#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nef n TRP 57 N 0.00 0.22 -0.00 0.00 -0.00 -1.26 -2.58 117.44 113.82 2nef n TRP 57 Ca 0.00 0.09 -0.17 0.00 -0.00 0.00 0.00 57.50 57.41 2nef n TRP 57 Cb 0.00 -0.64 -0.13 0.00 -0.00 0.00 0.00 31.31 30.53 2nef n TRP 57 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2nef h LEU 58 N 0.00 0.29 0.00 5.87 -0.00 -1.92 -3.45 115.31 116.10 2nef h LEU 58 Ca 0.00 -0.93 0.00 0.00 -0.00 0.00 0.00 57.88 56.95 2nef h LEU 58 Cb 0.26 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 40.82 2nef h LEU 58 CO 0.00 1.20 0.00 -0.62 -0.00 0.00 0.00 178.44 179.02 2nef n GLU 59 N -4.33 0.01 0.00 1.13 1.02 -1.07 -4.87 120.64 112.53 2nef n GLU 59 Ca -0.12 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 2nef n GLU 59 Cb 0.66 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.08 2nef n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2nef n ALA 60 N -3.00 0.00 -1.00 0.62 0.00 -1.26 -4.97 120.51 110.91 2nef n ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2nef n ALA 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2nef n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nef n GLN 61 N -0.87 0.00 -3.20 0.00 10.64 -1.26 -4.43 117.38 118.26 2nef n GLN 61 Ca 0.00 0.00 -0.04 0.00 -1.83 0.00 0.00 57.00 55.13 2nef n GLN 61 Cb 0.00 -0.69 -0.02 0.00 -0.86 0.00 0.00 30.24 28.66 2nef n GLN 61 CO 0.00 0.00 0.00 -2.00 -1.83 0.00 0.00 177.06 173.23 2nef s GLU 62 N -0.41 0.81 0.32 2.61 2.12 -1.26 -4.32 118.70 118.57 2nef s GLU 62 Ca 0.00 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 54.81 2nef s GLU 62 Cb 0.00 -0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.26 2nef s GLU 62 CO 0.00 -1.21 0.00 -1.91 -0.54 0.00 0.00 175.26 171.60 2nef n GLU 63 N 4.19 0.00 -2.18 4.30 2.13 -1.26 -5.12 120.64 122.70 2nef n GLU 63 Ca 0.12 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.55 2nef n GLU 63 Cb 0.54 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.23 2nef n GLU 63 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2nef s GLU 64 N -1.84 4.13 0.16 5.31 2.56 -1.26 -5.03 118.70 122.73 2nef s GLU 64 Ca 0.00 2.03 0.06 0.00 0.00 0.00 0.00 54.97 57.06 2nef s GLU 64 Cb 0.00 -2.83 -0.04 0.00 2.00 0.00 0.00 34.13 33.26 2nef s GLU 64 CO 0.00 -0.32 0.07 -1.21 -0.56 0.00 0.00 175.26 173.24 2nef s GLU 65 N -2.10 2.66 -0.02 4.30 0.41 -1.26 -4.88 118.70 117.81 2nef s GLU 65 Ca 0.54 -0.97 0.01 0.00 -0.41 0.00 0.00 54.97 54.14 2nef s GLU 65 Cb -0.35 -2.51 0.05 0.00 -1.78 0.00 0.00 34.13 29.53 2nef s GLU 65 CO 0.46 0.48 0.73 0.28 -0.49 0.00 0.00 175.26 176.71 2nef n VAL 66 N -0.19 0.48 0.00 2.63 0.31 -1.26 -4.95 118.33 115.34 2nef n VAL 66 Ca -0.09 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 2nef n VAL 66 Cb 0.55 -0.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.84 2nef n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nef n GLY 67 N 0.15 2.59 3.88 2.92 0.00 -1.26 -4.38 105.19 109.09 2nef n GLY 67 Ca 0.02 0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2nef n GLY 67 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nef s PHE 68 N 0.00 3.45 -0.09 1.61 -0.12 -1.26 -5.04 117.98 116.53 2nef s PHE 68 Ca 0.00 0.89 -0.30 0.00 -0.05 0.00 0.00 56.93 57.47 2nef s PHE 68 Cb 0.00 -2.29 -0.02 0.00 -0.63 0.00 0.00 43.02 40.08 2nef s PHE 68 CO 0.00 0.12 1.15 -1.25 -0.05 0.00 0.00 175.22 175.19 2nef s PRO 69 N -3.34 4.35 0.60 1.99 0.04 -1.26 -5.04 135.00 132.35 2nef s PRO 69 Ca 0.48 1.58 -0.09 0.00 0.04 0.00 0.00 61.00 63.02 2nef s PRO 69 Cb -0.11 -3.58 -0.02 0.00 0.04 0.00 0.00 34.50 30.84 2nef s PRO 69 CO 0.26 -0.45 0.97 0.14 0.04 0.00 0.00 177.00 177.96 2nef s VAL 70 N 2.32 4.23 0.22 -0.36 -7.23 -1.26 -5.05 120.40 113.27 2nef s VAL 70 Ca 0.53 0.44 -0.20 0.00 -1.81 0.00 0.00 61.98 60.95 2nef s VAL 70 Cb -0.22 -3.68 -0.08 0.00 0.56 0.00 0.00 36.38 32.95 2nef s VAL 70 CO 0.19 -0.81 0.72 0.42 -0.31 0.00 0.00 175.10 175.31 2nef s THR 71 N -3.09 4.57 -0.80 5.32 -4.23 -1.26 -5.00 115.64 111.16 2nef s THR 71 Ca 0.54 1.28 -0.26 0.00 -1.18 0.00 0.00 61.69 62.07 2nef s THR 71 Cb -0.11 -3.86 0.04 0.00 1.34 0.00 0.00 72.50 69.91 2nef s THR 71 CO 0.50 0.22 1.31 -2.16 -0.54 0.00 0.00 174.62 173.94 2nef s PRO 72 N -1.95 3.28 -0.40 3.99 0.04 -1.26 -4.94 135.00 133.75 2nef s PRO 72 Ca 0.43 -0.46 0.02 0.00 0.04 0.00 0.00 61.00 61.02 2nef s PRO 72 Cb -0.17 -4.44 0.12 0.00 0.04 0.00 0.00 34.50 30.05 2nef s PRO 72 CO 0.21 -2.15 0.18 -0.65 0.04 0.00 0.00 177.00 174.63 2nef s GLN 73 N 5.50 1.21 0.08 4.56 -1.52 -1.26 -5.02 119.66 123.21 2nef s GLN 73 Ca 0.37 -1.80 0.02 0.00 -1.95 0.00 0.00 55.36 52.00 2nef s GLN 73 Cb -0.07 -2.42 -0.03 0.00 -0.22 0.00 0.00 33.01 30.27 2nef s GLN 73 CO 0.09 -1.09 -0.07 0.14 -0.25 0.00 0.00 175.29 174.11 2nef s VAL 74 N 0.69 0.65 -0.01 1.09 -7.23 -1.26 -5.12 120.40 109.20 2nef s VAL 74 Ca 0.15 -1.60 -0.30 0.00 -1.81 0.00 0.00 61.98 58.42 2nef s VAL 74 Cb -0.22 -1.26 -0.05 0.00 0.56 0.00 0.00 36.38 35.41 2nef s VAL 74 CO -0.07 -0.67 1.35 -2.16 -0.31 0.00 0.00 175.10 173.23 2nef s PRO 75 N -2.94 4.30 -0.35 4.82 0.04 -1.26 -4.92 135.00 134.69 2nef s PRO 75 Ca 0.03 1.89 -0.27 0.00 0.04 0.00 0.00 61.00 62.68 2nef s PRO 75 Cb -0.01 -3.57 -0.05 0.00 0.04 0.00 0.00 34.50 30.92 2nef s PRO 75 CO -0.03 -0.54 2.15 -0.51 0.04 0.00 0.00 177.00 178.12 2nef s LEU 76 N 2.34 3.43 0.47 -3.56 1.43 -1.26 -4.31 118.68 117.22 2nef s LEU 76 Ca 0.62 1.41 -0.16 0.00 -1.03 0.00 0.00 54.13 54.97 2nef s LEU 76 Cb -0.30 -3.16 -0.08 0.00 0.03 0.00 0.00 46.19 42.69 2nef s LEU 76 CO 0.25 -2.20 0.93 -0.13 0.23 0.00 0.00 176.35 175.43 2nef s ARG 77 N 6.79 3.97 -0.39 1.70 1.81 -0.60 -4.98 118.95 127.25 2nef s ARG 77 Ca 0.93 0.88 -0.29 0.00 -1.72 0.00 0.00 55.73 55.52 2nef s ARG 77 Cb -0.25 -2.21 0.01 0.00 -0.45 0.00 0.00 34.95 32.06 2nef s ARG 77 CO 0.31 -0.17 1.37 -1.25 -0.68 0.00 0.00 175.30 174.89 2nef s PRO 78 N -3.83 3.66 -0.58 3.54 0.04 -1.26 -4.59 135.00 131.98 2nef s PRO 78 Ca 0.58 0.99 -0.26 0.00 0.04 0.00 0.00 61.00 62.34 2nef s PRO 78 Cb -0.10 -3.99 -0.06 0.00 0.04 0.00 0.00 34.50 30.39 2nef s PRO 78 CO 0.28 -1.45 2.24 1.41 0.04 0.00 0.00 177.00 179.51 2nef s MET 79 N 4.73 2.20 0.24 4.56 1.75 -1.26 -4.93 119.30 126.59 2nef s MET 79 Ca 0.59 1.01 -0.14 0.00 -1.25 0.00 0.00 55.69 55.90 2nef s MET 79 Cb -0.14 -4.58 -0.08 0.00 2.84 0.00 0.00 34.83 32.87 2nef s MET 79 CO 0.30 -3.27 0.64 0.95 -0.65 0.00 0.00 175.02 172.99 2nef s THR 80 N 11.56 4.78 0.26 10.11 -4.23 -1.26 -4.89 115.64 131.96 2nef s THR 80 Ca 0.87 0.83 -0.02 0.00 -1.18 0.00 0.00 61.69 62.20 2nef s THR 80 Cb -0.15 -3.68 0.23 0.00 1.34 0.00 0.00 72.50 70.24 2nef s THR 80 CO 0.21 0.01 1.76 0.22 -0.54 0.00 0.00 174.62 176.29 2nef h TYR 81 N 2.83 0.73 -0.09 3.99 3.20 -1.94 2.67 116.97 128.36 2nef h TYR 81 Ca -0.48 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.43 2nef h TYR 81 Cb 1.18 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.25 2nef h TYR 81 CO 0.63 0.18 0.06 -0.22 -1.64 0.00 0.00 178.16 177.17 2nef h LYS 82 N 0.61 0.10 -0.50 1.82 3.64 -1.95 -0.45 116.57 119.84 2nef h LYS 82 Ca 0.45 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.75 2nef h LYS 82 Cb 0.62 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 2nef h LYS 82 CO -0.36 0.06 0.02 0.00 -2.27 0.00 0.00 179.45 176.91 2nef h ALA 83 N 1.95 1.09 -0.01 5.00 0.00 0.43 -0.44 119.26 127.27 2nef h ALA 83 Ca 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 2nef h ALA 83 Cb 0.02 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2nef h ALA 83 CO -0.01 0.58 0.01 0.00 0.00 0.00 0.00 179.25 179.83 2nef h ALA 84 N 1.24 0.02 -0.16 0.00 0.00 0.02 0.47 119.26 120.85 2nef h ALA 84 Ca 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2nef h ALA 84 Cb 0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2nef h ALA 84 CO 0.02 -0.44 0.03 0.28 0.00 0.00 0.00 179.25 179.13 2nef h VAL 85 N -0.06 1.22 -0.32 0.00 2.07 -1.33 0.43 116.25 118.26 2nef h VAL 85 Ca 0.00 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2nef h VAL 85 Cb 0.08 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 2nef h VAL 85 CO -0.00 0.21 0.21 0.44 0.02 0.00 0.00 177.57 178.45 2nef h ASP 86 N 0.05 0.37 -0.79 0.57 3.32 -0.98 -2.15 116.42 116.82 2nef h ASP 86 Ca 0.05 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 2nef h ASP 86 Cb 0.30 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 2nef h ASP 86 CO 0.00 0.27 0.29 0.25 -1.72 0.00 0.00 179.24 178.34 2nef h LEU 87 N 0.42 1.10 -0.02 1.55 5.85 0.10 0.18 115.31 124.49 2nef h LEU 87 Ca 0.12 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.68 2nef h LEU 87 Cb -0.04 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 40.67 2nef h LEU 87 CO -0.02 0.99 -0.19 0.77 -0.34 0.00 0.00 178.44 179.65 2nef h SER 88 N 1.15 -0.55 0.59 1.25 4.64 0.48 -1.04 113.55 120.07 2nef h SER 88 Ca 0.26 0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.58 2nef h SER 88 Cb 0.25 0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2nef h SER 88 CO -0.02 -0.25 -0.40 0.45 -0.87 0.00 0.00 176.83 175.75 2nef h HIS 89 N -0.29 0.00 0.12 4.77 3.86 -1.25 -2.92 115.15 119.43 2nef h HIS 89 Ca 0.06 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2nef h HIS 89 Cb 0.38 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 2nef h HIS 89 CO -0.25 0.40 -0.09 0.35 0.86 0.00 0.00 177.93 179.20 2nef h PHE 90 N 0.00 -0.23 0.00 2.45 3.57 0.23 -0.92 116.94 122.05 2nef h PHE 90 Ca -0.00 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2nef h PHE 90 Cb 0.80 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 2nef h PHE 90 CO 0.00 -0.14 -0.03 -0.07 -2.23 0.00 0.00 178.31 175.84 2nef h LEU 91 N -0.21 0.00 0.08 0.59 3.38 -1.11 -2.03 115.31 116.00 2nef h LEU 91 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2nef h LEU 91 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2nef h LEU 91 CO -0.01 0.03 -0.04 0.50 0.09 0.00 0.00 178.44 179.01 2nef h LYS 92 N 0.00 -0.10 -0.17 1.13 3.64 -0.99 -2.78 116.57 117.30 2nef h LYS 92 Ca -0.00 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 2nef h LYS 92 Cb 0.06 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2nef h LYS 92 CO 0.00 0.02 -0.27 0.93 -2.27 0.00 0.00 179.45 177.86 2nef h GLU 93 N -0.20 0.48 -1.80 1.90 3.07 -1.25 -3.10 114.58 113.67 2nef h GLU 93 Ca -0.01 -0.29 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 2nef h GLU 93 Cb 0.17 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 2nef h GLU 93 CO 0.02 0.88 0.00 1.63 -1.40 0.00 0.00 179.01 180.14 2nef n LYS 94 N -4.40 0.95 0.00 2.33 4.76 -0.80 -4.84 118.16 116.17 2nef n LYS 94 Ca -0.06 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 2nef n LYS 94 Cb 0.45 -1.02 0.00 0.00 -1.84 0.00 0.00 35.03 32.62 2nef n LYS 94 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2nef n GLY 95 N 1.32 3.69 3.22 0.72 0.00 -1.05 -4.91 105.19 108.16 2nef n GLY 95 Ca 0.00 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 2nef n GLY 95 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nef s GLY 96 N 0.00 2.52 0.43 -0.02 0.00 -1.26 -3.65 107.32 105.33 2nef s GLY 96 Ca 0.00 -3.20 0.23 0.00 0.00 0.00 0.00 44.72 41.76 2nef s GLY 96 CO 0.00 1.18 1.69 -2.00 0.00 0.00 0.00 173.10 173.96 2nef h LEU 97 N 7.55 0.00 -9.86 0.66 5.85 -1.87 -3.42 115.31 114.23 2nef h LEU 97 Ca 0.01 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 58.17 2nef h LEU 97 Cb 1.01 0.00 0.18 0.00 0.37 0.00 0.00 40.66 42.21 2nef h LEU 97 CO 0.75 0.16 -0.00 1.21 -0.34 0.00 0.00 178.44 180.22 2nef n GLU 98 N -3.18 0.55 -0.35 1.25 0.00 -1.26 -1.39 120.64 116.25 2nef n GLU 98 Ca 0.02 0.24 0.00 0.00 0.00 0.00 0.00 57.16 57.42 2nef n GLU 98 Cb 0.51 -2.12 0.00 0.00 0.00 0.00 0.00 31.44 29.83 2nef n GLU 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2nef n GLY 99 N 1.26 0.00 3.60 8.31 0.00 -0.09 -4.83 105.19 113.45 2nef n GLY 99 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 2nef n GLY 99 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nef s LEU 100 N 0.00 3.59 -0.24 0.99 2.96 -0.49 -4.79 118.68 120.71 2nef s LEU 100 Ca 0.00 0.88 -0.28 0.00 -0.22 0.00 0.00 54.13 54.51 2nef s LEU 100 Cb 0.00 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.10 2nef s LEU 100 CO 0.00 -1.44 2.19 -0.63 -1.32 0.00 0.00 176.35 175.15 2nef s ILE 101 N 5.50 3.05 -0.48 6.68 -1.09 -1.26 -2.85 121.20 130.76 2nef s ILE 101 Ca 0.63 0.05 -0.27 0.00 -2.23 0.00 0.00 60.65 58.83 2nef s ILE 101 Cb -0.14 -3.07 -0.03 0.00 -1.58 0.00 0.00 42.46 37.64 2nef s ILE 101 CO 0.32 -0.04 1.95 -2.28 -1.23 0.00 0.00 174.94 173.66 2nef s HIS 102 N 8.33 1.58 0.00 3.97 5.65 0.82 -4.89 115.29 130.75 2nef s HIS 102 Ca 0.99 0.86 0.00 0.00 0.25 0.00 0.00 55.06 57.16 2nef s HIS 102 Cb -0.31 -4.01 0.00 0.00 -1.18 0.00 0.00 32.58 27.08 2nef s HIS 102 CO 0.35 -2.63 0.14 -1.13 -0.65 0.00 0.00 174.74 170.81 2nef n SER 103 N 12.47 0.00 0.00 9.88 3.41 -1.26 -3.19 113.62 134.94 2nef n SER 103 Ca 0.24 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 2nef n SER 103 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2nef n SER 103 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2nef n GLN 104 N -0.28 0.00 0.08 4.33 7.27 -1.26 -4.78 117.38 122.74 2nef n GLN 104 Ca 0.00 0.00 0.10 0.00 0.07 0.00 0.00 57.00 57.17 2nef n GLN 104 Cb 0.00 0.00 0.43 0.00 2.41 0.00 0.00 30.24 33.08 2nef n GLN 104 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 2nef n ARG 105 N -1.94 0.13 0.12 3.69 1.85 -1.26 -2.90 116.66 116.35 2nef n ARG 105 Ca 0.00 0.33 0.19 0.00 -1.00 0.00 0.00 57.85 57.37 2nef n ARG 105 Cb 0.00 -1.73 0.76 0.00 -1.05 0.00 0.00 32.46 30.44 2nef n ARG 105 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 2nef h ARG 106 N 0.00 0.00 0.00 2.89 9.65 -1.95 -1.20 114.38 123.77 2nef h ARG 106 Ca 0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2nef h ARG 106 Cb 0.36 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.94 2nef h ARG 106 CO 0.00 0.00 -0.00 0.37 2.80 0.00 0.00 179.97 183.14 2nef h GLN 107 N 0.00 -0.00 -0.42 0.20 4.15 -1.92 -2.76 115.11 114.36 2nef h GLN 107 Ca 0.16 0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.63 2nef h GLN 107 Cb 0.79 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.44 2nef h GLN 107 CO -0.00 0.19 0.16 -0.44 -1.93 0.00 0.00 178.83 176.81 2nef h ASP 108 N -0.20 0.19 -0.40 -0.69 5.19 -1.46 -2.14 116.42 116.92 2nef h ASP 108 Ca -0.00 0.04 0.08 0.00 -0.62 0.00 0.00 57.03 56.53 2nef h ASP 108 Cb 0.20 0.01 -0.09 0.00 0.18 0.00 0.00 39.33 39.63 2nef h ASP 108 CO 0.00 0.15 -0.35 0.40 -3.12 0.00 0.00 179.24 176.31 2nef h ILE 109 N 0.34 0.19 0.00 0.35 1.08 -1.35 2.03 117.51 120.15 2nef h ILE 109 Ca 0.19 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.66 2nef h ILE 109 Cb 0.16 0.19 0.00 0.00 -3.07 0.00 0.00 36.82 34.10 2nef h ILE 109 CO -0.18 0.00 0.00 -0.11 -0.69 0.00 0.00 178.15 177.17 2nef n LEU 110 N -5.42 0.00 -0.14 1.44 7.94 -0.92 0.23 117.00 120.13 2nef n LEU 110 Ca 0.01 0.96 -0.03 0.00 -1.11 0.00 0.00 56.01 55.83 2nef n LEU 110 Cb 0.34 -0.46 0.04 0.00 0.53 0.00 0.00 43.42 43.87 2nef n LEU 110 CO 0.06 -0.46 0.81 0.44 -1.11 0.00 0.00 177.39 177.14 2nef h ASP 111 N 0.00 -0.29 0.16 1.96 3.32 -1.18 -0.52 116.42 119.86 2nef h ASP 111 Ca 0.00 0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2nef h ASP 111 Cb 0.00 0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2nef h ASP 111 CO 0.00 -0.10 -0.07 0.25 -1.72 0.00 0.00 179.24 177.59 2nef h LEU 112 N 0.06 -0.18 -0.88 1.55 5.85 0.34 -2.72 115.31 119.32 2nef h LEU 112 Ca 0.22 -0.15 0.18 0.00 0.84 0.00 0.00 57.88 58.97 2nef h LEU 112 Cb 0.33 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.30 2nef h LEU 112 CO -0.42 0.05 0.44 -0.25 -0.34 0.00 0.00 178.44 177.93 2nef h TRP 113 N -0.40 0.76 -0.15 1.25 7.01 0.32 0.52 115.95 125.26 2nef h TRP 113 Ca -0.02 0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 2nef h TRP 113 Cb 0.32 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.17 2nef h TRP 113 CO -0.01 0.10 0.08 0.82 -2.79 0.00 0.00 178.44 176.65 2nef h ILE 114 N 0.56 1.05 0.56 2.65 2.04 -0.83 -2.80 117.51 120.74 2nef h ILE 114 Ca 0.51 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 66.21 2nef h ILE 114 Cb 0.84 0.85 0.01 0.00 -0.74 0.00 0.00 36.82 37.77 2nef h ILE 114 CO -0.43 0.06 -0.27 0.22 0.00 0.00 0.00 178.15 177.73 2nef h TYR 115 N 0.21 -0.69 0.00 1.37 3.20 0.34 -2.94 116.97 118.46 2nef h TYR 115 Ca 0.06 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2nef h TYR 115 Cb 0.01 0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.51 2nef h TYR 115 CO 0.00 -0.43 0.00 0.72 -1.64 0.00 0.00 178.16 176.81 2nef n HIS 116 N -4.81 0.00 0.00 -3.82 8.25 -1.08 -4.12 115.22 109.64 2nef n HIS 116 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 2nef n HIS 116 Cb 0.29 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.40 2nef n HIS 116 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2nef n THR 117 N -0.90 0.00 0.00 1.59 -2.24 -1.06 -4.95 114.28 106.72 2nef n THR 117 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2nef n THR 117 Cb 0.01 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 2nef n THR 117 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nef n GLN 118 N -0.12 0.00 0.00 -0.78 6.02 -1.21 -5.00 117.38 116.29 2nef n GLN 118 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2nef n GLN 118 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2nef n GLN 118 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nef n GLY 119 N 5.00 -0.48 3.75 1.08 0.00 -1.26 -4.72 105.19 108.56 2nef n GLY 119 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2nef n GLY 119 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nef s TYR 120 N -0.09 3.44 -0.08 1.61 2.02 -1.26 -1.55 117.35 121.43 2nef s TYR 120 Ca 0.00 1.50 -0.11 0.00 -0.37 0.00 0.00 57.07 58.09 2nef s TYR 120 Cb 0.00 -3.41 -0.05 0.00 -0.40 0.00 0.00 41.96 38.11 2nef s TYR 120 CO 0.00 -1.07 0.26 0.12 -1.57 0.00 0.00 175.55 173.30 2nef s PHE 121 N -0.43 3.62 -0.85 2.71 2.19 -1.26 -4.29 117.98 119.67 2nef s PHE 121 Ca 0.50 0.71 -0.25 0.00 0.33 0.00 0.00 56.93 58.22 2nef s PHE 121 Cb -0.33 -2.14 0.03 0.00 -1.31 0.00 0.00 43.02 39.27 2nef s PHE 121 CO 0.39 0.61 1.44 -1.25 1.83 0.00 0.00 175.22 178.24 2nef s PRO 122 N -0.77 3.26 0.00 10.12 0.04 -1.26 -4.50 135.00 141.90 2nef s PRO 122 Ca 0.18 -0.53 0.00 0.00 0.04 0.00 0.00 61.00 60.69 2nef s PRO 122 Cb -0.14 -4.73 0.00 0.00 0.04 0.00 0.00 34.50 29.67 2nef s PRO 122 CO 0.07 -2.30 0.48 -0.40 0.04 0.00 0.00 177.00 174.89 2nef n ASP 123 N 9.76 0.00 -0.00 6.66 5.68 -1.26 -4.83 116.55 132.56 2nef n ASP 123 Ca 0.19 -1.22 0.03 0.00 -0.50 0.00 0.00 54.79 53.29 2nef n ASP 123 Cb 0.50 -0.04 -0.04 0.00 -1.14 0.00 0.00 41.12 40.40 2nef n ASP 123 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 2nef n TRP 124 N 0.00 0.00 -2.40 2.11 4.27 -1.26 -4.93 117.44 115.22 2nef n TRP 124 Ca 0.00 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.19 2nef n TRP 124 Cb 0.54 -0.05 -0.02 0.00 -1.36 0.00 0.00 31.31 30.42 2nef n TRP 124 CO 0.00 0.00 0.00 1.14 -2.29 0.00 0.00 177.69 176.54 2nef s GLN 125 N -1.85 3.48 0.20 -2.67 1.03 -1.26 -4.58 119.66 114.00 2nef s GLN 125 Ca 0.01 0.69 -0.17 0.00 0.04 0.00 0.00 55.36 55.93 2nef s GLN 125 Cb 0.04 -4.05 0.02 0.00 0.03 0.00 0.00 33.01 29.05 2nef s GLN 125 CO 0.24 -1.70 0.50 -0.80 -2.54 0.00 0.00 175.29 171.00 2nef s ASN 126 N 3.94 -0.23 0.18 12.60 0.01 -1.26 -5.08 114.94 125.11 2nef s ASN 126 Ca 0.56 -0.53 -0.23 0.00 -0.71 0.00 0.00 52.86 51.95 2nef s ASN 126 Cb -0.12 0.57 0.05 0.00 0.41 0.00 0.00 41.25 42.17 2nef s ASN 126 CO 0.30 -1.05 0.73 -0.31 -1.51 0.00 0.00 177.10 175.26 2nef s TYR 127 N -3.89 -0.33 0.94 2.20 1.51 -1.26 -2.22 117.35 114.29 2nef s TYR 127 Ca 0.10 0.03 -0.16 0.00 -1.01 0.00 0.00 57.07 56.03 2nef s TYR 127 Cb -0.01 0.62 0.24 0.00 -0.11 0.00 0.00 41.96 42.71 2nef s TYR 127 CO -0.02 -0.96 0.60 0.25 -1.11 0.00 0.00 175.55 174.31 2nef n THR 128 N -0.41 0.00 -1.65 -0.71 -2.24 -0.83 -4.79 114.28 103.66 2nef n THR 128 Ca -0.10 -0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.20 2nef n THR 128 Cb 0.62 -0.75 0.01 0.00 -2.10 0.00 0.00 70.33 68.11 2nef n THR 128 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2nef n PRO 129 N -4.35 1.61 0.10 -0.78 -0.02 -1.26 -4.88 135.00 125.41 2nef n PRO 129 Ca 0.09 0.57 -0.14 0.00 -2.02 0.00 0.00 63.50 62.00 2nef n PRO 129 Cb 0.39 -2.18 -0.09 0.00 -0.02 0.00 0.00 33.50 31.61 2nef n PRO 129 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2nef h GLY 130 N 1.83 -1.17 -3.39 -1.23 0.00 -1.89 -3.44 103.07 93.77 2nef h GLY 130 Ca -0.45 0.64 -0.51 0.00 0.00 0.00 0.00 47.33 47.00 2nef h GLY 130 CO 0.59 -0.29 -1.02 -1.05 0.00 0.00 0.00 176.54 174.77 2nef n PRO 131 N -5.12 0.00 -0.17 4.80 -0.02 -1.26 -4.60 135.00 128.63 2nef n PRO 131 Ca -0.07 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.43 2nef n PRO 131 Cb 0.36 -0.86 -0.01 0.00 -0.02 0.00 0.00 33.50 32.98 2nef n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nef n GLY 132 N 2.19 -0.79 3.14 -1.23 0.00 -1.26 -4.70 105.19 102.53 2nef n GLY 132 Ca 0.06 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 45.10 2nef n GLY 132 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2nef n ILE 133 N -1.76 0.00 -3.15 -0.61 2.08 -1.26 -4.78 119.36 109.88 2nef n ILE 133 Ca 0.00 -0.09 0.04 0.00 0.56 0.00 0.00 62.75 63.27 2nef n ILE 133 Cb 0.08 -0.71 -0.00 0.00 -0.75 0.00 0.00 39.64 38.26 2nef n ILE 133 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 2nef s ARG 134 N -4.07 0.48 0.38 0.38 3.52 -1.16 -4.85 118.95 113.63 2nef s ARG 134 Ca 0.51 0.60 -0.08 0.00 -0.13 0.00 0.00 55.73 56.63 2nef s ARG 134 Cb -0.10 0.30 -0.06 0.00 -1.56 0.00 0.00 34.95 33.53 2nef s ARG 134 CO 0.47 -0.79 0.70 0.71 -0.81 0.00 0.00 175.30 175.58 2nef s TYR 135 N 2.86 3.49 0.06 5.12 2.02 -1.26 -2.61 117.35 127.03 2nef s TYR 135 Ca 0.14 0.87 -0.30 0.00 -0.37 0.00 0.00 57.07 57.41 2nef s TYR 135 Cb -0.10 -2.30 -0.05 0.00 -0.40 0.00 0.00 41.96 39.10 2nef s TYR 135 CO -0.23 -0.04 1.12 -1.25 -1.57 0.00 0.00 175.55 173.58 2nef s PRO 136 N -3.91 4.49 0.19 -1.71 0.04 -1.26 -1.96 135.00 130.88 2nef s PRO 136 Ca 0.48 1.66 -0.11 0.00 0.04 0.00 0.00 61.00 63.07 2nef s PRO 136 Cb -0.10 -3.37 0.21 0.00 0.04 0.00 0.00 34.50 31.27 2nef s PRO 136 CO 0.33 -0.16 1.76 -0.07 0.04 0.00 0.00 177.00 178.90 2nef h LEU 137 N 6.60 0.25-10.03 -3.56 3.38 -1.75 -3.40 115.31 106.79 2nef h LEU 137 Ca -0.42 0.06 -0.51 0.00 0.09 0.00 0.00 57.88 57.10 2nef h LEU 137 Cb 1.22 0.03 0.08 0.00 0.09 0.00 0.00 40.66 42.07 2nef h LEU 137 CO 0.78 0.17 0.49 0.42 0.09 0.00 0.00 178.44 180.39 2nef s THR 138 N -6.11 2.95 0.31 0.22 -4.23 -1.26 -4.42 115.64 103.09 2nef s THR 138 Ca -0.13 0.67 0.06 0.00 -1.18 0.00 0.00 61.69 61.12 2nef s THR 138 Cb 0.15 -3.32 -0.02 0.00 1.34 0.00 0.00 72.50 70.65 2nef s THR 138 CO 0.74 -0.04 0.43 0.12 -0.54 0.00 0.00 174.62 175.32 2nef s PHE 139 N -1.56 3.20 0.00 3.99 2.19 -1.26 -4.42 117.98 120.12 2nef s PHE 139 Ca 0.68 -0.16 0.00 0.00 0.33 0.00 0.00 56.93 57.77 2nef s PHE 139 Cb -0.29 -1.85 0.00 0.00 -1.31 0.00 0.00 43.02 39.56 2nef s PHE 139 CO 0.35 0.14 0.00 0.41 1.83 0.00 0.00 175.22 177.94 2nef n GLY 140 N -1.55 2.97 3.58 13.12 0.00 -0.94 -4.90 105.19 117.48 2nef n GLY 140 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 2nef n GLY 140 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2nef s TRP 141 N -1.86 1.80 -1.50 1.61 -0.00 -1.26 -3.89 118.94 113.84 2nef s TRP 141 Ca 0.00 0.70 0.00 0.00 -0.00 0.00 0.00 56.10 56.80 2nef s TRP 141 Cb 0.00 -4.12 0.00 0.00 -0.00 0.00 0.00 33.47 29.35 2nef s TRP 141 CO 0.00 -2.67 0.35 0.00 -0.00 0.00 0.00 176.95 174.63 2nef s TYR 143 N -1.50 2.32 -0.02 0.00 2.02 -1.26 0.18 117.35 119.08 2nef s TYR 143 Ca 0.00 -1.23 0.04 0.00 -0.37 0.00 0.00 57.07 55.51 2nef s TYR 143 Cb 0.00 -1.65 -0.01 0.00 -0.40 0.00 0.00 41.96 39.91 2nef s TYR 143 CO 0.00 -0.63 -0.14 -1.59 -1.57 0.00 0.00 175.55 171.62 2nef s LYS 144 N 1.18 1.31 0.42 -0.62 -2.85 -0.77 -4.65 119.74 113.76 2nef s LYS 144 Ca -0.01 -0.51 -0.21 0.00 -1.00 0.00 0.00 55.97 54.24 2nef s LYS 144 Cb -0.14 -1.22 -0.11 0.00 -2.06 0.00 0.00 37.83 34.30 2nef s LYS 144 CO -0.07 0.26 0.95 -0.51 0.10 0.00 0.00 175.35 176.09 2nef s LEU 145 N -0.15 3.97 -0.21 2.77 1.43 -1.07 0.37 118.68 125.79 2nef s LEU 145 Ca 0.02 1.71 -0.16 0.00 -1.03 0.00 0.00 54.13 54.66 2nef s LEU 145 Cb -0.08 -4.49 0.06 0.00 0.03 0.00 0.00 46.19 41.71 2nef s LEU 145 CO 0.00 -0.34 0.55 -0.69 0.23 0.00 0.00 176.35 176.10 2nef s VAL 146 N -2.13 -0.01 0.84 -1.59 1.01 -1.04 -3.01 120.40 114.48 2nef s VAL 146 Ca 0.61 0.02 -0.12 0.00 0.00 0.00 0.00 61.98 62.49 2nef s VAL 146 Cb -0.10 -0.78 0.10 0.00 0.00 0.00 0.00 36.38 35.60 2nef s VAL 146 CO 0.14 0.01 1.11 -2.16 0.00 0.00 0.00 175.10 174.19 2nef s PRO 147 N 0.79 1.71 0.72 2.72 0.04 -1.26 -3.06 135.00 136.66 2nef s PRO 147 Ca -0.04 0.58 -0.07 0.00 0.04 0.00 0.00 61.00 61.51 2nef s PRO 147 Cb -0.05 -1.88 0.08 0.00 0.04 0.00 0.00 34.50 32.69 2nef s PRO 147 CO -0.06 -1.87 1.03 0.08 0.04 0.00 0.00 177.00 176.22 2nef s VAL 148 N -3.15 2.25 -0.16 -0.36 1.01 -1.26 -4.96 120.40 113.77 2nef s VAL 148 Ca 0.62 -0.29 -0.29 0.00 0.00 0.00 0.00 61.98 62.02 2nef s VAL 148 Cb -0.15 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 2nef s VAL 148 CO 0.54 0.00 1.46 -1.61 0.00 0.00 0.00 175.10 175.49 2nef s GLU 149 N -5.28 4.09 -0.42 2.72 8.01 -1.26 -4.96 118.70 121.60 2nef s GLU 149 Ca 0.62 1.78 -0.29 0.00 0.01 0.00 0.00 54.97 57.09 2nef s GLU 149 Cb -0.10 -3.90 0.02 0.00 -4.31 0.00 0.00 34.13 25.85 2nef s GLU 149 CO 0.45 -0.92 1.11 -1.25 0.01 0.00 0.00 175.26 174.66 2nef s PRO 150 N 3.98 3.85 -0.17 0.39 0.04 -1.26 -4.97 135.00 136.87 2nef s PRO 150 Ca 0.64 0.74 -0.29 0.00 0.04 0.00 0.00 61.00 62.14 2nef s PRO 150 Cb -0.25 -3.84 -0.06 0.00 0.04 0.00 0.00 34.50 30.38 2nef s PRO 150 CO 0.23 -1.20 2.17 0.39 0.04 0.00 0.00 177.00 178.63 2nef n GLU 151 N 7.47 2.12 -1.68 4.56 -0.58 -1.26 -4.83 120.64 126.43 2nef n GLU 151 Ca 0.12 0.63 -0.40 0.00 -0.42 0.00 0.00 57.16 57.09 2nef n GLU 151 Cb 0.48 -3.15 -0.01 0.00 -0.57 0.00 0.00 31.44 28.19 2nef n GLU 151 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2nef n LYS 152 N 8.46 3.63 -1.55 3.49 5.02 -1.26 -4.80 118.16 131.15 2nef n LYS 152 Ca 0.28 -2.71 -0.40 0.00 -2.02 0.00 0.00 58.31 53.46 2nef n LYS 152 Cb 0.43 -2.92 -0.02 0.00 -0.02 0.00 0.00 35.03 32.50 2nef n LYS 152 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2nef n LEU 153 N 3.97 8.19 -1.27 -0.35 7.94 -1.26 -4.71 117.00 129.51 2nef n LEU 153 Ca 0.63 -4.42 0.00 0.00 -1.11 0.00 0.00 56.01 51.12 2nef n LEU 153 Cb 0.29 -1.55 0.00 0.00 0.53 0.00 0.00 43.42 42.70 2nef n LEU 153 CO 0.83 1.85 0.55 -0.62 -1.11 0.00 0.00 177.39 178.89 2nef n GLU 154 N 3.81 0.76 0.23 1.96 1.02 -1.26 -3.90 120.64 123.26 2nef n GLU 154 Ca 0.69 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.95 2nef n GLU 154 Cb 0.27 -1.12 0.44 0.00 -0.02 0.00 0.00 31.44 31.01 2nef n GLU 154 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2nef h GLU 155 N 1.03 0.00 -2.63 3.49 4.57 -2.01 -3.47 114.58 115.57 2nef h GLU 155 Ca 0.00 0.00 0.12 0.00 -1.18 0.00 0.00 59.36 58.30 2nef h GLU 155 Cb 0.76 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.30 2nef h GLU 155 CO 0.00 0.15 0.42 0.00 -1.18 0.00 0.00 179.01 178.40 2nef s ALA 156 N -3.53 -1.40 -0.88 2.92 0.00 -1.25 -5.05 121.76 112.57 2nef s ALA 156 Ca 0.02 -0.21 -0.20 0.00 0.00 0.00 0.00 51.96 51.57 2nef s ALA 156 Cb 0.09 0.71 -0.23 0.00 0.00 0.00 0.00 23.12 23.69 2nef s ALA 156 CO 0.62 -1.04 2.36 0.09 0.00 0.00 0.00 175.76 177.80 2nef n ASN 157 N -0.78 0.23 -4.89 0.00 3.02 -1.26 -4.87 115.26 106.71 2nef n ASN 157 Ca -0.05 -0.65 -0.29 0.00 -0.03 0.00 0.00 54.58 53.55 2nef n ASN 157 Cb 0.60 -1.04 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 2nef n ASN 157 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2nef s LYS 158 N 8.07 3.58 0.60 3.52 0.00 -1.26 -5.08 119.74 129.17 2nef s LYS 158 Ca 1.18 0.46 0.01 0.00 0.00 0.00 0.00 55.97 57.62 2nef s LYS 158 Cb -0.66 -2.24 0.06 0.00 0.00 0.00 0.00 37.83 34.99 2nef s LYS 158 CO 0.39 -0.36 0.84 -0.51 0.00 0.00 0.00 175.35 175.70 2nef s ASP 174 N -4.10 5.02 -0.47 0.03 1.01 -1.26 -5.07 116.67 111.83 2nef s ASP 174 Ca 0.51 -0.11 0.06 0.00 0.71 0.00 0.00 52.55 53.73 2nef s ASP 174 Cb -0.11 -0.63 0.24 0.00 1.01 0.00 0.00 42.92 43.43 2nef s ASP 174 CO 0.48 -1.34 0.79 -0.90 0.21 0.00 0.00 175.17 174.41 2nef n ASP 175 N -2.48 -2.18 -3.18 0.27 5.68 -1.26 -5.14 116.55 108.26 2nef n ASP 175 Ca 0.10 -3.14 -0.15 0.00 -0.50 0.00 0.00 54.79 51.11 2nef n ASP 175 Cb 0.60 1.22 0.14 0.00 -1.14 0.00 0.00 41.12 41.94 2nef n ASP 175 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 2nef n PRO 176 N 1.66 -2.69 -2.41 0.11 -0.02 -1.26 -4.77 135.00 125.62 2nef n PRO 176 Ca 0.12 -0.69 -0.42 0.00 -2.02 0.00 0.00 63.50 60.49 2nef n PRO 176 Cb 0.60 -1.00 -0.00 0.00 -0.02 0.00 0.00 33.50 33.07 2nef n PRO 176 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2nef n GLU 177 N -3.18 3.06 -0.87 -0.52 4.71 -1.26 -4.81 120.64 117.78 2nef n GLU 177 Ca 0.07 -3.12 -0.09 0.00 -0.01 0.00 0.00 57.16 54.00 2nef n GLU 177 Cb 0.29 -3.47 -0.13 0.00 -1.01 0.00 0.00 31.44 27.11 2nef n GLU 177 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2nef n ARG 178 N 8.02 1.74 0.00 3.49 1.74 -1.26 -4.48 116.66 125.90 2nef n ARG 178 Ca 0.49 -0.79 0.00 0.00 -0.77 0.00 0.00 57.85 56.78 2nef n ARG 178 Cb 0.45 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 2nef n ARG 178 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2nef n GLU 179 N 2.36 0.89 -2.95 5.56 -0.58 -1.26 -4.75 120.64 119.91 2nef n GLU 179 Ca 0.34 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.65 2nef n GLU 179 Cb 0.80 -1.23 -0.05 0.00 -0.57 0.00 0.00 31.44 30.39 2nef n GLU 179 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2nef s VAL 180 N -0.40 4.65 0.30 2.62 1.01 -1.26 -4.98 120.40 122.34 2nef s VAL 180 Ca 0.00 0.54 0.11 0.00 0.00 0.00 0.00 61.98 62.63 2nef s VAL 180 Cb 0.00 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.02 2nef s VAL 180 CO 0.00 -0.67 -0.10 -0.76 0.00 0.00 0.00 175.10 173.56 2nef s LEU 181 N 3.30 2.81 0.04 3.92 1.43 -1.19 -4.61 118.68 124.39 2nef s LEU 181 Ca 0.31 -0.97 0.09 0.00 -1.03 0.00 0.00 54.13 52.53 2nef s LEU 181 Cb -0.12 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 2nef s LEU 181 CO 0.22 -0.06 -0.25 -1.83 0.23 0.00 0.00 176.35 174.66 2nef s GLU 182 N -3.60 1.68 -0.28 1.70 -1.05 -1.17 0.29 118.70 116.27 2nef s GLU 182 Ca 0.32 -1.06 -0.29 0.00 -0.15 0.00 0.00 54.97 53.79 2nef s GLU 182 Cb -0.03 -1.84 0.00 0.00 -0.44 0.00 0.00 34.13 31.82 2nef s GLU 182 CO 0.17 0.47 1.27 -1.58 0.95 0.00 0.00 175.26 176.54 2nef s TRP 183 N -0.80 2.77 -0.26 4.83 0.51 -1.13 -2.50 118.94 122.36 2nef s TRP 183 Ca 0.11 0.94 -0.16 0.00 -2.12 0.00 0.00 56.10 54.87 2nef s TRP 183 Cb -0.10 -3.80 -0.04 0.00 -0.81 0.00 0.00 33.47 28.73 2nef s TRP 183 CO 0.02 -1.59 0.40 0.50 -0.51 0.00 0.00 176.95 175.77 2nef s ARG 184 N 3.98 4.04 0.15 4.98 3.52 0.16 -0.91 118.95 134.86 2nef s ARG 184 Ca 0.55 0.11 -0.31 0.00 -0.13 0.00 0.00 55.73 55.94 2nef s ARG 184 Cb -0.17 -3.65 -0.09 0.00 -1.56 0.00 0.00 34.95 29.49 2nef s ARG 184 CO 0.20 -0.27 1.42 0.12 -0.81 0.00 0.00 175.30 175.96 2nef s PHE 185 N 2.06 3.18 -0.48 5.12 2.19 -1.26 -1.85 117.98 126.94 2nef s PHE 185 Ca 0.16 0.93 0.06 0.00 0.33 0.00 0.00 56.93 58.41 2nef s PHE 185 Cb -0.16 -3.74 0.20 0.00 -1.31 0.00 0.00 43.02 38.01 2nef s PHE 185 CO 0.10 -2.57 0.66 -3.47 1.83 0.00 0.00 175.22 171.77 2nef n ASP 186 N 3.60 -2.55 0.00 6.13 -0.08 0.48 -4.96 116.55 119.16 2nef n ASP 186 Ca 0.11 -2.86 0.00 0.00 -1.51 0.00 0.00 54.79 50.53 2nef n ASP 186 Cb 0.41 1.16 0.00 0.00 2.34 0.00 0.00 41.12 45.03 2nef n ASP 186 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2nef n SER 187 N 2.62 0.00 0.28 1.67 7.64 -1.26 -1.07 113.62 123.50 2nef n SER 187 Ca 0.19 0.23 0.12 0.00 1.01 0.00 0.00 58.87 60.42 2nef n SER 187 Cb 0.55 -0.23 0.78 0.00 -1.01 0.00 0.00 64.21 64.30 2nef n SER 187 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2nef h ARG 188 N 0.00 0.00 0.00 1.43 2.43 -1.93 0.64 114.38 116.95 2nef h ARG 188 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2nef h ARG 188 Cb 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2nef h ARG 188 CO 0.00 0.03 0.00 1.28 -1.51 0.00 0.00 179.97 179.77 2nef n LEU 189 N -4.07 0.00 -0.11 3.80 4.77 -0.23 -1.41 117.00 119.75 2nef n LEU 189 Ca -0.03 0.20 0.14 0.00 -0.03 0.00 0.00 56.01 56.29 2nef n LEU 189 Cb 0.12 -0.20 0.61 0.00 -2.33 0.00 0.00 43.42 41.62 2nef n LEU 189 CO 0.30 -0.15 0.88 0.00 -1.33 0.00 0.00 177.39 177.09 2nef n ALA 190 N -1.20 2.75 -0.00 -1.18 0.00 0.22 -2.21 120.51 118.89 2nef n ALA 190 Ca 0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 53.44 53.20 2nef n ALA 190 Cb 0.05 -1.34 -0.01 0.00 0.00 0.00 0.00 19.45 18.15 2nef n ALA 190 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2nef n PHE 191 N -0.99 0.00 -3.68 0.00 3.72 -0.50 -4.95 117.46 111.06 2nef n PHE 191 Ca 0.14 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.42 2nef n PHE 191 Cb 0.28 -0.10 -0.09 0.00 -0.94 0.00 0.00 39.48 38.63 2nef n PHE 191 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 2nef s HIS 192 N -1.70 -0.68 0.20 1.38 -3.43 -1.24 -5.08 115.29 104.74 2nef s HIS 192 Ca -0.06 1.56 -0.06 0.00 -0.80 0.00 0.00 55.06 55.71 2nef s HIS 192 Cb 0.01 0.28 -0.02 0.00 -1.43 0.00 0.00 32.58 31.42 2nef s HIS 192 CO 0.09 -0.34 0.24 -1.58 -2.00 0.00 0.00 174.74 171.15 2nef s HIS 193 N 0.68 0.77 -0.55 0.38 2.46 -1.26 -4.74 115.29 113.03 2nef s HIS 193 Ca -0.03 -1.07 0.25 0.00 0.47 0.00 0.00 55.06 54.68 2nef s HIS 193 Cb -0.05 -0.26 0.64 0.00 -0.13 0.00 0.00 32.58 32.78 2nef s HIS 193 CO -0.05 -0.73 1.71 0.52 -2.47 0.00 0.00 174.74 173.72 2nef h MET 194 N 2.54 0.00 -0.93 2.88 2.86 -1.99 -3.30 114.93 116.99 2nef h MET 194 Ca -0.32 0.00 0.24 0.00 -2.06 0.00 0.00 59.70 57.56 2nef h MET 194 Cb 1.24 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 32.77 2nef h MET 194 CO 0.48 0.00 0.43 0.00 1.06 0.00 0.00 176.91 178.89 2nef h ALA 195 N 2.25 1.55 -0.16 6.32 0.00 -1.87 0.27 119.26 127.62 2nef h ALA 195 Ca 0.00 0.17 -0.22 0.00 0.00 0.00 0.00 54.91 54.85 2nef h ALA 195 Cb 0.83 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.77 2nef h ALA 195 CO 0.00 -0.38 -0.77 -0.09 0.00 0.00 0.00 179.25 178.01 2nef h ARG 196 N 0.40 0.81 0.00 0.00 2.43 -1.77 -3.01 114.38 113.23 2nef h ARG 196 Ca 0.60 -0.65 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2nef h ARG 196 Cb 1.19 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 2nef h ARG 196 CO -0.55 1.26 0.00 0.93 -1.51 0.00 0.00 179.97 180.10 2nef h GLU 197 N 0.55 0.00 0.11 0.20 3.07 -0.93 -3.01 114.58 114.57 2nef h GLU 197 Ca -0.05 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.81 2nef h GLU 197 Cb 1.40 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.31 2nef h GLU 197 CO 0.16 0.00 -0.05 -0.07 -1.40 0.00 0.00 179.01 177.65 2nef h LEU 198 N 0.00 -0.12 -6.03 1.33 3.38 -0.49 -3.44 115.31 109.94 2nef h LEU 198 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 2nef h LEU 198 Cb 0.43 0.03 -0.31 0.00 0.09 0.00 0.00 40.66 40.90 2nef h LEU 198 CO 0.00 0.22 -0.80 -1.00 0.09 0.00 0.00 178.44 176.95 2nef s HIS 199 N -1.94 0.16 -0.43 1.13 3.76 -1.19 -4.96 115.29 111.83 2nef s HIS 199 Ca -0.02 -1.61 0.23 0.00 -0.15 0.00 0.00 55.06 53.51 2nef s HIS 199 Cb 0.00 -0.52 0.27 0.00 1.11 0.00 0.00 32.58 33.44 2nef s HIS 199 CO 0.06 -0.97 1.38 -1.00 -0.85 0.00 0.00 174.74 173.36 2nef h PRO 200 N 5.78 0.00 0.00 8.40 0.13 -1.77 -3.29 132.00 141.25 2nef h PRO 200 Ca 0.17 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 2nef h PRO 200 Cb 0.99 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 2nef h PRO 200 CO 0.25 0.00 -0.03 1.49 -0.23 0.00 0.00 178.00 179.48 2nef h GLU 201 N 0.00 0.00 0.00 0.86 4.57 -1.89 -1.75 114.58 116.38 2nef h GLU 201 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2nef h GLU 201 Cb 0.93 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.52 2nef h GLU 201 CO 0.00 0.03 0.00 0.66 -1.18 0.00 0.00 179.01 178.52 2nef n TYR 202 N -3.18 0.00 -2.58 0.92 4.02 -1.24 -4.79 117.16 110.32 2nef n TYR 202 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 2nef n TYR 202 Cb 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.56 2nef n TYR 202 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2nef n PHE 203 N -0.53 0.00 -1.63 -0.72 3.72 -0.66 -5.15 117.46 112.49 2nef n PHE 203 Ca 0.01 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.12 2nef n PHE 203 Cb 0.01 0.00 0.15 0.00 -0.94 0.00 0.00 39.48 38.70 2nef n PHE 203 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2nef s LYS 204 N 1.05 0.90 -0.45 -1.08 1.02 -1.26 -5.04 119.74 114.88 2nef s LYS 204 Ca 0.00 0.07 0.05 0.00 0.02 0.00 0.00 55.97 56.11 2nef s LYS 204 Cb 0.00 -1.83 0.18 0.00 -0.52 0.00 0.00 37.83 35.66 2nef s LYS 204 CO 0.00 -2.32 0.49 1.21 -0.92 0.00 0.00 175.35 173.81 2nef s ASN 205 N -4.28 0.31 0.00 2.83 3.04 -1.26 -4.81 114.94 110.77 2nef s ASN 205 Ca 0.66 -2.52 0.00 0.00 0.04 0.00 0.00 52.86 51.04 2nef s ASN 205 Cb -0.11 0.48 0.00 0.00 -1.54 0.00 0.00 41.25 40.08 2nef s ASN 205 CO 0.53 -0.13 0.00 0.00 -3.04 0.00 0.00 177.10 174.46