# 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 N C C 113.02 3.31 20.50 23.98 102.16 -130.07 -87.27 59.28 99.90 0.09 0.01 99.82 0.09 0.03 0.00 0.00 0.00 0.05 0.01 1 I C C 38.98 19.51 9.75 27.88 115.48 134.11 -93.95 126.11 89.65 7.95 2.40 87.01 1.11 2.30 0.56 1.30 0.00 6.09 1.63 2 E C C 125.01 3.49 20.21 24.05 99.54 -167.04 -85.77 -28.27 84.27 12.72 3.02 54.26 19.38 10.43 0.40 3.00 0.00 11.27 1.25 3 N C C 74.71 8.35 20.73 29.46 136.70 4.10 -143.99 153.78 71.75 25.31 2.94 39.84 21.29 10.71 0.28 2.86 0.00 24.02 1.00 4 G E E 9.47 16.77 20.10 36.67 142.11 124.09 -155.08 -175.03 40.54 58.77 0.69 29.84 8.78 2.20 0.09 0.65 0.00 57.84 0.59 5 V E E 32.16 14.05 25.91 40.36 128.46 -98.43 -125.94 141.73 5.21 94.76 0.03 4.77 0.32 0.04 0.01 0.01 0.00 94.60 0.25 6 A E E 2.18 26.20 21.04 47.56 122.58 -162.12 -115.69 134.32 1.36 98.63 0.00 1.24 0.06 0.00 0.00 0.00 0.00 98.66 0.03 7 H E E 37.65 14.45 28.50 43.28 118.65 -163.23 -114.48 126.91 0.72 99.28 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.30 0.01 8 I E E 4.60 25.95 20.62 46.95 120.46 -165.30 -115.57 128.10 0.91 99.09 0.00 0.86 0.02 0.00 0.00 0.00 0.00 99.10 0.02 9 R E E 78.72 10.57 27.40 38.31 123.23 -172.29 -121.27 133.15 2.71 97.28 0.01 2.39 0.14 0.01 0.00 0.00 0.00 97.33 0.11 10 S E E 24.94 21.03 16.60 36.24 125.95 -166.83 -117.60 140.56 23.63 76.32 0.04 19.81 2.70 0.20 0.01 0.03 0.00 76.98 0.27 11 T C C 51.40 7.63 21.66 29.54 129.89 168.42 -123.83 170.90 69.17 30.62 0.21 55.59 11.43 1.02 0.04 0.19 0.00 30.66 1.07 12 F C S 129.22 7.28 17.69 25.78 95.43 -87.00 -63.16 -37.43 96.90 1.88 1.22 5.18 53.47 38.67 0.06 1.02 0.00 1.31 0.28 13 N C S 91.96 7.23 18.47 26.21 101.64 15.61 -104.89 -2.58 97.90 0.99 1.11 4.45 50.42 43.16 0.05 1.05 0.00 0.72 0.16 14 N C E 42.78 12.12 20.18 32.73 137.54 30.24 -144.16 156.31 55.69 43.61 0.70 30.78 18.03 7.46 0.06 0.74 0.00 42.18 0.75 15 T E E 6.98 23.20 18.14 41.75 122.82 -148.75 -117.50 133.43 8.98 91.01 0.01 8.08 0.34 0.02 0.00 0.00 0.00 91.44 0.12 16 I E E 25.61 14.01 27.37 42.17 118.97 -161.04 -113.32 127.63 0.34 99.66 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.70 0.01 17 V E E 2.06 26.41 21.98 48.99 120.24 -166.16 -114.35 129.40 0.08 99.92 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.93 0.00 18 T E E 17.43 15.77 28.65 44.84 123.73 -167.72 -117.76 135.94 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.95 0.00 19 I E E 2.07 26.29 22.61 49.55 120.49 -162.57 -113.52 129.62 0.07 99.93 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.93 0.00 20 T E E 17.11 14.21 24.78 39.54 133.57 -177.93 -127.86 157.46 0.28 99.72 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.68 0.06 21 D C C 23.63 14.87 19.65 34.80 124.09 -123.41 -82.76 175.30 63.67 36.28 0.05 63.05 0.60 0.10 0.01 0.03 0.00 35.37 0.83 22 E C T 95.42 12.83 16.76 29.73 91.03 -92.09 -65.19 -19.24 99.34 0.19 0.47 0.26 3.00 96.19 0.01 0.39 0.00 0.12 0.03 23 F C T 141.79 2.67 18.89 21.54 93.42 55.86 -89.21 0.88 99.35 0.08 0.57 0.25 2.98 96.22 0.02 0.48 0.00 0.04 0.02 24 G C S 28.99 12.69 13.79 26.70 97.48 -103.51 86.81 6.33 99.28 0.42 0.30 27.33 70.81 1.21 0.04 0.24 0.00 0.19 0.18 25 N C C 89.93 3.57 20.45 24.75 116.16 142.69 -81.59 138.17 98.03 1.88 0.08 94.95 3.04 0.27 0.02 0.04 0.00 0.95 0.72 26 A E E 47.39 15.99 14.52 29.98 110.52 -114.18 -73.59 127.13 2.41 97.58 0.01 2.35 0.14 0.01 0.01 0.01 0.00 95.89 1.59 27 L E E 57.47 12.18 19.27 31.97 101.49 174.81 -98.49 -31.65 2.43 97.56 0.01 1.53 0.72 0.04 0.00 0.01 0.00 97.68 0.03 28 S E E 24.49 12.67 22.25 35.78 143.62 -3.03 -160.09 155.31 0.76 99.23 0.01 0.57 0.08 0.01 0.00 0.00 0.00 99.32 0.01 29 W E E 92.31 19.81 19.20 37.14 134.57 -168.15 -144.24 145.08 0.82 99.18 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.22 0.02 30 S E E 21.71 15.54 24.12 39.49 139.23 170.64 -144.23 157.59 2.79 97.21 0.01 2.55 0.12 0.01 0.00 0.00 0.00 97.23 0.08 31 S E E 29.80 15.66 24.56 39.44 125.72 -139.73 -110.75 150.25 15.60 84.26 0.14 13.92 1.45 0.18 0.04 0.09 0.00 83.50 0.82 32 A C G 8.87 23.76 17.82 41.35 93.80 -127.17 -67.71 -28.09 47.90 4.66 47.44 24.72 8.98 15.92 13.44 32.52 0.05 3.42 0.95 33 G H G 25.98 13.26 20.95 33.74 91.93 63.56 -60.81 -32.77 32.98 1.00 66.03 7.39 5.83 19.74 15.69 50.37 0.02 0.58 0.38 34 A H G 63.53 7.44 22.30 29.95 91.96 59.24 -71.57 -20.69 29.69 0.78 69.52 5.36 5.13 18.76 17.00 52.95 0.02 0.45 0.32 35 L H G 49.00 15.90 16.69 32.16 96.08 56.90 -85.82 -3.65 45.25 1.71 53.03 6.26 9.81 28.61 14.79 38.41 0.17 0.89 1.06 36 G C T 37.03 6.83 21.59 28.71 107.49 -102.24 90.07 11.85 85.98 2.95 11.07 24.97 17.49 44.03 3.53 6.93 0.01 1.37 1.67 37 F C C 52.86 17.96 12.06 29.11 109.86 121.98 -90.64 111.05 86.89 8.69 4.42 63.10 15.78 6.84 1.89 2.51 0.01 3.40 6.49 38 K C T 146.86 3.60 15.52 20.98 111.70 -128.08 -73.04 130.83 91.56 4.47 3.97 18.20 16.08 57.33 0.99 2.87 0.01 2.41 2.12 39 G C T 62.66 1.13 15.56 16.14 96.87 12.59 80.10 -0.51 94.55 1.52 3.94 10.89 23.39 60.16 0.58 3.43 0.00 0.79 0.77 40 S C C 51.97 9.70 10.03 20.56 120.58 112.73 -100.40 156.37 88.83 3.17 8.00 39.90 34.52 14.06 1.58 6.43 0.00 1.19 2.31 41 K C S 163.16 1.85 16.16 18.46 96.57 -128.42 -81.22 -13.38 86.33 2.38 11.30 17.58 45.02 24.25 1.74 8.84 0.01 1.16 1.40 42 K C S 116.13 5.31 18.45 24.79 121.39 75.30 -103.92 144.37 82.45 5.42 12.13 27.69 35.45 19.68 2.25 9.29 0.02 2.49 3.13 43 S C C 33.72 19.39 14.10 32.21 114.37 -121.25 -81.42 131.74 87.19 4.97 7.84 66.46 13.17 6.45 2.88 4.99 0.00 1.82 4.23 44 T C C 43.24 11.10 22.84 34.10 123.86 -169.61 -113.17 148.59 91.80 0.74 7.46 76.15 13.56 0.75 8.42 0.27 0.00 0.15 0.69 45 P H H 54.82 15.48 20.29 34.97 92.94 -116.89 -60.75 -34.81 8.44 0.03 91.53 1.24 1.15 5.59 91.37 0.60 0.01 0.01 0.02 46 F H H 98.76 6.61 27.01 34.30 91.73 54.25 -64.61 -40.64 2.98 0.01 97.01 0.42 0.28 1.97 96.96 0.36 0.00 0.00 0.00 47 A H H 5.70 20.77 22.79 43.46 91.41 51.25 -63.96 -42.77 0.37 0.00 99.63 0.09 0.03 0.16 99.57 0.15 0.00 0.00 0.00 48 A H H 1.98 26.42 22.56 48.88 91.35 50.65 -63.73 -42.34 0.11 0.00 99.89 0.02 0.00 0.05 99.86 0.06 0.00 0.00 0.00 49 Q H H 64.25 12.82 28.79 41.78 91.57 50.41 -64.10 -42.09 0.10 0.00 99.90 0.01 0.00 0.06 99.90 0.03 0.00 0.00 0.00 50 M H H 57.77 9.42 30.05 41.17 91.54 49.88 -64.10 -42.30 0.15 0.00 99.85 0.01 0.01 0.09 99.86 0.02 0.00 0.00 0.00 51 A H H 1.45 25.92 25.36 50.94 91.50 49.88 -63.81 -43.09 0.19 0.00 99.81 0.02 0.01 0.12 99.83 0.03 0.00 0.00 0.00 52 S H H 2.58 25.97 25.18 50.64 91.70 50.74 -63.52 -42.78 0.23 0.00 99.77 0.02 0.01 0.15 99.79 0.04 0.00 0.00 0.00 53 E H H 82.68 8.39 29.99 39.82 91.30 50.18 -63.80 -42.29 0.26 0.00 99.74 0.02 0.01 0.17 99.75 0.04 0.00 0.00 0.00 54 T H H 35.84 10.97 29.01 41.27 91.74 49.13 -64.68 -42.17 0.43 0.00 99.57 0.05 0.03 0.29 99.58 0.06 0.00 0.00 0.00 55 A H H 0.83 27.39 24.11 51.51 91.60 50.37 -64.17 -43.09 0.37 0.00 99.63 0.05 0.02 0.23 99.64 0.06 0.00 0.00 0.00 56 S H H 8.19 22.22 24.03 45.32 91.64 50.82 -62.97 -43.05 0.21 0.00 99.79 0.02 0.01 0.13 99.80 0.04 0.00 0.00 0.00 57 K H H 107.70 3.60 29.05 32.99 91.34 50.14 -63.63 -41.98 0.14 0.00 99.86 0.01 0.01 0.09 99.86 0.04 0.00 0.00 0.00 58 S H H 17.43 12.93 23.59 37.21 91.60 49.68 -64.04 -42.07 0.16 0.00 99.84 0.01 0.01 0.11 99.81 0.06 0.00 0.00 0.00 59 A H H 1.62 26.25 15.84 42.73 91.48 50.85 -63.51 -42.90 0.32 0.00 99.68 0.03 0.01 0.23 99.56 0.16 0.00 0.00 0.00 60 M H H 86.04 11.34 19.82 31.06 91.49 49.78 -63.49 -40.33 0.91 0.00 99.09 0.06 0.04 0.74 98.66 0.51 0.00 0.00 0.00 61 E H H 141.94 1.60 21.48 22.30 90.36 53.06 -65.81 -29.00 6.22 0.00 93.77 0.10 0.14 6.19 93.11 0.46 0.00 0.00 0.00 62 H C T 77.30 11.99 15.27 27.86 93.49 50.76 -87.67 0.44 78.64 0.02 21.35 0.31 0.89 77.14 21.03 0.62 0.00 0.00 0.02 63 G C T 46.87 3.33 22.77 26.16 98.02 -102.66 88.03 12.44 99.81 0.01 0.18 1.38 0.80 97.73 0.07 0.02 0.00 0.00 0.00 64 L C C 15.31 23.56 10.48 33.45 114.15 156.56 -76.28 131.71 95.13 4.79 0.08 95.27 0.42 0.08 0.02 0.03 0.00 3.84 0.34 65 K C C 125.33 4.67 23.62 29.27 101.08 176.77 -104.97 -16.62 91.40 8.56 0.04 69.81 20.57 0.40 0.00 0.04 0.00 8.96 0.21 66 T E E 42.27 10.75 24.58 36.14 133.37 36.75 -138.28 144.13 23.95 75.97 0.08 18.89 4.09 0.35 0.01 0.07 0.00 76.27 0.31 67 V E E 2.82 26.97 17.06 45.12 125.33 -166.20 -126.50 133.99 1.49 98.51 0.00 1.41 0.06 0.00 0.00 0.00 0.00 98.47 0.06 68 E E E 57.19 10.61 28.22 39.79 117.75 -156.92 -108.01 127.45 0.39 99.61 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.64 0.01 69 V E E 3.00 26.52 18.97 46.28 120.87 -164.98 -115.55 129.20 0.31 99.69 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.71 0.00 70 T E E 34.31 11.12 27.87 39.92 118.26 -164.21 -113.64 124.88 0.35 99.65 0.00 0.33 0.00 0.00 0.00 0.00 0.00 99.66 0.01 71 V E E 6.07 25.05 17.20 42.73 121.21 -167.90 -114.89 130.15 2.41 97.59 0.00 2.39 0.05 0.00 0.00 0.00 0.00 97.44 0.11 72 K E E 95.88 8.30 24.74 33.16 117.12 -168.59 -112.11 123.90 37.89 62.08 0.03 30.99 5.66 0.22 0.00 0.03 0.00 62.64 0.45 73 G C C 20.71 10.26 20.73 31.59 139.47 53.15 149.26 -177.20 88.21 11.74 0.05 49.06 38.29 1.04 0.01 0.06 0.00 10.97 0.58 74 P C C 78.55 8.04 19.59 27.99 114.06 -56.41 -74.57 145.35 97.21 2.65 0.14 54.37 41.52 1.69 0.03 0.13 0.00 1.74 0.53 75 G C S 26.90 7.70 19.11 28.02 140.28 85.20 149.87 -174.70 97.79 0.89 1.32 27.60 68.37 1.84 0.82 0.35 0.00 0.23 0.80 76 P C T 99.35 3.76 21.08 25.18 105.04 -49.26 -67.13 122.17 86.78 0.25 12.97 2.40 10.54 74.42 8.17 4.08 0.01 0.11 0.27 77 G C T 16.59 16.54 17.02 33.08 95.74 31.08 64.02 -2.36 87.30 0.14 12.57 8.23 5.99 73.02 9.87 2.71 0.00 0.06 0.12 78 R H H 51.53 20.52 16.62 35.99 92.82 104.75 -60.83 -42.29 5.30 0.02 94.68 2.35 0.84 2.06 93.29 1.45 0.00 0.01 0.01 79 E H H 113.91 4.86 24.71 30.36 91.59 51.21 -63.38 -41.26 0.98 0.00 99.01 0.21 0.08 0.51 98.83 0.36 0.00 0.00 0.00 80 S H H 38.52 7.08 24.79 32.53 91.69 50.05 -64.73 -41.56 0.33 0.00 99.67 0.06 0.02 0.17 99.53 0.22 0.00 0.00 0.00 81 A H H 2.50 25.27 19.57 44.84 91.99 50.44 -64.58 -42.78 0.24 0.00 99.76 0.04 0.01 0.12 99.74 0.09 0.00 0.00 0.00 82 I H H 20.45 20.82 22.31 42.02 91.59 50.00 -63.57 -42.63 0.16 0.00 99.84 0.02 0.01 0.08 99.87 0.02 0.00 0.00 0.00 83 R H H 132.21 2.90 27.20 29.76 91.50 50.65 -63.27 -42.43 0.08 0.00 99.92 0.01 0.00 0.04 99.94 0.02 0.00 0.00 0.00 84 A H H 19.86 12.59 21.57 35.07 91.69 50.45 -64.14 -42.16 0.10 0.00 99.90 0.01 0.00 0.06 99.90 0.03 0.00 0.00 0.00 85 L H H 3.38 26.17 15.37 42.00 91.79 49.82 -64.53 -42.29 0.23 0.00 99.77 0.01 0.01 0.16 99.73 0.08 0.00 0.00 0.00 86 Q H H 98.16 9.12 19.23 28.99 91.36 51.04 -62.82 -40.00 0.72 0.00 99.28 0.03 0.02 0.61 99.06 0.27 0.00 0.00 0.00 87 S H H 86.49 1.63 19.71 20.87 89.87 55.41 -65.90 -25.02 9.40 0.00 90.60 0.14 0.20 9.50 89.71 0.44 0.00 0.00 0.00 88 A C T 37.90 13.09 14.10 27.94 92.84 55.08 -86.97 -1.44 85.54 0.02 14.44 0.25 1.06 83.85 14.30 0.52 0.00 0.00 0.02 89 G C T 53.09 2.06 21.78 23.26 96.50 -103.32 87.33 11.11 99.88 0.01 0.11 1.04 1.15 97.75 0.03 0.02 0.00 0.00 0.00 90 L C C 15.78 23.27 9.99 32.64 118.36 140.36 -91.07 137.89 95.52 4.46 0.01 94.63 0.97 0.05 0.00 0.00 0.00 4.20 0.14 91 E E E 118.77 3.14 25.20 28.25 111.84 -133.41 -90.59 122.78 36.21 63.75 0.04 35.54 0.66 0.06 0.01 0.02 0.00 63.04 0.67 92 V E E 24.11 23.67 11.50 34.41 113.75 -152.45 -91.32 122.27 4.92 95.07 0.01 5.18 0.07 0.01 0.00 0.00 0.00 94.47 0.27 93 T E E 72.13 5.40 22.41 28.37 100.03 176.04 -96.05 -30.35 6.26 93.73 0.01 4.28 1.53 0.05 0.00 0.00 0.00 94.11 0.03 94 A E E 37.70 8.49 23.57 32.96 141.58 0.34 -156.24 152.13 0.95 99.05 0.00 0.75 0.07 0.00 0.00 0.00 0.00 99.16 0.01 95 I E E 36.26 22.84 14.66 36.49 123.66 -163.61 -128.29 128.19 0.32 99.68 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.68 0.01 96 R E E 103.64 6.99 24.47 32.07 128.02 -176.48 -129.49 139.58 0.59 99.40 0.00 0.55 0.02 0.00 0.00 0.00 0.00 99.41 0.02 97 D E E 57.76 16.27 15.79 31.36 112.81 -131.05 -87.20 123.31 7.16 92.83 0.01 6.66 0.28 0.02 0.00 0.00 0.00 92.86 0.18 98 V C C 63.80 10.58 17.12 28.46 103.61 -176.90 -102.32 7.37 84.00 15.96 0.04 66.56 16.19 0.39 0.01 0.04 0.00 16.20 0.61 99 T C C 58.46 8.87 15.48 25.61 117.60 114.46 -93.53 136.12 92.55 7.40 0.05 47.37 45.53 0.53 0.01 0.05 0.00 5.71 0.81 100 P C C 87.63 6.15 16.52 23.86 111.20 -109.34 -70.12 142.22 95.71 4.22 0.06 72.49 22.91 0.63 0.01 0.06 0.00 3.08 0.82 101 V C C 61.49 11.46 12.02 24.39 118.75 -122.27 -103.19 131.80 93.45 6.41 0.13 74.58 18.75 0.41 0.05 0.09 0.00 3.38 2.73 102 P C C 77.23 5.85 14.91 22.23 113.68 -109.47 -66.51 145.28 91.90 6.01 2.09 80.45 6.88 4.22 0.42 1.89 0.00 3.88 2.27 103 H C C 108.39 9.21 11.11 21.25 115.97 -147.22 -101.85 127.18 84.46 6.90 8.64 46.39 19.10 18.42 1.28 7.87 0.00 3.09 3.84 104 N C T 120.56 3.06 14.67 18.60 99.72 2.82 50.13 37.07 85.14 3.17 11.69 25.80 24.18 34.84 1.22 10.89 0.00 1.56 1.50 105 G C C 47.55 4.96 13.15 19.42 102.99 -65.44 83.68 1.17 87.75 3.40 8.85 33.56 27.32 26.46 0.99 8.42 0.00 1.67 1.58 106 C C C 60.32 10.25 10.21 21.34 114.89 125.29 -88.98 133.19 89.38 7.11 3.50 59.02 21.80 7.83 0.81 2.95 0.00 3.17 4.43 107 R C C 143.71 4.20 13.65 19.64 119.65 -153.40 -103.81 138.68 95.51 4.22 0.26 69.70 25.62 0.53 0.11 0.14 0.00 1.66 2.25 108 P C C 76.55 6.71 11.44 19.84 115.85 -105.46 -65.75 149.77 98.76 0.65 0.59 93.78 4.16 0.96 0.19 0.31 0.00 0.31 0.30 109 P C C 89.39 5.36 10.07 17.24 110.76 -102.55 -67.01 147.87 90.56 1.00 8.43 67.79 9.39 12.65 1.66 7.42 0.00 0.50 0.59 110 K C C 154.13 2.16 9.47 13.38 111.56 -108.08 -84.03 133.27 87.47 2.18 10.35 51.96 19.74 15.15 1.84 9.10 0.00 1.10 1.13 111 R C C 171.35 2.42 7.84 12.29 113.42 -128.79 -89.66 133.19 87.01 3.21 9.78 64.03 14.07 8.19 1.98 8.48 0.00 1.82 1.42 112 R C C 172.18 2.23 7.41 11.66 113.27 -137.89 -90.22 131.47 93.76 2.47 3.78 89.48 1.69 3.50 1.25 1.71 0.00 1.31 1.06 113 R C C 176.11 2.19 9.89 13.78 110.10 -133.85 -88.95 124.12 99.85 0.09 0.06 99.48 0.23 0.19 0.02 0.02 0.00 0.04 0.03