#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gk4 n ALA 0 N 0.00 0.00 -3.68 -2.53 0.00 -1.26 -5.11 120.51 107.93 2gk4 n ALA 0 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2gk4 n ALA 0 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2gk4 n ALA 0 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2gk4 s LYS 2 N 0.00 0.45 -0.05 0.00 1.02 -1.26 -4.74 119.74 115.16 2gk4 s LYS 2 Ca 0.00 0.92 0.04 0.00 0.02 0.00 0.00 55.97 56.94 2gk4 s LYS 2 Cb 0.00 0.07 0.00 0.00 -0.52 0.00 0.00 37.83 37.38 2gk4 s LYS 2 CO 0.00 -0.17 -0.16 0.42 -0.92 0.00 0.00 175.35 174.52 2gk4 s ILE 3 N 1.61 1.40 -0.18 2.17 1.01 0.58 -1.15 121.20 126.66 2gk4 s ILE 3 Ca -0.09 -0.68 -0.07 0.00 0.00 0.00 0.00 60.65 59.81 2gk4 s ILE 3 Cb -0.08 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.13 2gk4 s ILE 3 CO -0.14 0.41 0.07 -0.22 0.00 0.00 0.00 174.94 175.06 2gk4 s LEU 4 N 0.20 3.90 -0.04 2.97 2.96 0.32 -1.01 118.68 127.98 2gk4 s LEU 4 Ca -0.07 0.13 0.04 0.00 -0.22 0.00 0.00 54.13 54.01 2gk4 s LEU 4 Cb -0.13 -1.98 -0.00 0.00 0.50 0.00 0.00 46.19 44.58 2gk4 s LEU 4 CO 0.03 0.20 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.42 2gk4 s VAL 5 N 0.21 1.24 0.10 1.68 1.01 -0.27 -0.50 120.40 123.87 2gk4 s VAL 5 Ca 0.05 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.48 2gk4 s VAL 5 Cb -0.12 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 2gk4 s VAL 5 CO 0.00 0.36 -0.10 0.42 0.00 0.00 0.00 175.10 175.78 2gk4 s THR 6 N 0.05 3.35 0.24 3.92 -4.23 -0.08 0.08 115.64 118.97 2gk4 s THR 6 Ca -0.03 -1.25 -0.18 0.00 -1.18 0.00 0.00 61.69 59.05 2gk4 s THR 6 Cb -0.10 -2.56 0.02 0.00 1.34 0.00 0.00 72.50 71.20 2gk4 s THR 6 CO 0.01 0.13 0.61 -0.94 -0.54 0.00 0.00 174.62 173.89 2gk4 s SER 7 N -2.15 -0.24 0.00 3.99 1.04 -0.28 -1.87 113.70 114.20 2gk4 s SER 7 Ca 0.21 -0.62 0.00 0.00 0.48 0.00 0.00 55.95 56.02 2gk4 s SER 7 Cb -0.11 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2gk4 s SER 7 CO 0.13 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.76 2gk4 n GLY 8 N -0.41 -1.05 3.23 7.32 0.00 -1.26 -3.66 105.19 109.36 2gk4 n GLY 8 Ca -0.06 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.22 2gk4 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2gk4 s GLY 9 N 0.00 -0.27 0.66 -0.02 0.00 -1.26 0.02 107.32 106.45 2gk4 s GLY 9 Ca 0.00 1.12 -0.06 0.00 0.00 0.00 0.00 44.72 45.78 2gk4 s GLY 9 CO 0.00 1.09 0.96 -0.51 0.00 0.00 0.00 173.10 174.64 2gk4 s THR 10 N 0.58 2.69 -0.00 0.90 -4.23 -0.80 -4.68 115.64 110.08 2gk4 s THR 10 Ca -0.03 -0.23 0.01 0.00 -1.18 0.00 0.00 61.69 60.26 2gk4 s THR 10 Cb -0.05 -3.13 -0.00 0.00 1.34 0.00 0.00 72.50 70.67 2gk4 s THR 10 CO -0.03 -0.13 -0.03 -0.94 -0.54 0.00 0.00 174.62 172.95 2gk4 s SER 11 N -4.45 0.35 -0.11 3.99 1.04 -0.69 -1.37 113.70 112.45 2gk4 s SER 11 Ca 0.58 -0.05 0.02 0.00 0.48 0.00 0.00 55.95 56.98 2gk4 s SER 11 Cb -0.11 -0.05 0.01 0.00 0.10 0.00 0.00 66.02 65.97 2gk4 s SER 11 CO 0.44 0.03 -0.18 -1.61 0.98 0.00 0.00 173.24 172.90 2gk4 s GLU 12 N 0.01 2.51 0.32 4.02 0.41 -0.02 -4.32 118.70 121.64 2gk4 s GLU 12 Ca 0.00 -0.67 -0.29 0.00 -0.41 0.00 0.00 54.97 53.60 2gk4 s GLU 12 Cb -0.02 -2.07 -0.10 0.00 -1.78 0.00 0.00 34.13 30.16 2gk4 s GLU 12 CO -0.00 -0.02 1.28 0.00 -0.49 0.00 0.00 175.26 176.03 2gk4 s ALA 13 N 0.85 3.49 -0.22 5.21 0.00 -1.26 -0.21 121.76 129.62 2gk4 s ALA 13 Ca -0.08 1.22 -0.07 0.00 0.00 0.00 0.00 51.96 53.02 2gk4 s ALA 13 Cb -0.15 -3.46 -0.18 0.00 0.00 0.00 0.00 23.12 19.32 2gk4 s ALA 13 CO -0.00 -0.59 -0.05 -0.89 0.00 0.00 0.00 175.76 174.23 2gk4 n ILE 14 N 0.90 1.58 -2.46 0.00 5.41 0.10 -4.85 119.36 120.04 2gk4 n ILE 14 Ca 0.00 -0.47 0.00 0.00 1.00 0.00 0.00 62.75 63.28 2gk4 n ILE 14 Cb 0.42 -1.69 0.00 0.00 -0.71 0.00 0.00 39.64 37.66 2gk4 n ILE 14 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2gk4 n ASP 15 N -3.71 0.00 0.09 4.38 5.68 -1.00 -4.99 116.55 117.00 2gk4 n ASP 15 Ca -0.43 -0.35 0.10 0.00 -0.50 0.00 0.00 54.79 53.61 2gk4 n ASP 15 Cb 0.94 0.00 0.42 0.00 -1.14 0.00 0.00 41.12 41.34 2gk4 n ASP 15 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2gk4 n SER 16 N -0.43 0.44 -0.06 -1.12 3.41 -1.26 -3.60 113.62 111.00 2gk4 n SER 16 Ca 0.00 0.63 -0.08 0.00 -0.26 0.00 0.00 58.87 59.16 2gk4 n SER 16 Cb 0.00 -0.71 -0.05 0.00 -0.26 0.00 0.00 64.21 63.19 2gk4 n SER 16 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2gk4 n VAL 17 N -2.00 0.63 -4.33 -3.33 0.31 -1.26 -5.08 118.33 103.27 2gk4 n VAL 17 Ca 0.02 -0.25 -0.28 0.00 -0.01 0.00 0.00 64.34 63.82 2gk4 n VAL 17 Cb 0.17 -0.89 -0.11 0.00 -0.91 0.00 0.00 33.84 32.10 2gk4 n VAL 17 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2gk4 s ARG 18 N -2.22 1.73 0.04 5.55 0.52 -1.24 -5.07 118.95 118.26 2gk4 s ARG 18 Ca -0.15 -1.28 -0.02 0.00 -0.52 0.00 0.00 55.73 53.77 2gk4 s ARG 18 Cb 0.04 -2.05 -0.02 0.00 0.52 0.00 0.00 34.95 33.44 2gk4 s ARG 18 CO 0.26 0.45 0.01 -1.12 0.02 0.00 0.00 175.30 174.92 2gk4 s SER 19 N -2.33 0.31 -0.21 0.23 0.01 -1.26 -0.72 113.70 109.72 2gk4 s SER 19 Ca 0.19 -0.69 -0.20 0.00 1.31 0.00 0.00 55.95 56.55 2gk4 s SER 19 Cb -0.10 0.18 -0.02 0.00 0.21 0.00 0.00 66.02 66.28 2gk4 s SER 19 CO 0.10 -0.47 0.62 -0.63 0.41 0.00 0.00 173.24 173.27 2gk4 s ILE 20 N -2.71 5.02 0.10 1.44 -1.09 0.71 -4.86 121.20 119.81 2gk4 s ILE 20 Ca -0.04 1.15 0.08 0.00 -2.23 0.00 0.00 60.65 59.61 2gk4 s ILE 20 Cb -0.01 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 2gk4 s ILE 20 CO -0.05 0.10 -0.16 0.42 -1.23 0.00 0.00 174.94 174.02 2gk4 s THR 21 N 2.04 3.00 -0.12 2.92 -4.23 -1.26 -0.84 115.64 117.15 2gk4 s THR 21 Ca 0.28 -1.39 0.01 0.00 -1.18 0.00 0.00 61.69 59.40 2gk4 s THR 21 Cb -0.16 -2.37 -0.01 0.00 1.34 0.00 0.00 72.50 71.30 2gk4 s THR 21 CO 0.10 0.13 -0.17 0.20 -0.54 0.00 0.00 174.62 174.34 2gk4 s ASN 22 N -2.08 3.70 -0.24 3.99 -0.87 -0.47 -5.00 114.94 113.97 2gk4 s ASN 22 Ca 0.19 -0.41 -0.09 0.00 -1.57 0.00 0.00 52.86 50.97 2gk4 s ASN 22 Cb -0.11 -1.55 -0.04 0.00 -0.02 0.00 0.00 41.25 39.53 2gk4 s ASN 22 CO 0.11 0.15 0.13 -2.28 -2.57 0.00 0.00 177.10 172.64 2gk4 s HIS 23 N 0.40 3.24 -0.16 2.20 2.46 -1.26 -4.21 115.29 117.96 2gk4 s HIS 23 Ca -0.13 0.06 -0.09 0.00 0.47 0.00 0.00 55.06 55.37 2gk4 s HIS 23 Cb -0.16 -2.24 0.06 0.00 -0.13 0.00 0.00 32.58 30.10 2gk4 s HIS 23 CO 0.06 -0.03 0.39 0.45 -2.47 0.00 0.00 174.74 173.14 2gk4 s SER 24 N 1.13 -0.49 0.21 9.88 0.15 -1.26 -4.93 113.70 118.39 2gk4 s SER 24 Ca 0.06 0.85 0.24 0.00 0.70 0.00 0.00 55.95 57.80 2gk4 s SER 24 Cb -0.14 0.74 0.92 0.00 -1.71 0.00 0.00 66.02 65.83 2gk4 s SER 24 CO 0.05 -0.19 1.72 0.35 1.20 0.00 0.00 173.24 176.37 2gk4 n THR 25 N 4.15 0.74 -1.50 6.45 -2.24 -1.26 -4.22 114.28 116.40 2gk4 n THR 25 Ca -0.23 0.08 -0.16 0.00 -2.27 0.00 0.00 64.05 61.47 2gk4 n THR 25 Cb 0.55 -0.96 -0.06 0.00 -2.10 0.00 0.00 70.33 67.75 2gk4 n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gk4 n GLY 26 N 0.42 1.51 0.23 3.38 0.00 -1.26 -0.55 105.19 108.92 2gk4 n GLY 26 Ca 0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 46.02 45.78 2gk4 n GLY 26 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2gk4 h HIS 27 N 0.00 0.38 -0.43 1.61 6.17 -1.90 -0.95 115.15 120.03 2gk4 h HIS 27 Ca -0.33 0.03 -0.13 0.00 0.71 0.00 0.00 60.37 60.66 2gk4 h HIS 27 Cb 1.05 -0.08 -0.01 0.00 2.52 0.00 0.00 27.41 30.89 2gk4 h HIS 27 CO 0.44 0.09 -0.23 1.25 0.71 0.00 0.00 177.93 180.19 2gk4 h LEU 28 N 0.39 0.91 -1.10 0.26 5.85 -1.98 -2.01 115.31 117.64 2gk4 h LEU 28 Ca 0.30 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.71 2gk4 h LEU 28 Cb 0.37 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 2gk4 h LEU 28 CO -0.31 1.10 0.61 1.23 -0.34 0.00 0.00 178.44 180.73 2gk4 h GLY 29 N 0.92 1.34 0.88 3.75 0.00 -1.80 -0.54 103.07 107.62 2gk4 h GLY 29 Ca 0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 2gk4 h GLY 29 CO 0.06 0.41 0.07 1.70 0.00 0.00 0.00 176.54 178.79 2gk4 h LYS 30 N 1.18 0.30 -0.34 4.80 3.64 -0.80 -0.17 116.57 125.18 2gk4 h LYS 30 Ca 0.37 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 2gk4 h LYS 30 Cb -0.01 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 2gk4 h LYS 30 CO -0.11 0.37 0.17 0.82 -2.27 0.00 0.00 179.45 178.43 2gk4 h ILE 31 N 0.16 1.16 -0.25 2.00 2.04 -0.93 -1.12 117.51 120.57 2gk4 h ILE 31 Ca 0.06 -0.46 0.02 0.00 1.00 0.00 0.00 64.86 65.49 2gk4 h ILE 31 Cb 0.19 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 2gk4 h ILE 31 CO -0.00 0.17 0.10 0.40 0.00 0.00 0.00 178.15 178.81 2gk4 h ILE 32 N 0.42 0.95 -0.43 -0.67 2.04 -1.06 -0.97 117.51 117.79 2gk4 h ILE 32 Ca 0.12 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 65.93 2gk4 h ILE 32 Cb 0.12 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 2gk4 h ILE 32 CO -0.01 0.04 0.23 0.74 0.00 0.00 0.00 178.15 179.15 2gk4 h THR 33 N 0.22 1.01 -0.84 -0.27 2.02 -0.78 -1.02 112.91 113.24 2gk4 h THR 33 Ca 0.11 -0.16 0.02 0.00 0.77 0.00 0.00 66.41 67.15 2gk4 h THR 33 Cb 0.07 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 66.93 2gk4 h THR 33 CO -0.11 0.09 0.55 -0.33 0.37 0.00 0.00 175.52 176.09 2gk4 h GLU 34 N 0.47 1.07 -0.86 6.66 5.08 -0.93 -0.11 114.58 125.95 2gk4 h GLU 34 Ca 0.18 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 2gk4 h GLU 34 Cb 0.05 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 2gk4 h GLU 34 CO -0.11 0.71 0.42 1.15 -1.00 0.00 0.00 179.01 180.18 2gk4 h THR 35 N 1.10 1.26 -0.22 1.13 2.02 -0.51 -1.56 112.91 116.13 2gk4 h THR 35 Ca 0.32 -0.73 -0.20 0.00 0.77 0.00 0.00 66.41 66.58 2gk4 h THR 35 Cb -0.06 0.16 0.01 0.00 -1.74 0.00 0.00 68.15 66.51 2gk4 h THR 35 CO -0.09 0.32 -0.63 -0.07 0.37 0.00 0.00 175.52 175.42 2gk4 h LEU 36 N 1.23 0.93 -0.75 2.58 3.38 -0.75 -1.86 115.31 120.07 2gk4 h LEU 36 Ca 0.30 -0.58 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2gk4 h LEU 36 Cb 0.12 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 2gk4 h LEU 36 CO -0.04 1.35 0.42 -0.07 0.09 0.00 0.00 178.44 180.19 2gk4 h LEU 37 N 0.57 0.93 -1.39 1.67 3.38 -0.84 -1.87 115.31 117.75 2gk4 h LEU 37 Ca -0.02 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2gk4 h LEU 37 Cb 1.25 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 2gk4 h LEU 37 CO 0.13 0.75 -0.30 0.28 0.09 0.00 0.00 178.44 179.39 2gk4 h SER 38 N 1.03 0.00 0.28 -0.43 0.02 -1.22 -2.01 113.55 111.22 2gk4 h SER 38 Ca 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 2gk4 h SER 38 Cb 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2gk4 h SER 38 CO -0.04 0.30 0.00 0.00 -1.14 0.00 0.00 176.83 175.95 2gk4 n ALA 39 N -2.41 2.57 -0.13 3.77 0.00 -0.71 -4.91 120.51 118.69 2gk4 n ALA 39 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2gk4 n ALA 39 Cb 0.37 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2gk4 n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gk4 n GLY 40 N 1.10 0.70 3.81 0.00 0.00 -0.75 -5.07 105.19 104.97 2gk4 n GLY 40 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 2gk4 n GLY 40 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gk4 s TYR 41 N -2.16 3.13 -0.11 1.61 1.51 -0.78 -4.79 117.35 115.76 2gk4 s TYR 41 Ca 0.00 1.57 -0.23 0.00 -1.01 0.00 0.00 57.07 57.40 2gk4 s TYR 41 Cb 0.00 -2.97 -0.03 0.00 -0.11 0.00 0.00 41.96 38.85 2gk4 s TYR 41 CO 0.00 -0.59 0.70 -2.00 -1.11 0.00 0.00 175.55 172.54 2gk4 s GLU 42 N -3.37 4.36 -0.08 -0.62 2.12 -1.26 -4.38 118.70 115.47 2gk4 s GLU 42 Ca 0.65 0.83 0.04 0.00 0.36 0.00 0.00 54.97 56.84 2gk4 s GLU 42 Cb -0.13 -3.50 0.00 0.00 0.26 0.00 0.00 34.13 30.76 2gk4 s GLU 42 CO 0.20 -0.06 -0.20 0.08 -0.54 0.00 0.00 175.26 174.74 2gk4 s VAL 43 N 1.25 1.72 -0.28 3.70 1.01 -0.14 -0.31 120.40 127.35 2gk4 s VAL 43 Ca 0.35 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2gk4 s VAL 43 Cb -0.17 -1.50 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 2gk4 s VAL 43 CO 0.15 0.48 0.07 0.00 0.00 0.00 0.00 175.10 175.81 2gk4 s LEU 45 N 1.54 4.49 -0.34 0.00 2.96 0.07 -1.11 118.68 126.28 2gk4 s LEU 45 Ca 0.04 -0.54 -0.17 0.00 -0.22 0.00 0.00 54.13 53.24 2gk4 s LEU 45 Cb -0.16 -2.10 -0.01 0.00 0.50 0.00 0.00 46.19 44.42 2gk4 s LEU 45 CO 0.02 -0.26 0.47 -0.63 -1.32 0.00 0.00 176.35 174.64 2gk4 s ILE 46 N 1.68 5.06 0.10 6.68 -1.09 0.11 -0.78 121.20 132.96 2gk4 s ILE 46 Ca 0.05 0.31 0.01 0.00 -2.23 0.00 0.00 60.65 58.80 2gk4 s ILE 46 Cb -0.18 -3.92 -0.01 0.00 -1.58 0.00 0.00 42.46 36.78 2gk4 s ILE 46 CO 0.09 -0.16 0.11 1.07 -1.23 0.00 0.00 174.94 174.82 2gk4 n THR 47 N 5.36 0.00 -4.46 2.92 5.66 -0.31 -1.12 114.28 122.33 2gk4 n THR 47 Ca -0.06 -0.68 -0.23 0.00 -3.05 0.00 0.00 64.05 60.03 2gk4 n THR 47 Cb 0.49 0.36 -0.10 0.00 -1.55 0.00 0.00 70.33 69.53 2gk4 n THR 47 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2gk4 s THR 48 N -2.46 2.10 0.06 1.09 -4.23 -1.24 -0.52 115.64 110.44 2gk4 s THR 48 Ca 0.11 -2.25 -0.11 0.00 -1.18 0.00 0.00 61.69 58.26 2gk4 s THR 48 Cb 0.00 -2.40 -0.03 0.00 1.34 0.00 0.00 72.50 71.42 2gk4 s THR 48 CO 0.08 -0.35 0.94 1.17 -0.54 0.00 0.00 174.62 175.92 2gk4 n LYS 49 N -0.62 -0.16 -0.14 3.99 3.00 -1.26 -1.76 118.16 121.20 2gk4 n LYS 49 Ca -0.06 0.93 0.11 0.00 -0.00 0.00 0.00 58.31 59.30 2gk4 n LYS 49 Cb 0.62 -1.38 0.28 0.00 0.00 0.00 0.00 35.03 34.55 2gk4 n LYS 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2gk4 n ARG 50 N -3.83 2.12 -1.82 1.64 1.74 -1.26 -4.96 116.66 110.30 2gk4 n ARG 50 Ca 0.01 -1.69 -0.35 0.00 -0.77 0.00 0.00 57.85 55.05 2gk4 n ARG 50 Cb 0.10 -1.45 0.05 0.00 -1.02 0.00 0.00 32.46 30.14 2gk4 n ARG 50 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2gk4 s ALA 51 N -1.63 2.41 0.26 7.54 0.00 -0.72 -4.96 121.76 124.67 2gk4 s ALA 51 Ca 0.35 0.93 -0.30 0.00 0.00 0.00 0.00 51.96 52.94 2gk4 s ALA 51 Cb 0.20 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.78 2gk4 s ALA 51 CO 0.28 -1.38 1.35 -0.51 0.00 0.00 0.00 175.76 175.50 2gk4 s LEU 52 N -4.47 4.41 0.05 0.00 1.43 0.29 -4.93 118.68 115.46 2gk4 s LEU 52 Ca 0.76 2.59 0.09 0.00 -1.03 0.00 0.00 54.13 56.53 2gk4 s LEU 52 Cb -0.29 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.27 2gk4 s LEU 52 CO 0.38 -0.58 -0.24 -0.54 0.23 0.00 0.00 176.35 175.59 2gk4 s LYS 53 N -0.81 1.60 0.88 1.70 1.02 -1.26 -4.67 119.74 118.20 2gk4 s LYS 53 Ca 0.55 -1.06 -0.11 0.00 0.02 0.00 0.00 55.97 55.37 2gk4 s LYS 53 Cb -0.39 -1.77 0.12 0.00 -0.52 0.00 0.00 37.83 35.27 2gk4 s LYS 53 CO 0.45 0.45 1.10 -2.14 -0.92 0.00 0.00 175.35 174.30 2gk4 s PRO 54 N -1.27 1.38 0.61 -1.68 0.02 -1.26 -5.00 135.00 127.80 2gk4 s PRO 54 Ca 0.10 1.18 -0.18 0.00 0.02 0.00 0.00 61.00 62.11 2gk4 s PRO 54 Cb -0.09 -1.80 -0.03 0.00 0.02 0.00 0.00 34.50 32.60 2gk4 s PRO 54 CO 0.02 -2.26 1.21 -1.21 -0.33 0.00 0.00 177.00 174.44 2gk4 s GLU 55 N -4.80 2.88 0.44 5.54 0.41 -1.26 -4.95 118.70 116.96 2gk4 s GLU 55 Ca 0.64 1.84 -0.23 0.00 -0.41 0.00 0.00 54.97 56.80 2gk4 s GLU 55 Cb -0.20 -1.92 -0.10 0.00 -1.78 0.00 0.00 34.13 30.14 2gk4 s GLU 55 CO 0.58 -1.28 0.97 -2.30 -0.49 0.00 0.00 175.26 172.73 2gk4 n PRO 56 N -1.70 1.25 -3.74 0.39 -0.02 -1.26 -5.01 135.00 124.91 2gk4 n PRO 56 Ca 0.14 0.45 -0.13 0.00 -2.02 0.00 0.00 63.50 61.94 2gk4 n PRO 56 Cb 0.50 -2.01 -0.10 0.00 -0.02 0.00 0.00 33.50 31.86 2gk4 n PRO 56 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2gk4 s HIS 57 N -1.32 -0.41 0.62 6.00 2.46 -1.26 -5.04 115.29 116.34 2gk4 s HIS 57 Ca 0.64 1.00 0.33 0.00 0.47 0.00 0.00 55.06 57.50 2gk4 s HIS 57 Cb -0.54 0.14 1.89 0.00 -0.13 0.00 0.00 32.58 33.94 2gk4 s HIS 57 CO 0.56 -0.22 2.19 -1.00 -2.47 0.00 0.00 174.74 173.80 2gk4 h PRO 58 N 5.42 0.00 -0.64 2.88 0.13 -2.02 0.18 132.00 137.95 2gk4 h PRO 58 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2gk4 h PRO 58 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2gk4 h PRO 58 CO 0.27 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.13 2gk4 n ASN 59 N -3.56 4.00 -4.53 1.44 3.02 -1.26 -4.93 115.26 109.44 2gk4 n ASN 59 Ca -0.01 -2.13 -0.34 0.00 -0.03 0.00 0.00 54.58 52.07 2gk4 n ASN 59 Cb 0.20 -0.47 -0.12 0.00 -0.61 0.00 0.00 39.78 38.78 2gk4 n ASN 59 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2gk4 s LEU 60 N -1.25 3.28 0.06 3.41 2.96 0.05 -0.97 118.68 126.21 2gk4 s LEU 60 Ca 0.45 -0.09 0.06 0.00 -0.22 0.00 0.00 54.13 54.33 2gk4 s LEU 60 Cb 0.25 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 2gk4 s LEU 60 CO 0.28 0.21 -0.16 -0.94 -1.32 0.00 0.00 176.35 174.42 2gk4 s SER 61 N 0.12 1.89 -0.07 3.68 1.04 -0.72 -4.60 113.70 115.04 2gk4 s SER 61 Ca -0.01 -0.55 0.03 0.00 0.48 0.00 0.00 55.95 55.90 2gk4 s SER 61 Cb -0.14 -0.10 0.01 0.00 0.10 0.00 0.00 66.02 65.89 2gk4 s SER 61 CO 0.03 0.01 -0.15 -0.63 0.98 0.00 0.00 173.24 173.48 2gk4 s ILE 62 N -1.03 1.33 -0.18 -1.02 1.01 -1.26 -0.75 121.20 119.29 2gk4 s ILE 62 Ca 0.02 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.08 2gk4 s ILE 62 Cb -0.09 -1.19 0.03 0.00 0.01 0.00 0.00 42.46 41.22 2gk4 s ILE 62 CO 0.02 0.40 -0.14 -0.13 0.00 0.00 0.00 174.94 175.09 2gk4 s ARG 63 N 0.57 2.37 -0.06 2.79 0.52 0.04 -4.97 118.95 120.20 2gk4 s ARG 63 Ca -0.15 -0.75 -0.24 0.00 -0.52 0.00 0.00 55.73 54.07 2gk4 s ARG 63 Cb -0.16 -2.35 -0.03 0.00 0.52 0.00 0.00 34.95 32.92 2gk4 s ARG 63 CO 0.05 -0.31 0.74 -1.21 0.02 0.00 0.00 175.30 174.59 2gk4 s GLU 64 N 1.39 4.44 0.40 3.54 2.02 -1.26 -1.16 118.70 128.07 2gk4 s GLU 64 Ca 0.02 0.95 0.05 0.00 0.02 0.00 0.00 54.97 56.01 2gk4 s GLU 64 Cb -0.14 -3.46 -0.06 0.00 0.10 0.00 0.00 34.13 30.57 2gk4 s GLU 64 CO -0.10 0.03 0.03 0.96 0.02 0.00 0.00 175.26 176.20 2gk4 s ILE 65 N 0.90 1.47 -0.10 -1.63 -4.36 0.32 -4.94 121.20 112.87 2gk4 s ILE 65 Ca 0.39 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.77 2gk4 s ILE 65 Cb -0.18 -2.73 -0.06 0.00 1.25 0.00 0.00 42.46 40.74 2gk4 s ILE 65 CO 0.19 0.00 -0.10 0.41 0.24 0.00 0.00 174.94 175.68 2gk4 n THR 66 N -0.93 0.56 -4.31 8.37 -1.04 -1.26 -4.42 114.28 111.24 2gk4 n THR 66 Ca -0.07 -0.19 -0.21 0.00 -2.04 0.00 0.00 64.05 61.54 2gk4 n THR 66 Cb 0.67 -1.08 -0.08 0.00 -1.82 0.00 0.00 70.33 68.02 2gk4 n THR 66 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2gk4 s ASN 67 N -5.23 1.88 0.28 8.00 2.20 -1.26 -1.70 114.94 119.10 2gk4 s ASN 67 Ca -0.13 -1.78 -0.03 0.00 -0.94 0.00 0.00 52.86 49.98 2gk4 s ASN 67 Cb 0.04 0.57 0.38 0.00 -2.00 0.00 0.00 41.25 40.24 2gk4 s ASN 67 CO 0.21 -1.07 1.94 0.74 -2.94 0.00 0.00 177.10 175.99 2gk4 h THR 68 N 2.07 1.23 0.01 0.54 2.02 -1.97 -0.42 112.91 116.39 2gk4 h THR 68 Ca -0.25 -0.46 0.02 0.00 0.77 0.00 0.00 66.41 66.49 2gk4 h THR 68 Cb 1.24 -0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 2gk4 h THR 68 CO 0.37 0.23 -0.11 0.50 0.37 0.00 0.00 175.52 176.89 2gk4 h LYS 69 N 1.17 -0.18 -0.69 6.66 3.64 -1.96 0.42 116.57 125.63 2gk4 h LYS 69 Ca 0.31 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.80 2gk4 h LYS 69 Cb -0.09 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 31.69 2gk4 h LYS 69 CO -0.06 -0.12 0.32 -0.44 -2.27 0.00 0.00 179.45 176.87 2gk4 h ASP 70 N -0.19 0.38 -0.34 4.20 3.45 -1.80 -0.25 116.42 121.88 2gk4 h ASP 70 Ca 0.04 0.07 -0.07 0.00 0.43 0.00 0.00 57.03 57.50 2gk4 h ASP 70 Cb 0.23 0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 39.00 2gk4 h ASP 70 CO -0.10 0.21 -0.05 0.25 -1.57 0.00 0.00 179.24 177.98 2gk4 h LEU 71 N 0.54 0.63 -0.55 1.55 5.85 -0.64 -1.52 115.31 121.16 2gk4 h LEU 71 Ca 0.35 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2gk4 h LEU 71 Cb 0.40 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 2gk4 h LEU 71 CO -0.29 0.82 0.32 0.25 -0.34 0.00 0.00 178.44 179.20 2gk4 h LEU 72 N 0.42 0.50 -0.32 2.25 7.12 0.38 -2.79 115.31 122.87 2gk4 h LEU 72 Ca 0.09 0.01 0.03 0.00 0.13 0.00 0.00 57.88 58.14 2gk4 h LEU 72 Cb 0.53 -0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 40.53 2gk4 h LEU 72 CO 0.03 0.35 0.12 0.40 -0.13 0.00 0.00 178.44 179.21 2gk4 h ILE 73 N 0.63 0.93 0.00 4.05 2.04 -0.81 -2.34 117.51 122.00 2gk4 h ILE 73 Ca 0.23 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 66.00 2gk4 h ILE 73 Cb 0.06 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 2gk4 h ILE 73 CO -0.12 0.05 0.00 -0.62 0.00 0.00 0.00 178.15 177.46 2gk4 n GLU 74 N -5.01 0.00 0.00 2.37 -0.58 -0.59 -1.45 120.64 115.37 2gk4 n GLU 74 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2gk4 n GLU 74 Cb 0.11 -1.02 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 2gk4 n GLU 74 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2gk4 n GLN 76 N 0.53 0.00 -0.03 3.49 6.02 -0.88 -0.44 117.38 126.07 2gk4 n GLN 76 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 2gk4 n GLN 76 Cb 0.00 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.18 2gk4 n GLN 76 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 2gk4 h GLU 77 N 0.00 0.18 0.00 -1.09 4.81 -1.52 -3.40 114.58 113.56 2gk4 h GLU 77 Ca 0.00 -0.08 -0.32 0.00 -0.13 0.00 0.00 59.36 58.83 2gk4 h GLU 77 Cb 0.00 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.31 2gk4 h GLU 77 CO 0.00 0.55 -2.30 0.54 -0.73 0.00 0.00 179.01 177.07 2gk4 n ARG 78 N -4.74 0.80 -0.33 1.92 1.74 0.41 -4.64 116.66 111.83 2gk4 n ARG 78 Ca -0.07 -0.03 0.07 0.00 -0.77 0.00 0.00 57.85 57.05 2gk4 n ARG 78 Cb 0.27 -1.50 0.23 0.00 -1.02 0.00 0.00 32.46 30.44 2gk4 n ARG 78 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2gk4 h VAL 79 N 0.00 0.84 0.00 1.55 2.07 -1.77 0.14 116.25 119.08 2gk4 h VAL 79 Ca -0.48 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.76 2gk4 h VAL 79 Cb 2.08 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2gk4 h VAL 79 CO 0.03 0.15 0.00 1.56 0.02 0.00 0.00 177.57 179.33 2gk4 h GLN 80 N 0.82 0.00 -0.02 1.57 4.20 -1.83 -2.83 115.11 117.02 2gk4 h GLN 80 Ca 0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.19 2gk4 h GLN 80 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2gk4 h GLN 80 CO -0.30 0.00 -0.28 -0.25 -0.67 0.00 0.00 178.83 177.33 2gk4 n ASP 81 N -2.73 1.96 -4.38 1.46 8.00 0.48 -4.96 116.55 116.39 2gk4 n ASP 81 Ca -0.02 -1.48 -0.29 0.00 0.71 0.00 0.00 54.79 53.71 2gk4 n ASP 81 Cb 0.10 0.25 -0.13 0.00 -0.02 0.00 0.00 41.12 41.32 2gk4 n ASP 81 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2gk4 s TYR 82 N -2.33 2.31 -0.94 1.24 1.51 -1.07 -4.87 117.35 113.19 2gk4 s TYR 82 Ca 0.24 -0.39 0.22 0.00 -1.01 0.00 0.00 57.07 56.13 2gk4 s TYR 82 Cb 0.19 -1.28 -0.02 0.00 -0.11 0.00 0.00 41.96 40.74 2gk4 s TYR 82 CO 0.48 0.29 1.03 1.04 -1.11 0.00 0.00 175.55 177.28 2gk4 n GLN 83 N 1.09 0.04 -3.80 -0.62 3.00 -0.30 -4.76 117.38 112.03 2gk4 n GLN 83 Ca -0.18 -0.01 -0.13 0.00 -0.01 0.00 0.00 57.00 56.68 2gk4 n GLN 83 Cb 0.53 -1.51 -0.12 0.00 0.00 0.00 0.00 30.24 29.14 2gk4 n GLN 83 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2gk4 s VAL 84 N -3.03 -0.00 -0.08 5.09 1.01 -1.21 -1.56 120.40 120.62 2gk4 s VAL 84 Ca 0.08 0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.08 2gk4 s VAL 84 Cb 0.16 -0.30 0.01 0.00 0.00 0.00 0.00 36.38 36.25 2gk4 s VAL 84 CO 0.82 0.00 -0.13 -0.22 0.00 0.00 0.00 175.10 175.57 2gk4 s LEU 85 N 0.14 1.64 -0.30 3.92 2.96 -0.21 -0.52 118.68 126.31 2gk4 s LEU 85 Ca -0.00 -0.35 0.02 0.00 -0.22 0.00 0.00 54.13 53.58 2gk4 s LEU 85 Cb -0.02 -0.93 0.07 0.00 0.50 0.00 0.00 46.19 45.81 2gk4 s LEU 85 CO 0.00 0.02 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.39 2gk4 s ILE 86 N 0.85 2.42 -0.56 6.68 1.01 0.35 -0.77 121.20 131.17 2gk4 s ILE 86 Ca -0.11 -1.78 -0.15 0.00 0.00 0.00 0.00 60.65 58.61 2gk4 s ILE 86 Cb -0.15 -2.52 0.14 0.00 0.01 0.00 0.00 42.46 39.94 2gk4 s ILE 86 CO 0.01 -0.22 0.51 -2.28 0.00 0.00 0.00 174.94 172.96 2gk4 s HIS 87 N 1.09 3.30 -0.67 3.97 2.46 0.12 -0.90 115.29 124.65 2gk4 s HIS 87 Ca -0.03 -1.39 -0.02 0.00 0.47 0.00 0.00 55.06 54.09 2gk4 s HIS 87 Cb -0.20 -3.78 0.17 0.00 -0.13 0.00 0.00 32.58 28.65 2gk4 s HIS 87 CO -0.05 -1.02 0.49 -1.54 -2.47 0.00 0.00 174.74 170.16 2gk4 s SER 88 N 3.41 5.31 -0.11 9.88 1.04 -0.78 -3.52 113.70 128.93 2gk4 s SER 88 Ca 0.04 -3.04 -0.00 0.00 0.48 0.00 0.00 55.95 53.43 2gk4 s SER 88 Cb -0.28 -1.85 0.02 0.00 0.10 0.00 0.00 66.02 64.01 2gk4 s SER 88 CO 0.02 -0.32 -0.09 0.00 0.98 0.00 0.00 173.24 173.82 2gk4 s ALA 90 N -0.34 1.40 -0.03 5.32 0.00 0.10 -4.55 121.76 123.66 2gk4 s ALA 90 Ca 0.19 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.59 2gk4 s ALA 90 Cb -0.18 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.05 2gk4 s ALA 90 CO -0.05 -0.36 -0.10 0.08 0.00 0.00 0.00 175.76 175.34 2gk4 s VAL 91 N 1.57 0.84 0.12 0.00 1.01 -1.26 -1.91 120.40 120.76 2gk4 s VAL 91 Ca 0.03 -0.38 -0.31 0.00 0.00 0.00 0.00 61.98 61.33 2gk4 s VAL 91 Cb -0.13 -0.75 -0.07 0.00 0.00 0.00 0.00 36.38 35.43 2gk4 s VAL 91 CO -0.07 0.26 1.26 -0.55 0.00 0.00 0.00 175.10 176.00 2gk4 s SER 92 N 0.27 6.99 0.18 3.32 0.15 -1.26 -4.89 113.70 118.47 2gk4 s SER 92 Ca -0.05 2.19 0.22 0.00 0.70 0.00 0.00 55.95 59.01 2gk4 s SER 92 Cb -0.10 -2.59 0.89 0.00 -1.71 0.00 0.00 66.02 62.51 2gk4 s SER 92 CO 0.01 -0.51 1.68 0.47 1.20 0.00 0.00 173.24 176.09 2gk4 n ASP 93 N 3.50 0.50 -4.21 5.45 10.43 -1.26 -4.69 116.55 126.28 2gk4 n ASP 93 Ca 0.08 0.60 -0.27 0.00 2.57 0.00 0.00 54.79 57.77 2gk4 n ASP 93 Cb 0.44 -0.72 -0.16 0.00 1.84 0.00 0.00 41.12 42.53 2gk4 n ASP 93 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 2gk4 s TYR 94 N -3.19 1.90 -0.12 1.24 1.51 -1.26 -0.82 117.35 116.60 2gk4 s TYR 94 Ca 0.06 -0.43 -0.02 0.00 -1.01 0.00 0.00 57.07 55.67 2gk4 s TYR 94 Cb 0.10 -1.24 -0.03 0.00 -0.11 0.00 0.00 41.96 40.69 2gk4 s TYR 94 CO 0.40 -0.09 -0.06 -0.08 -1.11 0.00 0.00 175.55 174.61 2gk4 s THR 95 N -0.31 3.70 0.26 -0.71 -1.32 0.12 -4.85 115.64 112.53 2gk4 s THR 95 Ca 0.04 -0.44 -0.30 0.00 -1.21 0.00 0.00 61.69 59.77 2gk4 s THR 95 Cb -0.10 -2.57 -0.11 0.00 -1.51 0.00 0.00 72.50 68.21 2gk4 s THR 95 CO 0.01 0.54 1.57 -2.16 -2.21 0.00 0.00 174.62 172.36 2gk4 s PRO 96 N -0.06 4.16 -0.06 7.08 0.04 -1.26 -0.84 135.00 144.06 2gk4 s PRO 96 Ca 0.01 2.50 -0.02 0.00 0.04 0.00 0.00 61.00 63.53 2gk4 s PRO 96 Cb -0.13 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.31 2gk4 s PRO 96 CO 0.03 -0.60 -0.07 0.28 0.04 0.00 0.00 177.00 176.68 2gk4 n VAL 97 N 2.58 0.35 -3.40 -0.36 0.31 0.92 -4.88 118.33 113.85 2gk4 n VAL 97 Ca 0.09 -0.11 -0.02 0.00 -0.01 0.00 0.00 64.34 64.30 2gk4 n VAL 97 Cb 0.38 -1.28 -0.00 0.00 -0.91 0.00 0.00 33.84 32.03 2gk4 n VAL 97 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gk4 n TYR 98 N -3.07 -0.83 0.00 3.52 4.19 -1.14 -5.01 117.16 114.81 2gk4 n TYR 98 Ca -0.12 -0.28 0.00 0.00 3.31 0.00 0.00 57.90 60.81 2gk4 n TYR 98 Cb 0.60 0.09 0.00 0.00 0.49 0.00 0.00 39.34 40.52 2gk4 n TYR 98 CO 0.00 0.00 0.00 -2.37 0.91 0.00 0.00 176.86 175.40 2gk4 n THR 100 N -0.07 0.00 -2.24 2.97 5.66 -0.45 -0.61 114.28 119.54 2gk4 n THR 100 Ca -0.00 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.64 2gk4 n THR 100 Cb 0.08 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.86 2gk4 n THR 100 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2gk4 s GLY 101 N 0.00 2.67 0.33 1.09 0.00 -1.26 -0.15 107.32 110.00 2gk4 s GLY 101 Ca 0.00 0.86 0.04 0.00 0.00 0.00 0.00 44.72 45.63 2gk4 s GLY 101 CO 0.00 1.24 1.91 -2.00 0.00 0.00 0.00 173.10 174.25 2gk4 h LEU 102 N 1.32 0.77 -0.94 0.66 5.85 -1.64 -2.84 115.31 118.48 2gk4 h LEU 102 Ca -0.50 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.19 2gk4 h LEU 102 Cb 1.26 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 2gk4 h LEU 102 CO 0.57 0.46 0.22 -0.33 -0.34 0.00 0.00 178.44 179.03 2gk4 h GLU 103 N 0.86 0.99 -0.71 1.25 5.08 -1.92 0.38 114.58 120.50 2gk4 h GLU 103 Ca 0.39 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 2gk4 h GLU 103 Cb 0.38 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2gk4 h GLU 103 CO -0.16 0.84 0.25 1.49 -1.00 0.00 0.00 179.01 180.43 2gk4 h GLU 104 N 0.96 1.09 -0.23 2.33 4.81 -1.90 -1.02 114.58 120.62 2gk4 h GLU 104 Ca 0.22 -0.22 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2gk4 h GLU 104 Cb 0.25 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2gk4 h GLU 104 CO -0.01 0.92 -0.08 0.28 -0.73 0.00 0.00 179.01 179.39 2gk4 h VAL 105 N 1.04 1.29 -0.81 0.32 2.07 -1.19 -2.81 116.25 116.16 2gk4 h VAL 105 Ca 0.23 -1.12 0.06 0.00 0.82 0.00 0.00 66.70 66.70 2gk4 h VAL 105 Cb 0.26 1.55 -0.06 0.00 -1.52 0.00 0.00 31.29 31.53 2gk4 h VAL 105 CO -0.01 0.34 0.49 -0.61 0.02 0.00 0.00 177.57 177.80 2gk4 h GLN 106 N 0.18 0.87 0.00 1.57 5.75 -0.16 -2.44 115.11 120.88 2gk4 h GLN 106 Ca 0.05 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 58.46 2gk4 h GLN 106 Cb 0.56 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 2gk4 h GLN 106 CO 0.03 0.57 -0.19 0.00 -2.65 0.00 0.00 178.83 176.59 2gk4 h ALA 107 N 1.40 1.15 -2.75 3.38 0.00 -1.01 -3.45 119.26 117.99 2gk4 h ALA 107 Ca 0.36 -0.18 -0.53 0.00 0.00 0.00 0.00 54.91 54.57 2gk4 h ALA 107 Cb 0.19 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 18.01 2gk4 h ALA 107 CO -0.18 0.24 0.82 0.45 0.00 0.00 0.00 179.25 180.58 2gk4 s SER 108 N -6.22 6.55 0.00 0.00 0.15 -0.92 -4.91 113.70 108.35 2gk4 s SER 108 Ca -0.01 2.76 0.28 0.00 0.70 0.00 0.00 55.95 59.67 2gk4 s SER 108 Cb 0.12 -2.62 1.02 0.00 -1.71 0.00 0.00 66.02 62.83 2gk4 s SER 108 CO 0.62 -0.79 1.73 -1.54 1.20 0.00 0.00 173.24 174.46 2gk4 n SER 109 N 2.52 0.75 -3.17 5.45 3.41 -1.26 -4.78 113.62 116.54 2gk4 n SER 109 Ca 0.08 -0.75 0.03 0.00 -0.26 0.00 0.00 58.87 57.97 2gk4 n SER 109 Cb 0.39 0.02 -0.01 0.00 -0.26 0.00 0.00 64.21 64.35 2gk4 n SER 109 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2gk4 s ASN 110 N -2.46 -1.34 0.46 4.04 2.47 -1.26 -5.05 114.94 111.79 2gk4 s ASN 110 Ca 0.27 0.46 0.24 0.00 0.42 0.00 0.00 52.86 54.25 2gk4 s ASN 110 Cb 0.20 2.01 1.06 0.00 -1.45 0.00 0.00 41.25 43.07 2gk4 s ASN 110 CO 0.49 -0.29 1.90 -0.07 -3.72 0.00 0.00 177.10 175.41 2gk4 h LEU 111 N 8.02 0.00 -0.97 3.21 4.07 -1.94 -2.62 115.31 125.07 2gk4 h LEU 111 Ca -0.12 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.84 2gk4 h LEU 111 Cb 1.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.91 2gk4 h LEU 111 CO 0.21 0.22 0.00 0.29 -1.08 0.00 0.00 178.44 178.08 2gk4 n LYS 112 N -3.55 0.11 -0.21 1.13 4.76 -1.26 -2.02 118.16 117.13 2gk4 n LYS 112 Ca -0.01 0.56 -0.03 0.00 -2.87 0.00 0.00 58.31 55.97 2gk4 n LYS 112 Cb 0.37 -1.83 0.17 0.00 -1.84 0.00 0.00 35.03 31.90 2gk4 n LYS 112 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 2gk4 h GLU 113 N 0.00 1.00 0.00 1.97 4.11 -1.90 -2.94 114.58 116.81 2gk4 h GLU 113 Ca 0.00 -0.15 0.00 0.00 0.07 0.00 0.00 59.36 59.28 2gk4 h GLU 113 Cb 0.06 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2gk4 h GLU 113 CO 0.00 0.79 0.00 1.19 0.07 0.00 0.00 179.01 181.06 2gk4 n PHE 114 N -4.32 0.00 1.37 2.06 3.01 -0.86 -2.92 117.46 115.80 2gk4 n PHE 114 Ca 0.06 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.65 2gk4 n PHE 114 Cb 0.15 -0.16 0.45 0.00 -0.01 0.00 0.00 39.48 39.91 2gk4 n PHE 114 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2gk4 n LEU 115 N -1.16 1.73 0.00 4.37 4.77 -1.11 -4.52 117.00 121.08 2gk4 n LEU 115 Ca 0.10 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 2gk4 n LEU 115 Cb 0.10 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2gk4 n LEU 115 CO 0.12 0.31 0.13 -1.54 -1.33 0.00 0.00 177.39 175.08 2gk4 n SER 116 N 0.35 0.53 0.00 -1.43 3.41 -1.15 -5.04 113.62 110.29 2gk4 n SER 116 Ca 0.18 -0.77 0.00 0.00 -0.26 0.00 0.00 58.87 58.02 2gk4 n SER 116 Cb 0.38 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.70 2gk4 n SER 116 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2gk4 n ASP 128 N -0.37 2.39 0.17 4.04 -0.08 -1.26 -5.10 116.55 116.34 2gk4 n ASP 128 Ca 0.00 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.31 2gk4 n ASP 128 Cb 0.01 0.42 0.31 0.00 2.34 0.00 0.00 41.12 44.20 2gk4 n ASP 128 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2gk4 h GLU 129 N 0.00 0.00 -4.81 -0.67 4.57 -2.01 -3.44 114.58 108.22 2gk4 h GLU 129 Ca 0.00 0.00 -0.45 0.00 -1.18 0.00 0.00 59.36 57.73 2gk4 h GLU 129 Cb 0.12 0.00 -0.30 0.00 -0.16 0.00 0.00 28.75 28.41 2gk4 h GLU 129 CO 0.00 0.44 -0.80 0.08 -1.18 0.00 0.00 179.01 177.55 2gk4 s VAL 130 N -3.75 0.91 0.18 0.32 1.01 -1.26 -5.10 120.40 112.71 2gk4 s VAL 130 Ca -0.01 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 61.59 2gk4 s VAL 130 Cb 0.12 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 2gk4 s VAL 130 CO 0.71 0.27 -0.00 -1.10 0.00 0.00 0.00 175.10 174.98 2gk4 s GLN 131 N 0.04 2.40 -0.08 2.72 -1.52 -1.26 -1.69 119.66 120.27 2gk4 s GLN 131 Ca -0.01 -1.12 0.01 0.00 -1.95 0.00 0.00 55.36 52.29 2gk4 s GLN 131 Cb -0.08 -2.35 0.02 0.00 -0.22 0.00 0.00 33.01 30.38 2gk4 s GLN 131 CO 0.00 0.45 -0.10 0.08 -0.25 0.00 0.00 175.29 175.48 2gk4 s VAL 132 N -1.75 1.01 -0.18 1.09 1.01 0.78 -4.81 120.40 117.55 2gk4 s VAL 132 Ca 0.28 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 2gk4 s VAL 132 Cb -0.09 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.30 2gk4 s VAL 132 CO 0.19 0.34 -0.07 -0.22 0.00 0.00 0.00 175.10 175.34 2gk4 s LEU 133 N 1.05 2.87 -0.18 3.92 0.20 -1.26 -1.35 118.68 123.94 2gk4 s LEU 133 Ca -0.08 -0.34 -0.12 0.00 0.69 0.00 0.00 54.13 54.28 2gk4 s LEU 133 Cb -0.15 -1.70 -0.05 0.00 -0.43 0.00 0.00 46.19 43.86 2gk4 s LEU 133 CO -0.01 0.06 0.22 -0.36 -0.29 0.00 0.00 176.35 175.97 2gk4 s PHE 134 N 1.00 3.44 -0.01 5.38 0.40 0.22 -5.00 117.98 123.41 2gk4 s PHE 134 Ca -0.00 0.48 0.07 0.00 -0.60 0.00 0.00 56.93 56.88 2gk4 s PHE 134 Cb -0.15 -2.26 -0.02 0.00 0.51 0.00 0.00 43.02 41.10 2gk4 s PHE 134 CO -0.00 0.26 -0.22 -0.51 0.70 0.00 0.00 175.22 175.45 2gk4 s LEU 135 N 0.43 2.06 0.16 -0.37 1.02 -1.26 -0.05 118.68 120.66 2gk4 s LEU 135 Ca 0.13 -0.41 0.07 0.00 0.02 0.00 0.00 54.13 53.94 2gk4 s LEU 135 Cb -0.12 -1.11 -0.04 0.00 0.02 0.00 0.00 46.19 44.94 2gk4 s LEU 135 CO 0.01 0.26 -0.04 -1.59 0.02 0.00 0.00 176.35 175.01 2gk4 s LYS 136 N -0.60 2.29 0.11 1.70 -2.85 -0.02 -4.80 119.74 115.58 2gk4 s LYS 136 Ca 0.08 -1.11 -0.36 0.00 -1.00 0.00 0.00 55.97 53.59 2gk4 s LYS 136 Cb -0.08 -2.32 -0.16 0.00 -2.06 0.00 0.00 37.83 33.21 2gk4 s LYS 136 CO -0.00 0.47 1.39 1.17 0.10 0.00 0.00 175.35 178.47 2gk4 n LYS 137 N 0.12 1.42 0.07 1.78 4.81 -1.26 0.13 118.16 125.22 2gk4 n LYS 137 Ca -0.11 0.51 -0.19 0.00 -0.87 0.00 0.00 58.31 57.65 2gk4 n LYS 137 Cb 0.54 -2.18 -0.10 0.00 0.02 0.00 0.00 35.03 33.32 2gk4 n LYS 137 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 2gk4 h THR 138 N 3.35 1.32 0.00 3.15 1.35 -1.30 -3.44 112.91 117.34 2gk4 h THR 138 Ca -0.47 -2.42 0.00 0.00 -0.55 0.00 0.00 66.41 62.97 2gk4 h THR 138 Cb 1.31 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 70.28 2gk4 h THR 138 CO 0.80 0.74 0.00 -2.65 -0.25 0.00 0.00 175.52 174.16 2gk4 n PRO 139 N -3.78 0.00 0.00 4.72 -0.02 -1.26 -5.04 135.00 129.61 2gk4 n PRO 139 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 2gk4 n PRO 139 Cb 0.92 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.40 2gk4 n PRO 139 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 2gk4 n ILE 141 N 0.00 0.00 0.17 4.25 0.13 -1.26 -5.05 119.36 117.60 2gk4 n ILE 141 Ca 0.00 0.00 0.12 0.00 -1.10 0.00 0.00 62.75 61.77 2gk4 n ILE 141 Cb 0.00 0.00 0.66 0.00 -0.84 0.00 0.00 39.64 39.46 2gk4 n ILE 141 CO 0.00 0.00 0.00 -0.29 2.80 0.00 0.00 176.55 179.06 2gk4 h ILE 142 N 0.70 0.90 0.00 9.51 -0.00 -2.00 -2.43 117.51 124.19 2gk4 h ILE 142 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 2gk4 h ILE 142 Cb 0.00 0.91 0.00 0.00 -0.00 0.00 0.00 36.82 37.73 2gk4 h ILE 142 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 178.15 176.61 2gk4 n SER 143 N -4.47 0.11 0.00 2.19 3.41 -1.26 -1.83 113.62 111.78 2gk4 n SER 143 Ca 0.01 0.53 0.11 0.00 -0.26 0.00 0.00 58.87 59.26 2gk4 n SER 143 Cb 0.27 -0.55 -0.08 0.00 -0.26 0.00 0.00 64.21 63.59 2gk4 n SER 143 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2gk4 n LEU 144 N -1.62 0.69 -0.19 1.04 4.77 -0.91 -4.53 117.00 116.24 2gk4 n LEU 144 Ca 0.03 -0.27 -0.02 0.00 -0.03 0.00 0.00 56.01 55.71 2gk4 n LEU 144 Cb 0.15 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.28 2gk4 n LEU 144 CO 0.12 0.15 1.02 0.58 -1.33 0.00 0.00 177.39 177.93 2gk4 h VAL 145 N 0.00 0.89 0.00 4.08 2.07 -1.44 -2.18 116.25 119.67 2gk4 h VAL 145 Ca 0.00 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 2gk4 h VAL 145 Cb 0.65 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2gk4 h VAL 145 CO 0.00 0.09 -0.01 0.11 0.02 0.00 0.00 177.57 177.78 2gk4 h LYS 146 N 0.49 0.00 0.09 1.57 1.79 -1.79 0.42 116.57 119.15 2gk4 h LYS 146 Ca 0.27 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.73 2gk4 h LYS 146 Cb 0.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 2gk4 h LYS 146 CO -0.22 0.01 -0.04 0.93 -1.08 0.00 0.00 179.45 179.05 2gk4 h GLU 147 N 0.00 -0.12 -0.03 3.15 4.39 -1.68 -2.20 114.58 118.10 2gk4 h GLU 147 Ca -0.00 0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.57 2gk4 h GLU 147 Cb 0.49 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 2gk4 h GLU 147 CO 0.00 0.25 -0.62 -1.49 -1.16 0.00 0.00 179.01 175.99 2gk4 h TRP 148 N -0.51 0.12 -1.83 4.33 6.55 -0.93 -3.39 115.95 120.29 2gk4 h TRP 148 Ca -0.01 -0.05 -0.39 0.00 0.95 0.00 0.00 58.89 59.39 2gk4 h TRP 148 Cb 0.42 -0.02 -0.29 0.00 -0.86 0.00 0.00 29.16 28.41 2gk4 h TRP 148 CO 0.05 0.69 -0.75 1.21 -1.05 0.00 0.00 178.44 178.59 2gk4 s ASN 149 N -6.87 0.47 0.14 -3.49 3.84 0.08 -4.72 114.94 104.40 2gk4 s ASN 149 Ca -0.02 -2.22 0.14 0.00 0.21 0.00 0.00 52.86 50.96 2gk4 s ASN 149 Cb 0.12 0.56 0.66 0.00 -0.55 0.00 0.00 41.25 42.04 2gk4 s ASN 149 CO 0.78 -0.16 1.43 -0.81 -2.79 0.00 0.00 177.10 175.54 2gk4 n PRO 150 N 3.30 0.08 0.00 0.43 -0.04 -0.83 -1.25 135.00 136.69 2gk4 n PRO 150 Ca 0.21 0.47 0.11 0.00 -0.04 0.00 0.00 63.50 64.25 2gk4 n PRO 150 Cb 0.49 -1.71 0.02 0.00 -0.04 0.00 0.00 33.50 32.27 2gk4 n PRO 150 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2gk4 n THR 151 N -1.86 0.00 -1.77 0.52 -2.24 -1.26 -4.95 114.28 102.71 2gk4 n THR 151 Ca 0.01 -0.33 -0.41 0.00 -2.27 0.00 0.00 64.05 61.05 2gk4 n THR 151 Cb 0.09 1.32 0.01 0.00 -2.10 0.00 0.00 70.33 69.65 2gk4 n THR 151 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gk4 n ILE 152 N 0.35 2.29 -2.84 2.28 3.06 -0.38 -4.95 119.36 119.16 2gk4 n ILE 152 Ca 0.10 -0.50 -0.42 0.00 -2.50 0.00 0.00 62.75 59.43 2gk4 n ILE 152 Cb 0.50 -1.92 -0.04 0.00 0.54 0.00 0.00 39.64 38.72 2gk4 n ILE 152 CO 0.00 0.00 0.00 -2.28 -2.50 0.00 0.00 176.55 171.77 2gk4 s HIS 153 N -1.15 3.12 -0.25 9.51 5.65 -0.60 -4.97 115.29 126.61 2gk4 s HIS 153 Ca 0.56 0.80 -0.05 0.00 0.25 0.00 0.00 55.06 56.62 2gk4 s HIS 153 Cb -0.47 -3.50 0.00 0.00 -1.18 0.00 0.00 32.58 27.43 2gk4 s HIS 153 CO 0.62 -0.74 0.01 -1.17 -0.65 0.00 0.00 174.74 172.81 2gk4 s LEU 154 N 3.30 3.35 -0.12 8.88 2.96 -1.26 -1.04 118.68 134.74 2gk4 s LEU 154 Ca 0.36 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.74 2gk4 s LEU 154 Cb -0.13 -1.80 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 2gk4 s LEU 154 CO 0.16 -0.10 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.26 2gk4 s ILE 155 N 1.48 2.36 0.38 6.68 1.09 0.05 -0.60 121.20 132.64 2gk4 s ILE 155 Ca 0.04 -0.90 0.04 0.00 -1.10 0.00 0.00 60.65 58.72 2gk4 s ILE 155 Cb -0.16 -1.95 -0.04 0.00 -1.06 0.00 0.00 42.46 39.25 2gk4 s ILE 155 CO -0.01 0.54 0.08 -0.83 -0.10 0.00 0.00 174.94 174.63 2gk4 s GLY 156 N 0.52 2.42 0.19 6.18 0.00 -0.68 -0.71 107.32 115.25 2gk4 s GLY 156 Ca -0.13 -1.52 0.09 0.00 0.00 0.00 0.00 44.72 43.15 2gk4 s GLY 156 CO 0.05 -1.87 -0.17 -1.36 0.00 0.00 0.00 173.10 169.74 2gk4 s PHE 157 N -3.20 1.83 -0.08 1.90 0.40 -1.23 -0.60 117.98 117.00 2gk4 s PHE 157 Ca 0.28 -0.49 -0.02 0.00 -0.60 0.00 0.00 56.93 56.10 2gk4 s PHE 157 Cb 0.05 -0.88 0.03 0.00 0.51 0.00 0.00 43.02 42.74 2gk4 s PHE 157 CO 0.14 0.38 0.03 0.21 0.70 0.00 0.00 175.22 176.67 2gk4 s LYS 158 N -3.14 0.41 -0.26 0.44 2.47 -0.65 -4.87 119.74 114.13 2gk4 s LYS 158 Ca 0.19 0.11 -0.04 0.00 -1.56 0.00 0.00 55.97 54.67 2gk4 s LYS 158 Cb -0.04 -1.04 0.01 0.00 -1.46 0.00 0.00 37.83 35.30 2gk4 s LYS 158 CO 0.07 -0.37 0.01 -1.17 0.16 0.00 0.00 175.35 174.05 2gk4 s LEU 159 N 2.02 3.38 0.50 5.43 2.96 -1.26 -0.78 118.68 130.93 2gk4 s LEU 159 Ca 0.04 -0.65 0.04 0.00 -0.22 0.00 0.00 54.13 53.34 2gk4 s LEU 159 Cb -0.13 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.77 2gk4 s LEU 159 CO -0.05 -0.12 0.15 -0.76 -1.32 0.00 0.00 176.35 174.25 2gk4 s LEU 160 N 1.45 2.59 -0.12 -0.68 1.43 -0.60 -4.98 118.68 117.77 2gk4 s LEU 160 Ca 0.03 -1.42 -0.01 0.00 -1.03 0.00 0.00 54.13 51.70 2gk4 s LEU 160 Cb -0.16 -1.00 0.03 0.00 0.03 0.00 0.00 46.19 45.10 2gk4 s LEU 160 CO -0.01 -0.85 -0.02 -0.69 0.23 0.00 0.00 176.35 175.01 2gk4 s VAL 161 N -2.79 0.66 -1.12 -1.59 1.01 -1.26 -1.00 120.40 114.32 2gk4 s VAL 161 Ca 0.22 -0.20 -0.13 0.00 0.00 0.00 0.00 61.98 61.88 2gk4 s VAL 161 Cb 0.01 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2gk4 s VAL 161 CO 0.13 0.19 0.84 -0.67 0.00 0.00 0.00 175.10 175.58 2gk4 n ASP 162 N 5.04 -5.39 -4.49 3.32 2.03 -1.26 -5.00 116.55 110.80 2gk4 n ASP 162 Ca -0.09 -0.87 -0.24 0.00 0.52 0.00 0.00 54.79 54.11 2gk4 n ASP 162 Cb 0.49 -4.20 -0.10 0.00 -0.72 0.00 0.00 41.12 36.59 2gk4 n ASP 162 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2gk4 s VAL 163 N -3.45 2.09 0.58 5.18 -7.23 -1.26 -5.14 120.40 111.17 2gk4 s VAL 163 Ca 0.42 -2.21 -0.17 0.00 -1.81 0.00 0.00 61.98 58.20 2gk4 s VAL 163 Cb -0.11 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2gk4 s VAL 163 CO 0.81 -0.27 1.09 0.42 -0.31 0.00 0.00 175.10 176.83 2gk4 s THR 164 N -2.72 3.49 0.37 5.32 -4.23 -1.26 -4.88 115.64 111.74 2gk4 s THR 164 Ca 0.31 0.79 0.17 0.00 -1.18 0.00 0.00 61.69 61.79 2gk4 s THR 164 Cb 0.02 -3.30 0.17 0.00 1.34 0.00 0.00 72.50 70.73 2gk4 s THR 164 CO 0.15 -0.33 1.91 -0.33 -0.54 0.00 0.00 174.62 175.48 2gk4 h GLU 165 N 0.72 0.00 -0.64 3.99 5.08 -2.00 -0.78 114.58 120.96 2gk4 h GLU 165 Ca -0.48 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.83 2gk4 h GLU 165 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 2gk4 h GLU 165 CO 0.57 0.27 0.21 -0.44 -1.00 0.00 0.00 179.01 178.61 2gk4 h ASP 166 N 0.00 0.93 -0.45 1.42 3.32 -2.00 -1.37 116.42 118.28 2gk4 h ASP 166 Ca -0.00 -0.20 -0.07 0.00 0.02 0.00 0.00 57.03 56.78 2gk4 h ASP 166 Cb 0.54 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 2gk4 h ASP 166 CO 0.04 0.88 0.01 -0.74 -1.72 0.00 0.00 179.24 177.71 2gk4 h HIS 167 N 0.92 0.84 -0.17 4.55 2.76 -1.82 -0.76 115.15 121.47 2gk4 h HIS 167 Ca 0.21 -0.14 0.04 0.00 -2.20 0.00 0.00 60.37 58.27 2gk4 h HIS 167 Cb 0.28 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 28.98 2gk4 h HIS 167 CO 0.02 0.82 -0.06 1.25 -1.30 0.00 0.00 177.93 178.66 2gk4 h LEU 168 N 0.62 -0.21 -0.63 0.26 5.85 -0.87 0.05 115.31 120.38 2gk4 h LEU 168 Ca 0.13 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2gk4 h LEU 168 Cb 0.47 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2gk4 h LEU 168 CO 0.02 -0.08 0.38 0.58 -0.34 0.00 0.00 178.44 179.00 2gk4 h VAL 169 N -0.03 1.18 -0.46 1.05 2.07 -1.14 -0.68 116.25 118.25 2gk4 h VAL 169 Ca 0.09 -0.41 0.02 0.00 0.82 0.00 0.00 66.70 67.22 2gk4 h VAL 169 Cb 0.16 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2gk4 h VAL 169 CO -0.19 0.19 0.28 0.44 0.02 0.00 0.00 177.57 178.30 2gk4 h ASP 170 N 0.85 0.46 -0.33 0.57 3.32 -0.75 0.16 116.42 120.70 2gk4 h ASP 170 Ca 0.23 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.22 2gk4 h ASP 170 Cb -0.02 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 2gk4 h ASP 170 CO -0.04 0.33 -0.02 0.40 -1.72 0.00 0.00 179.24 178.18 2gk4 h ILE 171 N 0.56 1.26 -0.59 0.35 1.08 -0.79 -2.18 117.51 117.21 2gk4 h ILE 171 Ca 0.18 -1.01 0.04 0.00 -0.39 0.00 0.00 64.86 63.67 2gk4 h ILE 171 Cb -0.01 1.26 -0.04 0.00 -3.07 0.00 0.00 36.82 34.96 2gk4 h ILE 171 CO -0.07 0.33 0.34 0.00 -0.69 0.00 0.00 178.15 178.06 2gk4 h ALA 172 N 0.84 0.77 -0.79 1.87 0.00 -0.91 -1.34 119.26 119.69 2gk4 h ALA 172 Ca 0.09 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2gk4 h ALA 172 Cb 0.48 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2gk4 h ALA 172 CO 0.02 0.05 0.33 0.00 0.00 0.00 0.00 179.25 179.66 2gk4 h ARG 173 N 0.67 1.17 -0.48 0.00 3.08 -0.55 0.53 114.38 118.79 2gk4 h ARG 173 Ca 0.25 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2gk4 h ARG 173 Cb 0.07 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2gk4 h ARG 173 CO -0.12 0.94 0.30 0.87 -1.07 0.00 0.00 179.97 180.89 2gk4 h LYS 174 N 1.14 0.65 -0.78 0.04 1.57 -1.12 -0.97 116.57 117.09 2gk4 h LYS 174 Ca 0.26 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.97 2gk4 h LYS 174 Cb 0.19 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 2gk4 h LYS 174 CO -0.02 0.45 0.39 1.03 -0.57 0.00 0.00 179.45 180.72 2gk4 h SER 175 N 0.65 1.00 -0.42 0.86 0.87 -0.80 0.21 113.55 115.92 2gk4 h SER 175 Ca 0.17 -0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.64 2gk4 h SER 175 Cb -0.04 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.65 2gk4 h SER 175 CO -0.04 0.83 0.27 0.25 -0.53 0.00 0.00 176.83 177.62 2gk4 h LEU 176 N 1.10 0.47 -0.33 2.23 5.85 -0.46 0.08 115.31 124.25 2gk4 h LEU 176 Ca 0.27 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.90 2gk4 h LEU 176 Cb 0.09 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 2gk4 h LEU 176 CO -0.04 0.34 -0.12 0.40 -0.34 0.00 0.00 178.44 178.68 2gk4 h ILE 177 N 0.56 1.28 -0.35 4.05 1.08 -0.77 -1.27 117.51 122.10 2gk4 h ILE 177 Ca 0.16 -1.21 -0.05 0.00 -0.39 0.00 0.00 64.86 63.37 2gk4 h ILE 177 Cb -0.05 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 35.06 2gk4 h ILE 177 CO -0.04 0.39 0.02 0.50 -0.69 0.00 0.00 178.15 178.33 2gk4 h LYS 178 N 0.45 0.60 -0.01 2.37 3.64 -0.75 -2.77 116.57 120.10 2gk4 h LYS 178 Ca 0.08 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2gk4 h LYS 178 Cb 0.64 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2gk4 h LYS 178 CO 0.04 0.71 -0.01 0.09 -2.27 0.00 0.00 179.45 178.01 2gk4 n ASN 179 N -4.53 0.71 -2.60 4.20 3.02 -0.00 -4.85 115.26 111.21 2gk4 n ASN 179 Ca -0.02 -1.20 -0.13 0.00 -0.03 0.00 0.00 54.58 53.20 2gk4 n ASN 179 Cb 0.26 -0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.42 2gk4 n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gk4 n GLN 180 N -0.46 -2.52 -1.52 3.52 6.02 -0.87 -4.63 117.38 116.92 2gk4 n GLN 180 Ca 0.21 0.51 -0.33 0.00 -0.01 0.00 0.00 57.00 57.38 2gk4 n GLN 180 Cb 0.23 -5.12 0.08 0.00 1.02 0.00 0.00 30.24 26.45 2gk4 n GLN 180 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2gk4 s ALA 181 N -2.60 2.25 -0.13 -1.58 0.00 -0.53 -4.90 121.76 114.28 2gk4 s ALA 181 Ca 0.06 0.64 0.17 0.00 0.00 0.00 0.00 51.96 52.83 2gk4 s ALA 181 Cb -0.03 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 2gk4 s ALA 181 CO 0.08 -1.64 0.92 -0.44 0.00 0.00 0.00 175.76 174.69 2gk4 h ASP 182 N -0.33 0.00 -3.37 0.00 5.19 -1.17 -3.45 116.42 113.29 2gk4 h ASP 182 Ca -0.46 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 55.87 2gk4 h ASP 182 Cb 1.26 0.00 -0.24 0.00 0.18 0.00 0.00 39.33 40.53 2gk4 h ASP 182 CO 0.51 0.56 -0.15 -0.22 -3.12 0.00 0.00 179.24 176.82 2gk4 s LEU 183 N -5.88 -0.30 -0.14 1.55 2.96 -1.11 -4.66 118.68 111.09 2gk4 s LEU 183 Ca -0.02 1.11 0.02 0.00 -0.22 0.00 0.00 54.13 55.02 2gk4 s LEU 183 Cb 0.09 1.77 0.01 0.00 0.50 0.00 0.00 46.19 48.55 2gk4 s LEU 183 CO 0.80 -0.20 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.79 2gk4 s ILE 184 N 1.13 2.22 -0.46 6.68 -1.09 -0.45 -1.68 121.20 127.54 2gk4 s ILE 184 Ca -0.07 -0.93 -0.19 0.00 -2.23 0.00 0.00 60.65 57.23 2gk4 s ILE 184 Cb -0.06 -1.90 0.04 0.00 -1.58 0.00 0.00 42.46 38.96 2gk4 s ILE 184 CO -0.11 0.54 0.58 -0.63 -1.23 0.00 0.00 174.94 174.09 2gk4 s ILE 185 N 0.77 4.92 -0.10 2.92 1.01 0.23 -0.63 121.20 130.33 2gk4 s ILE 185 Ca -0.08 -0.28 -0.09 0.00 0.00 0.00 0.00 60.65 60.20 2gk4 s ILE 185 Cb -0.16 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 2gk4 s ILE 185 CO -0.01 -0.63 0.21 0.00 0.00 0.00 0.00 174.94 174.51 2gk4 s ALA 186 N 2.54 3.82 0.07 9.38 0.00 0.82 -1.64 121.76 136.74 2gk4 s ALA 186 Ca 0.16 -0.54 -0.15 0.00 0.00 0.00 0.00 51.96 51.44 2gk4 s ALA 186 Cb -0.17 -2.09 0.03 0.00 0.00 0.00 0.00 23.12 20.88 2gk4 s ALA 186 CO 0.14 0.54 0.35 0.54 0.00 0.00 0.00 175.76 177.34 2gk4 s ASN 187 N -0.91 -0.18 -0.13 0.00 6.03 0.04 -0.69 114.94 119.11 2gk4 s ASN 187 Ca 0.17 -0.21 0.01 0.00 -1.03 0.00 0.00 52.86 51.79 2gk4 s ASN 187 Cb -0.13 0.41 -0.01 0.00 -3.03 0.00 0.00 41.25 38.48 2gk4 s ASN 187 CO 0.06 -0.70 -0.16 -0.62 -2.03 0.00 0.00 177.10 173.65 2gk4 s ASP 188 N -2.32 3.78 0.36 3.54 -1.08 -1.26 -1.56 116.67 118.13 2gk4 s ASP 188 Ca -0.02 -0.39 0.15 0.00 -0.52 0.00 0.00 52.55 51.77 2gk4 s ASP 188 Cb 0.00 -1.56 1.05 0.00 -1.46 0.00 0.00 42.92 40.95 2gk4 s ASP 188 CO -0.06 0.16 1.71 0.25 0.52 0.00 0.00 175.17 177.75 2gk4 h LEU 189 N 6.76 0.54 0.00 -1.34 5.85 -1.45 -0.45 115.31 125.21 2gk4 h LEU 189 Ca -0.25 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2gk4 h LEU 189 Cb 1.22 0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.31 2gk4 h LEU 189 CO 0.54 0.01 0.00 0.35 -0.34 0.00 0.00 178.44 179.00 2gk4 n THR 190 N -4.85 0.12 -1.01 1.05 -2.24 -1.26 -2.39 114.28 103.71 2gk4 n THR 190 Ca 0.29 0.03 0.08 0.00 -2.27 0.00 0.00 64.05 62.18 2gk4 n THR 190 Cb 0.91 -0.59 0.27 0.00 -2.10 0.00 0.00 70.33 68.81 2gk4 n THR 190 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gk4 n GLN 191 N -1.25 2.98 -4.80 -0.78 1.13 -0.18 -4.92 117.38 109.56 2gk4 n GLN 191 Ca 0.14 -2.87 -0.32 0.00 -1.94 0.00 0.00 57.00 52.00 2gk4 n GLN 191 Cb 0.19 -1.87 -0.16 0.00 0.11 0.00 0.00 30.24 28.51 2gk4 n GLN 191 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2gk4 s ILE 192 N -2.85 2.17 0.01 5.09 1.01 -1.00 -1.87 121.20 123.76 2gk4 s ILE 192 Ca 0.43 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 60.13 2gk4 s ILE 192 Cb 0.35 -1.86 -0.00 0.00 0.01 0.00 0.00 42.46 40.95 2gk4 s ILE 192 CO 0.09 0.55 0.01 -1.54 0.00 0.00 0.00 174.94 174.05 2gk4 n SER 193 N 3.90 -0.02 -0.21 3.58 3.41 0.34 -5.00 113.62 119.63 2gk4 n SER 193 Ca -0.20 -1.07 0.06 0.00 -0.26 0.00 0.00 58.87 57.40 2gk4 n SER 193 Cb 0.52 0.05 0.33 0.00 -0.26 0.00 0.00 64.21 64.85 2gk4 n SER 193 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gk4 h ALA 194 N 1.03 1.66 0.00 7.33 0.00 -2.03 -3.22 119.26 124.04 2gk4 h ALA 194 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2gk4 h ALA 194 Cb 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2gk4 h ALA 194 CO 0.01 0.23 0.00 -0.25 0.00 0.00 0.00 179.25 179.24 2gk4 n ASP 195 N -4.48 1.01 -4.06 0.00 9.92 -1.26 -5.03 116.55 112.65 2gk4 n ASP 195 Ca 0.11 -1.41 -0.14 0.00 -0.53 0.00 0.00 54.79 52.82 2gk4 n ASP 195 Cb 0.21 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.57 2gk4 n ASP 195 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2gk4 s GLN 196 N -0.41 0.55 -0.38 -1.24 -1.52 -1.22 -4.88 119.66 110.56 2gk4 s GLN 196 Ca 0.00 -0.69 0.05 0.00 -1.95 0.00 0.00 55.36 52.78 2gk4 s GLN 196 Cb 0.00 -0.37 0.17 0.00 -0.22 0.00 0.00 33.01 32.59 2gk4 s GLN 196 CO 0.00 0.07 0.49 -1.58 -0.25 0.00 0.00 175.29 174.03 2gk4 s HIS 197 N -1.17 -1.00 0.10 0.91 2.46 0.55 -0.51 115.29 116.63 2gk4 s HIS 197 Ca -0.07 -0.24 -0.31 0.00 0.47 0.00 0.00 55.06 54.91 2gk4 s HIS 197 Cb -0.09 -0.06 -0.07 0.00 -0.13 0.00 0.00 32.58 32.24 2gk4 s HIS 197 CO 0.00 -1.06 1.25 0.50 -2.47 0.00 0.00 174.74 172.96 2gk4 s ARG 198 N 1.72 4.41 0.03 2.88 3.52 -0.78 -2.46 118.95 128.26 2gk4 s ARG 198 Ca 0.16 1.88 -0.04 0.00 -0.13 0.00 0.00 55.73 57.59 2gk4 s ARG 198 Cb -0.10 -3.30 -0.01 0.00 -1.56 0.00 0.00 34.95 29.98 2gk4 s ARG 198 CO -0.07 -0.28 0.07 0.00 -0.81 0.00 0.00 175.30 174.21 2gk4 s ALA 199 N 0.85 -0.04 -0.19 6.12 0.00 -0.83 -4.45 121.76 123.22 2gk4 s ALA 199 Ca 0.59 -0.51 -0.01 0.00 0.00 0.00 0.00 51.96 52.03 2gk4 s ALA 199 Cb -0.32 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.00 2gk4 s ALA 199 CO 0.31 -0.26 -0.13 0.42 0.00 0.00 0.00 175.76 176.10 2gk4 s ILE 200 N -2.14 2.70 -0.49 0.00 -1.09 0.14 -1.46 121.20 118.86 2gk4 s ILE 200 Ca -0.09 -0.73 -0.28 0.00 -2.23 0.00 0.00 60.65 57.32 2gk4 s ILE 200 Cb -0.04 -2.18 0.03 0.00 -1.58 0.00 0.00 42.46 38.69 2gk4 s ILE 200 CO -0.03 0.49 1.09 -0.36 -1.23 0.00 0.00 174.94 174.90 2gk4 s PHE 201 N 1.23 2.81 -0.27 3.97 0.40 0.78 -0.12 117.98 126.77 2gk4 s PHE 201 Ca 0.03 0.57 -0.09 0.00 -0.60 0.00 0.00 56.93 56.83 2gk4 s PHE 201 Cb -0.14 -4.33 -0.04 0.00 0.51 0.00 0.00 43.02 39.02 2gk4 s PHE 201 CO -0.06 -1.27 0.14 0.08 0.70 0.00 0.00 175.22 174.81 2gk4 s VAL 202 N 4.34 4.87 0.45 -0.44 1.01 0.20 -2.04 120.40 128.79 2gk4 s VAL 202 Ca 0.44 -0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.45 2gk4 s VAL 202 Cb -0.08 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.95 2gk4 s VAL 202 CO 0.29 0.27 0.03 -1.61 0.00 0.00 0.00 175.10 174.09 2gk4 s GLU 203 N 1.69 2.05 0.31 2.72 2.02 -0.33 -1.35 118.70 125.82 2gk4 s GLU 203 Ca 0.07 -2.25 0.01 0.00 0.02 0.00 0.00 54.97 52.82 2gk4 s GLU 203 Cb -0.16 -1.33 0.52 0.00 0.10 0.00 0.00 34.13 33.27 2gk4 s GLU 203 CO 0.08 -0.30 1.88 0.87 0.02 0.00 0.00 175.26 177.81 2gk4 h LYS 204 N 1.59 0.73 0.00 1.61 1.57 -1.94 -3.30 116.57 116.82 2gk4 h LYS 204 Ca -0.42 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 2gk4 h LYS 204 Cb 1.28 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2gk4 h LYS 204 CO 0.72 0.64 -0.09 0.09 -0.57 0.00 0.00 179.45 180.25 2gk4 n ASN 205 N -4.31 1.23 -3.45 0.86 4.13 -1.26 -5.07 115.26 107.39 2gk4 n ASN 205 Ca 0.04 -2.00 -0.13 0.00 1.68 0.00 0.00 54.58 54.17 2gk4 n ASN 205 Cb 0.19 -0.13 -0.03 0.00 -1.54 0.00 0.00 39.78 38.27 2gk4 n ASN 205 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gk4 s GLN 206 N -1.01 1.22 0.20 3.52 -2.07 -1.24 -5.17 119.66 115.11 2gk4 s GLN 206 Ca 0.07 -0.32 0.10 0.00 -1.82 0.00 0.00 55.36 53.39 2gk4 s GLN 206 Cb 0.06 0.56 -0.04 0.00 -1.09 0.00 0.00 33.01 32.50 2gk4 s GLN 206 CO 0.01 -0.50 -0.20 -0.51 -1.32 0.00 0.00 175.29 172.76 2gk4 s LEU 207 N -2.41 2.47 -0.14 2.60 1.43 -1.26 -1.19 118.68 120.19 2gk4 s LEU 207 Ca -0.02 -0.90 -0.14 0.00 -1.03 0.00 0.00 54.13 52.05 2gk4 s LEU 207 Cb -0.01 -0.99 0.04 0.00 0.03 0.00 0.00 46.19 45.26 2gk4 s LEU 207 CO -0.08 0.03 0.38 -1.58 0.23 0.00 0.00 176.35 175.33 2gk4 s GLN 208 N -2.92 0.46 0.10 1.70 0.74 -0.86 -4.98 119.66 113.89 2gk4 s GLN 208 Ca 0.20 0.49 0.06 0.00 0.05 0.00 0.00 55.36 56.16 2gk4 s GLN 208 Cb -0.06 0.22 -0.04 0.00 1.10 0.00 0.00 33.01 34.23 2gk4 s GLN 208 CO 0.09 -0.06 -0.06 0.95 -0.55 0.00 0.00 175.29 175.65 2gk4 s THR 209 N 0.11 3.60 0.20 -0.34 -4.23 -1.26 -0.16 115.64 113.56 2gk4 s THR 209 Ca -0.01 -1.17 0.02 0.00 -1.18 0.00 0.00 61.69 59.35 2gk4 s THR 209 Cb -0.03 -2.70 -0.05 0.00 1.34 0.00 0.00 72.50 71.07 2gk4 s THR 209 CO 0.01 0.12 0.03 0.68 -0.54 0.00 0.00 174.62 174.92 2gk4 s VAL 210 N -1.25 0.65 0.00 2.29 -7.23 -0.53 -4.99 120.40 109.34 2gk4 s VAL 210 Ca 0.23 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 2gk4 s VAL 210 Cb -0.11 -2.30 0.00 0.00 0.56 0.00 0.00 36.38 34.52 2gk4 s VAL 210 CO 0.15 -0.31 0.18 0.00 -0.31 0.00 0.00 175.10 174.81 2gk4 n GLN 211 N -0.32 3.08 -3.92 4.82 1.13 -1.26 -1.97 117.38 118.93 2gk4 n GLN 211 Ca -0.04 -0.18 -0.09 0.00 -1.94 0.00 0.00 57.00 54.75 2gk4 n GLN 211 Cb 0.64 -0.63 -0.08 0.00 0.11 0.00 0.00 30.24 30.28 2gk4 n GLN 211 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2gk4 s THR 212 N -0.49 0.14 0.32 5.09 -4.23 -1.03 -0.33 115.64 115.11 2gk4 s THR 212 Ca 0.00 -1.33 0.01 0.00 -1.18 0.00 0.00 61.69 59.19 2gk4 s THR 212 Cb 0.00 -1.48 0.27 0.00 1.34 0.00 0.00 72.50 72.63 2gk4 s THR 212 CO 0.00 -0.63 1.96 0.11 -0.54 0.00 0.00 174.62 175.53 2gk4 h LYS 213 N 2.77 0.95 -0.60 3.99 1.57 -1.90 -1.32 116.57 122.03 2gk4 h LYS 213 Ca -0.34 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.33 2gk4 h LYS 213 Cb 1.20 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 2gk4 h LYS 213 CO 0.56 0.63 0.14 0.93 -0.57 0.00 0.00 179.45 181.14 2gk4 h GLU 214 N 0.98 0.95 -0.35 3.15 3.07 -1.96 -1.41 114.58 119.00 2gk4 h GLU 214 Ca 0.31 -0.21 -0.12 0.00 -0.50 0.00 0.00 59.36 58.84 2gk4 h GLU 214 Cb 0.03 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 2gk4 h GLU 214 CO -0.09 0.85 -0.29 0.93 -1.40 0.00 0.00 179.01 179.02 2gk4 h GLU 215 N 0.91 0.74 0.16 2.33 5.08 -1.75 -0.35 114.58 121.70 2gk4 h GLU 215 Ca 0.19 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2gk4 h GLU 215 Cb 0.34 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2gk4 h GLU 215 CO 0.00 0.93 -0.12 0.82 -1.00 0.00 0.00 179.01 179.65 2gk4 h ILE 216 N 0.63 0.74 -0.68 3.13 2.04 -0.98 -0.68 117.51 121.71 2gk4 h ILE 216 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.94 2gk4 h ILE 216 Cb 0.80 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 2gk4 h ILE 216 CO 0.07 0.00 0.43 0.00 0.00 0.00 0.00 178.15 178.64 2gk4 h ALA 217 N 0.54 0.86 -0.64 1.87 0.00 -1.07 -0.04 119.26 120.79 2gk4 h ALA 217 Ca -0.01 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2gk4 h ALA 217 Cb 0.25 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2gk4 h ALA 217 CO -0.00 0.31 0.11 0.93 0.00 0.00 0.00 179.25 180.60 2gk4 h GLU 218 N 0.92 1.06 -0.15 0.00 5.08 -0.94 -1.02 114.58 119.52 2gk4 h GLU 218 Ca 0.25 -0.28 -0.15 0.00 -1.00 0.00 0.00 59.36 58.18 2gk4 h GLU 218 Cb -0.06 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2gk4 h GLU 218 CO -0.05 0.98 -0.48 1.25 -1.00 0.00 0.00 179.01 179.71 2gk4 h LEU 219 N 0.97 0.69 -0.52 1.33 5.85 -0.94 -2.62 115.31 120.07 2gk4 h LEU 219 Ca 0.20 -0.60 0.05 0.00 0.84 0.00 0.00 57.88 58.37 2gk4 h LEU 219 Cb 0.43 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 2gk4 h LEU 219 CO 0.01 1.17 0.25 0.25 -0.34 0.00 0.00 178.44 179.78 2gk4 h LEU 220 N 0.25 0.34 -0.56 2.25 5.85 -0.91 0.27 115.31 122.81 2gk4 h LEU 220 Ca -0.02 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.82 2gk4 h LEU 220 Cb 1.10 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.04 2gk4 h LEU 220 CO 0.10 0.24 0.19 0.25 -0.34 0.00 0.00 178.44 178.87 2gk4 h LEU 221 N 0.48 0.16 -0.81 2.25 5.85 -1.16 -0.08 115.31 122.01 2gk4 h LEU 221 Ca 0.23 0.08 0.01 0.00 0.84 0.00 0.00 57.88 59.04 2gk4 h LEU 221 Cb 0.16 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 2gk4 h LEU 221 CO -0.18 0.11 0.53 -0.33 -0.34 0.00 0.00 178.44 178.24 2gk4 h GLU 222 N 0.35 1.05 -0.29 1.25 5.08 -0.93 0.12 114.58 121.22 2gk4 h GLU 222 Ca 0.28 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.55 2gk4 h GLU 222 Cb 0.34 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2gk4 h GLU 222 CO -0.30 0.70 0.08 0.87 -1.00 0.00 0.00 179.01 179.36 2gk4 h LYS 223 N 1.09 0.45 0.18 2.33 1.79 -0.56 -0.40 116.57 121.45 2gk4 h LYS 223 Ca 0.30 -0.11 -0.01 0.00 -2.18 0.00 0.00 60.65 58.65 2gk4 h LYS 223 Cb -0.11 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.48 2gk4 h LYS 223 CO -0.07 0.53 -0.09 0.82 -1.08 0.00 0.00 179.45 179.56 2gk4 h ILE 224 N 0.30 0.86 -0.88 1.86 2.04 -0.69 0.26 117.51 121.26 2gk4 h ILE 224 Ca 0.09 -0.21 0.14 0.00 1.00 0.00 0.00 64.86 65.88 2gk4 h ILE 224 Cb 0.27 0.99 -0.09 0.00 -0.74 0.00 0.00 36.82 37.25 2gk4 h ILE 224 CO -0.00 0.05 0.49 1.56 0.00 0.00 0.00 178.15 180.25 2gk4 h GLN 225 N -0.35 0.71 -0.31 2.37 4.20 -0.73 -1.54 115.11 119.46 2gk4 h GLN 225 Ca -0.03 -0.04 -0.17 0.00 0.06 0.00 0.00 58.65 58.47 2gk4 h GLN 225 Cb 0.27 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 2gk4 h GLN 225 CO 0.04 0.47 -0.48 0.00 -0.67 0.00 0.00 178.83 178.19 2gk4 h ALA 226 N 1.54 0.56 -0.51 3.87 0.00 -0.77 -2.03 119.26 121.92 2gk4 h ALA 226 Ca 0.46 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2gk4 h ALA 226 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2gk4 h ALA 226 CO -0.32 0.68 0.15 -0.92 0.00 0.00 0.00 179.25 178.83 2gk4 h TYR 227 N 0.67 0.77 -0.34 0.00 3.20 -0.45 -2.61 116.97 118.20 2gk4 h TYR 227 Ca 0.03 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2gk4 h TYR 227 Cb 1.07 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.11 2gk4 h TYR 227 CO 0.06 0.63 0.00 -2.39 -1.64 0.00 0.00 178.16 174.83 2gk4 n HIS 228 N -4.31 0.44 -0.23 -3.82 1.44 -0.62 -5.10 115.22 103.03 2gk4 n HIS 228 Ca 0.04 -0.22 0.00 0.00 -2.01 0.00 0.00 57.72 55.53 2gk4 n HIS 228 Cb 0.20 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.31 2gk4 n HIS 228 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96