PRO 152 Cb -0.00 -2.27 -0.24 0.00 0.04 0.00 0.00 34.50 32.02 1nrp s PRO 152 CO -0.03 -0.72 0.98 0.77 0.04 0.00 0.00 177.00 178.03 1nrp h SER 153 N -0.19 0.18 -2.99 6.66 0.02 -1.95 -3.43 113.55 111.85 1nrp h SER 153 Ca -0.45 -0.82 -0.49 0.00 -0.84 0.00 0.00 61.79 59.19 1nrp h SER 153 Cb 1.26 -0.06 -0.14 0.00 0.14 0.00 0.00 62.40 63.60 1nrp h SER 153 CO 0.61 0.98 -0.65 0.54 -1.14 0.00 0.00 176.83 177.17 1nrp s VAL 154 N -2.94 1.49 0.04 2.27 0.11 -1.26 0.42 120.40 120.52 1nrp s VAL 154 Ca -0.16 -2.07 -0.33 0.00 -2.93 0.00 0.00 61.98 56.49 1nrp s VAL 154 Cb 0.00 -2.59 -0.12 0.00 -1.53 0.00 0.00 36.38 32.14 1nrp s VAL 154 CO 0.73 -0.18 1.81 -0.11 -3.33 0.00 0.00 175.10 174.02 1nrp n LEU 155 N -0.63 3.58 -4.63 2.54 7.94 -1.18 -4.82 117.00 119.80 1nrp n LEU 155 Ca -0.04 1.00 -0.35 0.00 -1.11 0.00 0.00 56.01 55.51 1nrp n LEU 155 Cb 0.65 -1.44 -0.10 0.00 0.53 0.00 0.00 43.42 43.06 1nrp n LEU 155 CO 0.41 -0.03 -0.26 -1.10 -1.11 0.00 0.00 177.39 175.30 1nrp s GLN 156 N 3.03 3.83 -0.15 1.96 -1.52 1.54 -0.53 119.66 127.81 1nrp s GLN 156 Ca 0.86 -0.36 -0.02 0.00 -1.95 0.00 0.00 55.36 53.90 1nrp s GLN 156 Cb -0.61 -3.14 -0.02 0.00 -0.22 0.00 0.00 33.01 29.02 1nrp s GLN 156 CO 0.44 0.34 -0.10 0.08 -0.25 0.00 0.00 175.29 175.80 1nrp s VAL 157 N 0.18 3.31 0.01 1.09 1.01 -0.51 -0.68 120.40 124.82 1nrp s VAL 157 Ca 0.04 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.42 1nrp s VAL 157 Cb -0.12 -2.42 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 1nrp s VAL 157 CO 0.01 0.51 0.04 0.54 0.00 0.00 0.00 175.10 176.20 1nrp s VAL 158 N 0.47 0.09 -0.04 2.92 0.11 -0.68 -1.54 120.40 121.73 1nrp s VAL 158 Ca -0.07 -0.78 0.02 0.00 -2.93 0.00 0.00 61.98 58.21 1nrp s VAL 158 Cb -0.15 -0.32 0.01 0.00 -1.53 0.00 0.00 36.38 34.39 1nrp s VAL 158 CO 0.04 -0.43 -0.08 0.20 -3.33 0.00 0.00 175.10 171.50 1nrp s ASN 159 N -1.37 1.24 0.04 3.54 -0.87 -1.26 -0.67 114.94 115.60 1nrp s ASN 159 Ca -0.15 -0.19 0.03 0.00 -1.57 0.00 0.00 52.86 50.98 1nrp s ASN 159 Cb -0.09 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.25 40.62 1nrp s ASN 159 CO 0.00 0.01 -0.09 -0.76 -2.57 0.00 0.00 177.10 173.70 1nrp s LEU 160 N 0.59 2.22 0.63 0.60 1.43 0.46 -4.90 118.68 119.72 1nrp s LEU 160 Ca -0.10 -0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 52.39 1nrp s LEU 160 Cb -0.13 -0.25 -0.03 0.00 0.03 0.00 0.00 46.19 45.81 1nrp s LEU 160 CO 0.01 -0.14 1.04 -2.16 0.23 0.00 0.00 176.35 175.33 1nrp s PRO 161 N -1.38 3.36 0.36 1.29 0.04 -1.26 0.91 135.00 138.32 1nrp s PRO 161 Ca -0.07 0.89 -0.09 0.00 0.04 0.00 0.00 61.00 61.78 1nrp s PRO 161 Cb -0.09 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 1nrp s PRO 161 CO 0.01 -0.76 0.69 0.42 0.04 0.00 0.00 177.00 177.40 1nrp s ILE 162 N -3.00 4.86 -0.19 0.56 -1.09 -1.23 -2.18 121.20 118.93 1nrp s ILE 162 Ca 0.57 0.45 -0.08 0.00 -2.23 0.00 0.00 60.65 59.36 1nrp s ILE 162 Cb -0.12 -3.72 -0.04 0.00 -1.58 0.00 0.00 42.46 36.99 1nrp s ILE 162 CO 0.50 -0.43 0.09 -0.69 -1.23 0.00 0.00 174.94 173.18 1nrp s VAL 163 N -2.25 4.97 -0.37 2.92 1.01 -0.66 -1.79 120.40 124.23 1nrp s VAL 163 Ca 0.49 0.03 -0.35 0.00 0.00 0.00 0.00 61.98 62.15 1nrp s VAL 163 Cb -0.10 -3.26 -0.12 0.00 0.00 0.00 0.00 36.38 32.90 1nrp s VAL 163 CO 0.30 0.44 2.20 -0.62 0.00 0.00 0.00 175.10 177.43 1nrp n GLU 164 N 3.61 1.01 -0.20 2.72 4.71 -1.26 -4.75 120.64 126.49 1nrp n GLU 164 Ca -0.16 0.27 0.15 0.00 -0.01 0.00 0.00 57.16 57.40 1nrp n GLU 164 Cb 0.52 -2.42 0.28 0.00 -1.01 0.00 0.00 31.44 28.81 1nrp n GLU 164 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 1nrp n ARG 165 N 8.20 -0.04 0.12 3.49 0.63 -1.26 -0.17 116.66 127.63 1nrp n ARG 165 Ca 0.42 0.86 -0.08 0.00 -0.92 0.00 0.00 57.85 58.13 1nrp n ARG 165 Cb 0.22 -1.47 -0.04 0.00 0.45 0.00 0.00 32.46 31.62 1nrp n ARG 165 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1nrp h PRO 166 N 0.00 -0.41 -1.38 -0.14 0.10 -2.01 -2.42 132.00 125.75 1nrp h PRO 166 Ca 0.45 0.03 0.40 0.00 0.10 0.00 0.00 66.00 66.98 1nrp h PRO 166 Cb 1.10 0.09 -0.06 0.00 0.10 0.00 0.00 31.00 32.23 1nrp h PRO 166 CO -0.51 -0.27 0.98 0.28 0.10 0.00 0.00 178.00 178.58 1nrp h VAL 167 N -0.43 0.30 -0.09 3.15 2.07 -0.91 0.12 116.25 120.47 1nrp h VAL 167 Ca -0.02 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1nrp h VAL 167 Cb 0.38 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1nrp h VAL 167 CO -0.04 0.01 0.02 0.00 0.02 0.00 0.00 177.57 177.57 1nrp n LYS 169 N -4.89 0.09 -0.75 0.00 5.02 0.42 -2.23 118.16 115.82 1nrp n LYS 169 Ca -0.06 0.22 0.06 0.00 -2.02 0.00 0.00 58.31 56.51 1nrp n LYS 169 Cb 0.15 -1.50 0.17 0.00 -0.02 0.00 0.00 35.03 33.83 1nrp n LYS 169 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1nrp n ASP 170 N -1.28 1.58 -0.08 4.39 8.00 -0.82 -4.42 116.55 123.93 1nrp n ASP 170 Ca 0.03 -3.54 -0.12 0.00 0.71 0.00 0.00 54.79 51.88 1nrp n ASP 170 Cb 0.05 -0.48 -0.07 0.00 -0.02 0.00 0.00 41.12 40.60 1nrp n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1nrp n SER 171 N -0.82 2.52 -1.21 -2.24 3.41 -0.95 -5.03 113.62 109.30 1nrp n SER 171 Ca 0.16 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1nrp n SER 171 Cb 0.77 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1nrp n SER 171 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1nrp n THR 172 N -3.08 0.00 -1.59 6.66 5.66 -1.24 -4.85 114.28 115.84 1nrp n THR 172 Ca -0.28 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.72 1nrp n THR 172 Cb 0.77 -1.35 0.00 0.00 -1.55 0.00 0.00 70.33 68.21 1nrp n THR 172 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 1nrp n ARG 173 N -0.17 0.00 -3.25 1.09 0.00 -1.26 -5.00 116.66 108.07 1nrp n ARG 173 Ca 0.00 -0.10 -0.39 0.00 -0.00 0.00 0.00 57.85 57.37 1nrp n ARG 173 Cb 0.00 -0.21 -0.06 0.00 -0.00 0.00 0.00 32.46 32.20 1nrp n ARG 173 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1nrp s ILE 174 N 0.00 4.96 -0.52 8.89 1.01 -1.26 -4.97 121.20 129.30 1nrp s ILE 174 Ca 0.00 1.17 -0.26 0.00 0.00 0.00 0.00 60.65 61.56 1nrp s ILE 174 Cb 0.00 -3.90 -0.06 0.00 0.01 0.00 0.00 42.46 38.51 1nrp s ILE 174 CO 0.00 0.42 2.32 -0.60 0.00 0.00 0.00 174.94 177.08 1nrp s ARG 175 N -0.16 2.16 -0.22 2.79 3.52 -1.26 -4.90 118.95 120.88 1nrp s ARG 175 Ca 0.30 1.24 -0.15 0.00 -0.13 0.00 0.00 55.73 56.98 1nrp s ARG 175 Cb -0.18 -4.56 -0.04 0.00 -1.56 0.00 0.00 34.95 28.61 1nrp s ARG 175 CO 0.16 -3.24 0.37 0.96 -0.81 0.00 0.00 175.30 172.74 1nrp s ILE 176 N 11.80 5.21 0.10 4.11 -4.36 -1.26 -4.80 121.20 132.00 1nrp s ILE 176 Ca 0.92 0.62 -0.07 0.00 -0.26 0.00 0.00 60.65 61.85 1nrp s ILE 176 Cb -0.16 -3.70 -0.06 0.00 1.25 0.00 0.00 42.46 39.80 1nrp s ILE 176 CO 0.24 0.24 0.38 0.42 0.24 0.00 0.00 174.94 176.46 1nrp s THR 177 N 1.49 5.14 -1.25 8.37 -4.23 -1.26 -4.96 115.64 118.94 1nrp s THR 177 Ca 0.17 0.26 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 1nrp s THR 177 Cb -0.15 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.07 1nrp s THR 177 CO 0.08 0.18 0.00 -0.90 -0.54 0.00 0.00 174.62 173.44 1nrp n ASP 178 N 0.56 0.00 -0.03 3.99 5.68 -1.26 0.15 116.55 125.64 1nrp n ASP 178 Ca -0.06 0.00 0.04 0.00 -0.50 0.00 0.00 54.79 54.27 1nrp n ASP 178 Cb 0.52 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.46 1nrp n ASP 178 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1nrp n ASN 179 N -0.27 0.48 -4.47 -1.12 2.85 -1.26 -4.99 115.26 106.48 1nrp n ASN 179 Ca 0.00 -0.74 -0.30 0.00 -0.11 0.00 0.00 54.58 53.43 1nrp n ASN 179 Cb 0.00 0.92 -0.12 0.00 1.24 0.00 0.00 39.78 41.82 1nrp n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 1nrp s MET 180 N -1.66 1.97 0.17 1.20 1.00 0.12 -0.01 119.30 122.10 1nrp s MET 180 Ca 0.04 -1.05 0.07 0.00 0.00 0.00 0.00 55.69 54.74 1nrp s MET 180 Cb 0.06 -2.16 -0.04 0.00 0.00 0.00 0.00 34.83 32.69 1nrp s MET 180 CO 0.31 0.52 -0.14 -0.59 0.00 0.00 0.00 175.02 175.11 1nrp s PHE 181 N -1.00 1.60 -0.03 -0.03 -0.12 0.56 -4.85 117.98 114.11 1nrp s PHE 181 Ca 0.16 -0.58 0.04 0.00 -0.05 0.00 0.00 56.93 56.50 1nrp s PHE 181 Cb -0.11 -0.78 -0.03 0.00 -0.63 0.00 0.00 43.02 41.48 1nrp s PHE 181 CO 0.07 0.27 -0.14 0.00 -0.05 0.00 0.00 175.22 175.38 1nrp s ALA 183 N -0.79 4.19 0.00 0.00 0.00 -1.08 -1.66 121.76 122.42 1nrp s ALA 183 Ca 0.13 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.40 1nrp s ALA 183 Cb -0.11 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.16 1nrp s ALA 183 CO 0.02 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.84 1nrp n GLY 184 N -1.64 1.77 3.68 0.00 0.00 -0.93 -2.92 105.19 105.15 1nrp n GLY 184 Ca 0.02 -1.50 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 1nrp n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nrp s TYR 184 N -0.76 1.62 0.58 1.61 1.51 -1.26 -4.81 117.35 115.83 1nrp s TYR 184 Ca 0.00 1.79 -0.12 0.00 -1.01 0.00 0.00 57.07 57.72 1nrp s TYR 184 Cb 0.00 -3.38 -0.05 0.00 -0.11 0.00 0.00 41.96 38.42 1nrp s TYR 184 CO 0.00 -2.85 1.00 0.15 -1.11 0.00 0.00 175.55 172.74 1nrp s LYS 185 N -4.57 3.71 0.20 -0.62 1.02 -1.26 -4.89 119.74 113.33 1nrp s LYS 185 Ca 0.68 0.78 -0.12 0.00 0.02 0.00 0.00 55.97 57.33 1nrp s LYS 185 Cb -0.24 -2.12 0.25 0.00 -0.52 0.00 0.00 37.83 35.20 1nrp s LYS 185 CO 0.57 -0.45 1.68 -1.35 -0.92 0.00 0.00 175.35 174.88 1nrp h PRO 186 N 0.11 0.14 -0.00 -1.68 0.11 -1.93 -2.15 132.00 126.61 1nrp h PRO 186 Ca -0.45 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.49 1nrp h PRO 186 Cb 1.19 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1nrp h PRO 186 CO 0.62 0.09 -0.77 -0.44 -0.21 0.00 0.00 178.00 177.29 1nrp h ASP 186 N 0.15 0.02 -0.21 -2.05 3.32 -1.97 -3.32 116.42 112.36 1nrp h ASP 186 Ca 0.29 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.39 1nrp h ASP 186 Cb 0.45 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1nrp h ASP 186 CO -0.45 0.78 0.84 -0.33 -1.72 0.00 0.00 179.24 178.36 1nrp h GLU 186 N 0.01 0.00 -2.16 3.56 5.08 -1.76 -3.44 114.58 115.86 1nrp h GLU 186 Ca -0.01 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.00 1nrp h GLU 186 Cb 1.37 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.58 1nrp h GLU 186 CO 0.10 0.00 -0.42 0.41 -1.00 0.00 0.00 179.01 178.10 1nrp n GLY 186 N -1.47 0.06 3.28 -3.84 0.00 -1.25 -4.98 105.19 96.98 1nrp n GLY 186 Ca 0.04 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 1nrp n GLY 186 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nrp s LYS 186 N -4.60 0.63 0.14 1.61 2.36 -1.26 -5.17 119.74 113.44 1nrp s LYS 186 Ca 0.00 0.08 0.03 0.00 -2.55 0.00 0.00 55.97 53.53 1nrp s LYS 186 Cb 0.00 0.29 -0.04 0.00 -1.05 0.00 0.00 37.83 37.02 1nrp s LYS 186 CO 0.00 -0.15 -0.06 -0.98 1.55 0.00 0.00 175.35 175.71 1nrp s ARG 187 N -0.81 0.99 0.00 4.03 1.70 -1.26 -4.76 118.95 118.84 1nrp s ARG 187 Ca -0.09 -1.43 0.00 0.00 -0.47 0.00 0.00 55.73 53.74 1nrp s ARG 187 Cb -0.04 -0.36 0.00 0.00 -0.57 0.00 0.00 34.95 33.98 1nrp s ARG 187 CO 0.04 -0.02 0.00 0.41 -1.08 0.00 0.00 175.30 174.64 1nrp n GLY 188 N -0.15 2.37 3.21 3.88 0.00 -1.26 -4.79 105.19 108.45 1nrp n GLY 188 Ca -0.10 -0.74 0.02 0.00 0.00 0.00 0.00 46.02 45.20 1nrp n GLY 188 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nrp n ASP 189 N 0.00 -1.02 -4.47 1.61 2.03 0.81 -4.74 116.55 110.77 1nrp n ASP 189 Ca 0.00 -1.27 -0.32 0.00 0.52 0.00 0.00 54.79 53.72 1nrp n ASP 189 Cb 0.00 1.59 -0.13 0.00 -0.72 0.00 0.00 41.12 41.86 1nrp n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1nrp s ALA 190 N -1.82 2.64 0.00 -1.67 0.00 -1.26 0.30 121.76 119.95 1nrp s ALA 190 Ca 0.24 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.19 1nrp s ALA 190 Cb -0.01 -0.93 0.00 0.00 0.00 0.00 0.00 23.12 22.18 1nrp s ALA 190 CO 0.00 0.56 0.00 0.00 0.00 0.00 0.00 175.76 176.32 1nrp n GLU 192 N 0.00 0.87 -1.19 0.00 2.13 -1.26 -0.39 120.64 120.81 1nrp n GLU 192 Ca 0.00 0.32 -0.06 0.00 0.66 0.00 0.00 57.16 58.08 1nrp n GLU 192 Cb 0.00 -1.95 -0.03 0.00 0.27 0.00 0.00 31.44 29.73 1nrp n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nrp n GLY 193 N 3.74 0.84 0.09 8.31 0.00 -1.26 -0.62 105.19 116.29 1nrp n GLY 193 Ca 0.26 -0.78 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 1nrp n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nrp n ASP 194 N 1.02 0.68 -4.31 1.61 8.00 0.48 -4.01 116.55 120.01 1nrp n ASP 194 Ca -0.06 0.30 -0.38 0.00 0.71 0.00 0.00 54.79 55.36 1nrp n ASP 194 Cb 0.20 0.19 0.02 0.00 -0.02 0.00 0.00 41.12 41.52 1nrp n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1nrp n SER 195 N -2.98 -2.87 0.00 -2.24 7.64 -1.25 -1.33 113.62 110.59 1nrp n SER 195 Ca -0.22 0.65 0.00 0.00 1.01 0.00 0.00 58.87 60.32 1nrp n SER 195 Cb 1.08 -0.96 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 1nrp n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nrp n GLY 196 N 2.29 2.32 3.66 0.23 0.00 -0.90 -2.85 105.19 109.95 1nrp n GLY 196 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1nrp n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nrp n GLY 197 N -0.57 0.14 3.84 -0.02 0.00 -0.44 -4.07 105.19 104.07 1nrp n GLY 197 Ca 0.00 0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 1nrp n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nrp s PRO 198 N -2.47 3.73 -0.57 1.61 0.04 -1.26 -1.23 135.00 134.85 1nrp s PRO 198 Ca 0.68 0.94 0.07 0.00 0.04 0.00 0.00 61.00 62.73 1nrp s PRO 198 Cb -0.47 -2.10 0.25 0.00 0.04 0.00 0.00 34.50 32.22 1nrp s PRO 198 CO 0.53 -0.45 0.69 0.34 0.04 0.00 0.00 177.00 178.14 1nrp n PHE 199 N -1.99 2.62 -3.59 0.56 -0.00 -0.65 -3.63 117.46 110.77 1nrp n PHE 199 Ca 0.07 -4.00 -0.36 0.00 -0.00 0.00 0.00 57.45 53.15 1nrp n PHE 199 Cb 0.54 -0.51 -0.07 0.00 -0.00 0.00 0.00 39.48 39.44 1nrp n PHE 199 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.76 176.90 1nrp s VAL 200 N -2.16 5.33 0.35 -2.13 -7.23 -1.21 0.19 120.40 113.54 1nrp s VAL 200 Ca 0.39 0.47 0.08 0.00 -1.81 0.00 0.00 61.98 61.11 1nrp s VAL 200 Cb 0.16 -3.59 -0.04 0.00 0.56 0.00 0.00 36.38 33.46 1nrp s VAL 200 CO -0.04 0.42 0.15 -0.32 -0.31 0.00 0.00 175.10 175.01 1nrp s MET 201 N 0.30 2.36 -0.10 4.82 1.75 -0.18 -2.57 119.30 125.69 1nrp s MET 201 Ca 0.15 -1.58 0.00 0.00 -1.25 0.00 0.00 55.69 53.02 1nrp s MET 201 Cb -0.13 -2.16 0.02 0.00 2.84 0.00 0.00 34.83 35.40 1nrp s MET 201 CO 0.03 0.08 -0.09 0.21 -0.65 0.00 0.00 175.02 174.60 1nrp s LYS 202 N -3.86 1.56 -0.11 4.11 2.20 -1.26 -0.54 119.74 121.83 1nrp s LYS 202 Ca 0.38 -0.30 -0.30 0.00 -0.36 0.00 0.00 55.97 55.40 1nrp s LYS 202 Cb -0.02 -1.51 -0.03 0.00 -1.51 0.00 0.00 37.83 34.76 1nrp s LYS 202 CO 0.23 -0.17 1.36 0.45 -0.36 0.00 0.00 175.35 176.86 1nrp s SER 203 N 1.35 6.88 0.26 1.43 0.15 -1.14 -4.93 113.70 117.69 1nrp s SER 203 Ca -0.02 1.87 0.26 0.00 0.70 0.00 0.00 55.95 58.76 1nrp s SER 203 Cb -0.14 -2.54 0.77 0.00 -1.71 0.00 0.00 66.02 62.40 1nrp s SER 203 CO -0.04 -0.78 1.75 1.55 1.20 0.00 0.00 173.24 176.92 1nrp h PRO 204 N 8.39 0.00 0.68 5.44 0.13 -1.97 -1.88 132.00 142.79 1nrp h PRO 204 Ca -0.31 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.78 1nrp h PRO 204 Cb 1.13 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.27 1nrp h PRO 204 CO 0.95 0.00 -0.33 0.74 -0.23 0.00 0.00 178.00 179.13 1nrp h PHE 204 N 0.00 -0.84 -0.21 1.56 0.04 -1.97 -3.38 116.94 112.13 1nrp h PHE 204 Ca 0.00 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1nrp h PHE 204 Cb 0.74 0.28 0.00 0.00 2.20 0.00 0.00 35.95 39.16 1nrp h PHE 204 CO 0.00 -0.53 0.00 0.27 -0.60 0.00 0.00 178.31 177.45 1nrp n ASN 204 N -5.07 2.50 -1.12 2.17 2.04 -1.24 -5.00 115.26 109.54 1nrp n ASN 204 Ca -0.11 -1.84 -0.15 0.00 -0.44 0.00 0.00 54.58 52.04 1nrp n ASN 204 Cb 0.36 -0.14 -0.06 0.00 -2.53 0.00 0.00 39.78 37.40 1nrp n ASN 204 CO 0.00 0.00 0.00 -0.46 -0.44 0.00 0.00 177.26 176.36 1nrp n ASN 205 N 0.37 -5.29 -4.92 0.53 0.23 -0.71 -4.99 115.26 100.49 1nrp n ASN 205 Ca 0.08 0.36 -0.27 0.00 -0.53 0.00 0.00 54.58 54.22 1nrp n ASN 205 Cb 0.35 -4.08 0.07 0.00 -2.08 0.00 0.00 39.78 34.04 1nrp n ASN 205 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1nrp s ARG 206 N -3.19 2.20 -0.16 -3.83 3.00 -1.24 -4.93 118.95 110.79 1nrp s ARG 206 Ca 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 55.73 55.68 1nrp s ARG 206 Cb 0.00 -2.09 0.01 0.00 0.00 0.00 0.00 34.95 32.87 1nrp s ARG 206 CO 0.00 -1.32 -0.19 -1.58 0.00 0.00 0.00 175.30 172.21 1nrp s TRP 207 N -3.36 2.75 -0.20 -0.53 0.52 -1.26 -2.90 118.94 113.96 1nrp s TRP 207 Ca 0.60 -1.37 -0.02 0.00 0.02 0.00 0.00 56.10 55.33 1nrp s TRP 207 Cb -0.11 -1.89 0.00 0.00 -1.15 0.00 0.00 33.47 30.33 1nrp s TRP 207 CO 0.47 -0.65 -0.10 0.71 0.02 0.00 0.00 176.95 177.40 1nrp s TYR 208 N 1.03 2.89 -1.01 -1.98 1.51 0.30 -2.56 117.35 117.53 1nrp s TYR 208 Ca -0.02 -1.17 -0.23 0.00 -1.01 0.00 0.00 57.07 54.64 1nrp s TYR 208 Cb -0.14 -2.04 0.02 0.00 -0.11 0.00 0.00 41.96 39.69 1nrp s TYR 208 CO -0.06 -0.63 1.63 -1.14 -1.11 0.00 0.00 175.55 174.25 1nrp s GLN 209 N 1.39 3.27 0.17 -0.62 0.74 -0.54 -1.01 119.66 123.07 1nrp s GLN 209 Ca 0.05 -0.94 -0.04 0.00 0.05 0.00 0.00 55.36 54.48 1nrp s GLN 209 Cb -0.14 -5.28 0.03 0.00 1.10 0.00 0.00 33.01 28.72 1nrp s GLN 209 CO -0.06 -2.62 1.43 0.52 -0.55 0.00 0.00 175.29 174.00 1nrp h MET 210 N 10.08 0.52 -4.99 1.67 2.86 -0.08 -3.42 114.93 121.57 1nrp h MET 210 Ca 0.19 -0.40 -0.49 0.00 -2.06 0.00 0.00 59.70 56.94 1nrp h MET 210 Cb 1.00 0.07 -0.13 0.00 0.06 0.00 0.00 31.60 32.60 1nrp h MET 210 CO 1.36 1.03 -0.54 0.20 1.06 0.00 0.00 176.91 180.02 1nrp s GLY 211 N -4.22 2.34 -0.17 8.32 0.00 0.51 -3.37 107.32 110.74 1nrp s GLY 211 Ca -0.07 -1.57 -0.05 0.00 0.00 0.00 0.00 44.72 43.04 1nrp s GLY 211 CO 0.85 -1.71 0.29 -0.42 0.00 0.00 0.00 173.10 172.11 1nrp s ILE 212 N -3.38 -0.46 0.19 0.90 1.01 -1.23 -1.64 121.20 116.59 1nrp s ILE 212 Ca 0.31 0.14 -0.32 0.00 0.00 0.00 0.00 60.65 60.78 1nrp s ILE 212 Cb 0.04 -0.57 -0.12 0.00 0.01 0.00 0.00 42.46 41.82 1nrp s ILE 212 CO 0.17 0.02 1.72 0.52 0.00 0.00 0.00 174.94 177.36 1nrp n VAL 213 N 5.35 0.04 0.03 2.92 0.31 -0.36 0.07 118.33 126.69 1nrp n VAL 213 Ca -0.06 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1nrp n VAL 213 Cb 0.50 -1.94 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 1nrp n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1nrp n SER 214 N 4.09 0.22 -2.95 4.52 2.88 -1.17 -2.12 113.62 119.10 1nrp n SER 214 Ca 0.16 0.09 -0.11 0.00 -1.33 0.00 0.00 58.87 57.69 1nrp n SER 214 Cb 0.34 -0.02 0.01 0.00 -0.75 0.00 0.00 64.21 63.79 1nrp n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1nrp s TRP 215 N -2.00 0.41 -0.11 0.66 1.48 -1.11 -4.98 118.94 113.29 1nrp s TRP 215 Ca 0.00 -0.97 -0.33 0.00 -1.06 0.00 0.00 56.10 53.73 1nrp s TRP 215 Cb 0.00 0.58 0.15 0.00 -1.16 0.00 0.00 33.47 33.04 1nrp s TRP 215 CO 0.00 -1.47 1.40 0.20 -4.06 0.00 0.00 176.95 173.02 1nrp s GLY 216 N -3.13 -0.44 -0.64 3.67 0.00 -1.26 -2.77 107.32 102.75 1nrp s GLY 216 Ca 0.20 1.07 0.03 0.00 0.00 0.00 0.00 44.72 46.02 1nrp s GLY 216 CO 0.14 0.24 1.34 1.18 0.00 0.00 0.00 173.10 176.00 1nrp n GLU 217 N -0.42 3.53 0.00 2.90 1.02 -1.26 -5.02 120.64 121.40 1nrp n GLU 217 Ca -0.07 -4.45 0.00 0.00 -0.02 0.00 0.00 57.16 52.62 1nrp n GLU 217 Cb 0.63 -2.28 0.00 0.00 -0.02 0.00 0.00 31.44 29.76 1nrp n GLU 217 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nrp n GLY 219 N -0.37 0.36 3.15 0.62 0.00 -1.26 -4.96 105.19 102.73 1nrp n GLY 219 Ca 0.41 -1.26 0.04 0.00 0.00 0.00 0.00 46.02 45.21 1nrp n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nrp n ASP 221 N 5.40 -4.34 -4.68 0.00 2.03 -1.26 -4.51 116.55 109.19 1nrp n ASP 221 Ca 0.00 -0.28 -0.42 0.00 0.52 0.00 0.00 54.79 54.61 1nrp n ASP 221 Cb 0.53 -2.92 -0.03 0.00 -0.72 0.00 0.00 41.12 37.98 1nrp n ASP 221 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1nrp s ARG 221 N -5.69 4.25 -0.37 -0.67 3.52 -1.26 -4.93 118.95 113.79 1nrp s ARG 221 Ca 0.31 2.05 -0.28 0.00 -0.13 0.00 0.00 55.73 57.69 1nrp s ARG 221 Cb -0.14 -3.66 -0.04 0.00 -1.56 0.00 0.00 34.95 29.55 1nrp s ARG 221 CO 0.38 -0.66 2.05 -0.51 -0.81 0.00 0.00 175.30 175.76 1nrp s ASP 222 N 2.23 5.39 0.00 -2.12 1.01 -1.26 -2.06 116.67 119.86 1nrp s ASP 222 Ca 0.67 1.30 0.00 0.00 0.71 0.00 0.00 52.55 55.23 1nrp s ASP 222 Cb -0.33 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.09 1nrp s ASP 222 CO 0.27 -2.11 0.00 0.61 0.21 0.00 0.00 175.17 174.15 1nrp n GLY 223 N 5.68 0.64 3.17 0.21 0.00 -1.26 -4.97 105.19 108.66 1nrp n GLY 223 Ca 0.27 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 1nrp n GLY 223 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nrp s LYS 224 N 0.00 0.83 -0.02 1.61 2.20 -0.87 -4.58 119.74 118.91 1nrp s LYS 224 Ca 0.00 -1.22 0.05 0.00 -0.36 0.00 0.00 55.97 54.44 1nrp s LYS 224 Cb 0.00 0.27 -0.01 0.00 -1.51 0.00 0.00 37.83 36.58 1nrp s LYS 224 CO 0.00 -0.23 -0.17 0.71 -0.36 0.00 0.00 175.35 175.30 1nrp s TYR 225 N -3.95 1.57 1.21 4.03 2.02 -1.26 -4.67 117.35 116.30 1nrp s TYR 225 Ca 0.13 -0.34 -0.16 0.00 -0.37 0.00 0.00 57.07 56.32 1nrp s TYR 225 Cb 0.06 -1.03 0.25 0.00 -0.40 0.00 0.00 41.96 40.85 1nrp s TYR 225 CO -0.05 -0.07 0.66 0.41 -1.57 0.00 0.00 175.55 174.92 1nrp n GLY 226 N 2.81 -2.54 2.78 0.71 0.00 -1.15 -4.79 105.19 103.02 1nrp n GLY 226 Ca -0.16 -1.14 -0.21 0.00 0.00 0.00 0.00 46.02 44.51 1nrp n GLY 226 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nrp s PHE 227 N -2.28 0.55 0.34 1.61 0.40 -1.11 -2.63 117.98 114.85 1nrp s PHE 227 Ca 0.63 -0.09 0.09 0.00 -0.60 0.00 0.00 56.93 56.96 1nrp s PHE 227 Cb -0.19 -0.69 -0.06 0.00 0.51 0.00 0.00 43.02 42.60 1nrp s PHE 227 CO 0.63 -0.27 -0.04 0.71 0.70 0.00 0.00 175.22 176.95 1nrp s TYR 228 N 1.75 2.47 0.17 0.36 1.51 0.59 -2.75 117.35 121.45 1nrp s TYR 228 Ca 0.01 -0.47 -0.20 0.00 -1.01 0.00 0.00 57.07 55.40 1nrp s TYR 228 Cb -0.13 -1.44 -0.08 0.00 -0.11 0.00 0.00 41.96 40.21 1nrp s TYR 228 CO -0.04 0.53 0.68 0.99 -1.11 0.00 0.00 175.55 176.60 1nrp s THR 229 N -2.57 4.61 -1.16 -0.71 2.01 0.11 0.21 115.64 118.14 1nrp s THR 229 Ca 0.34 1.27 -0.23 0.00 0.31 0.00 0.00 61.69 63.38 1nrp s THR 229 Cb 0.01 -3.90 -0.09 0.00 0.01 0.00 0.00 72.50 68.54 1nrp s THR 229 CO 0.18 0.33 1.94 -2.28 -0.69 0.00 0.00 174.62 174.10 1nrp s HIS 230 N -1.37 1.93 0.55 4.92 2.46 0.99 -3.57 115.29 121.20 1nrp s HIS 230 Ca 0.38 0.52 0.33 0.00 0.47 0.00 0.00 55.06 56.76 1nrp s HIS 230 Cb -0.18 -3.99 1.48 0.00 -0.13 0.00 0.00 32.58 29.77 1nrp s HIS 230 CO 0.21 -1.22 1.84 0.28 -2.47 0.00 0.00 174.74 173.37 1nrp h VAL 231 N 6.26 0.44 0.04 0.89 2.07 -1.85 -2.07 116.25 122.03 1nrp h VAL 231 Ca 0.20 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.55 1nrp h VAL 231 Cb 0.94 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1nrp h VAL 231 CO 1.22 0.00 -0.94 0.15 0.02 0.00 0.00 177.57 178.02 1nrp h PHE 232 N 0.00 0.15 -0.69 1.57 3.57 -1.87 -2.70 116.94 116.97 1nrp h PHE 232 Ca 0.44 -0.11 0.08 0.00 3.53 0.00 0.00 57.97 61.91 1nrp h PHE 232 Cb 1.85 -0.01 -0.11 0.00 2.79 0.00 0.00 35.95 40.48 1nrp h PHE 232 CO 0.00 1.37 -0.52 -0.09 -2.23 0.00 0.00 178.31 176.84 1nrp h ARG 233 N -0.77 -0.18 -0.96 1.11 2.43 -1.76 0.52 114.38 114.77 1nrp h ARG 233 Ca -0.23 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.95 1nrp h ARG 233 Cb 1.37 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.96 1nrp h ARG 233 CO -0.06 -0.12 0.00 1.28 -1.51 0.00 0.00 179.97 179.56 1nrp n LEU 234 N -5.35 1.48 0.19 3.80 4.77 -1.02 -3.85 117.00 117.02 1nrp n LEU 234 Ca 0.01 -0.75 0.14 0.00 -0.03 0.00 0.00 56.01 55.38 1nrp n LEU 234 Cb 0.32 -0.52 0.49 0.00 -2.33 0.00 0.00 43.42 41.38 1nrp n LEU 234 CO -0.06 0.29 0.90 0.50 -1.33 0.00 0.00 177.39 177.69 1nrp h LYS 235 N 0.41 0.00 0.04 3.23 1.63 0.42 -2.90 116.57 119.39 1nrp h LYS 235 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1nrp h LYS 235 Cb 0.65 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.28 1nrp h LYS 235 CO 0.05 0.00 -0.04 0.87 -3.45 0.00 0.00 179.45 176.88 1nrp h LYS 236 N 0.00 -0.08 0.14 1.90 1.57 -1.71 -2.98 116.57 115.40 1nrp h LYS 236 Ca 0.00 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1nrp h LYS 236 Cb 0.59 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.88 1nrp h LYS 236 CO 0.00 -0.05 -0.47 2.35 -0.57 0.00 0.00 179.45 180.70 1nrp h TRP 237 N -0.08 -1.37 -0.46 -1.35 7.01 -1.86 -2.62 115.95 115.22 1nrp h TRP 237 Ca -0.00 0.03 0.18 0.00 2.11 0.00 0.00 58.89 61.21 1nrp h TRP 237 Cb 0.07 0.58 -0.07 0.00 -2.10 0.00 0.00 29.16 27.64 1nrp h TRP 237 CO -0.10 -0.54 0.26 -0.89 -2.79 0.00 0.00 178.44 174.38 1nrp n ILE 238 N -5.15 -0.16 0.10 2.65 5.41 -1.10 0.25 119.36 121.35 1nrp n ILE 238 Ca -0.08 0.84 -0.09 0.00 1.00 0.00 0.00 62.75 64.42 1nrp n ILE 238 Cb 0.37 -1.37 -0.06 0.00 -0.71 0.00 0.00 39.64 37.88 1nrp n ILE 238 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1nrp h GLN 239 N 0.00 -0.33 -0.81 0.38 4.15 -1.30 -3.33 115.11 113.87 1nrp h GLN 239 Ca 0.36 0.02 0.20 0.00 0.77 0.00 0.00 58.65 60.00 1nrp h GLN 239 Cb 1.01 0.07 -0.13 0.00 0.21 0.00 0.00 27.48 28.64 1nrp h GLN 239 CO -0.30 -0.02 0.12 -0.22 -1.93 0.00 0.00 178.83 176.48 1nrp h LYS 240 N -0.98 0.16 0.00 1.69 3.64 -0.23 -0.30 116.57 120.55 1nrp h LYS 240 Ca -0.03 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.28 1nrp h LYS 240 Cb 0.46 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1nrp h LYS 240 CO 0.06 0.11 -0.29 -0.24 -2.27 0.00 0.00 179.45 176.82 1nrp h VAL 241 N 0.17 0.55 0.02 2.00 3.04 -1.71 -1.36 116.25 118.96 1nrp h VAL 241 Ca 0.47 -1.52 -0.23 0.00 -1.01 0.00 0.00 66.70 64.41 1nrp h VAL 241 Cb 0.89 2.07 0.02 0.00 -2.01 0.00 0.00 31.29 32.26 1nrp h VAL 241 CO -0.65 0.28 -0.90 0.40 -1.01 0.00 0.00 177.57 175.69 1nrp h ILE 242 N 0.00 1.35 -0.29 3.17 2.04 -1.33 -2.52 117.51 119.93 1nrp h ILE 242 Ca -0.00 -2.23 0.00 0.00 1.00 0.00 0.00 64.86 63.63 1nrp h ILE 242 Cb 1.05 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 39.68 1nrp h ILE 242 CO 0.04 0.67 0.00 -0.90 0.00 0.00 0.00 178.15 177.96 1nrp n ASP 243 N -3.99 1.54 0.00 1.72 5.68 -0.25 -2.61 116.55 118.63 1nrp n ASP 243 Ca -0.11 -2.00 0.00 0.00 -0.50 0.00 0.00 54.79 52.18 1nrp n ASP 243 Cb 0.82 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.61 1nrp n ASP 243 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1nrp n GLN 244 N 0.34 3.26 -1.19 0.11 7.27 -0.52 -4.85 117.38 121.80 1nrp n GLN 244 Ca 0.10 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.18 1nrp n GLN 244 Cb 0.24 -0.26 -0.00 0.00 2.41 0.00 0.00 30.24 32.63 1nrp n GLN 244 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1nrp n PHE 245 N -0.48 0.00 -0.51 3.69 3.72 -0.95 -5.05 117.46 117.88 1nrp n PHE 245 Ca 0.00 -0.39 0.00 0.00 -0.05 0.00 0.00 57.45 57.01 1nrp n PHE 245 Cb 0.00 0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.55 1nrp n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12