# 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 M C C 114.90 5.46 12.57 19.55 115.70 -143.29 -90.55 134.33 99.83 0.14 0.03 99.73 0.11 0.05 0.01 0.00 0.00 0.07 0.02 1 A C C 71.01 5.34 10.16 17.11 113.48 -131.26 -84.45 137.33 89.94 7.44 2.62 83.14 2.04 5.02 0.89 1.26 0.00 5.51 2.13 2 F C C 120.21 6.79 8.74 16.98 116.60 -137.92 -97.52 134.61 78.69 17.95 3.37 54.62 15.99 7.16 1.19 2.43 0.01 10.95 7.65 3 K C C 135.85 3.50 11.12 16.48 115.10 -148.75 -95.11 133.15 82.35 14.34 3.31 60.72 16.04 5.14 1.12 2.35 0.00 10.03 4.60 4 D C C 95.97 5.01 9.89 16.68 108.13 -125.31 -86.29 107.77 92.99 5.11 1.90 76.67 11.59 4.51 0.57 1.38 0.00 3.28 2.00 5 T C T 94.22 4.08 9.86 15.73 100.52 -166.05 -88.22 1.90 96.16 1.81 2.03 31.47 16.62 48.27 0.42 1.54 0.00 1.05 0.62 6 G C T 56.10 2.36 11.58 14.99 102.86 -102.15 76.42 0.29 97.01 1.55 1.45 23.11 26.02 47.88 0.19 1.38 0.00 0.97 0.44 7 K C C 141.55 2.47 10.53 14.58 115.23 87.88 -95.07 139.52 96.03 3.28 0.68 49.94 43.56 2.62 0.17 0.50 0.00 1.28 1.93 8 T C C 91.15 3.94 10.65 16.44 116.60 -113.60 -90.45 135.67 97.85 2.00 0.15 77.05 20.18 0.78 0.04 0.11 0.00 1.09 0.75 9 P C C 75.91 7.80 9.47 18.66 112.88 -107.92 -67.90 146.89 95.83 3.52 0.65 75.09 16.64 3.99 0.15 0.59 0.00 1.91 1.64 10 V C C 106.06 3.75 10.69 15.95 110.15 -136.69 -88.90 118.06 93.23 5.93 0.84 60.51 29.68 2.97 0.25 0.63 0.00 2.65 3.30 11 E C C 129.22 3.31 10.74 15.82 116.35 -115.15 -97.15 132.49 96.01 3.05 0.93 69.98 24.96 1.34 0.33 0.54 0.00 1.73 1.12 12 P C C 87.22 5.52 9.87 17.11 111.89 -112.19 -68.34 147.64 83.14 3.40 13.46 61.67 10.11 11.18 2.86 10.90 0.00 2.44 0.84 13 E C C 144.19 2.50 11.27 15.38 108.31 -124.30 -83.39 113.82 71.47 10.85 17.69 43.78 15.78 12.65 4.02 13.52 0.02 8.09 2.15 14 V C C 82.13 6.74 10.46 18.85 119.90 -159.86 -111.18 134.32 65.75 18.79 15.45 47.84 12.47 6.04 4.57 10.50 0.01 16.19 2.37 15 A C C 64.38 5.93 13.13 20.62 114.36 -138.74 -88.88 134.24 66.15 26.33 7.52 53.40 8.67 3.80 2.77 4.40 0.00 24.70 2.26 16 I C C 84.15 9.60 13.32 24.04 118.67 -160.43 -109.84 131.61 58.40 39.39 2.21 49.51 6.39 1.55 0.91 1.21 0.00 38.47 1.95 17 H E E 76.90 10.74 14.74 26.58 118.27 -166.95 -105.55 132.77 44.26 54.93 0.81 37.24 5.53 0.95 0.28 0.47 0.00 54.54 0.99 18 R E E 114.41 8.78 17.67 27.42 123.93 -156.78 -117.18 136.70 23.44 76.27 0.29 20.50 2.59 0.32 0.09 0.15 0.00 75.71 0.64 19 I E E 32.61 17.84 14.87 33.28 123.14 -166.69 -121.24 132.53 8.67 91.28 0.05 8.34 0.32 0.03 0.02 0.02 0.00 91.00 0.26 20 R E E 108.34 7.85 21.73 30.48 117.75 -157.90 -109.27 126.55 4.48 95.51 0.01 4.26 0.15 0.01 0.00 0.00 0.00 95.48 0.09 21 I E E 17.73 21.74 15.79 38.06 121.03 -167.66 -115.57 129.73 2.32 97.67 0.01 2.35 0.04 0.00 0.00 0.00 0.00 97.57 0.04 22 T E E 52.22 8.60 24.91 34.33 117.64 -159.30 -109.36 126.38 1.62 98.37 0.00 1.60 0.03 0.00 0.00 0.00 0.00 98.33 0.04 23 L E E 9.23 24.35 16.82 41.63 122.23 -169.94 -114.38 134.82 2.22 97.77 0.01 2.23 0.04 0.00 0.00 0.00 0.00 97.65 0.07 24 T E E 51.21 9.53 25.43 35.50 127.51 -169.86 -123.33 142.37 5.37 94.61 0.02 5.14 0.23 0.02 0.01 0.01 0.00 94.30 0.30 25 S E E 12.28 20.02 14.78 34.92 138.07 162.82 -149.99 160.50 27.28 72.66 0.06 26.28 1.04 0.09 0.02 0.04 0.00 70.81 1.73 26 R C S 148.57 4.88 20.31 26.03 94.53 -133.13 -81.70 -15.72 99.11 0.86 0.04 2.92 95.67 0.77 0.01 0.01 0.00 0.55 0.08 27 N C C 70.95 7.29 18.76 27.10 111.10 66.65 -106.91 106.55 98.72 1.04 0.24 61.67 36.51 0.71 0.13 0.08 0.00 0.38 0.53 28 V H H 59.74 14.35 14.08 28.75 93.74 -167.07 -63.39 -36.69 3.81 0.02 96.17 0.98 0.73 1.91 95.48 0.88 0.00 0.01 0.01 29 K H H 137.15 1.71 21.87 22.56 91.57 55.20 -63.30 -40.58 2.22 0.01 97.76 0.28 0.24 1.59 96.86 1.02 0.00 0.00 0.00 30 S H H 26.21 9.85 18.62 30.01 91.84 49.08 -65.04 -40.59 1.15 0.01 98.84 0.25 0.10 0.71 97.77 1.16 0.00 0.00 0.00 31 L H H 6.03 24.21 14.67 39.04 91.41 52.13 -63.59 -42.06 0.26 0.00 99.74 0.05 0.02 0.13 99.65 0.15 0.00 0.00 0.00 32 E H H 88.85 9.60 22.51 32.07 91.46 51.85 -63.49 -41.12 0.10 0.00 99.90 0.01 0.00 0.05 99.91 0.02 0.00 0.00 0.00 33 K H H 117.59 2.71 25.86 27.86 91.76 50.03 -64.53 -41.48 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 34 V H H 12.31 19.25 21.23 40.41 91.76 49.10 -64.04 -43.32 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 35 C H H 7.44 22.64 20.52 42.74 91.39 50.75 -63.69 -42.64 0.10 0.00 99.90 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 36 A H H 46.31 5.34 25.07 30.71 91.22 51.25 -63.01 -42.09 0.07 0.00 99.93 0.00 0.00 0.05 99.94 0.01 0.00 0.00 0.00 37 D H H 55.07 7.91 24.82 33.17 91.70 49.87 -65.15 -41.27 0.09 0.00 99.91 0.00 0.00 0.07 99.92 0.01 0.00 0.00 0.00 38 L H H 4.42 24.79 19.89 44.58 91.78 50.15 -63.86 -43.39 0.13 0.00 99.87 0.01 0.00 0.10 99.87 0.02 0.00 0.00 0.00 39 I H H 38.80 15.77 22.07 37.31 91.58 49.77 -63.39 -42.78 0.18 0.00 99.82 0.01 0.01 0.12 99.84 0.02 0.00 0.00 0.00 40 R H H 129.74 2.23 25.92 26.62 91.65 49.59 -64.13 -41.66 0.36 0.00 99.64 0.03 0.02 0.25 99.66 0.05 0.00 0.00 0.00 41 G H H 9.90 11.42 19.20 32.47 91.78 50.67 -64.10 -41.99 0.97 0.00 99.03 0.06 0.05 0.71 99.07 0.12 0.00 0.00 0.00 42 A H H 5.99 20.67 13.63 34.73 91.72 51.18 -63.46 -41.69 1.34 0.01 98.65 0.19 0.10 0.88 98.46 0.37 0.00 0.00 0.00 43 K H H 131.61 3.55 18.12 22.85 91.59 50.14 -64.10 -40.55 1.86 0.01 98.13 0.17 0.10 1.40 97.55 0.76 0.00 0.00 0.00 44 E H H 138.02 1.68 17.10 18.51 91.05 52.45 -65.64 -30.51 7.30 0.01 92.68 0.22 0.27 6.81 92.07 0.62 0.01 0.00 0.01 45 K C T 89.16 8.95 12.81 23.14 95.52 45.96 -95.09 7.64 82.82 0.04 17.14 0.40 1.60 80.05 17.20 0.70 0.00 0.01 0.04 46 N C T 137.26 0.90 18.73 18.09 92.99 -116.93 60.15 38.86 99.82 0.01 0.18 1.50 1.04 97.36 0.06 0.03 0.00 0.00 0.00 47 L C C 25.89 20.33 8.78 27.96 118.48 158.54 -95.03 139.93 97.95 2.02 0.03 97.14 0.92 0.07 0.01 0.01 0.00 1.73 0.12 48 K E E 137.28 2.35 23.58 25.34 110.13 -125.81 -85.07 124.76 49.14 50.80 0.06 48.09 0.97 0.10 0.01 0.04 0.00 50.00 0.79 49 V E E 31.23 22.48 10.12 31.12 119.97 -166.03 -109.22 132.36 9.46 90.50 0.04 9.52 0.31 0.03 0.03 0.02 0.00 86.69 3.41 50 K E E 124.62 4.10 20.34 24.96 109.58 -169.49 -106.27 73.40 19.23 80.73 0.04 16.38 2.28 0.17 0.01 0.03 0.00 80.43 0.69 51 G E E 29.35 5.33 20.64 26.66 133.58 -38.84 112.44 -175.83 36.92 63.06 0.01 18.53 17.93 0.31 0.00 0.01 0.00 62.98 0.24 52 P E E 58.55 14.65 15.55 29.86 116.02 -53.85 -70.22 144.57 43.52 56.46 0.02 39.46 2.42 0.07 0.00 0.02 0.00 57.44 0.58 53 V E E 38.56 14.47 16.77 32.06 122.43 -159.53 -117.07 132.26 13.93 86.04 0.02 13.24 0.58 0.03 0.01 0.01 0.00 80.22 5.91 54 R E E 137.22 6.55 20.66 28.47 115.48 -130.91 -86.05 131.56 28.12 71.86 0.02 27.85 0.66 0.03 0.01 0.01 0.00 66.97 4.47 55 M C C 34.02 20.50 11.77 31.34 119.46 -139.32 -89.37 143.72 87.33 12.66 0.01 85.97 1.90 0.04 0.00 0.01 0.00 11.59 0.48 56 P C C 60.59 6.78 18.50 26.20 115.36 -102.60 -66.52 152.06 92.61 7.32 0.07 86.61 5.56 0.32 0.01 0.06 0.00 6.90 0.53 57 T C C 79.75 9.70 14.28 24.69 112.72 -120.54 -82.71 132.02 72.76 27.09 0.15 56.30 14.99 0.66 0.02 0.16 0.00 26.81 1.06 58 K E E 104.04 7.33 15.51 24.09 122.00 -146.93 -108.99 140.89 19.04 80.87 0.09 15.69 2.87 0.24 0.02 0.08 0.00 80.61 0.50 59 T E E 71.06 8.93 14.31 24.47 120.95 -153.84 -112.38 133.82 3.04 96.94 0.02 2.82 0.17 0.02 0.01 0.01 0.00 96.85 0.12 60 L E E 60.21 11.19 13.46 25.88 120.83 -161.69 -111.74 135.51 1.19 98.80 0.00 1.09 0.06 0.00 0.00 0.00 0.00 98.81 0.03 61 R E E 134.69 5.57 16.47 23.57 118.94 -154.95 -109.06 131.53 0.89 99.10 0.00 0.78 0.04 0.00 0.00 0.00 0.00 99.16 0.01 62 I E E 55.46 12.60 12.75 26.43 121.32 -164.34 -115.50 133.36 1.54 98.45 0.01 1.44 0.05 0.00 0.00 0.00 0.00 98.48 0.03 63 T E E 61.34 6.79 16.45 24.74 123.85 -164.72 -114.51 144.34 3.57 96.42 0.02 3.30 0.14 0.02 0.00 0.01 0.00 96.47 0.06 64 T E E 54.82 11.42 13.37 25.77 124.97 -164.28 -119.67 144.46 4.55 95.42 0.02 4.04 0.36 0.04 0.01 0.01 0.00 95.36 0.19 65 R E E 121.34 6.71 14.63 22.89 119.35 -137.21 -98.91 138.63 9.32 90.64 0.03 8.35 0.87 0.08 0.01 0.02 0.00 90.00 0.67 66 K E E 122.15 5.29 14.02 20.89 116.84 -133.02 -93.55 138.14 45.99 53.94 0.07 41.24 3.89 0.22 0.02 0.06 0.00 52.49 2.08 67 T C C 45.88 9.82 9.39 20.68 116.30 -119.22 -81.73 144.17 92.38 7.48 0.14 88.04 3.91 0.47 0.04 0.11 0.00 6.48 0.95 68 P C T 105.60 2.41 12.25 15.86 92.91 -131.26 -65.72 -21.45 97.93 0.69 1.38 6.16 31.59 60.04 0.08 1.46 0.00 0.47 0.19 69 C C T 91.06 2.85 10.43 14.36 97.93 53.57 -91.40 -0.48 97.11 0.99 1.91 3.66 31.64 61.85 0.12 1.83 0.00 0.57 0.33 70 G C S 44.79 3.56 10.36 15.54 110.63 -95.39 91.77 13.30 90.27 6.00 3.73 29.20 49.02 11.73 0.48 3.56 0.00 3.06 2.96 71 E C T 141.12 2.16 9.75 13.49 109.20 115.77 -75.65 125.82 90.43 3.14 6.43 7.93 16.97 64.73 0.55 6.62 0.00 2.17 1.03 72 G C T 62.80 1.05 12.13 13.00 97.69 11.61 81.55 0.29 91.59 2.24 6.18 8.79 17.59 64.37 0.51 6.46 0.00 1.62 0.65 73 S C C 54.59 5.74 8.49 16.16 113.68 124.83 -85.68 142.14 90.10 5.26 4.64 56.04 25.43 8.48 0.61 4.60 0.00 3.51 1.33 74 K C C 154.08 2.38 12.98 16.61 102.83 -134.99 -86.40 27.77 79.89 18.74 1.37 56.54 18.84 4.45 0.22 1.29 0.00 17.26 1.39 75 T E E 65.68 6.55 11.74 20.13 122.50 132.87 -106.88 145.67 36.72 63.05 0.23 31.96 3.72 0.50 0.05 0.19 0.00 62.55 1.03 76 W E E 116.90 9.73 12.13 23.08 123.18 -150.11 -112.57 141.47 6.44 93.54 0.02 6.05 0.30 0.04 0.01 0.01 0.00 93.13 0.47 77 D E E 66.84 7.91 15.11 24.47 120.27 -151.14 -104.71 139.61 5.41 94.58 0.01 4.93 0.20 0.01 0.00 0.00 0.00 94.78 0.08 78 R E E 119.28 8.50 15.02 24.78 120.76 -141.70 -108.01 135.24 5.94 94.06 0.00 5.55 0.16 0.01 0.00 0.00 0.00 94.23 0.06 79 F E E 54.68 13.00 13.40 27.55 124.41 -164.13 -117.83 143.53 4.36 95.63 0.00 4.15 0.09 0.00 0.00 0.00 0.00 95.66 0.08 80 Q E E 88.61 7.41 17.71 26.31 120.66 -146.29 -107.27 136.93 1.93 98.07 0.00 1.77 0.05 0.00 0.00 0.00 0.00 98.14 0.04 81 M E E 50.47 14.83 14.34 29.64 127.26 -171.17 -124.90 143.57 2.12 97.87 0.00 1.97 0.05 0.00 0.00 0.00 0.00 97.95 0.02 82 R E E 101.43 8.47 18.72 28.21 118.35 -145.34 -106.84 130.15 1.42 98.58 0.00 1.30 0.04 0.00 0.00 0.00 0.00 98.64 0.02 83 I E E 42.83 14.64 16.31 31.75 119.42 -163.58 -112.53 128.71 2.14 97.86 0.00 1.96 0.08 0.00 0.00 0.00 0.00 97.90 0.05 84 H E E 53.88 11.90 18.40 31.43 120.25 -158.74 -108.71 134.12 4.57 95.42 0.01 4.01 0.35 0.02 0.00 0.00 0.00 95.53 0.08 85 K E E 75.80 13.15 18.99 32.19 126.89 -169.32 -123.37 140.62 6.75 93.24 0.01 6.07 0.42 0.02 0.00 0.00 0.00 93.39 0.09 86 R E E 54.26 15.59 18.69 34.35 123.97 -158.12 -116.21 135.67 3.53 96.47 0.00 3.31 0.12 0.00 0.00 0.00 0.00 96.50 0.06 87 L E E 44.58 12.44 21.96 35.10 119.14 -157.79 -111.16 129.28 1.08 98.92 0.00 0.98 0.04 0.00 0.00 0.00 0.00 98.96 0.02 88 I E E 11.78 21.94 18.25 40.36 120.14 -164.72 -115.61 127.67 0.37 99.63 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.64 0.01 89 D E E 53.45 9.35 25.46 35.26 115.07 -155.42 -104.04 122.76 1.09 98.91 0.00 0.98 0.04 0.00 0.00 0.00 0.00 98.96 0.02 90 L E E 12.80 22.70 14.72 37.49 117.87 -163.53 -104.74 128.20 13.06 86.83 0.11 12.42 0.51 0.10 0.04 0.05 0.00 86.38 0.50 91 H C E 97.36 7.05 21.06 28.50 107.59 -161.25 -93.14 22.61 59.18 40.61 0.21 32.62 26.05 1.82 0.04 0.19 0.00 38.36 0.93 92 S C S 45.22 8.87 18.04 27.87 118.64 17.23 -132.60 120.98 91.22 8.47 0.30 29.31 59.54 2.35 0.08 0.18 0.00 8.01 0.53 93 P C C 49.89 13.57 14.46 28.34 103.76 -134.31 -68.96 85.19 85.77 1.51 12.71 69.23 8.94 6.75 11.31 2.32 0.00 0.96 0.49 94 S H H 60.56 6.76 16.40 24.13 96.90 113.48 -68.96 -35.62 45.05 0.58 54.36 25.73 9.36 10.26 50.62 3.49 0.01 0.24 0.28 95 E H H 112.41 3.57 19.04 22.69 93.90 52.64 -67.47 -35.70 21.99 0.44 77.57 10.41 4.29 8.25 73.21 3.41 0.04 0.22 0.18 96 I H H 26.44 16.90 15.60 32.43 93.47 51.48 -66.15 -42.15 10.22 0.46 89.33 5.23 1.68 4.00 85.48 3.18 0.02 0.32 0.10 97 V H H 30.68 17.11 15.74 32.55 92.21 52.13 -63.56 -41.71 3.54 0.18 96.28 1.65 0.56 1.52 93.87 2.22 0.01 0.15 0.02 98 K H H 124.19 2.83 20.72 23.51 91.91 51.68 -64.22 -40.01 2.67 0.11 97.22 0.86 0.35 1.49 94.15 3.02 0.01 0.10 0.01 99 Q H H 81.51 7.41 19.28 27.39 92.26 50.62 -66.36 -39.83 3.51 0.13 96.37 0.84 0.41 2.21 92.34 4.05 0.01 0.12 0.02 100 I H H 14.91 22.53 14.38 36.24 93.00 49.86 -67.28 -37.91 5.26 0.22 94.51 1.06 0.62 3.47 89.92 4.67 0.03 0.19 0.04 101 T H H 59.91 12.27 16.96 29.28 92.58 57.05 -71.53 -21.54 22.14 0.64 77.22 2.67 2.18 16.83 73.57 3.98 0.15 0.42 0.20 102 S C T 81.42 2.11 19.93 21.56 95.47 57.11 -88.07 -5.13 57.91 1.66 40.44 7.86 5.05 42.83 37.24 5.28 0.13 1.03 0.59 103 I C C 46.81 16.88 10.41 26.95 117.21 106.48 -82.72 138.08 88.34 9.81 1.86 57.11 29.53 2.50 1.45 0.61 0.01 6.66 2.13 104 S C C 80.02 2.91 21.06 24.46 113.57 -140.01 -97.73 126.15 79.94 19.59 0.47 77.46 1.98 0.73 0.24 0.19 0.00 16.72 2.67 105 I C C 41.00 20.99 11.03 30.65 122.47 -168.38 -116.05 131.29 56.35 43.52 0.13 55.26 2.02 0.08 0.11 0.04 0.00 16.88 25.62 106 E C C 98.19 5.55 19.61 25.74 118.92 -125.39 -76.96 150.12 99.16 0.82 0.01 98.81 0.55 0.04 0.00 0.00 0.00 0.47 0.12 107 P C T 87.85 6.37 16.36 24.02 110.68 -84.66 -60.25 139.43 99.30 0.42 0.28 0.61 2.92 95.95 0.02 0.18 0.00 0.26 0.07 108 G C T 40.55 5.55 18.66 25.32 95.87 23.94 87.51 -5.52 99.08 0.69 0.23 0.95 2.98 95.29 0.01 0.17 0.00 0.55 0.04 109 V C C 25.13 18.53 12.67 31.49 119.35 117.48 -97.13 135.86 61.10 38.84 0.06 55.58 4.31 0.19 0.01 0.06 0.00 39.06 0.80 110 E E E 100.07 6.02 23.02 29.69 118.70 -150.82 -106.97 132.75 12.74 87.23 0.03 12.50 0.28 0.03 0.01 0.01 0.00 86.90 0.28 111 V E E 23.27 22.66 13.40 35.57 125.97 -170.27 -124.89 137.66 5.82 94.18 0.00 5.73 0.10 0.00 0.00 0.00 0.00 94.10 0.06 112 E E E 94.26 5.58 24.78 30.76 121.35 -164.04 -115.37 132.27 2.76 97.23 0.00 2.75 0.05 0.00 0.00 0.00 0.00 97.16 0.03 113 V E E 25.43 22.59 13.42 35.48 123.52 -167.22 -119.15 133.15 2.97 97.02 0.00 3.09 0.04 0.00 0.00 0.00 0.00 96.83 0.03 114 T E E 60.13 6.16 23.49 30.13 125.02 -171.49 -120.19 141.57 2.87 97.12 0.01 2.91 0.06 0.01 0.00 0.00 0.00 96.96 0.07 115 I E E 56.86 16.11 13.56 29.72 119.70 -149.62 -105.23 131.80 8.16 91.79 0.05 7.82 0.29 0.04 0.02 0.02 0.00 91.41 0.41 116 A E E 48.43 8.15 14.13 23.86 122.10 -158.97 -106.76 147.83 41.75 57.92 0.33 32.89 6.92 1.20 0.08 0.25 0.00 57.85 0.80 117 D C C 109.11 3.30 13.58 18.39 111.87 -113.56 -83.54 129.04 68.78 30.84 0.37 63.20 2.65 1.39 0.09 0.27 0.00 31.16 1.24 118 A C C 65.62 8.17 11.85 21.03 108.86 -135.00 -77.80 120.44 99.74 0.24 0.02 99.65 0.12 0.05 0.00 0.00 0.00 0.17 0.01