G4VH52_SCHMA Loading...

Putative 28s ribosomal protein S11

AlphaFold DB , UniProt , Accession G4VH52, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 194 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.6	Very low	45	Very low	239 Å²	239	146.1 Å²	146.1	100%	1.177	81%	0.806	S	S	*	*				0	103.3	0	-72.6	171.2	169.1	0	0	105.9
2	I	39.6	Very low	45.3	Very low	171 Å²	171	152 Å²	152	88%	0.877	81%	0.807	S	S	*	*				-157.3	140.3	72.8	-80	151.3	0	0	0	107.9
3	C	37.3	Very low	45.6	Very low	115 Å²	115	150.5 Å²	150.5	78%	0.777	80%	0.798	S	S	*	*			trans	-64	139.7	-171.2	-70.4	0	0	0	0	115
4	S	37.3	Very low	46.1	Very low	105 Å²	105	148.9 Å²	148.9	73%	0.734	79%	0.789	S	S	*	*			trans	-56.4	128.3	152.1	-174	0	0	0	0	110.8
5	K	47.3	Very low	46.5	Very low	206 Å²	206	147.7 Å²	147.7	90%	0.896	78%	0.782	S	S	*	*			trans	-130.2	92.6	158.4	-79	-165.5	177.5	-177.5	0	109.1
6	H	41.7	Very low	47	Very low	160 Å²	160	149.1 Å²	149.1	74%	0.741	78%	0.78	S	S	*	*			trans	-79	155.9	163.7	-133.4	-75.5	0	0	0	109.6
7	T	42.4	Very low	47.6	Very low	131 Å²	131	143.9 Å²	143.9	80%	0.804	76%	0.759	S	S	*	*			trans	79.3	121.3	170.4	81.4	0	0	0	0	113.8
8	S	48.8	Very low	48.1	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	75%	0.747	S	S	*	*				-156.7	107.6	58.9	-179.7	0	0	0	0	110.4
9	S	52.4	Low	48.4	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	74%	0.742	S	S	*	*			trans	-114.7	3.1	177.6	-164.6	0	0	0	0	113
10	K	52	Low	48.9	Very low	189 Å²	189	141.3 Å²	141.3	82%	0.822	74%	0.738	S	S	*	*	S	Bend	trans	-92	-9.9	-171.8	-80.3	-170.6	174.3	-176.8	0	115.8
11	S	51.3	Low	49.4	Very low	87 Å²	87	140.7 Å²	140.7	61%	0.608	73%	0.732	S	S	*	*	S	Bend	trans	-90.9	-11.6	179.8	52.3	0	0	0	0	114.9
12	R	48.9	Very low	50.3	Low	217 Å²	217	134.7 Å²	134.7	82%	0.819	71%	0.705	S	S	*	*	S	Bend	trans	-88.1	-17.5	-177.8	-127.7	178.5	-160.7	-174.7	4.6	114.7
13	L	49.4	Very low	51.3	Low	133 Å²	133	130.9 Å²	130.9	70%	0.696	69%	0.689	S	S	*	*	S	Bend	trans	-86.4	-19.5	-176.8	-73.7	170	0	0	0	113.8
14	L	51.8	Low	52.4	Low	127 Å²	127	132 Å²	132	67%	0.665	68%	0.681	S	S	*	*	H	α-helix	trans	-82.1	-13.9	177.8	-65.1	176.4	0	0	0	113.4	S17	L14-S17 PolarHBondContact O-OG 3.49Å
15	L	52.9	Low	53.3	Low	132 Å²	132	136.5 Å²	136.5	69%	0.691	68%	0.682	S	S	*	*	H	α-helix	trans	-85	-10.6	174.8	-70.1	173.9	0	0	0	113.4
16	F	54.3	Low	54.2	Low	169 Å²	169	135.2 Å²	135.2	74%	0.741	67%	0.672	S	S	*	*	H	α-helix	trans	-90.8	-26.6	-177.4	-145.9	-96.6	0	0	0	113
17	S	56.5	Low	55	Low	61 Å²	61	130.7 Å²	130.7	43%	0.427	66%	0.662	S	S	.	*	H	α-helix	trans	-75.3	-35.5	177.5	52.2	0	0	0	0	113.1	L14 L19 F20 Q21	L14-S17 PolarHBondContact O-OG 3.49Å; S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 3.49Å; S17-F20 PolarHBondContact O-N 3.41Å; S17-Q21 PolarHBondContact O-N 3.02Å
18	D	56.4	Low	55.6	Low	103 Å²	103	128.3 Å²	128.3	55%	0.551	65%	0.65	S	S	*	*	H	α-helix	trans	-75.1	-28.4	-175.4	-68.1	-6.8	0	0	0	112	N22	D18-N22 PolarHBondContact O-N 3.22Å
19	L	55.4	Low	56	Low	124 Å²	124	127.9 Å²	127.9	65%	0.649	65%	0.648	S	S	*	*	H	α-helix	trans	-73.9	-31.8	176.8	-151	127.6	0	0	0	111.9	S17 V23	S17-L19 VanDerWaalsContact C-N 3.34Å; S17-L19 PolarHBondContact O-N 3.49Å; L19-V23 WeakPolarHBondContact O-CG2 3.15Å; L19-V23 PolarHBondContact O-N 3.41Å
20	F	58.6	Low	56.1	Low	152 Å²	152	129.4 Å²	129.4	67%	0.667	64%	0.644	S	S	*	*	H	α-helix	trans	-74.9	-37.4	178	-162.5	-101.1	0	0	0	112.3	S17 F24	S17-F20 PolarHBondContact O-N 3.41Å; F20-F24 PolarHBondContact O-N 3.11Å
21	Q	57.7	Low	56.2	Low	130 Å²	130	126.2 Å²	126.2	61%	0.607	64%	0.64	S	S	*	*	H	α-helix	trans	-70.8	-35.4	176.6	-72.7	-66.4	-19.8	0	0	112.6	S17 F24 R25	S17-Q21 PolarHBondContact O-N 3.02Å; Q21-F24 PolarHBondContact O-N 2.76Å; Q21-R25 WeakPolarHBondContact O-CB 3.41Å; Q21-R25 PolarHBondContact O-N 3.46Å; Q21-R25 VanDerWaalsContact O-N 3.1Å
22	N	64.1	Low	56.4	Low	112 Å²	112	127.3 Å²	127.3	60%	0.599	64%	0.643	S	S	*	*	H	α-helix	trans	-70.6	-32.7	177.4	-89.3	-21.4	0	0	0	113.7	D18 W26	D18-N22 PolarHBondContact O-N 3.22Å; N22-W26 WeakPolarHBondContact O-CB 3.48Å; N22-W26 PolarHBondContact O-N 3.35Å
23	V	61.3	Low	56.1	Low	91 Å²	91	125 Å²	125	55%	0.552	64%	0.639	S	S	*	*	H	α-helix	trans	-69.3	-39.3	176.1	172.8	0	0	0	0	111.3	L19 W26 A27	L19-V23 WeakPolarHBondContact O-CG2 3.15Å; L19-V23 PolarHBondContact O-N 3.41Å; V23-W26 PolarHBondContact O-N 2.87Å; V23-A27 PolarHBondContact O-N 2.96Å; V23-A27 VanDerWaalsContact O-N 3.14Å
24	F	58.9	Low	56.1	Low	140 Å²	140	124.9 Å²	124.9	61%	0.614	64%	0.639	S	S	*	*	H	α-helix	trans	-69.5	-36.9	177.7	-156.4	-99.1	0	0	0	112	F20 Q21 A27 S28	F20-F24 PolarHBondContact O-N 3.11Å; Q21-F24 PolarHBondContact O-N 2.76Å; F24-A27 PolarHBondContact O-N 3.03Å; F24-S28 PolarHBondContact O-N 3.4Å; F24-S28 PolarHBondContact O-OG 2.93Å
25	R	57.8	Low	55.9	Low	199 Å²	199	123 Å²	123	75%	0.751	64%	0.636	S	S	*	*	H	α-helix	trans	-73	-30.4	178.3	-140	176.6	174.9	-168.8	-2.8	113.1	Q21 S29	Q21-R25 WeakPolarHBondContact O-CB 3.41Å; Q21-R25 PolarHBondContact O-N 3.46Å; Q21-R25 VanDerWaalsContact O-N 3.1Å; R25-S29 PolarHBondContact O-N 3.38Å
26	W	64.7	Low	55.5	Low	179 Å²	179	121.7 Å²	121.7	68%	0.678	63%	0.634	S	S	*	*	H	α-helix	trans	-70.4	-38.7	172.8	-171.5	76.4	0	0	0	112	N22 V23 S28 S29	N22-W26 WeakPolarHBondContact O-CB 3.48Å; N22-W26 PolarHBondContact O-N 3.35Å; V23-W26 PolarHBondContact O-N 2.87Å; W26-S28 VanDerWaalsContact C-N 3.32Å; W26-S28 PolarHBondContact O-N 3.09Å; W26-S29 PolarHBondContact O-N 3.34Å
27	A	60.1	Low	55.1	Low	65 Å²	65	121 Å²	121	54%	0.537	64%	0.638	S	S	.	*	H	α-helix	trans	-65.1	-33.7	175.5	0	0	0	0	0	112.8	V23 F24	V23-A27 PolarHBondContact O-N 2.96Å; V23-A27 VanDerWaalsContact O-N 3.14Å; F24-A27 PolarHBondContact O-N 3.03Å
28	S	54.9	Low	54.8	Low	80 Å²	80	124.2 Å²	124.2	56%	0.559	65%	0.649	S	S	*	*	H	α-helix	trans	-80.9	-17.5	-178.6	-54.1	0	0	0	0	114.6	F24 W26	F24-S28 PolarHBondContact O-N 3.4Å; F24-S28 PolarHBondContact O-OG 2.93Å; W26-S28 VanDerWaalsContact C-N 3.32Å; W26-S28 PolarHBondContact O-N 3.09Å
29	S	57	Low	54.5	Low	94 Å²	94	124.4 Å²	124.4	66%	0.657	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	1.3	-171.1	-155.7	0	0	0	0	115.1	R25 W26	R25-S29 PolarHBondContact O-N 3.38Å; W26-S29 PolarHBondContact O-N 3.34Å
30	Q	54.1	Low	54.1	Low	134 Å²	134	125.9 Å²	125.9	63%	0.626	66%	0.664	S	S	*	*	S	Bend	trans	-106.9	10.7	179.2	-71.6	-173.8	7	0	0	114.7	V32	Q30-V32 VanDerWaalsContact C-N 3.29Å; Q30-V32 PolarHBondContact O-N 3.27Å
31	V	53.7	Low	53.5	Low	122 Å²	122	126.1 Å²	126.1	74%	0.739	67%	0.672	S	S	*	*			trans	-95.9	59.1	169.5	-165.7	0	0	0	0	109.5	F33	V31-F33 PolarHBondContact O-N 3.35Å
32	V	54.9	Low	53.3	Low	110 Å²	110	126.6 Å²	126.6	67%	0.667	67%	0.672	S	S	*	*			trans	-85.7	96.9	157.1	177	0	0	0	0	105.2	Q30 N34	Q30-V32 VanDerWaalsContact C-N 3.29Å; Q30-V32 PolarHBondContact O-N 3.27Å; V32-N34 PolarHBondContact O-N 3.08Å
33	F	43.7	Very low	52.4	Low	169 Å²	169	124.9 Å²	124.9	74%	0.741	67%	0.673	S	S	*	*			trans	-64.9	80	173.6	-165.3	-96	0	0	0	108	V31 S35	V31-F33 PolarHBondContact O-N 3.35Å; F33-S35 PolarHBondContact O-N 2.86Å
34	N	49.7	Very low	51.7	Low	130 Å²	130	126.3 Å²	126.3	70%	0.695	68%	0.684	S	S	*	*			trans	-66.3	92.8	166.8	-88.5	-8.3	0	0	0	106.8	V32 T36	V32-N34 PolarHBondContact O-N 3.08Å; N34-T36 PolarHBondContact O-N 2.92Å
35	S	46.1	Very low	51.1	Low	87 Å²	87	128.3 Å²	128.3	61%	0.608	69%	0.688	S	S	*	*			trans	-66.6	18.3	179.2	-179.7	0	0	0	0	113.8	F33	F33-S35 PolarHBondContact O-N 2.86Å
36	T	46.2	Very low	50.1	Low	104 Å²	104	122.6 Å²	122.6	64%	0.638	68%	0.678	S	S	*	*	S	Bend	trans	-133.4	124.1	-178	49.7	0	0	0	0	108.5	N34	N34-T36 PolarHBondContact O-N 2.92Å
37	N	45.5	Very low	49.3	Very low	155 Å²	155	121.8 Å²	121.8	83%	0.829	69%	0.686	S	S	*	*			trans	84.4	52.3	-168.6	-46.3	-61.6	0	0	0	114.8	P39	N37-P39 WeakPolarHBondContact O-CD 3.22Å
38	I	50.3	Low	48.5	Very low	128 Å²	128	123.5 Å²	123.5	66%	0.656	69%	0.694	S	S	*	*			trans	-73.4	102.3	139.4	-60.9	167.2	0	0	0	103.8	D40	I38-D40 PolarHBondContact O-N 2.79Å; I38-D40 VanDerWaalsContact O-N 3.12Å
39	P	50.6	Low	48.2	Very low	107 Å²	107	123.6 Å²	123.6	70%	0.695	70%	0.7	S	S	*	*			trans	-58.2	124.5	167.9	26.3	-31.7	0	0	0	105.3	N37 L41	N37-P39 WeakPolarHBondContact O-CD 3.22Å; P39-L41 PolarHBondContact O-N 3.33Å
40	D	46.2	Very low	47.6	Very low	155 Å²	155	123.7 Å²	123.7	83%	0.829	70%	0.696	S	S	*	*			trans	-32.7	105.6	175.9	-74.4	-43.4	0	0	0	108.8	I38 K42	I38-D40 PolarHBondContact O-N 2.79Å; I38-D40 VanDerWaalsContact O-N 3.12Å; D40-K42 PolarHBondContact O-N 3.38Å
41	L	46.2	Very low	47.2	Very low	158 Å²	158	121.1 Å²	121.1	83%	0.827	70%	0.698	S	S	*	*			trans	-59.4	92.6	161	-88.7	162.9	0	0	0	102.5	P39 A43	P39-L41 PolarHBondContact O-N 3.33Å; L41-A43 VanDerWaalsContact C-N 3.3Å; L41-A43 PolarHBondContact O-N 3.44Å
42	K	52.5	Low	46.9	Very low	140 Å²	140	123.9 Å²	123.9	61%	0.609	70%	0.703	S	S	*	*			trans	-45.1	105.4	178	-174.6	160.7	-163.1	158	0	104.8	D40 R45	D40-K42 PolarHBondContact O-N 3.38Å; K42-R45 VanDerWaalsContact NZ-NH2 3.13Å
43	A	46.7	Very low	46.8	Very low	76 Å²	76	127.3 Å²	127.3	63%	0.628	71%	0.709	S	S	*	*			trans	-43.1	129.7	178.7	0	0	0	0	0	105.7	L41 R45	L41-A43 VanDerWaalsContact C-N 3.3Å; L41-A43 PolarHBondContact O-N 3.44Å; A43-R45 PolarHBondContact O-N 3.46Å
44	P	46.7	Very low	47.1	Very low	120 Å²	120	124.3 Å²	124.3	78%	0.779	70%	0.704	S	S	*	*			trans	-47.8	111	-173	19.7	-31.9	0	0	0	105.8	S46	P44-S46 PolarHBondContact O-N 3.42Å
45	R	45.6	Very low	47.4	Very low	183 Å²	183	122.5 Å²	122.5	69%	0.691	71%	0.707	S	S	*	*			trans	-45.8	118.2	-176.1	-78.9	177.6	171.2	145.2	-5.2	104.1	K42 A43 L47	K42-R45 VanDerWaalsContact NZ-NH2 3.13Å; A43-R45 PolarHBondContact O-N 3.46Å; R45-L47 PolarHBondContact O-N 3.2Å
46	S	37.1	Very low	47.7	Very low	78 Å²	78	121.7 Å²	121.7	55%	0.545	69%	0.694	S	S	.	*			trans	-8.8	117.9	173.7	51.2	0	0	0	0	111.8	P44 S48 A49	P44-S46 PolarHBondContact O-N 3.42Å; S46-S48 WeakPolarHBondContact CB-OG 3.44Å; S46-S48 PolarHBondContact O-N 3.44Å; S46-S48 PolarHBondContact OG-OG 3.14Å; S46-A49 PolarHBondContact O-N 3.5Å; S46-A49 VanDerWaalsContact O-N 3.13Å
47	L	46.7	Very low	47.7	Very low	163 Å²	163	119.6 Å²	119.6	85%	0.853	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	17.4	173.1	-72.4	166.3	0	0	0	113.7	R45 V50	R45-L47 PolarHBondContact O-N 3.2Å; L47-V50 WeakPolarHBondContact O-CG2 3.18Å
48	S	44.5	Very low	48.3	Very low	100 Å²	100	117.7 Å²	117.7	70%	0.699	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-1	169.8	58	0	0	0	0	114.1	S46	S46-S48 WeakPolarHBondContact CB-OG 3.44Å; S46-S48 PolarHBondContact O-N 3.44Å; S46-S48 PolarHBondContact OG-OG 3.14Å
49	A	47.5	Very low	48.5	Very low	83 Å²	83	116.4 Å²	116.4	69%	0.686	66%	0.664	S	S	*	*			trans	-95.1	30.7	162.6	0	0	0	0	0	111.4	S46 A51	S46-A49 PolarHBondContact O-N 3.5Å; S46-A49 VanDerWaalsContact O-N 3.13Å; A49-A51 PolarHBondContact O-N 3.03Å
50	V	44.6	Very low	49.3	Very low	95 Å²	95	119.1 Å²	119.1	58%	0.576	67%	0.672	S	S	*	*			trans	-54.9	97	151.8	171.6	0	0	0	0	103.9	L47 E52	L47-V50 WeakPolarHBondContact O-CG2 3.18Å; V50-E52 PolarHBondContact O-N 3.1Å
51	A	45.6	Very low	49.9	Very low	80 Å²	80	114.8 Å²	114.8	66%	0.661	66%	0.664	S	S	*	*			trans	-35.2	119.4	168.2	0	0	0	0	0	105.9	A49 K53	A49-A51 PolarHBondContact O-N 3.03Å; A51-K53 VanDerWaalsContact C-N 3.29Å; A51-K53 PolarHBondContact O-N 3Å
52	E	47	Very low	50.7	Low	180 Å²	180	113.7 Å²	113.7	84%	0.841	65%	0.654	S	S	*	*			trans	-37.7	107.2	168.9	-72.9	173.1	152.4	0	0	104.9	V50 T54	V50-E52 PolarHBondContact O-N 3.1Å; E52-T54 PolarHBondContact O-N 3.34Å
53	K	53.2	Low	51.1	Low	182 Å²	182	113 Å²	113	79%	0.791	65%	0.653	S	S	*	*			trans	-60.4	99.2	178.5	-82	176.7	176.8	176.2	0	102.1	A51 A55	A51-K53 VanDerWaalsContact C-N 3.29Å; A51-K53 PolarHBondContact O-N 3Å; K53-A55 VanDerWaalsContact C-N 3.27Å; K53-A55 WeakPolarHBondContact O-CA 3.42Å; K53-A55 PolarHBondContact O-N 3.49Å
54	T	50.9	Low	51.7	Low	106 Å²	106	112.3 Å²	112.3	65%	0.65	64%	0.641	S	S	*	*			trans	-49.7	106.6	177.7	-42	0	0	0	0	103.4	E52 Q56	E52-T54 PolarHBondContact O-N 3.34Å; T54-Q56 PolarHBondContact O-N 3.36Å
55	A	55.8	Low	52.5	Low	92 Å²	92	111 Å²	111	76%	0.76	63%	0.63	S	S	*	*			trans	-68.1	92.9	-170	0	0	0	0	0	104.4	K53 P57	K53-A55 VanDerWaalsContact C-N 3.27Å; K53-A55 WeakPolarHBondContact O-CA 3.42Å; K53-A55 PolarHBondContact O-N 3.49Å; A55-P57 VanDerWaalsContact O-N 3.11Å
56	Q	52.9	Low	53.3	Low	70 Å²	70	104.1 Å²	104.1	33%	0.327	61%	0.609	S	S	.	*			trans	-54	124.1	178	-69.3	-173.8	-10	0	0	105.7	T54 I58 H63 C69	T54-Q56 PolarHBondContact O-N 3.36Å; Q56-I58 PolarHBondContact O-N 3.21Å; Q56-H63 WeakPolarHBondContact CB-ND1 3.49Å; Q56-H63 PolarHBondContact OE1-ND1 3.39Å; Q56-C69 PolarHBondContact NE2-SG 3.24Å
57	P	45.7	Very low	54.5	Low	61 Å²	61	107.9 Å²	107.9	40%	0.396	62%	0.618	S	S	.	*			trans	-60.1	114.3	-174.4	21.9	-31.3	0	0	0	108.3	A55 I59 T66	A55-P57 VanDerWaalsContact O-N 3.11Å; P57-I59 PolarHBondContact O-N 3.4Å; P57-I59 VanDerWaalsContact O-N 3.15Å; P57-T66 HydrophobicContact CG-CG2 3.68Å
58	I	58	Low	55.4	Low	114 Å²	114	106.4 Å²	106.4	59%	0.585	61%	0.606	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.5	98	174.4	-59.7	173	0	0	0	105.9	Q56 G61	Q56-I58 PolarHBondContact O-N 3.21Å; I58-G61 VanDerWaalsContact CG2-CA 3.41Å
59	I	54.3	Low	56.2	Low	101 Å²	101	102.8 Å²	102.8	52%	0.518	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.9	118.9	172	-60.7	171.9	0	0	0	106.7	P57 G61 H62 V64	P57-I59 PolarHBondContact O-N 3.4Å; P57-I59 VanDerWaalsContact O-N 3.15Å; I59-G61 PolarHBondContact O-N 3.17Å; I59-H62 PolarHBondContact N-O 3.3Å; I59-H62 PolarHBondContact O-N 3.47Å; I59-V64 HydrophobicContact CB-CG2 4.21Å
60	L	66.5	Low	56.9	Low	165 Å²	165	102.1 Å²	102.1	86%	0.864	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	57	28.8	-179.3	-56.7	171.3	0	0	0	114.4	H62	L60-H62 VanDerWaalsContact C-N 3.29Å; L60-H62 PolarHBondContact O-CD2 3.24Å; L60-H62 PolarHBondContact O-N 3.08Å
61	G	60.4	Low	57.8	Low	63 Å²	63	101.6 Å²	101.6	65%	0.649	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.8	0.8	-178.8	0	0	0	0	0	114.6	I58 I59	I58-G61 VanDerWaalsContact CG2-CA 3.41Å; I59-G61 PolarHBondContact O-N 3.17Å
62	H	62.3	Low	59	Low	136 Å²	136	100.3 Å²	100.3	63%	0.63	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.3	177.1	-66.5	-77	0	0	0	111	I59 L60 V64	I59-H62 PolarHBondContact N-O 3.3Å; I59-H62 PolarHBondContact O-N 3.47Å; L60-H62 VanDerWaalsContact C-N 3.29Å; L60-H62 PolarHBondContact O-CD2 3.24Å; L60-H62 PolarHBondContact O-N 3.08Å; H62-V64 PolarHBondContact O-N 3.31Å
63	H	60.7	Low	60	Low	124 Å²	124	98 Å²	98	57%	0.574	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	101.7	165.4	-88.1	-89.1	0	0	0	108.4	Q56	Q56-H63 WeakPolarHBondContact CB-ND1 3.49Å; Q56-H63 PolarHBondContact OE1-ND1 3.39Å
64	V	58.7	Low	60.8	Low	63 Å²	63	90.7 Å²	90.7	38%	0.382	51%	0.512	S	S	.	.			trans	-81.7	121	174.5	-175.9	0	0	0	0	107.8	I59 H62 T66	I59-V64 HydrophobicContact CB-CG2 4.21Å; H62-V64 PolarHBondContact O-N 3.31Å; V64-T66 PolarHBondContact O-N 3.12Å
65	V	63.5	Low	61.6	Low	91 Å²	91	91.3 Å²	91.3	55%	0.552	51%	0.507	S	S	*	.			trans	-65.3	104.1	173.2	-174	0	0	0	0	107.4	C69 L70	V65-C69 HydrophobicContact CG1-CB 3.74Å; V65-L70 HydrophobicContact CG1-CD2 3.86Å; V65-L70 HydrophobicContact CG1-CG 4.22Å
66	T	62.5	Low	62.6	Low	40 Å²	40	94.1 Å²	94.1	25%	0.245	51%	0.51	C	S	.	.			trans	-77.1	161	175.3	52.7	0	0	0	0	111	P57 V64 E68 C69 L70	P57-T66 HydrophobicContact CG-CG2 3.68Å; V64-T66 PolarHBondContact O-N 3.12Å; T66-E68 PolarHBondContact O-N 2.91Å; T66-E68 VanDerWaalsContact O-N 3.14Å; T66-C69 WeakPolarHBondContact O-CA 3.38Å; T66-C69 VanDerWaalsContact O-CB 3.28Å; T66-C69 WeakPolarHBondContact O-CB 3.07Å; T66-C69 PolarHBondContact O-N 3.45Å; T66-C69 PolarHBondContact OG1-SG 3.12Å; T66-L70 PolarHBondContact O-N 3Å
67	E	63.1	Low	63.8	Low	157 Å²	157	96.5 Å²	96.5	73%	0.734	52%	0.519	S	S	*	.	H	α-helix	trans	-47.6	-39.5	173.7	-65.1	-85.1	150.1	0	0	112	C69 L70 T71	E67-C69 VanDerWaalsContact C-N 3.29Å; E67-C69 PolarHBondContact O-N 3.23Å; E67-L70 WeakPolarHBondContact O-CA 3.32Å; E67-L70 WeakPolarHBondContact O-CB 3.46Å; E67-L70 PolarHBondContact O-N 3.04Å; E67-T71 PolarHBondContact O-N 2.85Å; E67-T71 PolarHBondContact O-OG1 3.24Å
68	E	64.7	Low	65.7	Low	131 Å²	131	97.6 Å²	97.6	61%	0.612	52%	0.519	S	S	*	.	H	α-helix	trans	-64.2	-31.9	177.7	-57.9	-167.1	171.6	0	0	113.3	T66 L70 T71 S72	T66-E68 PolarHBondContact O-N 2.91Å; T66-E68 VanDerWaalsContact O-N 3.14Å; E68-L70 VanDerWaalsContact C-N 3.26Å; E68-L70 PolarHBondContact O-N 3.05Å; E68-T71 PolarHBondContact O-N 3.11Å; E68-T71 PolarHBondContact O-OG1 2.86Å; E68-S72 PolarHBondContact O-N 2.82Å; E68-S72 VanDerWaalsContact O-N 3.08Å
69	C	61.8	Low	66.9	Low	25 Å²	25	94.2 Å²	94.2	17%	0.169	50%	0.499	C	S	.	.	H	α-helix	trans	-70	-28.3	173.9	-60.8	0	0	0	0	111.2	Q56 V65 T66 E67 S72	Q56-C69 PolarHBondContact NE2-SG 3.24Å; V65-C69 HydrophobicContact CG1-CB 3.74Å; T66-C69 WeakPolarHBondContact O-CA 3.38Å; T66-C69 VanDerWaalsContact O-CB 3.28Å; T66-C69 WeakPolarHBondContact O-CB 3.07Å; T66-C69 PolarHBondContact O-N 3.45Å; T66-C69 PolarHBondContact OG1-SG 3.12Å; E67-C69 VanDerWaalsContact C-N 3.29Å; E67-C69 PolarHBondContact O-N 3.23Å; C69-S72 PolarHBondContact O-OG 3.04Å
70	L	62	Low	68.4	Low	69 Å²	69	96 Å²	96	36%	0.361	50%	0.5	S	S	.	.	H	α-helix	trans	-76.7	-29.6	177.9	-60.7	175.7	0	0	0	113	V65 T66 E67 E68 Y79	V65-L70 HydrophobicContact CG1-CD2 3.86Å; V65-L70 HydrophobicContact CG1-CG 4.22Å; T66-L70 PolarHBondContact O-N 3Å; E67-L70 WeakPolarHBondContact O-CA 3.32Å; E67-L70 WeakPolarHBondContact O-CB 3.46Å; E67-L70 PolarHBondContact O-N 3.04Å; E68-L70 VanDerWaalsContact C-N 3.26Å; E68-L70 PolarHBondContact O-N 3.05Å; L70-Y79 HydrophobicContact CD2-CD1 3.84Å; L70-Y79 HydrophobicContact CD2-CE1 3.98Å; L70-Y79 WeakPolarHBondContact O-CB 3.42Å
71	T	64.2	Low	69.5	Low	84 Å²	84	92.8 Å²	92.8	52%	0.515	48%	0.481	S	S	.	.	H	α-helix	trans	-90.9	-9	176.6	52.2	0	0	0	0	113.5	E67 E68 L73	E67-T71 PolarHBondContact O-N 2.85Å; E67-T71 PolarHBondContact O-OG1 3.24Å; E68-T71 PolarHBondContact O-N 3.11Å; E68-T71 PolarHBondContact O-OG1 2.86Å; T71-L73 PolarHBondContact O-N 3.33Å
72	S	70.6	Confident	70.9	Confident	53 Å²	53	90 Å²	90	37%	0.371	45%	0.451	S	S	.	.			trans	-52.8	130.3	175.4	67.4	0	0	0	0	111.5	E68 C69 Y79	E68-S72 PolarHBondContact O-N 2.82Å; E68-S72 VanDerWaalsContact O-N 3.08Å; C69-S72 PolarHBondContact O-OG 3.04Å; S72-Y79 PolarHBondContact O-N 3.12Å
73	L	67.3	Low	72.5	Confident	130 Å²	130	84.1 Å²	84.1	68%	0.681	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.9	177.7	-66.6	174.9	0	0	0	109.1	T71 Q78	T71-L73 PolarHBondContact O-N 3.33Å; L73-Q78 HydrophobicContact CD2-CG 3.97Å
74	V	70.3	Confident	74.2	Confident	29 Å²	29	79.8 Å²	79.8	18%	0.176	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.7	171.1	-175.6	0	0	0	0	109.3	D76 K77 I172	V74-D76 PolarHBondContact O-N 2.67Å; V74-K77 PolarHBondContact N-O 2.8Å; V74-K77 PolarHBondContact O-N 2.67Å; V74-K77 VanDerWaalsContact O-N 3.11Å; V74-I172 HydrophobicContact CB-CD1 3.92Å; V74-I172 HydrophobicContact CG1-CD1 3.59Å; V74-I172 HydrophobicContact CG1-CG1 3.98Å; V74-I172 HydrophobicContact CG2-CD1 4.26Å; V74-I172 HydrophobicContact CG2-CG2 4.17Å
75	E	68.6	Low	76	Confident	119 Å²	119	76.8 Å²	76.8	56%	0.556	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	-60.2	-173.6	-53.8	-146.3	151.5	0	0	113.3	K170	E75-K170 HydrophobicContact CG-CD 4.32Å; E75-K170 WeakPolarHBondContact OE1-CD 3.49Å; E75-K170 WeakPolarHBondContact OE1-CE 3.4Å; E75-K170 IonicContact OE1-NZ 2.67Å; E75-K170 PolarHBondContact OE1-NZ 2.98Å
76	D	77.2	Confident	77.6	Confident	151 Å²	151	75.5 Å²	75.5	81%	0.807	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.9	-6.3	174.6	-64.7	-65.3	0	0	0	113.5	V74	V74-D76 PolarHBondContact O-N 2.67Å
77	K	78.3	Confident	79.3	Confident	120 Å²	120	73.7 Å²	73.7	52%	0.522	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.2	-174.7	-63.5	-176.4	-178.5	-178	0	110.4	V74	V74-K77 PolarHBondContact N-O 2.8Å; V74-K77 PolarHBondContact O-N 2.67Å; V74-K77 VanDerWaalsContact O-N 3.11Å
78	Q	84.7	Confident	80.8	Confident	84 Å²	84	69.2 Å²	69.2	39%	0.393	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	148.5	171	-65.8	-176.6	-9.5	0	0	109.5	L73 Y80 E81	L73-Q78 HydrophobicContact CD2-CG 3.97Å; Q78-Y80 PolarHBondContact O-N 2.91Å; Q78-E81 HydrophobicContact CB-CG 4.4Å; Q78-E81 PolarHBondContact O-N 3.3Å; Q78-E81 VanDerWaalsContact O-N 3.12Å
79	Y	84	Confident	82.2	Confident	44 Å²	44	64 Å²	64	17%	0.173	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-49.7	-50.8	177	179.3	-116.9	0	0	0	109.7	L70 S72 E81 T82 R147 I172 S173	L70-Y79 HydrophobicContact CD2-CD1 3.84Å; L70-Y79 HydrophobicContact CD2-CE1 3.98Å; L70-Y79 WeakPolarHBondContact O-CB 3.42Å; S72-Y79 PolarHBondContact O-N 3.12Å; Y79-E81 VanDerWaalsContact C-N 3.26Å; Y79-E81 PolarHBondContact O-N 3.3Å; Y79-E81 VanDerWaalsContact O-N 3.12Å; Y79-T82 VanDerWaalsContact O-CB 3.3Å; Y79-T82 WeakPolarHBondContact O-CB 3.38Å; Y79-T82 PolarHBondContact O-N 3.01Å; Y79-T82 PolarHBondContact O-OG1 3.48Å; Y79-T82 VanDerWaalsContact O-OG1 3.04Å; Y79-R147 HydrophobicContact CE2-CG 3.96Å; Y79-R147 VanDerWaalsContact CE2-NE 3.28Å; Y79-R147 PolarHBondContact O-NE 2.81Å; Y79-R147 PolarHBondContact O-NH1 2.81Å; Y79-R147 PolarHBondContact O-NH2 3.15Å; Y79-I172 HydrophobicContact CD2-CG2 3.85Å; Y79-I172 HydrophobicContact CE2-CB 4.5Å; Y79-I172 HydrophobicContact CE2-CG2 3.73Å; Y79-S173 VanDerWaalsContact OH-CB 3.25Å; Y79-S173 WeakPolarHBondContact OH-CB 3.3Å; Y79-S173 PolarHBondContact OH-OG 2.87Å
80	Y	84.4	Confident	83.6	Confident	137 Å²	137	70.2 Å²	70.2	54%	0.537	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-48.7	-39.9	-179.5	179.1	-99.7	0	0	0	115.1	Q78 T82 C101 R147	Q78-Y80 PolarHBondContact O-N 2.91Å; Y80-T82 VanDerWaalsContact C-N 3.3Å; Y80-T82 PolarHBondContact O-N 3.17Å; Y80-C101 WeakPolarHBondContact O-CB 3.28Å; Y80-R147 VanDerWaalsContact N-NH2 3.14Å; Y80-R147 PolarHBondContact O-NH1 2.87Å
81	E	89.7	Confident	84.8	Confident	99 Å²	99	78.7 Å²	78.7	46%	0.463	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-82	-8.9	-175	-61.6	-177.5	155	0	0	113.7	Q78 Y79	Q78-E81 HydrophobicContact CB-CG 4.4Å; Q78-E81 PolarHBondContact O-N 3.3Å; Q78-E81 VanDerWaalsContact O-N 3.12Å; Y79-E81 VanDerWaalsContact C-N 3.26Å; Y79-E81 PolarHBondContact O-N 3.3Å; Y79-E81 VanDerWaalsContact O-N 3.12Å
82	T	91.2	Very high	85.9	Confident	4 Å²	4	77.9 Å²	77.9	3%	0.025	36%	0.363	C	S	.	.	S	Bend	trans	-63.5	132.8	179.1	-54	0	0	0	0	110.1	Y79 Y80 A145 R147 I172	Y79-T82 VanDerWaalsContact O-CB 3.3Å; Y79-T82 WeakPolarHBondContact O-CB 3.38Å; Y79-T82 PolarHBondContact O-N 3.01Å; Y79-T82 PolarHBondContact O-OG1 3.48Å; Y79-T82 VanDerWaalsContact O-OG1 3.04Å; Y80-T82 VanDerWaalsContact C-N 3.3Å; Y80-T82 PolarHBondContact O-N 3.17Å; T82-A145 WeakPolarHBondContact CG2-O 3.45Å; T82-R147 HydrophobicContact CG2-CG 4.1Å; T82-I172 HydrophobicContact CG2-CD1 3.49Å; T82-I172 VanDerWaalsContact CG2-CD1 3.49Å
83	P	95.3	Very high	87	Confident	13 Å²	13	77 Å²	77	8%	0.084	35%	0.354	C	S	.	.			trans	-60.6	152.7	175.7	25.7	-34.2	0	0	0	111.7	L98 T99 I143 V146 R147	P83-L98 HydrophobicContact CB-CD1 4.44Å; P83-T99 CarbonylContact C-O 3.57Å; P83-T99 WeakPolarHBondContact CA-O 3.47Å; P83-T99 VanDerWaalsContact CB-O 3.28Å; P83-T99 WeakPolarHBondContact CB-O 3.34Å; P83-I143 HydrophobicContact CB-CD1 4.48Å; P83-I143 HydrophobicContact CG-CD1 4.24Å; P83-I143 HydrophobicContact CG-CG1 4.33Å; P83-I143 HydrophobicContact CG-CG2 3.48Å; P83-I143 VanDerWaalsContact CG-CG2 3.48Å; P83-V146 HydrophobicContact CG-CG2 4.43Å; P83-R147 PolarHBondContact O-N 2.88Å
84	I	96	Very high	88.3	Confident	32 Å²	32	70.8 Å²	70.8	16%	0.164	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.6	-174.6	-54.1	170.7	0	0	0	108.5	H86 T99 R147 V149	I84-H86 WeakPolarHBondContact CG2-NE2 3.48Å; I84-T99 PolarHBondContact N-O 2.73Å; I84-T99 PolarHBondContact O-N 2.85Å; I84-T99 PolarHBondContact O-OG1 2.83Å; I84-T99 VanDerWaalsContact O-OG1 3.11Å; I84-R147 CarbonylContact C-O 3.54Å; I84-R147 WeakPolarHBondContact CA-O 3.49Å; I84-R147 HydrophobicContact CG1-CB 4.39Å; I84-V149 HydrophobicContact CG2-CB 4.38Å; I84-V149 HydrophobicContact CG2-CG2 3.59Å
85	L	97.4	Very high	89.6	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	107.4	171.1	176	68.4	0	0	0	108.9	L87 A96 L98 I134 V146 R147 V148 V149 L164	L85-L87 HydrophobicContact CD1-CD2 4.3Å; L85-L87 HydrophobicContact CD2-CD1 4.46Å; L85-L87 HydrophobicContact CD2-CD2 4.19Å; L85-L87 HydrophobicContact CD2-CG 4.39Å; L85-L87 HydrophobicContact CG-CD2 4.04Å; L85-L87 HydrophobicContact CG-CG 4.15Å; L85-A96 HydrophobicContact CD1-CB 4.33Å; L85-L98 HydrophobicContact CB-CD1 4.4Å; L85-L98 HydrophobicContact CD1-CB 4.42Å; L85-I134 HydrophobicContact CD1-CG1 3.71Å; L85-I134 HydrophobicContact CD1-CG2 4.25Å; L85-I134 HydrophobicContact CD2-CG2 4.31Å; L85-V146 HydrophobicContact CB-CG1 3.36Å; L85-R147 PolarHBondContact N-O 3.46Å; L85-V148 HydrophobicContact CD2-CG2 4.39Å; L85-V149 PolarHBondContact O-N 3.45Å; L85-L164 HydrophobicContact CD2-CD1 3.5Å; L85-L164 HydrophobicContact CD2-CD2 3.5Å; L85-L164 HydrophobicContact CD2-CG 4.15Å
86	H	97.1	Very high	90.9	Very high	64 Å²	64	65.6 Å²	65.6	30%	0.296	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122.2	174.7	-64.2	-77.5	0	0	0	110.3	I84 A96 T97 T99	I84-H86 WeakPolarHBondContact CG2-NE2 3.48Å; H86-A96 WeakPolarHBondContact O-CA 3.35Å; H86-T97 PolarHBondContact N-O 2.95Å; H86-T97 PolarHBondContact O-N 2.74Å; H86-T99 PolarHBondContact CD2-OG1 2.88Å; H86-T99 VanDerWaalsContact CD2-OG1 3.24Å; H86-T99 PolarHBondContact NE2-OG1 2.76Å
87	L	96.8	Very high	91.9	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	103.1	179.7	-64.4	176.5	0	0	0	109.6	L85 A96 V148 V149 F150 N151 V160 L164	L85-L87 HydrophobicContact CD1-CD2 4.3Å; L85-L87 HydrophobicContact CD2-CD1 4.46Å; L85-L87 HydrophobicContact CD2-CD2 4.19Å; L85-L87 HydrophobicContact CD2-CG 4.39Å; L85-L87 HydrophobicContact CG-CD2 4.04Å; L85-L87 HydrophobicContact CG-CG 4.15Å; L87-A96 HydrophobicContact CD2-CB 3.5Å; L87-V148 HydrophobicContact CD1-CG1 3.48Å; L87-V148 VanDerWaalsContact CD1-CG1 3.48Å; L87-V148 HydrophobicContact CG-CG1 4.25Å; L87-V149 PolarHBondContact N-O 2.73Å; L87-F150 HydrophobicContact CB-CD1 3.78Å; L87-F150 HydrophobicContact CB-CE1 3.84Å; L87-F150 HydrophobicContact CB-CG 4.26Å; L87-F150 HydrophobicContact CB-CZ 4.37Å; L87-F150 HydrophobicContact CD1-CD1 4.08Å; L87-F150 HydrophobicContact CD1-CD2 4.14Å; L87-F150 HydrophobicContact CD1-CE1 3.44Å; L87-F150 VanDerWaalsContact CD1-CE1 3.44Å; L87-F150 HydrophobicContact CD1-CE2 3.5Å; L87-F150 HydrophobicContact CD1-CG 4.4Å; L87-F150 HydrophobicContact CD1-CZ 3.14Å; L87-F150 HydrophobicContact CG-CE1 4.29Å; L87-F150 HydrophobicContact CG-CZ 4.37Å; L87-N151 PolarHBondContact O-N 3.07Å; L87-V160 HydrophobicContact CD1-CB 4.46Å; L87-V160 HydrophobicContact CD1-CG1 3.58Å; L87-V160 HydrophobicContact CD2-CG1 3.84Å; L87-V160 HydrophobicContact CG-CG1 4.36Å; L87-L164 HydrophobicContact CD1-CD1 4.32Å
88	L	95.6	Very high	92.8	Very high	64 Å²	64	54.6 Å²	54.6	34%	0.335	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	112	177.5	-176.8	66	0	0	0	110.6	R90 V94 V95 N151	L88-R90 HydrophobicContact CD2-CG 4.32Å; L88-R90 HydrophobicContact CG-CG 4.21Å; L88-V94 WeakPolarHBondContact O-CA 3.15Å; L88-V95 HydrophobicContact CB-CB 4.41Å; L88-V95 PolarHBondContact N-O 2.79Å; L88-V95 PolarHBondContact O-N 3.06Å; L88-N151 HydrophobicContact CD1-CB 3.91Å
89	S	93.9	Very high	93.5	Very high	21 Å²	21	50.9 Å²	50.9	15%	0.147	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	114.5	172.7	-171.6	0	0	0	0	111.2	N151 C156	S89-N151 WeakPolarHBondContact CB-O 3.48Å; S89-N151 PolarHBondContact N-O 2.68Å; S89-C156 WeakPolarHBondContact CB-SG 3.44Å; S89-C156 PolarHBondContact OG-SG 3.12Å
90	R	90.8	Very high	94	Very high	156 Å²	156	51.2 Å²	51.2	59%	0.589	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	157.2	168.2	-55.7	-172.5	179.2	-170.1	0.8	109.6	L88 N92 N93	L88-R90 HydrophobicContact CD2-CG 4.32Å; L88-R90 HydrophobicContact CG-CG 4.21Å; R90-N92 PolarHBondContact O-N 3.14Å; R90-N93 CarbonylContact C-O 3.59Å; R90-N93 WeakPolarHBondContact CA-O 3.22Å; R90-N93 VanDerWaalsContact CB-O 3.29Å; R90-N93 WeakPolarHBondContact CB-O 3.29Å; R90-N93 PolarHBondContact N-O 3.35Å; R90-N93 PolarHBondContact O-N 3.47Å; R90-N93 VanDerWaalsContact O-N 3.15Å
91	R	86.7	Confident	94.3	Very high	246 Å²	246	46.6 Å²	46.6	93%	0.928	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-28.7	-175.1	-126.8	-170.1	88.4	92.8	0.4	115.9
92	N	87.8	Confident	94.4	Very high	68 Å²	68	47.5 Å²	47.5	36%	0.364	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.3	23.8	179.2	-168.4	29.4	0	0	0	112.7	R90 N118 K121	R90-N92 PolarHBondContact O-N 3.14Å; N92-N118 PolarHBondContact ND2-O 2.99Å; N92-N118 PolarHBondContact OD1-O 3.37Å; N92-K121 WeakPolarHBondContact O-CB 3.37Å
93	N	93	Very high	94.5	Very high	33 Å²	33	49.6 Å²	49.6	18%	0.176	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	141.7	176.4	-163.4	20.5	0	0	0	110.7	R90 C111	R90-N93 CarbonylContact C-O 3.59Å; R90-N93 WeakPolarHBondContact CA-O 3.22Å; R90-N93 VanDerWaalsContact CB-O 3.29Å; R90-N93 WeakPolarHBondContact CB-O 3.29Å; R90-N93 PolarHBondContact N-O 3.35Å; R90-N93 PolarHBondContact O-N 3.47Å; R90-N93 VanDerWaalsContact O-N 3.15Å; N93-C111 WeakPolarHBondContact OD1-CB 3.48Å; N93-C111 PolarHBondContact OD1-N 2.62Å; N93-C111 VanDerWaalsContact OD1-N 3.17Å
94	V	95.6	Very high	94.5	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.3	163.5	175.7	0	0	0	0	107.7	L88 S110 C111 F127 V130 C156 V160	L88-V94 WeakPolarHBondContact O-CA 3.15Å; V94-S110 WeakPolarHBondContact O-CA 3.38Å; V94-S110 VanDerWaalsContact O-CB 3.27Å; V94-S110 WeakPolarHBondContact O-CB 3.42Å; V94-C111 PolarHBondContact O-N 2.88Å; V94-F127 HydrophobicContact CB-CD1 4.14Å; V94-F127 HydrophobicContact CB-CE1 4.39Å; V94-F127 HydrophobicContact CG2-CD1 3.42Å; V94-F127 VanDerWaalsContact CG2-CD1 3.42Å; V94-F127 HydrophobicContact CG2-CE1 3.47Å; V94-F127 VanDerWaalsContact CG2-CE1 3.47Å; V94-F127 HydrophobicContact CG2-CG 4.26Å; V94-F127 HydrophobicContact CG2-CZ 4.32Å; V94-V130 HydrophobicContact CG1-CG1 4.46Å; V94-C156 HydrophobicContact CG2-CB 3.37Å; V94-V160 HydrophobicContact CG1-CG2 4.07Å
95	V	96.6	Very high	94.6	Very high	39 Å²	39	60.9 Å²	60.9	24%	0.236	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.5	173	-176.4	0	0	0	0	107.5	L88	L88-V95 HydrophobicContact CB-CB 4.41Å; L88-V95 PolarHBondContact N-O 2.79Å; L88-V95 PolarHBondContact O-N 3.06Å
96	A	97.5	Very high	94.5	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.5	175.4	0	0	0	0	0	108.9	L85 H86 L87 G108 T109 V130 I134	L85-A96 HydrophobicContact CD1-CB 4.33Å; H86-A96 WeakPolarHBondContact O-CA 3.35Å; L87-A96 HydrophobicContact CD2-CB 3.5Å; A96-G108 CarbonylContact O-C 3.53Å; A96-G108 VanDerWaalsContact O-CA 3.29Å; A96-G108 WeakPolarHBondContact O-CA 3.32Å; A96-T109 PolarHBondContact N-O 3.47Å; A96-T109 PolarHBondContact O-N 3.24Å; A96-T109 VanDerWaalsContact O-O 3.09Å; A96-V130 HydrophobicContact CB-CG1 3.77Å; A96-I134 HydrophobicContact CB-CB 4.23Å; A96-I134 HydrophobicContact CB-CG1 4.18Å; A96-I134 HydrophobicContact CB-CG2 4.28Å
97	T	97.9	Very high	94.5	Very high	38 Å²	38	62.8 Å²	62.8	23%	0.233	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	119.6	179.7	-48	0	0	0	0	108.5	H86 T99 V105	H86-T97 PolarHBondContact N-O 2.95Å; H86-T97 PolarHBondContact O-N 2.74Å; T97-T99 HydrophobicContact CG2-CG2 4.16Å; T97-V105 HydrophobicContact CG2-CB 4.38Å; T97-V105 HydrophobicContact CG2-CG1 3.63Å; T97-V105 HydrophobicContact CG2-CG2 3.89Å
98	L	97.7	Very high	94.5	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.9	174.6	-176.9	68.2	0	0	0	108.7	P83 L85 L106 N107 I134 A138 L141 I143 V146	P83-L98 HydrophobicContact CB-CD1 4.44Å; L85-L98 HydrophobicContact CB-CD1 4.4Å; L85-L98 HydrophobicContact CD1-CB 4.42Å; L98-L106 HydrophobicContact CD2-CB 4.42Å; L98-L106 HydrophobicContact CD2-CD1 4.28Å; L98-L106 HydrophobicContact CG-CB 4.45Å; L98-L106 HydrophobicContact CG-CD1 4.32Å; L98-L106 PolarHBondContact O-N 2.83Å; L98-N107 HydrophobicContact CB-CB 4.39Å; L98-N107 PolarHBondContact N-O 3.04Å; L98-N107 PolarHBondContact O-N 2.9Å; L98-I134 HydrophobicContact CB-CD1 4.24Å; L98-I134 HydrophobicContact CB-CG1 4.49Å; L98-A138 HydrophobicContact CD2-CB 3.68Å; L98-L141 HydrophobicContact CD2-CD1 4.37Å; L98-I143 HydrophobicContact CD2-CD1 3.83Å; L98-V146 HydrophobicContact CD1-CG1 4.3Å; L98-V146 HydrophobicContact CD1-CG2 4.4Å
99	T	97.5	Very high	94.6	Very high	7 Å²	7	61.9 Å²	61.9	4%	0.043	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	155.2	179.9	56.5	0	0	0	0	111.4	P83 I84 H86 T97 R104 V105	P83-T99 CarbonylContact C-O 3.57Å; P83-T99 WeakPolarHBondContact CA-O 3.47Å; P83-T99 VanDerWaalsContact CB-O 3.28Å; P83-T99 WeakPolarHBondContact CB-O 3.34Å; I84-T99 PolarHBondContact N-O 2.73Å; I84-T99 PolarHBondContact O-N 2.85Å; I84-T99 PolarHBondContact O-OG1 2.83Å; I84-T99 VanDerWaalsContact O-OG1 3.11Å; H86-T99 PolarHBondContact CD2-OG1 2.88Å; H86-T99 VanDerWaalsContact CD2-OG1 3.24Å; H86-T99 PolarHBondContact NE2-OG1 2.76Å; T97-T99 HydrophobicContact CG2-CG2 4.16Å; T99-R104 CarbonylContact C-O 3.53Å; T99-R104 WeakPolarHBondContact CA-O 3.37Å; T99-R104 WeakPolarHBondContact CB-O 3.32Å; T99-V105 HydrophobicContact CG2-CG2 3.98Å
100	D	95.5	Very high	94.7	Very high	51 Å²	51	62 Å²	62	27%	0.273	32%	0.319	S	S	.	.			trans	-69.2	172.7	165.2	-65.2	-38.8	0	0	0	111.6	N102 G103 R104 L106	D100-N102 PolarHBondContact O-N 2.86Å; D100-G103 PolarHBondContact O-N 2.94Å; D100-R104 PolarHBondContact N-O 2.87Å; D100-L106 WeakPolarHBondContact OD1-CD1 2.99Å; D100-L106 WeakPolarHBondContact OD1-CG 3.04Å; D100-L106 WeakPolarHBondContact OD2-CD2 3.44Å
101	C	90.1	Very high	95	Very high	40 Å²	40	54.6 Å²	54.6	27%	0.27	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-32.4	170.3	54.8	0	0	0	0	112.9	Y80 G103	Y80-C101 WeakPolarHBondContact O-CB 3.28Å; C101-G103 VanDerWaalsContact C-N 3.28Å; C101-G103 PolarHBondContact O-N 2.74Å
102	N	92.6	Very high	95.5	Very high	118 Å²	118	43.5 Å²	43.5	63%	0.631	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	2.2	178.8	-62.3	-38.5	0	0	0	113.9	D100 R104	D100-N102 PolarHBondContact O-N 2.86Å; N102-R104 VanDerWaalsContact C-N 3.32Å; N102-R104 PolarHBondContact O-N 2.97Å
103	G	92.7	Very high	95.9	Very high	48 Å²	48	43.7 Å²	43.7	50%	0.495	26%	0.264	S	S	.	.			trans	78.1	8.2	-179.8	0	0	0	0	0	115.4	D100 C101	D100-G103 PolarHBondContact O-N 2.94Å; C101-G103 VanDerWaalsContact C-N 3.28Å; C101-G103 PolarHBondContact O-N 2.74Å
104	R	96.5	Very high	96	Very high	184 Å²	184	45.6 Å²	45.6	69%	0.694	27%	0.272	S	S	*	.			trans	-71.1	132.2	171	-65.7	-178.1	-178.1	178	0.7	109.5	T99 D100 N102 L106	T99-R104 CarbonylContact C-O 3.53Å; T99-R104 WeakPolarHBondContact CA-O 3.37Å; T99-R104 WeakPolarHBondContact CB-O 3.32Å; D100-R104 PolarHBondContact N-O 2.87Å; N102-R104 VanDerWaalsContact C-N 3.32Å; N102-R104 PolarHBondContact O-N 2.97Å; R104-L106 PolarHBondContact O-N 2.86Å
105	V	97.3	Very high	96.1	Very high	98 Å²	98	47.7 Å²	47.7	59%	0.594	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	119.7	-178.5	179.9	0	0	0	0	109.7	T97 T99	T97-V105 HydrophobicContact CG2-CB 4.38Å; T97-V105 HydrophobicContact CG2-CG1 3.63Å; T97-V105 HydrophobicContact CG2-CG2 3.89Å; T99-V105 HydrophobicContact CG2-CG2 3.98Å
106	L	96	Very high	96.1	Very high	60 Å²	60	47.7 Å²	47.7	31%	0.314	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-47.1	174.3	-65.8	179	0	0	0	111.4	L98 D100 R104 L141 I143	L98-L106 HydrophobicContact CD2-CB 4.42Å; L98-L106 HydrophobicContact CD2-CD1 4.28Å; L98-L106 HydrophobicContact CG-CB 4.45Å; L98-L106 HydrophobicContact CG-CD1 4.32Å; L98-L106 PolarHBondContact O-N 2.83Å; D100-L106 WeakPolarHBondContact OD1-CD1 2.99Å; D100-L106 WeakPolarHBondContact OD1-CG 3.04Å; D100-L106 WeakPolarHBondContact OD2-CD2 3.44Å; R104-L106 PolarHBondContact O-N 2.86Å; L106-L141 HydrophobicContact CB-CD1 3.81Å; L106-L141 HydrophobicContact CD1-CD1 4.02Å; L106-L141 HydrophobicContact CG-CD1 4.44Å; L106-I143 HydrophobicContact CD1-CD1 3.52Å
107	N	96.7	Very high	96	Very high	45 Å²	45	54.9 Å²	54.9	24%	0.241	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	156.1	-174.3	-90.5	-46.6	0	0	0	111.2	L98 I134 K137 L141	L98-N107 HydrophobicContact CB-CB 4.39Å; L98-N107 PolarHBondContact N-O 3.04Å; L98-N107 PolarHBondContact O-N 2.9Å; N107-I134 HydrophobicContact CB-CD1 4.37Å; N107-K137 HydrophobicContact CB-CB 4.5Å; N107-L141 WeakPolarHBondContact ND2-CD1 3.36Å
108	G	96.8	Very high	95.8	Very high	39 Å²	39	59.1 Å²	59.1	40%	0.402	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.8	173.8	0	0	0	0	0	113.1	A96 K137	A96-G108 CarbonylContact O-C 3.53Å; A96-G108 VanDerWaalsContact O-CA 3.29Å; A96-G108 WeakPolarHBondContact O-CA 3.32Å; G108-K137 PolarHBondContact O-NZ 3.11Å; G108-K137 VanDerWaalsContact O-NZ 3.17Å
109	T	97.3	Very high	95.6	Very high	6 Å²	6	62.7 Å²	62.7	4%	0.037	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	159.4	170.5	53.8	0	0	0	0	110.3	A96 E114 I134 K137	A96-T109 PolarHBondContact N-O 3.47Å; A96-T109 PolarHBondContact O-N 3.24Å; A96-T109 VanDerWaalsContact O-O 3.09Å; T109-E114 WeakPolarHBondContact CG2-OE1 3.35Å; T109-I134 HydrophobicContact CG2-CD1 4.35Å; T109-K137 HydrophobicContact CG2-CD 3.71Å
110	S	97.1	Very high	95.5	Very high	25 Å²	25	71.1 Å²	71.1	18%	0.175	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	163.9	171.1	68.2	0	0	0	0	110	V94 G112 A113 E114 V130	V94-S110 WeakPolarHBondContact O-CA 3.38Å; V94-S110 VanDerWaalsContact O-CB 3.27Å; V94-S110 WeakPolarHBondContact O-CB 3.42Å; S110-G112 PolarHBondContact O-N 3.24Å; S110-G112 VanDerWaalsContact O-N 3.1Å; S110-A113 WeakPolarHBondContact O-CB 3.28Å; S110-A113 PolarHBondContact O-N 3.04Å; S110-A113 PolarHBondContact OG-N 3.4Å; S110-E114 PolarHBondContact O-N 3.44Å; S110-E114 VanDerWaalsContact O-N 3.14Å; S110-V130 VanDerWaalsContact C-CG2 3.47Å
111	C	96.7	Very high	95.4	Very high	0 Å²	0	71 Å²	71	0%	0	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-33	179.7	-56	0	0	0	0	111.5	N93 V94 F116 K121 A126 V130	N93-C111 WeakPolarHBondContact OD1-CB 3.48Å; N93-C111 PolarHBondContact OD1-N 2.62Å; N93-C111 VanDerWaalsContact OD1-N 3.17Å; V94-C111 PolarHBondContact O-N 2.88Å; C111-F116 WeakPolarHBondContact O-CB 3.25Å; C111-F116 WeakPolarHBondContact O-CD2 3.47Å; C111-F116 PolarHBondContact O-N 2.97Å; C111-F116 VanDerWaalsContact O-N 3.13Å; C111-K121 HydrophobicContact CB-CB 4.23Å; C111-K121 HydrophobicContact CB-CG 4.44Å; C111-A126 HydrophobicContact CB-CB 4.4Å; C111-V130 HydrophobicContact CB-CG2 4.17Å; C111-V130 VanDerWaalsContact N-CG2 3.29Å; C111-V130 VanDerWaalsContact SG-CG2 3.59Å
112	G	96.3	Very high	95.5	Very high	13 Å²	13	74.2 Å²	74.2	13%	0.134	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-31.7	175.1	0	0	0	0	0	114.7	S110 G115 R117	S110-G112 PolarHBondContact O-N 3.24Å; S110-G112 VanDerWaalsContact O-N 3.1Å; G112-G115 PolarHBondContact O-N 3.37Å; G112-R117 PolarHBondContact O-NH1 3.43Å
113	A	96.1	Very high	95.6	Very high	71 Å²	71	71 Å²	71	59%	0.587	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-35.7	177.6	0	0	0	0	0	111.5	S110 G115	S110-A113 WeakPolarHBondContact O-CB 3.28Å; S110-A113 PolarHBondContact O-N 3.04Å; S110-A113 PolarHBondContact OG-N 3.4Å; A113-G115 PolarHBondContact O-N 3.49Å; A113-G115 VanDerWaalsContact O-N 3.12Å
114	E	96.1	Very high	95.7	Very high	73 Å²	73	72.4 Å²	72.4	34%	0.341	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	3.4	173.6	-55.6	-51.5	131.7	0	0	113.4	T109 S110 F116 V130 S133	T109-E114 WeakPolarHBondContact CG2-OE1 3.35Å; S110-E114 PolarHBondContact O-N 3.44Å; S110-E114 VanDerWaalsContact O-N 3.14Å; E114-F116 HydrophobicContact CB-CD2 4.02Å; E114-F116 HydrophobicContact CB-CE2 4.02Å; E114-V130 HydrophobicContact CG-CG2 4.01Å; E114-S133 VanDerWaalsContact CD-CB 3.43Å; E114-S133 VanDerWaalsContact CD-OG 3.31Å; E114-S133 WeakPolarHBondContact OE1-CB 3.5Å; E114-S133 PolarHBondContact OE1-OG 2.8Å; E114-S133 WeakPolarHBondContact OE2-CB 3.5Å
115	G	96.7	Very high	95.7	Very high	45 Å²	45	67.4 Å²	67.4	46%	0.464	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	-3.1	174.1	0	0	0	0	0	115.5	G112 A113	G112-G115 PolarHBondContact O-N 3.37Å; A113-G115 PolarHBondContact O-N 3.49Å; A113-G115 VanDerWaalsContact O-N 3.12Å
116	F	97.2	Very high	95.7	Very high	39 Å²	39	62.7 Å²	62.7	17%	0.171	36%	0.356	C	S	.	.			trans	-68.4	138.6	175.2	-60.2	-87.1	0	0	0	110.8	C111 E114 R120 K121 A126 T129	C111-F116 WeakPolarHBondContact O-CB 3.25Å; C111-F116 WeakPolarHBondContact O-CD2 3.47Å; C111-F116 PolarHBondContact O-N 2.97Å; C111-F116 VanDerWaalsContact O-N 3.13Å; E114-F116 HydrophobicContact CB-CD2 4.02Å; E114-F116 HydrophobicContact CB-CE2 4.02Å; F116-R120 HydrophobicContact CD1-CB 4.28Å; F116-K121 HydrophobicContact CB-CB 4.44Å; F116-K121 HydrophobicContact CB-CG 3.86Å; F116-K121 WeakPolarHBondContact O-CE 3.5Å; F116-K121 VanDerWaalsContact O-CG 3.28Å; F116-K121 WeakPolarHBondContact O-CG 3.4Å; F116-A126 HydrophobicContact CB-CB 4.26Å; F116-A126 HydrophobicContact CD1-CB 3.71Å; F116-A126 HydrophobicContact CD2-CB 3.7Å; F116-A126 HydrophobicContact CE1-CB 3.92Å; F116-A126 HydrophobicContact CE2-CB 3.94Å; F116-A126 HydrophobicContact CG-CB 3.59Å; F116-A126 HydrophobicContact CZ-CB 4.04Å; F116-T129 HydrophobicContact CE2-CG2 4.32Å; F116-T129 WeakPolarHBondContact CE2-OG1 3.34Å; F116-T129 HydrophobicContact CZ-CG2 4.15Å
117	R	95.4	Very high	95.7	Very high	152 Å²	152	60.2 Å²	60.2	57%	0.574	34%	0.343	S	S	*	.			trans	-123.3	145.8	-178.7	-60.7	-64.9	-175.3	-123.1	7.1	110.5	G112 A119 R120	G112-R117 PolarHBondContact O-NH1 3.43Å; R117-A119 PolarHBondContact O-N 3.14Å; R117-R120 WeakPolarHBondContact O-CB 3.47Å; R117-R120 PolarHBondContact O-N 3.12Å
118	N	94.4	Very high	95.7	Very high	127 Å²	127	61.2 Å²	61.2	68%	0.679	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	47.7	-126.2	173	-56.7	-20.7	0	0	0	113.4	N92 R120 K121	N92-N118 PolarHBondContact ND2-O 2.99Å; N92-N118 PolarHBondContact OD1-O 3.37Å; N118-R120 PolarHBondContact O-N 2.89Å; N118-K121 WeakPolarHBondContact O-CB 3.49Å; N118-K121 PolarHBondContact O-N 3.1Å; N118-K121 VanDerWaalsContact O-N 3.14Å
119	A	93	Very high	95.8	Very high	76 Å²	76	61.4 Å²	61.4	63%	0.628	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-62.5	-21.8	-178.8	0	0	0	0	0	113.6	R117 K121 M122	R117-A119 PolarHBondContact O-N 3.14Å; A119-K121 PolarHBondContact O-N 3.15Å; A119-M122 WeakPolarHBondContact O-CG 3.41Å; A119-M122 PolarHBondContact O-N 2.88Å
120	R	94.4	Very high	95.8	Very high	184 Å²	184	61.1 Å²	61.1	69%	0.694	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-72.8	-17.8	177.8	-58.2	178	72.9	-179.1	2.7	112.4	F116 R117 N118 M122 S123 A126	F116-R120 HydrophobicContact CD1-CB 4.28Å; R117-R120 WeakPolarHBondContact O-CB 3.47Å; R117-R120 PolarHBondContact O-N 3.12Å; N118-R120 PolarHBondContact O-N 2.89Å; R120-M122 VanDerWaalsContact C-N 3.29Å; R120-M122 PolarHBondContact O-N 2.86Å; R120-S123 WeakPolarHBondContact O-CB 3.48Å; R120-S123 PolarHBondContact O-N 3.42Å; R120-A126 WeakPolarHBondContact O-CB 3.47Å
121	K	94.5	Very high	95.8	Very high	49 Å²	49	60 Å²	60	21%	0.213	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-69.3	-22.9	177.6	-67.8	-179.7	177	-179.2	0	113.7	N92 C111 F116 N118 A119 F127	N92-K121 WeakPolarHBondContact O-CB 3.37Å; C111-K121 HydrophobicContact CB-CB 4.23Å; C111-K121 HydrophobicContact CB-CG 4.44Å; F116-K121 HydrophobicContact CB-CB 4.44Å; F116-K121 HydrophobicContact CB-CG 3.86Å; F116-K121 WeakPolarHBondContact O-CE 3.5Å; F116-K121 VanDerWaalsContact O-CG 3.28Å; F116-K121 WeakPolarHBondContact O-CG 3.4Å; N118-K121 WeakPolarHBondContact O-CB 3.49Å; N118-K121 PolarHBondContact O-N 3.1Å; N118-K121 VanDerWaalsContact O-N 3.14Å; A119-K121 PolarHBondContact O-N 3.15Å; K121-F127 VanDerWaalsContact O-CE1 3.29Å; K121-F127 WeakPolarHBondContact O-CE1 3.42Å
122	M	92.3	Very high	95.8	Very high	106 Å²	106	62.4 Å²	62.4	52%	0.522	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-93.6	4.5	179.7	59.6	173.7	-70.6	0	0	113.9	A119 R120 F127	A119-M122 WeakPolarHBondContact O-CG 3.41Å; A119-M122 PolarHBondContact O-N 2.88Å; R120-M122 VanDerWaalsContact C-N 3.29Å; R120-M122 PolarHBondContact O-N 2.86Å; M122-F127 HydrophobicContact CB-CZ 4.39Å; M122-F127 WeakPolarHBondContact O-CE2 3.47Å; M122-F127 WeakPolarHBondContact O-CZ 3.27Å
123	S	94	Very high	95.9	Very high	50 Å²	50	62.4 Å²	62.4	35%	0.35	34%	0.34	S	S	.	.	S	Bend	trans	-74.3	146.6	178.4	-178.9	0	0	0	0	111.4	R120 V125 A126 F127	R120-S123 WeakPolarHBondContact O-CB 3.48Å; R120-S123 PolarHBondContact O-N 3.42Å; S123-V125 PolarHBondContact O-N 2.89Å; S123-V125 PolarHBondContact OG-N 3.31Å; S123-A126 WeakPolarHBondContact O-CA 3.43Å; S123-A126 WeakPolarHBondContact O-CB 3.33Å; S123-A126 PolarHBondContact O-N 2.86Å; S123-F127 WeakPolarHBondContact O-CD2 3.34Å; S123-F127 PolarHBondContact O-N 3.02Å; S123-F127 VanDerWaalsContact O-N 3.14Å
124	T	95	Very high	96	Very high	79 Å²	79	59.1 Å²	59.1	49%	0.485	31%	0.313	S	S	.	.	H	α-helix	trans	-57.5	-33.4	174.2	51.8	0	0	0	0	112.3	A126 F127 Q128	T124-A126 VanDerWaalsContact C-N 3.34Å; T124-A126 PolarHBondContact O-N 3.36Å; T124-F127 PolarHBondContact O-N 2.67Å; T124-Q128 WeakPolarHBondContact O-CG 3.29Å; T124-Q128 PolarHBondContact O-N 3.01Å
125	V	95.8	Very high	96.1	Very high	78 Å²	78	55.6 Å²	55.6	47%	0.473	30%	0.296	S	S	.	.	H	α-helix	trans	-64.1	-39.2	174.3	-177.9	0	0	0	0	111.1	S123 F127 T129	S123-V125 PolarHBondContact O-N 2.89Å; S123-V125 PolarHBondContact OG-N 3.31Å; V125-F127 VanDerWaalsContact C-N 3.3Å; V125-F127 PolarHBondContact O-N 2.74Å; V125-T129 WeakPolarHBondContact O-CB 3.35Å; V125-T129 VanDerWaalsContact O-CG2 3.29Å; V125-T129 WeakPolarHBondContact O-CG2 3.29Å; V125-T129 PolarHBondContact O-N 2.78Å; V125-T129 PolarHBondContact O-OG1 3.13Å
126	A	97.2	Very high	96.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.2	-31.1	176.2	0	0	0	0	0	112.3	C111 F116 R120 S123 T124 T129 V130	C111-A126 HydrophobicContact CB-CB 4.4Å; F116-A126 HydrophobicContact CB-CB 4.26Å; F116-A126 HydrophobicContact CD1-CB 3.71Å; F116-A126 HydrophobicContact CD2-CB 3.7Å; F116-A126 HydrophobicContact CE1-CB 3.92Å; F116-A126 HydrophobicContact CE2-CB 3.94Å; F116-A126 HydrophobicContact CG-CB 3.59Å; F116-A126 HydrophobicContact CZ-CB 4.04Å; R120-A126 WeakPolarHBondContact O-CB 3.47Å; S123-A126 WeakPolarHBondContact O-CA 3.43Å; S123-A126 WeakPolarHBondContact O-CB 3.33Å; S123-A126 PolarHBondContact O-N 2.86Å; T124-A126 VanDerWaalsContact C-N 3.34Å; T124-A126 PolarHBondContact O-N 3.36Å; A126-T129 VanDerWaalsContact C-OG1 3.29Å; A126-T129 VanDerWaalsContact CA-OG1 3.3Å; A126-T129 WeakPolarHBondContact CA-OG1 3.36Å; A126-T129 PolarHBondContact O-OG1 3.28Å; A126-V130 WeakPolarHBondContact O-CG2 3.41Å; A126-V130 PolarHBondContact O-N 3.28Å
127	F	96.6	Very high	96.1	Very high	8 Å²	8	59 Å²	59	4%	0.035	30%	0.302	C	S	.	.	H	α-helix	trans	-75.9	-42.4	176	-59.7	-30.6	0	0	0	112.3	V94 K121 M122 S123 T124 V125 V130 G131 C156 P159 V160	V94-F127 HydrophobicContact CB-CD1 4.14Å; V94-F127 HydrophobicContact CB-CE1 4.39Å; V94-F127 HydrophobicContact CG2-CD1 3.42Å; V94-F127 VanDerWaalsContact CG2-CD1 3.42Å; V94-F127 HydrophobicContact CG2-CE1 3.47Å; V94-F127 VanDerWaalsContact CG2-CE1 3.47Å; V94-F127 HydrophobicContact CG2-CG 4.26Å; V94-F127 HydrophobicContact CG2-CZ 4.32Å; K121-F127 VanDerWaalsContact O-CE1 3.29Å; K121-F127 WeakPolarHBondContact O-CE1 3.42Å; M122-F127 HydrophobicContact CB-CZ 4.39Å; M122-F127 WeakPolarHBondContact O-CE2 3.47Å; M122-F127 WeakPolarHBondContact O-CZ 3.27Å; S123-F127 WeakPolarHBondContact O-CD2 3.34Å; S123-F127 PolarHBondContact O-N 3.02Å; S123-F127 VanDerWaalsContact O-N 3.14Å; T124-F127 PolarHBondContact O-N 2.67Å; V125-F127 VanDerWaalsContact C-N 3.3Å; V125-F127 PolarHBondContact O-N 2.74Å; F127-V130 PolarHBondContact O-N 2.65Å; F127-G131 PolarHBondContact O-N 3.14Å; F127-G131 VanDerWaalsContact O-N 3.12Å; F127-C156 HydrophobicContact CD1-CB 4.47Å; F127-C156 HydrophobicContact CD2-CB 4.2Å; F127-C156 HydrophobicContact CE2-CB 4.28Å; F127-C156 HydrophobicContact CG-CB 4.3Å; F127-C156 HydrophobicContact CZ-CB 4.45Å; F127-P159 HydrophobicContact CB-CB 3.9Å; F127-P159 HydrophobicContact CB-CG 3.79Å; F127-P159 HydrophobicContact CD2-CG 3.83Å; F127-P159 HydrophobicContact CG-CG 4.29Å; F127-V160 HydrophobicContact CB-CG2 3.92Å
128	Q	97.1	Very high	96.1	Very high	66 Å²	66	51.8 Å²	51.8	31%	0.308	28%	0.275	S	S	.	.	H	α-helix	trans	-61.3	-44.3	175.2	-78.3	174.1	-13.7	0	0	111.8	T124 V130 G131 I132 P159	T124-Q128 WeakPolarHBondContact O-CG 3.29Å; T124-Q128 PolarHBondContact O-N 3.01Å; Q128-V130 VanDerWaalsContact C-N 3.32Å; Q128-V130 PolarHBondContact O-N 3.29Å; Q128-G131 WeakPolarHBondContact O-CA 3.4Å; Q128-G131 PolarHBondContact O-N 3.37Å; Q128-G131 VanDerWaalsContact O-N 3.1Å; Q128-I132 WeakPolarHBondContact O-CG1 3.16Å; Q128-I132 PolarHBondContact O-N 2.86Å; Q128-P159 WeakPolarHBondContact CA-O 3.34Å; Q128-P159 HydrophobicContact CG-CB 3.82Å; Q128-P159 WeakPolarHBondContact CG-O 3.26Å
129	T	97.8	Very high	96.2	Very high	43 Å²	43	50.4 Å²	50.4	26%	0.264	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-35.4	177.1	45.8	0	0	0	0	113	F116 V125 A126 I132 S133	F116-T129 HydrophobicContact CE2-CG2 4.32Å; F116-T129 WeakPolarHBondContact CE2-OG1 3.34Å; F116-T129 HydrophobicContact CZ-CG2 4.15Å; V125-T129 WeakPolarHBondContact O-CB 3.35Å; V125-T129 VanDerWaalsContact O-CG2 3.29Å; V125-T129 WeakPolarHBondContact O-CG2 3.29Å; V125-T129 PolarHBondContact O-N 2.78Å; V125-T129 PolarHBondContact O-OG1 3.13Å; A126-T129 VanDerWaalsContact C-OG1 3.29Å; A126-T129 VanDerWaalsContact CA-OG1 3.3Å; A126-T129 WeakPolarHBondContact CA-OG1 3.36Å; A126-T129 PolarHBondContact O-OG1 3.28Å; T129-I132 PolarHBondContact O-N 2.83Å; T129-S133 VanDerWaalsContact O-CB 3.29Å; T129-S133 WeakPolarHBondContact O-CB 3.39Å; T129-S133 PolarHBondContact O-N 2.81Å; T129-S133 PolarHBondContact O-OG 2.81Å
130	V	97.7	Very high	96.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-42.1	171	170.8	0	0	0	0	111.7	V94 A96 S110 C111 E114 A126 F127 Q128 S133 I134	V94-V130 HydrophobicContact CG1-CG1 4.46Å; A96-V130 HydrophobicContact CB-CG1 3.77Å; S110-V130 VanDerWaalsContact C-CG2 3.47Å; C111-V130 HydrophobicContact CB-CG2 4.17Å; C111-V130 VanDerWaalsContact N-CG2 3.29Å; C111-V130 VanDerWaalsContact SG-CG2 3.59Å; E114-V130 HydrophobicContact CG-CG2 4.01Å; A126-V130 WeakPolarHBondContact O-CG2 3.41Å; A126-V130 PolarHBondContact O-N 3.28Å; F127-V130 PolarHBondContact O-N 2.65Å; Q128-V130 VanDerWaalsContact C-N 3.32Å; Q128-V130 PolarHBondContact O-N 3.29Å; V130-S133 WeakPolarHBondContact CA-OG 3.31Å; V130-S133 PolarHBondContact O-OG 2.89Å; V130-I134 WeakPolarHBondContact O-CG2 3.16Å; V130-I134 PolarHBondContact O-N 3.06Å
131	G	97.3	Very high	96.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-43.8	174.5	0	0	0	0	0	112.6	F127 Q128 I134 G135 L164	F127-G131 PolarHBondContact O-N 3.14Å; F127-G131 VanDerWaalsContact O-N 3.12Å; Q128-G131 WeakPolarHBondContact O-CA 3.4Å; Q128-G131 PolarHBondContact O-N 3.37Å; Q128-G131 VanDerWaalsContact O-N 3.1Å; G131-I134 WeakPolarHBondContact O-CG2 3.35Å; G131-G135 PolarHBondContact O-N 3.04Å; G131-G135 VanDerWaalsContact O-N 3.11Å; G131-L164 WeakPolarHBondContact O-CD2 3.29Å
132	I	97.8	Very high	96.3	Very high	51 Å²	51	52 Å²	52	26%	0.262	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-48.1	178.2	-65.2	165.6	0	0	0	110.7	Q128 T129 G135 L136 G163 I166	Q128-I132 WeakPolarHBondContact O-CG1 3.16Å; Q128-I132 PolarHBondContact O-N 2.86Å; T129-I132 PolarHBondContact O-N 2.83Å; I132-G135 PolarHBondContact O-N 3.24Å; I132-L136 HydrophobicContact CG2-CD1 3.9Å; I132-L136 HydrophobicContact CG2-CG 4.29Å; I132-L136 VanDerWaalsContact O-CG 3.32Å; I132-L136 WeakPolarHBondContact O-CG 3.33Å; I132-L136 PolarHBondContact O-N 3.49Å; I132-G163 WeakPolarHBondContact CG1-O 3.37Å; I132-I166 HydrophobicContact CD1-CG2 4.15Å; I132-I166 HydrophobicContact CG1-CB 4.29Å; I132-I166 HydrophobicContact CG1-CG2 4.19Å
133	S	97.9	Very high	96.4	Very high	14 Å²	14	48.1 Å²	48.1	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-44.9	-177.7	57	0	0	0	0	112.6	E114 T129 V130 G135 L136 K137	E114-S133 VanDerWaalsContact CD-CB 3.43Å; E114-S133 VanDerWaalsContact CD-OG 3.31Å; E114-S133 WeakPolarHBondContact OE1-CB 3.5Å; E114-S133 PolarHBondContact OE1-OG 2.8Å; E114-S133 WeakPolarHBondContact OE2-CB 3.5Å; T129-S133 VanDerWaalsContact O-CB 3.29Å; T129-S133 WeakPolarHBondContact O-CB 3.39Å; T129-S133 PolarHBondContact O-N 2.81Å; T129-S133 PolarHBondContact O-OG 2.81Å; V130-S133 WeakPolarHBondContact CA-OG 3.31Å; V130-S133 PolarHBondContact O-OG 2.89Å; S133-G135 VanDerWaalsContact C-N 3.29Å; S133-G135 PolarHBondContact O-N 2.86Å; S133-L136 PolarHBondContact O-N 2.92Å; S133-K137 WeakPolarHBondContact O-CG 3.47Å; S133-K137 PolarHBondContact O-N 3.16Å
134	I	97.9	Very high	96.2	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-66.2	-36.5	177	-161.8	65.1	0	0	0	111	L85 A96 L98 N107 T109 V130 G131 K137 A138 L164	L85-I134 HydrophobicContact CD1-CG1 3.71Å; L85-I134 HydrophobicContact CD1-CG2 4.25Å; L85-I134 HydrophobicContact CD2-CG2 4.31Å; A96-I134 HydrophobicContact CB-CB 4.23Å; A96-I134 HydrophobicContact CB-CG1 4.18Å; A96-I134 HydrophobicContact CB-CG2 4.28Å; L98-I134 HydrophobicContact CB-CD1 4.24Å; L98-I134 HydrophobicContact CB-CG1 4.49Å; N107-I134 HydrophobicContact CB-CD1 4.37Å; T109-I134 HydrophobicContact CG2-CD1 4.35Å; V130-I134 WeakPolarHBondContact O-CG2 3.16Å; V130-I134 PolarHBondContact O-N 3.06Å; G131-I134 WeakPolarHBondContact O-CG2 3.35Å; I134-K137 PolarHBondContact O-N 3.1Å; I134-A138 WeakPolarHBondContact O-CB 3.3Å; I134-A138 PolarHBondContact O-N 3.34Å; I134-L164 HydrophobicContact CG2-CD2 3.58Å
135	G	97.3	Very high	96.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-67	-42.1	177.6	0	0	0	0	0	113.7	G131 I132 S133 K137 A138 K139 S167 L169	G131-G135 PolarHBondContact O-N 3.04Å; G131-G135 VanDerWaalsContact O-N 3.11Å; I132-G135 PolarHBondContact O-N 3.24Å; S133-G135 VanDerWaalsContact C-N 3.29Å; S133-G135 PolarHBondContact O-N 2.86Å; G135-K137 VanDerWaalsContact C-N 3.34Å; G135-K137 PolarHBondContact O-N 3.12Å; G135-A138 PolarHBondContact O-N 2.99Å; G135-K139 WeakPolarHBondContact O-CG 3.37Å; G135-K139 PolarHBondContact O-N 3.44Å; G135-S167 WeakPolarHBondContact CA-OG 3.39Å; G135-L169 VanDerWaalsContact CA-CD1 3.44Å
136	L	96.9	Very high	96.1	Very high	89 Å²	89	40.9 Å²	40.9	47%	0.466	23%	0.228	S	C	.	.	H	α-helix	trans	-63.6	-39	172.3	-68.3	175	0	0	0	111.9	I132 S133 K139 K140	I132-L136 HydrophobicContact CG2-CD1 3.9Å; I132-L136 HydrophobicContact CG2-CG 4.29Å; I132-L136 VanDerWaalsContact O-CG 3.32Å; I132-L136 WeakPolarHBondContact O-CG 3.33Å; I132-L136 PolarHBondContact O-N 3.49Å; S133-L136 PolarHBondContact O-N 2.92Å; L136-K139 PolarHBondContact O-N 2.96Å; L136-K140 WeakPolarHBondContact O-CG 3.35Å; L136-K140 PolarHBondContact O-N 3.34Å; L136-K140 VanDerWaalsContact O-N 3.08Å
137	K	97.1	Very high	95.9	Very high	67 Å²	67	42 Å²	42	29%	0.291	23%	0.232	S	C	.	.	H	α-helix	trans	-64.9	-40.7	174.5	-72.7	-178.7	-173.2	-167.3	0	112.2	N107 G108 T109 S133 I134 G135 K140 L141	N107-K137 HydrophobicContact CB-CB 4.5Å; G108-K137 PolarHBondContact O-NZ 3.11Å; G108-K137 VanDerWaalsContact O-NZ 3.17Å; T109-K137 HydrophobicContact CG2-CD 3.71Å; S133-K137 WeakPolarHBondContact O-CG 3.47Å; S133-K137 PolarHBondContact O-N 3.16Å; I134-K137 PolarHBondContact O-N 3.1Å; G135-K137 VanDerWaalsContact C-N 3.34Å; G135-K137 PolarHBondContact O-N 3.12Å; K137-K140 PolarHBondContact O-N 3.38Å; K137-L141 PolarHBondContact O-N 3.03Å
138	A	96.9	Very high	95.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-43.2	175.5	0	0	0	0	0	111.7	L98 I134 G135 K140 L141 G142 I143 L169	L98-A138 HydrophobicContact CD2-CB 3.68Å; I134-A138 WeakPolarHBondContact O-CB 3.3Å; I134-A138 PolarHBondContact O-N 3.34Å; G135-A138 PolarHBondContact O-N 2.99Å; A138-K140 VanDerWaalsContact C-N 3.32Å; A138-K140 PolarHBondContact O-N 3.49Å; A138-L141 WeakPolarHBondContact O-CA 3.42Å; A138-L141 WeakPolarHBondContact O-CB 3.12Å; A138-L141 PolarHBondContact O-N 3.23Å; A138-G142 PolarHBondContact O-N 2.93Å; A138-I143 HydrophobicContact CB-CB 4.32Å; A138-I143 PolarHBondContact O-N 2.92Å; A138-I143 VanDerWaalsContact O-N 3.09Å; A138-L169 HydrophobicContact CB-CD1 3.92Å; A138-L169 HydrophobicContact CB-CD2 3.96Å; A138-L169 HydrophobicContact CB-CG 4.47Å
139	K	95.8	Very high	95.8	Very high	98 Å²	98	39.6 Å²	39.6	43%	0.426	22%	0.222	S	C	.	.	H	α-helix	trans	-61.3	-37.9	175.4	-77.1	-171.3	167.6	-171.2	0	113.1	G135 L136 L141 G142 S167 G168 L169	G135-K139 WeakPolarHBondContact O-CG 3.37Å; G135-K139 PolarHBondContact O-N 3.44Å; L136-K139 PolarHBondContact O-N 2.96Å; K139-L141 PolarHBondContact O-N 3.41Å; K139-G142 PolarHBondContact O-N 3.03Å; K139-S167 WeakPolarHBondContact CD-O 2.89Å; K139-S167 WeakPolarHBondContact CE-O 3.28Å; K139-S167 PolarHBondContact NZ-O 3.17Å; K139-G168 VanDerWaalsContact CE-C 3.43Å; K139-G168 WeakPolarHBondContact CE-O 3.35Å; K139-G168 PolarHBondContact NZ-O 3.31Å; K139-L169 HydrophobicContact CG-CD2 4.18Å
140	K	96.2	Very high	95.7	Very high	184 Å²	184	37.8 Å²	37.8	80%	0.8	21%	0.211	S	C	*	.	H	α-helix	trans	-61.2	-27.7	173.7	-72.2	174.5	-176.6	-172.8	0	113	L136 K137 A138 G142	L136-K140 WeakPolarHBondContact O-CG 3.35Å; L136-K140 PolarHBondContact O-N 3.34Å; L136-K140 VanDerWaalsContact O-N 3.08Å; K137-K140 PolarHBondContact O-N 3.38Å; A138-K140 VanDerWaalsContact C-N 3.32Å; A138-K140 PolarHBondContact O-N 3.49Å; K140-G142 VanDerWaalsContact C-N 3.33Å
141	L	94.7	Very high	95.6	Very high	90 Å²	90	39 Å²	39	47%	0.471	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-3.6	174.2	-62.1	-179.4	0	0	0	113.4	L98 L106 N107 K137 A138 K139 I143	L98-L141 HydrophobicContact CD2-CD1 4.37Å; L106-L141 HydrophobicContact CB-CD1 3.81Å; L106-L141 HydrophobicContact CD1-CD1 4.02Å; L106-L141 HydrophobicContact CG-CD1 4.44Å; N107-L141 WeakPolarHBondContact ND2-CD1 3.36Å; K137-L141 PolarHBondContact O-N 3.03Å; A138-L141 WeakPolarHBondContact O-CA 3.42Å; A138-L141 WeakPolarHBondContact O-CB 3.12Å; A138-L141 PolarHBondContact O-N 3.23Å; K139-L141 PolarHBondContact O-N 3.41Å; L141-I143 HydrophobicContact CB-CD1 4.15Å; L141-I143 HydrophobicContact CB-CG1 4.37Å; L141-I143 HydrophobicContact CD1-CD1 4.26Å
142	G	93.5	Very high	95.3	Very high	69 Å²	69	39.8 Å²	39.8	71%	0.711	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.4	20.9	-175.9	0	0	0	0	0	114.5	A138 K139 K140	A138-G142 PolarHBondContact O-N 2.93Å; K139-G142 PolarHBondContact O-N 3.03Å; K140-G142 VanDerWaalsContact C-N 3.33Å
143	I	93.6	Very high	94.8	Very high	24 Å²	24	44.1 Å²	44.1	12%	0.123	25%	0.248	C	C	.	.			trans	-92.9	117.3	177.7	-62.8	165	0	0	0	109.4	P83 L98 L106 A138 L141 A145 V146 L169	P83-I143 HydrophobicContact CB-CD1 4.48Å; P83-I143 HydrophobicContact CG-CD1 4.24Å; P83-I143 HydrophobicContact CG-CG1 4.33Å; P83-I143 HydrophobicContact CG-CG2 3.48Å; P83-I143 VanDerWaalsContact CG-CG2 3.48Å; L98-I143 HydrophobicContact CD2-CD1 3.83Å; L106-I143 HydrophobicContact CD1-CD1 3.52Å; A138-I143 HydrophobicContact CB-CB 4.32Å; A138-I143 PolarHBondContact O-N 2.92Å; A138-I143 VanDerWaalsContact O-N 3.09Å; L141-I143 HydrophobicContact CB-CD1 4.15Å; L141-I143 HydrophobicContact CB-CG1 4.37Å; L141-I143 HydrophobicContact CD1-CD1 4.26Å; I143-A145 WeakPolarHBondContact CG2-O 3.47Å; I143-V146 HydrophobicContact CG2-CG2 3.62Å; I143-L169 WeakPolarHBondContact O-CD2 3.33Å
144	G	91.3	Very high	94.2	Very high	37 Å²	37	45.6 Å²	45.6	38%	0.381	27%	0.266	S	S	.	.			trans	-95.5	-37.4	176.5	0	0	0	0	0	114.1	K170	G144-K170 PolarHBondContact O-N 3.13Å
145	A	92.6	Very high	93.8	Very high	16 Å²	16	49.7 Å²	49.7	13%	0.132	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.3	-174.7	0	0	0	0	0	111.9	T82 I143 K170 I172	T82-A145 WeakPolarHBondContact CG2-O 3.45Å; I143-A145 WeakPolarHBondContact CG2-O 3.47Å; A145-K170 WeakPolarHBondContact CA-O 3.29Å; A145-K170 HydrophobicContact CB-CB 4.29Å; A145-I172 HydrophobicContact CB-CD1 3.82Å; A145-I172 HydrophobicContact CB-CG1 4.01Å
146	V	94.5	Very high	93.6	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	145.1	-171.5	179.7	0	0	0	0	110.7	P83 L85 L98 I143 L169 K170 I172	P83-V146 HydrophobicContact CG-CG2 4.43Å; L85-V146 HydrophobicContact CB-CG1 3.36Å; L98-V146 HydrophobicContact CD1-CG1 4.3Å; L98-V146 HydrophobicContact CD1-CG2 4.4Å; I143-V146 HydrophobicContact CG2-CG2 3.62Å; V146-L169 HydrophobicContact CG2-CD1 4.17Å; V146-L169 HydrophobicContact CG2-CD2 4.35Å; V146-K170 PolarHBondContact N-O 3.24Å; V146-I172 PolarHBondContact O-N 3.5Å
147	R	93.5	Very high	93.4	Very high	24 Å²	24	49.1 Å²	49.1	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.7	168.1	-65	161	161	-177.7	-22.1	109.8	Y79 Y80 T82 P83 I84 L85 S173	Y79-R147 HydrophobicContact CE2-CG 3.96Å; Y79-R147 VanDerWaalsContact CE2-NE 3.28Å; Y79-R147 PolarHBondContact O-NE 2.81Å; Y79-R147 PolarHBondContact O-NH1 2.81Å; Y79-R147 PolarHBondContact O-NH2 3.15Å; Y80-R147 VanDerWaalsContact N-NH2 3.14Å; Y80-R147 PolarHBondContact O-NH1 2.87Å; T82-R147 HydrophobicContact CG2-CG 4.1Å; P83-R147 PolarHBondContact O-N 2.88Å; I84-R147 CarbonylContact C-O 3.54Å; I84-R147 WeakPolarHBondContact CA-O 3.49Å; I84-R147 HydrophobicContact CG1-CB 4.39Å; L85-R147 PolarHBondContact N-O 3.46Å; R147-S173 WeakPolarHBondContact CG-OG 3.45Å
148	V	95.8	Very high	93.2	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.3	-175.8	-175.1	0	0	0	0	109.9	L85 L87 F150 L161 L164 M171 S173 L174 T175	L85-V148 HydrophobicContact CD2-CG2 4.39Å; L87-V148 HydrophobicContact CD1-CG1 3.48Å; L87-V148 VanDerWaalsContact CD1-CG1 3.48Å; L87-V148 HydrophobicContact CG-CG1 4.25Å; V148-F150 HydrophobicContact CG1-CD2 3.83Å; V148-F150 HydrophobicContact CG1-CE2 3.5Å; V148-F150 HydrophobicContact CG1-CZ 4.38Å; V148-L161 HydrophobicContact CG1-CD2 3.99Å; V148-L164 HydrophobicContact CG2-CD1 4.21Å; V148-M171 HydrophobicContact CB-CE 4.43Å; V148-M171 HydrophobicContact CG2-CB 4.42Å; V148-M171 HydrophobicContact CG2-CE 4.02Å; V148-M171 HydrophobicContact CG2-CG 3.96Å; V148-M171 HydrophobicContact CG2-SD 4.45Å; V148-S173 PolarHBondContact N-O 2.94Å; V148-L174 HydrophobicContact CB-CD1 4.11Å; V148-L174 HydrophobicContact CG1-CD1 4.03Å; V148-L174 WeakPolarHBondContact O-CA 3.48Å; V148-T175 PolarHBondContact O-N 3.36Å
149	V	95.9	Very high	93.2	Very high	21 Å²	21	53.2 Å²	53.2	13%	0.127	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.8	176.4	-175.4	0	0	0	0	108.8	I84 L85 L87 N151 T175 D177	I84-V149 HydrophobicContact CG2-CB 4.38Å; I84-V149 HydrophobicContact CG2-CG2 3.59Å; L85-V149 PolarHBondContact O-N 3.45Å; L87-V149 PolarHBondContact N-O 2.73Å; V149-N151 WeakPolarHBondContact CG1-OD1 3.12Å; V149-T175 CarbonylContact C-O 3.56Å; V149-T175 WeakPolarHBondContact CA-O 3.39Å; V149-D177 HydrophobicContact CG1-CB 3.57Å
150	F	95.7	Very high	93.3	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.022	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.4	177.1	-86.6	-87.1	0	0	0	111.5	L87 V148 R157 V160 L161 L174 T175 D177	L87-F150 HydrophobicContact CB-CD1 3.78Å; L87-F150 HydrophobicContact CB-CE1 3.84Å; L87-F150 HydrophobicContact CB-CG 4.26Å; L87-F150 HydrophobicContact CB-CZ 4.37Å; L87-F150 HydrophobicContact CD1-CD1 4.08Å; L87-F150 HydrophobicContact CD1-CD2 4.14Å; L87-F150 HydrophobicContact CD1-CE1 3.44Å; L87-F150 VanDerWaalsContact CD1-CE1 3.44Å; L87-F150 HydrophobicContact CD1-CE2 3.5Å; L87-F150 HydrophobicContact CD1-CG 4.4Å; L87-F150 HydrophobicContact CD1-CZ 3.14Å; L87-F150 HydrophobicContact CG-CE1 4.29Å; L87-F150 HydrophobicContact CG-CZ 4.37Å; V148-F150 HydrophobicContact CG1-CD2 3.83Å; V148-F150 HydrophobicContact CG1-CE2 3.5Å; V148-F150 HydrophobicContact CG1-CZ 4.38Å; F150-R157 HydrophobicContact CD1-CG 3.99Å; F150-R157 HydrophobicContact CE1-CB 4.27Å; F150-R157 HydrophobicContact CE1-CG 4.13Å; F150-R157 HydrophobicContact CG-CG 4.46Å; F150-R157 HydrophobicContact CZ-CB 4.5Å; F150-V160 HydrophobicContact CZ-CB 4.41Å; F150-L161 HydrophobicContact CE2-CD1 4.03Å; F150-L161 HydrophobicContact CE2-CD2 3.42Å; F150-L161 VanDerWaalsContact CE2-CD2 3.42Å; F150-L161 HydrophobicContact CE2-CG 3.75Å; F150-L161 HydrophobicContact CZ-CD1 4.32Å; F150-L161 HydrophobicContact CZ-CD2 3.7Å; F150-L161 HydrophobicContact CZ-CG 3.74Å; F150-L174 HydrophobicContact CD2-CD1 3.54Å; F150-L174 HydrophobicContact CE2-CD1 3.48Å; F150-L174 VanDerWaalsContact CE2-CD1 3.48Å; F150-T175 PolarHBondContact N-O 3.14Å; F150-D177 CarbonylContact O-C 3.57Å; F150-D177 PolarHBondContact O-N 3.47Å
151	N	94.9	Very high	93.3	Very high	26 Å²	26	40.9 Å²	40.9	14%	0.139	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	114.1	176	-63	40.3	0	0	0	108	L87 L88 S89 V149 D177	L87-N151 PolarHBondContact O-N 3.07Å; L88-N151 HydrophobicContact CD1-CB 3.91Å; S89-N151 WeakPolarHBondContact CB-O 3.48Å; S89-N151 PolarHBondContact N-O 2.68Å; V149-N151 WeakPolarHBondContact CG1-OD1 3.12Å; N151-D177 PolarHBondContact ND2-O 3.18Å; N151-D177 VanDerWaalsContact ND2-O 3.14Å; N151-D177 PolarHBondContact ND2-OD2 3.36Å
152	G	91.3	Very high	93.4	Very high	16 Å²	16	38.8 Å²	38.8	17%	0.165	25%	0.252	C	S	.	.	S	Bend	trans	110	156.2	176.5	0	0	0	0	0	114.1	R157 T178	G152-R157 PolarHBondContact O-NH2 2.76Å; G152-R157 VanDerWaalsContact O-NH2 3.14Å; G152-T178 PolarHBondContact N-OG1 3.47Å
153	L	87.6	Confident	93.6	Very high	142 Å²	142	35.5 Å²	35.5	74%	0.743	22%	0.218	S	C	*	.			trans	-97.3	135.2	-179.6	-62.7	160.7	0	0	0	109.3	T178	L153-T178 HydrophobicContact CD1-CG2 4.45Å; L153-T178 HydrophobicContact CG-CG2 4.12Å
154	G	85.4	Confident	93.7	Very high	46 Å²	46	34.4 Å²	34.4	47%	0.474	21%	0.212	S	C	.	.	S	Bend	trans	159.7	178.5	175.8	0	0	0	0	0	115	C156	G154-C156 PolarHBondContact O-N 2.71Å; G154-C156 VanDerWaalsContact O-N 3.09Å
155	S	89.8	Confident	94	Very high	86 Å²	86	37.4 Å²	37.4	60%	0.601	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-0.9	-176.3	55.1	0	0	0	0	115.2	P159	S155-P159 VanDerWaalsContact O-CD 3.25Å; S155-P159 WeakPolarHBondContact O-CD 3.47Å; S155-P159 VanDerWaalsContact O-CG 3.27Å; S155-P159 WeakPolarHBondContact O-CG 3.39Å
156	C	92.2	Very high	94.2	Very high	3 Å²	3	42 Å²	42	2%	0.02	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-20.4	-175.5	62.3	0	0	0	0	114.7	S89 V94 F127 G154 P159 V160	S89-C156 WeakPolarHBondContact CB-SG 3.44Å; S89-C156 PolarHBondContact OG-SG 3.12Å; V94-C156 HydrophobicContact CG2-CB 3.37Å; F127-C156 HydrophobicContact CD1-CB 4.47Å; F127-C156 HydrophobicContact CD2-CB 4.2Å; F127-C156 HydrophobicContact CE2-CB 4.28Å; F127-C156 HydrophobicContact CG-CB 4.3Å; F127-C156 HydrophobicContact CZ-CB 4.45Å; G154-C156 PolarHBondContact O-N 2.71Å; G154-C156 VanDerWaalsContact O-N 3.09Å; C156-P159 WeakPolarHBondContact O-CD 3.33Å; C156-P159 WeakPolarHBondContact O-CG 3.42Å; C156-V160 HydrophobicContact CB-CG2 4.37Å; C156-V160 WeakPolarHBondContact O-CB 3.25Å; C156-V160 WeakPolarHBondContact O-CG2 3.27Å; C156-V160 PolarHBondContact O-N 3.15Å; C156-V160 VanDerWaalsContact O-N 3.17Å
157	R	93.5	Very high	94.3	Very high	75 Å²	75	42.3 Å²	42.3	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-56.8	-65.1	-169.4	-65.5	-174.7	179.7	-163	-5.4	112.1	F150 G152 L161 D176 T178	F150-R157 HydrophobicContact CD1-CG 3.99Å; F150-R157 HydrophobicContact CE1-CB 4.27Å; F150-R157 HydrophobicContact CE1-CG 4.13Å; F150-R157 HydrophobicContact CG-CG 4.46Å; F150-R157 HydrophobicContact CZ-CB 4.5Å; G152-R157 PolarHBondContact O-NH2 2.76Å; G152-R157 VanDerWaalsContact O-NH2 3.14Å; R157-L161 VanDerWaalsContact O-CG 3.26Å; R157-L161 WeakPolarHBondContact O-CG 3.2Å; R157-L161 PolarHBondContact O-N 3.22Å; R157-D176 IonicContact CZ-OD1 3.99Å; R157-D176 IonicContact CZ-OD2 3.22Å; R157-D176 VanDerWaalsContact CZ-OD2 3.22Å; R157-D176 IonicContact NH1-OD2 2.87Å; R157-D176 PolarHBondContact NH1-OD2 2.99Å; R157-D176 VanDerWaalsContact NH2-CG 3.26Å; R157-D176 IonicContact NH2-OD1 3.13Å; R157-D176 PolarHBondContact NH2-OD1 3.22Å; R157-D176 VanDerWaalsContact NH2-OD1 3.13Å; R157-D176 IonicContact NH2-OD2 2.75Å; R157-D176 PolarHBondContact NH2-OD2 3.36Å; R157-T178 PolarHBondContact NH2-OG1 3.13Å
158	L	93.6	Very high	94.3	Very high	141 Å²	141	43.1 Å²	43.1	74%	0.738	26%	0.259	S	S	*	.	H	α-helix	trans	-60.2	-47.3	-178.6	-63.6	175.1	0	0	0	115.1	V160 L161 S162	L158-V160 PolarHBondContact O-N 3.43Å; L158-L161 PolarHBondContact O-N 3.01Å; L158-S162 WeakPolarHBondContact O-CB 3.5Å; L158-S162 PolarHBondContact O-N 2.78Å
159	P	96.3	Very high	94.1	Very high	12 Å²	12	43.5 Å²	43.5	8%	0.078	26%	0.261	C	S	.	.	H	α-helix	trans	-68.1	-35.8	-177.4	23.9	-33.6	0	0	0	113.1	F127 Q128 S155 C156 S162 G163	F127-P159 HydrophobicContact CB-CB 3.9Å; F127-P159 HydrophobicContact CB-CG 3.79Å; F127-P159 HydrophobicContact CD2-CG 3.83Å; F127-P159 HydrophobicContact CG-CG 4.29Å; Q128-P159 WeakPolarHBondContact CA-O 3.34Å; Q128-P159 HydrophobicContact CG-CB 3.82Å; Q128-P159 WeakPolarHBondContact CG-O 3.26Å; S155-P159 VanDerWaalsContact O-CD 3.25Å; S155-P159 WeakPolarHBondContact O-CD 3.47Å; S155-P159 VanDerWaalsContact O-CG 3.27Å; S155-P159 WeakPolarHBondContact O-CG 3.39Å; C156-P159 WeakPolarHBondContact O-CD 3.33Å; C156-P159 WeakPolarHBondContact O-CG 3.42Å; P159-S162 PolarHBondContact O-N 2.95Å; P159-G163 PolarHBondContact O-N 3.19Å
160	V	96.8	Very high	94	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.6	-43.8	174.9	178.6	0	0	0	0	110.4	L87 V94 F127 F150 C156 L158 S162 G163 L164	L87-V160 HydrophobicContact CD1-CB 4.46Å; L87-V160 HydrophobicContact CD1-CG1 3.58Å; L87-V160 HydrophobicContact CD2-CG1 3.84Å; L87-V160 HydrophobicContact CG-CG1 4.36Å; V94-V160 HydrophobicContact CG1-CG2 4.07Å; F127-V160 HydrophobicContact CB-CG2 3.92Å; F150-V160 HydrophobicContact CZ-CB 4.41Å; C156-V160 HydrophobicContact CB-CG2 4.37Å; C156-V160 WeakPolarHBondContact O-CB 3.25Å; C156-V160 WeakPolarHBondContact O-CG2 3.27Å; C156-V160 PolarHBondContact O-N 3.15Å; C156-V160 VanDerWaalsContact O-N 3.17Å; L158-V160 PolarHBondContact O-N 3.43Å; V160-S162 PolarHBondContact O-N 2.59Å; V160-G163 PolarHBondContact O-N 3.14Å; V160-G163 VanDerWaalsContact O-N 3.16Å; V160-L164 HydrophobicContact CG1-CD1 4.28Å; V160-L164 WeakPolarHBondContact O-CG 3.45Å; V160-L164 PolarHBondContact O-N 3.13Å
161	L	96.5	Very high	93.8	Very high	23 Å²	23	49.3 Å²	49.3	12%	0.12	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-42.1	176.9	-67.3	-178.5	0	0	0	112.7	V148 F150 R157 L158 G163 L164 N165 M171 L174	V148-L161 HydrophobicContact CG1-CD2 3.99Å; F150-L161 HydrophobicContact CE2-CD1 4.03Å; F150-L161 HydrophobicContact CE2-CD2 3.42Å; F150-L161 VanDerWaalsContact CE2-CD2 3.42Å; F150-L161 HydrophobicContact CE2-CG 3.75Å; F150-L161 HydrophobicContact CZ-CD1 4.32Å; F150-L161 HydrophobicContact CZ-CD2 3.7Å; F150-L161 HydrophobicContact CZ-CG 3.74Å; R157-L161 VanDerWaalsContact O-CG 3.26Å; R157-L161 WeakPolarHBondContact O-CG 3.2Å; R157-L161 PolarHBondContact O-N 3.22Å; L158-L161 PolarHBondContact O-N 3.01Å; L161-G163 VanDerWaalsContact C-N 3.31Å; L161-G163 PolarHBondContact O-N 3.15Å; L161-L164 HydrophobicContact CD2-CD1 4.03Å; L161-L164 PolarHBondContact O-N 2.91Å; L161-N165 PolarHBondContact O-N 3.47Å; L161-M171 HydrophobicContact CB-CE 4.47Å; L161-M171 HydrophobicContact CB-SD 4.45Å; L161-M171 HydrophobicContact CD1-CE 4.22Å; L161-M171 HydrophobicContact CD2-CE 3.17Å; L161-M171 HydrophobicContact CD2-SD 3.72Å; L161-M171 HydrophobicContact CG-CE 4.1Å; L161-L174 HydrophobicContact CD1-CD1 3.82Å; L161-L174 HydrophobicContact CD1-CD2 4.09Å; L161-L174 HydrophobicContact CD2-CD1 3.93Å; L161-L174 HydrophobicContact CG-CD1 4.45Å
162	S	96.4	Very high	93.7	Very high	46 Å²	46	50.4 Å²	50.4	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-58	-44.4	172.5	174.2	0	0	0	0	111.4	L158 P159 V160 L164 N165 I166	L158-S162 WeakPolarHBondContact O-CB 3.5Å; L158-S162 PolarHBondContact O-N 2.78Å; P159-S162 PolarHBondContact O-N 2.95Å; V160-S162 PolarHBondContact O-N 2.59Å; S162-L164 PolarHBondContact O-N 3.17Å; S162-N165 PolarHBondContact O-N 2.88Å; S162-I166 VanDerWaalsContact O-CG1 3.31Å; S162-I166 WeakPolarHBondContact O-CG1 3.49Å; S162-I166 PolarHBondContact O-N 3.19Å
163	G	97.6	Very high	93.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-38.5	175.4	0	0	0	0	0	114	I132 P159 V160 L161 I166 S167	I132-G163 WeakPolarHBondContact CG1-O 3.37Å; P159-G163 PolarHBondContact O-N 3.19Å; V160-G163 PolarHBondContact O-N 3.14Å; V160-G163 VanDerWaalsContact O-N 3.16Å; L161-G163 VanDerWaalsContact C-N 3.31Å; L161-G163 PolarHBondContact O-N 3.15Å; G163-I166 PolarHBondContact O-N 3.25Å; G163-S167 PolarHBondContact O-N 3.43Å
164	L	97	Very high	93.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-43.5	175.1	-70.6	169	0	0	0	111.6	L85 L87 G131 I134 V148 V160 L161 S162 I166 S167 G168 L169 M171	L85-L164 HydrophobicContact CD2-CD1 3.5Å; L85-L164 HydrophobicContact CD2-CD2 3.5Å; L85-L164 HydrophobicContact CD2-CG 4.15Å; L87-L164 HydrophobicContact CD1-CD1 4.32Å; G131-L164 WeakPolarHBondContact O-CD2 3.29Å; I134-L164 HydrophobicContact CG2-CD2 3.58Å; V148-L164 HydrophobicContact CG2-CD1 4.21Å; V160-L164 HydrophobicContact CG1-CD1 4.28Å; V160-L164 WeakPolarHBondContact O-CG 3.45Å; V160-L164 PolarHBondContact O-N 3.13Å; L161-L164 HydrophobicContact CD2-CD1 4.03Å; L161-L164 PolarHBondContact O-N 2.91Å; S162-L164 PolarHBondContact O-N 3.17Å; L164-I166 PolarHBondContact O-N 3.33Å; L164-S167 WeakPolarHBondContact O-CB 3.35Å; L164-S167 PolarHBondContact O-N 3.43Å; L164-S167 PolarHBondContact O-OG 3.14Å; L164-G168 PolarHBondContact O-N 3.48Å; L164-L169 HydrophobicContact CD2-CD1 4.14Å; L164-L169 PolarHBondContact O-N 2.96Å; L164-M171 HydrophobicContact CB-SD 4.3Å; L164-M171 HydrophobicContact CD1-SD 4.49Å
165	N	96.5	Very high	94.2	Very high	100 Å²	100	49.9 Å²	49.9	54%	0.535	28%	0.278	S	S	.	.	H	α-helix	trans	-62.7	-41.9	175.7	-74	-23.1	0	0	0	111.9	L161 S162 S167 G168	L161-N165 PolarHBondContact O-N 3.47Å; S162-N165 PolarHBondContact O-N 2.88Å; N165-S167 VanDerWaalsContact C-N 3.29Å; N165-S167 PolarHBondContact O-N 3.48Å; N165-G168 WeakPolarHBondContact O-CA 3.49Å; N165-G168 PolarHBondContact O-N 3.46Å
166	I	97.6	Very high	94.3	Very high	111 Å²	111	49.7 Å²	49.7	57%	0.569	27%	0.271	S	S	*	.	H	α-helix	trans	-61.6	-39.2	176.3	-68.5	163.6	0	0	0	111.2	I132 S162 G163 L164 G168	I132-I166 HydrophobicContact CD1-CG2 4.15Å; I132-I166 HydrophobicContact CG1-CB 4.29Å; I132-I166 HydrophobicContact CG1-CG2 4.19Å; S162-I166 VanDerWaalsContact O-CG1 3.31Å; S162-I166 WeakPolarHBondContact O-CG1 3.49Å; S162-I166 PolarHBondContact O-N 3.19Å; G163-I166 PolarHBondContact O-N 3.25Å; L164-I166 PolarHBondContact O-N 3.33Å; I166-G168 PolarHBondContact O-N 3.22Å; I166-G168 VanDerWaalsContact O-N 3.12Å
167	S	95.9	Very high	94.4	Very high	9 Å²	9	53.5 Å²	53.5	6%	0.063	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-18.9	176.1	80.5	0	0	0	0	112.6	G135 K139 G163 L164 N165	G135-S167 WeakPolarHBondContact CA-OG 3.39Å; K139-S167 WeakPolarHBondContact CD-O 2.89Å; K139-S167 WeakPolarHBondContact CE-O 3.28Å; K139-S167 PolarHBondContact NZ-O 3.17Å; G163-S167 PolarHBondContact O-N 3.43Å; L164-S167 WeakPolarHBondContact O-CB 3.35Å; L164-S167 PolarHBondContact O-N 3.43Å; L164-S167 PolarHBondContact O-OG 3.14Å; N165-S167 VanDerWaalsContact C-N 3.29Å; N165-S167 PolarHBondContact O-N 3.48Å
168	G	93.9	Very high	94.4	Very high	42 Å²	42	51.6 Å²	51.6	43%	0.433	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	30.9	-178.1	0	0	0	0	0	113.4	K139 L164 N165 I166	K139-G168 VanDerWaalsContact CE-C 3.43Å; K139-G168 WeakPolarHBondContact CE-O 3.35Å; K139-G168 PolarHBondContact NZ-O 3.31Å; L164-G168 PolarHBondContact O-N 3.48Å; N165-G168 WeakPolarHBondContact O-CA 3.49Å; N165-G168 PolarHBondContact O-N 3.46Å; I166-G168 PolarHBondContact O-N 3.22Å; I166-G168 VanDerWaalsContact O-N 3.12Å
169	L	92.6	Very high	94.3	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.047	29%	0.291	C	S	.	.			trans	-82.7	137.6	165.1	-77.4	-177.7	0	0	0	109.7	G135 A138 K139 I143 V146 L164	G135-L169 VanDerWaalsContact CA-CD1 3.44Å; A138-L169 HydrophobicContact CB-CD1 3.92Å; A138-L169 HydrophobicContact CB-CD2 3.96Å; A138-L169 HydrophobicContact CB-CG 4.47Å; K139-L169 HydrophobicContact CG-CD2 4.18Å; I143-L169 WeakPolarHBondContact O-CD2 3.33Å; V146-L169 HydrophobicContact CG2-CD1 4.17Å; V146-L169 HydrophobicContact CG2-CD2 4.35Å; L164-L169 HydrophobicContact CD2-CD1 4.14Å; L164-L169 PolarHBondContact O-N 2.96Å
170	K	92.7	Very high	93.8	Very high	97 Å²	97	58.2 Å²	58.2	42%	0.422	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.7	174.2	-170.2	177.9	-171.8	178.3	0	110.1	E75 G144 A145 V146	E75-K170 HydrophobicContact CG-CD 4.32Å; E75-K170 WeakPolarHBondContact OE1-CD 3.49Å; E75-K170 WeakPolarHBondContact OE1-CE 3.4Å; E75-K170 IonicContact OE1-NZ 2.67Å; E75-K170 PolarHBondContact OE1-NZ 2.98Å; G144-K170 PolarHBondContact O-N 3.13Å; A145-K170 WeakPolarHBondContact CA-O 3.29Å; A145-K170 HydrophobicContact CB-CB 4.29Å; V146-K170 PolarHBondContact N-O 3.24Å
171	M	92.6	Very high	93.1	Very high	51 Å²	51	63.9 Å²	63.9	25%	0.251	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.6	173.8	-62.2	173	45.2	0	0	109.8	V148 L161 L164 L174	V148-M171 HydrophobicContact CB-CE 4.43Å; V148-M171 HydrophobicContact CG2-CB 4.42Å; V148-M171 HydrophobicContact CG2-CE 4.02Å; V148-M171 HydrophobicContact CG2-CG 3.96Å; V148-M171 HydrophobicContact CG2-SD 4.45Å; L161-M171 HydrophobicContact CB-CE 4.47Å; L161-M171 HydrophobicContact CB-SD 4.45Å; L161-M171 HydrophobicContact CD1-CE 4.22Å; L161-M171 HydrophobicContact CD2-CE 3.17Å; L161-M171 HydrophobicContact CD2-SD 3.72Å; L161-M171 HydrophobicContact CG-CE 4.1Å; L164-M171 HydrophobicContact CB-SD 4.3Å; L164-M171 HydrophobicContact CD1-SD 4.49Å; M171-L174 HydrophobicContact CE-CD1 4.22Å
172	I	91.1	Very high	92.4	Very high	49 Å²	49	71.7 Å²	71.7	25%	0.251	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-46.9	-179.4	-54.3	179.9	0	0	0	110.8	V74 Y79 T82 A145 V146	V74-I172 HydrophobicContact CB-CD1 3.92Å; V74-I172 HydrophobicContact CG1-CD1 3.59Å; V74-I172 HydrophobicContact CG1-CG1 3.98Å; V74-I172 HydrophobicContact CG2-CD1 4.26Å; V74-I172 HydrophobicContact CG2-CG2 4.17Å; Y79-I172 HydrophobicContact CD2-CG2 3.85Å; Y79-I172 HydrophobicContact CE2-CB 4.5Å; Y79-I172 HydrophobicContact CE2-CG2 3.73Å; T82-I172 HydrophobicContact CG2-CD1 3.49Å; T82-I172 VanDerWaalsContact CG2-CD1 3.49Å; A145-I172 HydrophobicContact CB-CD1 3.82Å; A145-I172 HydrophobicContact CB-CG1 4.01Å; V146-I172 PolarHBondContact O-N 3.5Å
173	S	89.8	Confident	91.2	Very high	22 Å²	22	72.3 Å²	72.3	15%	0.154	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.9	-176.9	62.6	0	0	0	0	111.1	Y79 R147 V148	Y79-S173 VanDerWaalsContact OH-CB 3.25Å; Y79-S173 WeakPolarHBondContact OH-CB 3.3Å; Y79-S173 PolarHBondContact OH-OG 2.87Å; R147-S173 WeakPolarHBondContact CG-OG 3.45Å; V148-S173 PolarHBondContact N-O 2.94Å
174	L	93.4	Very high	90.2	Very high	104 Å²	104	78.9 Å²	78.9	55%	0.545	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	114.7	174.3	-173.9	75.2	0	0	0	107.8	V148 F150 L161 M171	V148-L174 HydrophobicContact CB-CD1 4.11Å; V148-L174 HydrophobicContact CG1-CD1 4.03Å; V148-L174 WeakPolarHBondContact O-CA 3.48Å; F150-L174 HydrophobicContact CD2-CD1 3.54Å; F150-L174 HydrophobicContact CE2-CD1 3.48Å; F150-L174 VanDerWaalsContact CE2-CD1 3.48Å; L161-L174 HydrophobicContact CD1-CD1 3.82Å; L161-L174 HydrophobicContact CD1-CD2 4.09Å; L161-L174 HydrophobicContact CD2-CD1 3.93Å; L161-L174 HydrophobicContact CG-CD1 4.45Å; M171-L174 HydrophobicContact CE-CD1 4.22Å
175	T	92.6	Very high	88.8	Confident	66 Å²	66	82.4 Å²	82.4	41%	0.405	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.5	-179.1	-53.4	0	0	0	0	109.7	V148 V149 F150	V148-T175 PolarHBondContact O-N 3.36Å; V149-T175 CarbonylContact C-O 3.56Å; V149-T175 WeakPolarHBondContact CA-O 3.39Å; F150-T175 PolarHBondContact N-O 3.14Å
176	D	92.7	Very high	87.8	Confident	83 Å²	83	87.9 Å²	87.9	44%	0.444	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113.7	173.4	-168.6	-2.3	0	0	0	109	R157 T178	R157-D176 IonicContact CZ-OD1 3.99Å; R157-D176 IonicContact CZ-OD2 3.22Å; R157-D176 VanDerWaalsContact CZ-OD2 3.22Å; R157-D176 IonicContact NH1-OD2 2.87Å; R157-D176 PolarHBondContact NH1-OD2 2.99Å; R157-D176 VanDerWaalsContact NH2-CG 3.26Å; R157-D176 IonicContact NH2-OD1 3.13Å; R157-D176 PolarHBondContact NH2-OD1 3.22Å; R157-D176 VanDerWaalsContact NH2-OD1 3.13Å; R157-D176 IonicContact NH2-OD2 2.75Å; R157-D176 PolarHBondContact NH2-OD2 3.36Å; D176-T178 WeakPolarHBondContact OD1-CB 3.5Å; D176-T178 PolarHBondContact OD1-N 3.5Å; D176-T178 PolarHBondContact OD1-OG1 3.17Å
177	D	93.5	Very high	87.4	Confident	83 Å²	83	93.8 Å²	93.8	44%	0.444	48%	0.482	S	S	.	.			trans	-114.4	51.4	174.9	-179.5	36.2	0	0	0	109.7	V149 F150 N151 K179	V149-D177 HydrophobicContact CG1-CB 3.57Å; F150-D177 CarbonylContact O-C 3.57Å; F150-D177 PolarHBondContact O-N 3.47Å; N151-D177 PolarHBondContact ND2-O 3.18Å; N151-D177 VanDerWaalsContact ND2-O 3.14Å; N151-D177 PolarHBondContact ND2-OD2 3.36Å; D177-K179 PolarHBondContact O-N 3.05Å
178	T	94.2	Very high	86.8	Confident	34 Å²	34	98.8 Å²	98.8	21%	0.209	51%	0.514	C	S	.	.			trans	-75.7	116	173.1	-65.3	0	0	0	0	110.1	G152 L153 R157 D176 V180	G152-T178 PolarHBondContact N-OG1 3.47Å; L153-T178 HydrophobicContact CD1-CG2 4.45Å; L153-T178 HydrophobicContact CG-CG2 4.12Å; R157-T178 PolarHBondContact NH2-OG1 3.13Å; D176-T178 WeakPolarHBondContact OD1-CB 3.5Å; D176-T178 PolarHBondContact OD1-N 3.5Å; D176-T178 PolarHBondContact OD1-OG1 3.17Å; T178-V180 PolarHBondContact O-N 2.94Å; T178-V180 VanDerWaalsContact O-N 3.15Å
179	K	90	Very high	86.4	Confident	189 Å²	189	106.5 Å²	106.5	82%	0.822	54%	0.536	S	S	*	.			trans	-59.1	117.3	175.8	-62.4	-177.7	-179.8	-174.2	0	111.1	D177	D177-K179 PolarHBondContact O-N 3.05Å
180	V	87.4	Confident	86.4	Confident	103 Å²	103	115.4 Å²	115.4	62%	0.624	57%	0.574	S	S	*	*			trans	-98.5	129.3	172.1	-176.6	0	0	0	0	108.7	T178	T178-V180 PolarHBondContact O-N 2.94Å; T178-V180 VanDerWaalsContact O-N 3.15Å
181	H	81.8	Confident	86.3	Confident	119 Å²	119	118.5 Å²	118.5	55%	0.551	59%	0.59	S	S	*	*			trans	-86.8	115.4	169.9	-175.9	64.5	0	0	0	108.8	G183	H181-G183 PolarHBondContact CD2-N 3.35Å; H181-G183 PolarHBondContact O-N 3.47Å
182	Y	82.1	Confident	86.4	Confident	187 Å²	187	126.7 Å²	126.7	73%	0.733	62%	0.618	S	S	*	*			trans	-70.5	15.8	-179.1	-64.8	-70.4	0	0	0	114.9	H184	Y182-H184 VanDerWaalsContact C-N 3.27Å; Y182-H184 WeakPolarHBondContact CB-CE1 3.07Å; Y182-H184 AromaticContact CG-CE1 3.93Å; Y182-H184 PolarHBondContact O-N 2.75Å
183	G	71.5	Confident	86.4	Confident	59 Å²	59	135.9 Å²	135.9	61%	0.608	65%	0.649	S	S	*	*			trans	77	-3.9	171	0	0	0	0	0	116.5	H181 G185	H181-G183 PolarHBondContact CD2-N 3.35Å; H181-G183 PolarHBondContact O-N 3.47Å; G183-G185 PolarHBondContact O-N 2.87Å; G183-G185 VanDerWaalsContact O-N 3.13Å
184	H	76.2	Confident	85.9	Confident	138 Å²	138	145.3 Å²	145.3	64%	0.639	70%	0.696	S	S	*	*			trans	-76.4	103.5	176.9	28.3	-103.4	0	0	0	112	Y182	Y182-H184 VanDerWaalsContact C-N 3.27Å; Y182-H184 WeakPolarHBondContact CB-CE1 3.07Å; Y182-H184 AromaticContact CG-CE1 3.93Å; Y182-H184 PolarHBondContact O-N 2.75Å
185	G	67.7	Low	85.6	Confident	75 Å²	75	147.4 Å²	147.4	77%	0.773	70%	0.704	S	S	*	*	S	Bend	trans	106.4	3.9	144.3	0	0	0	0	0	118.1	G183	G183-G185 PolarHBondContact O-N 2.87Å; G183-G185 VanDerWaalsContact O-N 3.13Å
186	R	75.6	Confident	85.2	Confident	216 Å²	216	151.7 Å²	151.7	82%	0.815	72%	0.719	S	S	*	*			trans	-123.5	111.3	171.2	-61.8	-167.2	-173.8	-138.6	3	111.2
187	R	87.4	Confident	84.8	Confident	235 Å²	235	155.5 Å²	155.5	89%	0.887	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-49.1	131.5	166.7	-176.8	177.4	-179.1	136.7	1.1	108.5	K189	R187-K189 PolarHBondContact O-N 3.09Å
188	P	84.3	Confident	84.3	Confident	114 Å²	114	159.8 Å²	159.8	74%	0.74	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-51.5	135.1	176.2	-26.5	33.5	0	0	0	110.8
189	K	84.8	Confident	83.6	Confident	203 Å²	203	167.6 Å²	167.6	88%	0.883	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.5	142.2	176.3	-68.4	-176.6	179.1	-178	0	109	R187 Q191	R187-K189 PolarHBondContact O-N 3.09Å; K189-Q191 PolarHBondContact O-N 3.34Å
190	K	92.6	Very high	83.2	Confident	196 Å²	196	166.2 Å²	166.2	85%	0.852	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-50.3	130.2	174.2	-175	173.9	-177.7	173.1	0	109.6	R192	K190-R192 PolarHBondContact O-N 3.29Å
191	Q	92.1	Very high	82.9	Confident	162 Å²	162	170.7 Å²	170.7	76%	0.757	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-56.9	131.3	176.4	-176.1	167.4	-31.6	0	0	109.4	K189	K189-Q191 PolarHBondContact O-N 3.34Å
192	R	93.4	Very high	83	Confident	223 Å²	223	174.7 Å²	174.7	84%	0.842	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-66.9	145	176.6	-65.3	-175.5	-68	-175.3	0.7	108.7	K190 I194	K190-R192 PolarHBondContact O-N 3.29Å; R192-I194 PolarHBondContact O-N 3.45Å
193	R	92.2	Very high	83.1	Confident	242 Å²	242	173.7 Å²	173.7	91%	0.913	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-58.5	134.8	168.5	-60.3	-177.9	-178.2	-162.1	-0	107.7
194	I	79.2	Confident	84.1	Confident	221 Å²	221	184.1 Å²	184.1	100%	1.133	84%	0.839	S	S	*	*			trans	-81.8	0	174.5	-62	173.7	0	0	0	107.7	R192	R192-I194 PolarHBondContact O-N 3.45Å

Retrieved 194 of 194 residues in 284.8 ms (Link to these results)

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