# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 Q C C 114.01 5.52 15.90 22.89 118.99 -162.38 -102.26 134.99 99.64 0.35 0.01 99.62 0.07 0.03 0.00 0.00 0.00 0.26 0.01 1 A C C 56.40 9.65 12.54 23.16 119.31 -149.39 -96.88 137.04 69.75 30.08 0.18 67.62 0.66 0.51 0.04 0.09 0.00 30.36 0.73 2 V E E 75.34 8.70 14.36 24.36 119.35 -156.00 -110.25 130.65 26.00 73.81 0.19 22.66 2.68 0.48 0.07 0.13 0.00 72.45 1.53 3 V E E 59.54 12.26 14.00 27.14 120.70 -160.42 -113.00 131.32 16.27 83.61 0.12 14.94 1.11 0.18 0.05 0.07 0.00 81.77 1.87 4 T E E 70.34 8.53 17.04 26.71 122.86 -166.68 -116.88 137.97 29.51 70.32 0.17 25.95 2.68 0.38 0.05 0.13 0.00 69.59 1.23 5 Q C C 81.92 12.19 13.93 26.48 122.53 -159.94 -109.36 139.80 57.63 42.12 0.24 45.34 10.58 0.97 0.05 0.21 0.00 41.52 1.31 6 E C C 104.59 7.05 16.93 24.90 116.51 -118.98 -82.14 139.76 78.54 21.19 0.27 62.71 13.34 1.17 0.04 0.24 0.00 21.74 0.76 7 S C C 60.55 10.31 15.38 26.04 102.75 -126.98 -73.91 3.48 78.27 21.40 0.33 61.89 13.52 1.34 0.05 0.29 0.00 22.29 0.63 8 A E E 57.13 9.28 17.37 27.36 128.72 -28.86 -124.08 147.88 39.82 59.96 0.22 30.92 8.24 0.70 0.04 0.19 0.00 59.27 0.65 9 L E E 36.24 17.60 14.83 32.33 127.50 -168.53 -128.32 140.26 7.17 92.80 0.03 6.49 0.63 0.05 0.00 0.02 0.00 92.57 0.24 10 T E E 80.33 6.79 22.07 30.14 122.70 -156.68 -116.68 135.83 1.75 98.24 0.00 1.68 0.09 0.01 0.00 0.00 0.00 98.12 0.10 11 T E E 17.68 19.42 13.91 33.22 134.21 177.08 -138.16 153.88 4.85 95.14 0.01 4.79 0.19 0.01 0.00 0.00 0.00 94.07 0.93 12 S C C 53.87 4.69 22.63 27.03 120.83 -114.04 -81.12 156.99 91.08 8.90 0.03 90.15 1.03 0.09 0.01 0.02 0.00 8.32 0.38 13 P C T 65.31 12.79 14.03 27.12 109.88 -82.57 -60.13 136.40 99.42 0.31 0.27 0.27 3.00 96.29 0.01 0.20 0.00 0.18 0.05 14 G C T 51.08 2.99 19.01 22.51 95.89 22.36 89.06 -5.80 99.57 0.20 0.22 0.51 3.24 95.91 0.01 0.18 0.00 0.13 0.02 15 E C C 79.76 7.98 16.54 25.79 124.74 117.56 -85.73 157.32 93.85 6.06 0.09 79.16 14.54 0.33 0.01 0.09 0.00 5.27 0.59 16 T C C 76.35 8.31 18.41 27.93 123.13 -130.93 -109.02 142.51 61.41 38.58 0.01 61.43 0.51 0.02 0.00 0.01 0.00 37.58 0.46 17 V E E 13.86 21.51 14.71 36.27 126.60 -167.15 -123.17 139.69 0.74 99.26 0.00 0.75 0.01 0.00 0.00 0.00 0.00 99.19 0.05 18 T E E 65.35 7.73 24.96 33.21 117.93 -148.36 -107.05 128.67 0.28 99.72 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.70 0.01 19 L E E 5.30 25.54 16.48 42.70 120.14 -166.98 -112.36 130.73 3.00 96.99 0.00 2.80 0.10 0.00 0.00 0.00 0.00 97.02 0.07 20 T E E 48.24 9.43 26.82 36.75 124.11 -165.89 -115.43 137.43 27.84 72.14 0.02 25.58 1.05 0.06 0.00 0.01 0.00 73.10 0.20 21 C E E 5.99 25.18 16.41 41.75 125.86 -164.20 -123.07 137.97 36.46 63.43 0.11 33.63 2.03 0.22 0.03 0.08 0.00 62.89 1.13 22 R E E 105.81 7.90 25.79 34.12 121.20 -169.72 -114.05 136.10 29.91 69.74 0.35 26.10 2.78 0.51 0.18 0.23 0.00 60.76 9.44 23 S C C 22.08 20.98 13.66 33.66 119.86 -158.98 -100.71 141.94 58.12 40.88 1.00 50.81 4.82 1.53 0.28 0.83 0.00 36.94 4.80 24 N C C 101.97 5.07 19.85 25.61 103.39 -153.97 -95.56 11.50 83.55 15.32 1.14 47.41 30.73 6.07 0.18 1.09 0.00 12.87 1.64 25 I C S 92.02 8.40 15.44 24.62 108.52 70.03 -99.11 42.12 85.70 11.51 2.79 23.33 47.63 15.65 0.46 2.25 0.01 8.52 2.15 26 G C S 38.77 5.28 18.55 24.56 125.75 -74.55 100.96 -170.15 85.50 12.22 2.28 26.66 46.28 13.09 0.28 2.06 0.00 10.03 1.59 27 A C C 67.52 6.35 18.64 25.79 115.41 -37.15 -79.41 139.91 79.40 18.30 2.30 57.02 15.72 6.17 0.44 2.24 0.00 15.22 3.18 28 V C C 30.77 20.81 11.37 31.11 116.46 -143.61 -98.17 130.62 66.85 31.49 1.66 55.96 6.95 2.45 0.63 1.20 0.00 22.69 10.13 29 T C C 83.74 5.25 19.98 25.78 111.97 -164.86 -102.31 127.61 79.29 19.24 1.46 58.37 15.76 4.67 0.41 1.23 0.00 15.78 3.78 30 S C S 56.12 9.27 17.00 26.73 113.69 -95.85 -102.32 128.68 83.96 12.80 3.24 30.52 38.44 16.14 0.61 2.54 0.01 8.88 2.87 31 S C S 60.80 8.35 18.80 27.49 105.07 47.46 -85.29 45.45 89.20 7.76 3.04 17.21 45.94 26.66 0.37 2.60 0.00 6.00 1.22 32 N C S 56.26 14.53 18.96 32.83 104.98 56.30 -98.89 34.01 76.25 21.43 2.31 26.10 33.48 17.48 0.25 2.12 0.00 19.00 1.57 33 C E E 26.12 15.52 23.27 38.72 126.49 110.13 -120.17 144.28 42.94 56.49 0.57 32.52 9.73 1.66 0.14 0.51 0.00 52.55 2.89 34 A E E 2.91 25.69 20.12 46.16 120.35 -134.28 -95.17 142.13 24.48 75.37 0.15 21.85 1.79 0.26 0.04 0.10 0.00 75.22 0.75 35 N E E 31.04 16.37 27.80 43.69 131.43 -170.40 -129.63 147.92 5.39 94.58 0.03 4.96 0.34 0.05 0.01 0.01 0.00 94.37 0.26 36 W E E 10.61 24.13 21.81 45.83 123.76 -149.63 -110.98 136.41 2.55 97.43 0.01 2.35 0.14 0.02 0.00 0.00 0.00 97.40 0.08 37 V E E 16.86 16.61 23.60 40.42 130.96 -174.18 -128.54 148.43 1.74 98.26 0.01 1.59 0.08 0.01 0.00 0.00 0.00 98.23 0.09 38 Q E E 38.63 15.14 20.72 36.09 122.49 -152.23 -110.79 137.56 4.03 95.96 0.01 3.55 0.29 0.03 0.00 0.01 0.00 95.90 0.22 39 E E E 55.42 13.64 15.84 30.14 120.32 -157.11 -108.12 132.65 27.75 72.21 0.03 24.59 2.27 0.13 0.01 0.03 0.00 71.73 1.23 40 K C C 92.20 6.78 14.94 23.08 121.27 -158.73 -104.52 148.81 93.16 6.80 0.04 90.16 2.79 0.20 0.01 0.03 0.00 6.01 0.80 41 P C T 96.05 4.08 11.80 17.44 107.81 -86.32 -60.32 137.98 98.99 0.27 0.73 0.94 6.02 91.91 0.02 0.87 0.00 0.18 0.06 42 D C T 133.61 0.64 13.09 12.51 95.46 10.85 68.54 10.46 99.06 0.21 0.73 1.13 5.43 92.35 0.02 0.89 0.00 0.15 0.04 43 H C S 98.18 6.29 10.06 18.16 127.12 97.45 -116.03 156.24 83.77 14.76 1.47 33.12 46.60 4.97 0.20 1.46 0.00 9.67 3.98 44 F C C 141.10 3.18 15.25 19.45 114.75 -112.56 -86.44 136.86 87.23 12.63 0.14 75.77 9.91 0.76 0.03 0.12 0.00 12.49 0.91 45 F C C 72.04 16.29 11.59 27.20 115.73 -121.53 -84.06 138.39 62.36 37.52 0.12 56.60 3.52 0.34 0.02 0.09 0.00 38.63 0.80 46 T E E 58.23 10.11 20.28 30.83 126.88 -171.41 -121.37 144.47 11.51 88.38 0.11 9.53 1.75 0.29 0.03 0.08 0.00 87.69 0.63 47 G E E 17.42 17.49 18.87 35.61 130.81 -155.77 -125.06 154.11 5.73 94.19 0.08 4.54 1.13 0.21 0.02 0.06 0.00 93.85 0.21 48 L E E 30.75 17.56 21.92 39.06 122.45 -153.09 -116.48 134.49 4.26 95.68 0.05 3.85 0.39 0.08 0.02 0.03 0.00 95.42 0.21 49 I E E 34.09 18.43 22.02 39.72 120.90 -162.51 -110.76 130.65 6.32 93.61 0.08 5.39 0.66 0.13 0.03 0.04 0.00 93.23 0.52 50 G E E 12.14 16.97 21.35 37.60 139.38 156.93 -159.12 168.60 21.18 78.48 0.34 15.56 5.46 1.13 0.09 0.24 0.00 76.18 1.35 51 D E E 53.68 10.86 22.95 34.00 119.66 -116.54 -111.90 130.58 48.65 50.62 0.73 41.26 5.87 1.32 0.22 0.56 0.00 48.80 1.98 52 T C C 33.28 19.34 14.33 32.89 97.76 -161.17 -82.29 -6.66 79.51 13.01 7.48 30.60 21.67 28.95 1.18 5.94 0.02 9.71 1.92 53 N C T 107.78 4.16 19.55 24.45 95.71 70.32 -83.62 -9.28 86.32 6.20 7.48 18.36 32.44 36.44 0.96 6.13 0.01 4.03 1.62 54 N C C 89.63 6.14 16.52 23.64 109.60 62.05 -103.54 89.79 87.57 6.35 6.08 41.73 32.20 13.81 1.01 5.29 0.00 3.52 2.43 55 R C C 114.56 11.95 11.82 23.93 117.55 -151.99 -94.17 138.79 91.31 7.18 1.52 74.22 13.49 3.10 0.50 1.07 0.00 3.62 4.00 56 R C C 123.48 6.81 13.70 21.88 117.24 -120.39 -84.27 143.86 90.83 7.99 1.18 76.75 9.97 3.27 0.38 0.81 0.00 2.86 5.96 57 S C T 89.28 2.62 13.87 17.70 109.59 -94.32 -64.76 136.48 97.09 1.75 1.15 6.90 11.07 79.03 0.19 1.00 0.00 1.11 0.71 58 G C T 56.30 2.67 15.96 19.17 98.30 19.46 85.99 -2.82 98.26 1.09 0.66 7.07 13.52 77.58 0.07 0.66 0.00 0.89 0.20 59 V C C 37.68 16.06 10.75 26.78 117.57 104.89 -101.40 130.50 82.18 17.43 0.39 47.27 35.42 0.91 0.15 0.23 0.00 6.17 9.84 60 P C C 65.97 7.00 18.74 26.66 112.08 -115.59 -67.51 147.47 86.97 11.41 1.62 69.69 11.51 5.15 0.37 1.54 0.00 7.96 3.78 61 A C C 47.54 14.47 17.23 31.02 106.84 -110.19 -71.16 131.08 89.08 6.44 4.47 64.66 14.40 9.27 0.46 5.00 0.00 5.10 1.12 62 R C S 80.71 13.59 21.97 34.87 99.04 91.97 -91.02 -9.92 84.43 12.24 3.32 30.73 46.88 6.78 0.31 3.03 0.00 11.41 0.85 63 F E E 12.66 24.18 16.88 40.76 125.67 58.07 -120.05 138.07 17.02 81.57 1.42 13.14 3.95 1.42 0.36 1.04 0.00 78.72 1.36 64 S E E 42.73 9.92 25.88 36.54 134.67 166.83 -136.13 154.03 6.18 93.76 0.06 5.46 0.61 0.08 0.02 0.03 0.00 93.14 0.67 65 G E E 13.16 21.17 17.16 37.24 143.53 164.05 -158.28 168.11 6.43 93.55 0.02 5.61 0.55 0.04 0.00 0.01 0.00 93.69 0.10 66 S E E 46.33 7.38 25.76 34.22 136.87 -145.28 -145.12 157.85 3.49 96.50 0.01 3.04 0.26 0.02 0.00 0.01 0.00 96.62 0.04 67 L E E 49.65 19.52 14.52 33.33 118.01 -132.26 -104.52 128.53 2.70 97.28 0.02 2.18 0.29 0.04 0.00 0.01 0.00 97.33 0.15 68 I E E 82.88 6.52 18.68 26.33 113.50 -174.68 -127.88 105.85 8.04 91.85 0.11 5.77 1.69 0.56 0.02 0.09 0.00 91.20 0.66 69 G C T 50.67 2.34 18.67 21.43 108.85 -48.35 60.42 -128.69 99.32 0.41 0.27 0.54 7.32 91.54 0.01 0.26 0.00 0.30 0.04 70 D C T 78.84 11.51 15.85 27.87 95.96 -19.42 -95.68 10.45 99.64 0.18 0.18 0.50 7.36 91.81 0.01 0.18 0.00 0.12 0.02 71 K E E 78.28 10.03 21.74 32.88 127.73 90.51 -116.31 142.82 5.60 94.38 0.02 3.53 1.75 0.21 0.00 0.01 0.00 93.71 0.78 72 A E E 2.84 25.44 17.19 43.48 124.26 -162.80 -120.40 138.54 2.03 97.97 0.00 1.86 0.06 0.00 0.00 0.00 0.00 98.02 0.06 73 A E E 20.47 12.03 27.69 40.91 125.39 -164.64 -120.82 137.19 3.35 96.65 0.00 2.94 0.13 0.01 0.00 0.00 0.00 96.90 0.02 74 L E E 2.44 26.79 19.63 47.32 121.30 -166.67 -116.95 130.15 0.77 99.23 0.00 0.70 0.01 0.00 0.00 0.00 0.00 99.27 0.00 75 T E E 39.85 10.45 27.79 39.14 119.55 -162.85 -114.57 127.82 0.16 99.84 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.83 0.01 76 I E E 5.69 25.13 17.18 43.01 117.57 -166.19 -113.79 123.55 1.40 98.60 0.00 1.50 0.01 0.00 0.00 0.00 0.00 98.19 0.29 77 T C C 60.44 7.28 23.74 31.42 128.22 -174.61 -120.43 148.57 82.67 17.26 0.07 49.02 24.36 6.81 0.00 0.09 0.00 19.34 0.38 78 G C S 45.01 3.49 24.07 27.98 93.84 17.62 69.38 28.82 99.23 0.75 0.03 4.70 85.98 8.58 0.00 0.03 0.00 0.65 0.06 79 A C C 9.82 24.28 9.65 33.25 116.09 -158.18 -71.33 141.12 99.64 0.35 0.01 98.45 1.25 0.03 0.00 0.00 0.00 0.14 0.13 80 Q C C 83.54 4.58 23.74 28.18 130.33 -165.95 -121.45 157.47 99.74 0.23 0.03 99.51 0.26 0.01 0.01 0.01 0.00 0.04 0.16 81 T H G 78.18 10.65 15.59 26.79 91.43 -104.64 -59.32 -31.36 3.23 0.02 96.75 0.23 0.22 1.91 0.28 97.34 0.00 0.02 0.00 82 E H G 131.48 2.85 21.18 24.43 89.97 62.34 -71.18 -16.15 2.89 0.03 97.08 0.13 0.19 1.88 0.19 97.59 0.00 0.03 0.00 83 D H G 13.81 21.07 14.82 36.17 92.96 63.62 -83.85 -2.79 4.21 0.05 95.74 0.69 0.45 1.65 0.28 96.88 0.00 0.05 0.00 84 E C C 68.76 13.80 19.74 33.73 114.72 114.56 -70.63 136.28 98.15 1.81 0.04 96.46 1.89 0.05 0.00 0.03 0.00 1.48 0.09 85 A E E 18.30 13.82 22.17 36.58 145.88 122.75 -172.44 176.00 4.31 95.68 0.00 4.08 0.21 0.01 0.00 0.00 0.00 95.30 0.40 86 I E E 55.23 11.48 25.06 37.02 117.54 -90.11 -102.04 131.26 0.48 99.52 0.00 0.47 0.01 0.00 0.00 0.00 0.00 99.51 0.01 87 Y E E 5.64 25.67 18.84 45.06 124.29 -166.38 -116.01 137.77 0.25 99.75 0.00 0.22 0.01 0.00 0.00 0.00 0.00 99.77 0.00 88 F E E 29.17 15.69 27.68 43.45 127.10 -167.02 -122.02 143.16 0.24 99.76 0.00 0.21 0.01 0.00 0.00 0.00 0.00 99.78 0.00 89 C E E 1.56 26.67 21.95 49.13 124.61 -165.33 -118.66 137.43 0.40 99.60 0.00 0.36 0.01 0.00 0.00 0.00 0.00 99.62 0.00 90 A E E 11.73 16.33 27.31 43.87 125.04 -165.65 -119.53 137.94 0.29 99.71 0.00 0.27 0.01 0.00 0.00 0.00 0.00 99.72 0.00 91 L E E 5.74 23.91 20.41 44.49 123.93 -163.38 -117.50 136.37 0.18 99.82 0.00 0.16 0.01 0.00 0.00 0.00 0.00 99.83 0.00 92 W E E 64.42 11.77 22.44 35.07 120.01 -159.94 -113.14 129.10 0.64 99.36 0.00 0.55 0.04 0.00 0.00 0.00 0.00 99.40 0.02 93 Y E E 50.40 15.85 13.91 30.00 121.23 173.52 -133.94 120.70 9.14 90.83 0.02 7.02 1.37 0.18 0.00 0.02 0.00 91.21 0.19 94 N C T 116.45 3.23 16.36 20.65 95.85 -28.83 53.81 36.16 99.36 0.48 0.16 0.80 11.23 87.39 0.00 0.17 0.00 0.37 0.04 95 N C T 126.19 2.90 15.81 19.69 94.47 -42.37 71.17 10.06 99.70 0.19 0.11 0.78 11.34 87.59 0.00 0.13 0.00 0.14 0.01 96 L E E 66.35 9.24 16.65 27.36 125.96 104.29 -113.93 142.36 8.32 91.67 0.01 6.09 1.54 0.08 0.00 0.01 0.00 92.14 0.14 97 W E E 77.16 15.83 17.89 33.66 116.62 -138.45 -97.97 128.97 0.86 99.14 0.00 0.80 0.02 0.00 0.00 0.00 0.00 99.18 0.01 98 V E E 24.23 16.58 22.03 38.67 123.49 -169.25 -119.55 133.69 0.37 99.63 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.01 99 F E E 45.51 19.20 21.59 39.70 118.10 -145.12 -97.44 131.80 4.67 95.33 0.00 4.11 0.30 0.03 0.00 0.00 0.00 95.41 0.15 100 G C C 12.55 18.81 20.63 38.21 117.73 -151.36 -88.45 -151.45 59.93 39.97 0.10 44.92 11.93 1.51 0.01 0.11 0.00 41.08 0.44 101 G C C 33.16 10.86 23.85 34.13 104.12 -82.99 -79.52 -4.30 75.63 24.27 0.10 51.59 21.05 1.62 0.01 0.11 0.00 25.14 0.48 102 G C C 13.72 16.65 20.29 36.21 127.87 -126.64 97.78 177.69 71.73 28.21 0.06 61.49 7.36 0.53 0.01 0.07 0.00 30.10 0.44 103 T E E 19.93 20.09 19.33 38.99 126.28 -94.73 -118.86 141.57 15.95 84.04 0.01 15.19 0.38 0.02 0.00 0.00 0.00 84.14 0.26 104 K E E 94.95 9.08 25.16 34.50 117.87 -140.84 -102.24 128.30 0.71 99.29 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.28 0.03 105 L E E 8.50 24.60 15.54 40.45 122.14 -164.43 -114.06 133.27 0.65 99.34 0.00 0.65 0.01 0.00 0.00 0.00 0.00 99.33 0.01 106 T E E 53.15 7.15 24.76 32.42 120.83 -161.52 -112.66 133.30 1.57 98.43 0.00 1.56 0.04 0.00 0.00 0.00 0.00 98.33 0.07 107 V E E 25.01 20.28 13.01 33.06 114.68 -144.97 -95.67 125.74 9.85 90.13 0.01 10.27 0.13 0.01 0.00 0.00 0.00 88.87 0.71 108 L C C 77.44 8.32 19.27 28.15 111.22 -158.14 -91.50 122.81 99.57 0.43 0.00 99.61 0.04 0.01 0.00 0.00 0.00 0.33 0.01