A0A087XG29_POEFO Loading...

Voltage-gated potassium channel subunit beta-1

AlphaFold DB , UniProt , Accession A0A087XG29, Species POEFO (Poecilia formosa, Amazon molly), Gene KCNAB1, Length 397 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	37.6	Very low	30.1	Very low	244 Å²	244	143.1 Å²	143.1	100%	1.202	80%	0.799	S	S	*	*				0	95	0	-104.5	168.4	179.6	0	0	108.1
2	Q	30.1	Very low	30.1	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	80%	0.802	S	S	*	*			trans	20.1	136.1	133.1	-85	-175.1	-24.4	0	0	118.2
3	V	29.3	Very low	30.2	Very low	118 Å²	118	149.4 Å²	149.4	72%	0.715	81%	0.81	S	S	*	*			cis	-163.2	134	5	-165.5	0	0	0	0	103.5
4	S	26.6	Very low	30.3	Very low	96 Å²	96	157.1 Å²	157.1	67%	0.671	82%	0.822	S	S	*	*				49.4	141.9	81	-81.8	0	0	0	0	113.8
5	I	30.6	Very low	30.2	Very low	153 Å²	153	152.3 Å²	152.3	79%	0.785	83%	0.825	S	S	*	*			cis	-170	149.5	17.7	-104.1	157.3	0	0	0	110
6	A	28.7	Very low	30.1	Very low	80 Å²	80	153.8 Å²	153.8	66%	0.661	83%	0.832	S	S	*	*			trans	27.4	142.3	143.8	0	0	0	0	0	126.9
7	C	26.7	Very low	30.1	Very low	115 Å²	115	149.4 Å²	149.4	78%	0.777	83%	0.831	S	S	*	*				46.3	135.7	125.2	-67.8	0	0	0	0	122
8	T	29.6	Very low	30.1	Very low	144 Å²	144	149.2 Å²	149.2	88%	0.883	83%	0.829	S	S	*	*				175.1	150	100.6	29.7	0	0	0	0	113.8
9	D	32.1	Very low	30.2	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	83%	0.828	S	S	*	*			trans	-69	153.6	167.1	-75.4	-53.5	0	0	0	113.7
10	H	31.1	Very low	30.2	Very low	165 Å²	165	147.7 Å²	147.7	76%	0.764	82%	0.819	S	S	*	*				171.5	141.6	119.4	-104.2	-60.2	0	0	0	116.2
11	N	28.7	Very low	30.2	Very low	123 Å²	123	149.7 Å²	149.7	66%	0.658	82%	0.819	S	S	*	*			trans	78.7	107.7	135.4	-70.6	-20.4	0	0	0	124.5
12	L	30.7	Very low	29.9	Very low	161 Å²	161	146.8 Å²	146.8	84%	0.843	80%	0.802	S	S	*	*				19.3	129.1	116.9	-72.9	159.8	0	0	0	121.6
13	K	31.5	Very low	29.7	Very low	207 Å²	207	143 Å²	143	90%	0.9	80%	0.797	S	S	*	*			trans	-177.1	113	132.1	-101.8	171.7	-176.6	-179.7	0	109.8
14	R	30.7	Very low	29.8	Very low	258 Å²	258	141.3 Å²	141.3	97%	0.974	80%	0.795	S	S	*	*				51	119	96.5	-102.8	-172.3	-180	-175.9	1.1	116.7
15	G	28.4	Very low	29.9	Very low	85 Å²	85	142.9 Å²	142.9	88%	0.876	80%	0.801	S	S	*	*			trans	-166	114	161.9	0	0	0	0	0	111.2
16	N	29.6	Very low	30	Very low	175 Å²	175	141 Å²	141	94%	0.936	80%	0.801	S	S	*	*			trans	-92.5	150.6	179.5	-131.3	19.4	0	0	0	109.6
17	G	30.2	Very low	30.5	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	80%	0.803	S	S	*	*			trans	-171.5	100.5	171.1	0	0	0	0	0	113.1
18	D	29.9	Very low	30.8	Very low	147 Å²	147	142.8 Å²	142.8	79%	0.786	80%	0.798	S	S	*	*			trans	-72.2	148.3	172.9	-106.4	-36.9	0	0	0	112.5
19	H	32.7	Very low	31.3	Very low	176 Å²	176	143 Å²	143	82%	0.815	80%	0.799	S	S	*	*				173.5	114	124.4	-93.4	-59.2	0	0	0	113.4
20	S	29.8	Very low	31.7	Very low	92 Å²	92	140.9 Å²	140.9	64%	0.643	79%	0.791	S	S	*	*			trans	35.7	141.5	132.4	63.6	0	0	0	0	120.6
21	K	30.5	Very low	31.9	Very low	190 Å²	190	138.8 Å²	138.8	83%	0.826	79%	0.785	S	S	*	*			cis	-179.4	167	22.2	-124.9	173.4	-173	178.4	0	109.2
22	Q	30.1	Very low	32.1	Very low	182 Å²	182	141.4 Å²	141.4	85%	0.85	79%	0.794	S	S	*	*			trans	81.4	137.5	163.9	-64.8	172.6	5.5	0	0	117.1
23	S	27.1	Very low	32.4	Very low	110 Å²	110	137.2 Å²	137.2	77%	0.769	78%	0.782	S	S	*	*			cis	-171.2	169.5	-5.8	59.7	0	0	0	0	108.7
24	A	30.6	Very low	32.8	Very low	82 Å²	82	137 Å²	137	68%	0.678	78%	0.775	S	S	*	*			trans	89	91.5	157.9	0	0	0	0	0	120.7
25	T	28.9	Very low	33.1	Very low	129 Å²	129	128.1 Å²	128.1	79%	0.791	76%	0.757	S	S	*	*				44.8	119.3	119.5	52.2	0	0	0	0	123
26	S	32.3	Very low	33.6	Very low	112 Å²	112	132.2 Å²	132.2	78%	0.783	75%	0.751	S	S	*	*			trans	89.2	160.4	132.6	-58	0	0	0	0	119
27	P	39.3	Very low	33.9	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	74%	0.742	S	S	*	*				-132.8	178	-93.8	29.3	-4.9	0	0	0	114.8
28	N	33.2	Very low	34.2	Very low	127 Å²	127	138.1 Å²	138.1	68%	0.679	74%	0.74	S	S	*	*			trans	73	93.5	150.6	-70.1	-23	0	0	0	120	V30	N28-V30 PolarHBondContact O-N 2.94Å
29	V	39.6	Very low	34.3	Very low	149 Å²	149	135.8 Å²	135.8	90%	0.903	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	13.8	163.2	-179.7	0	0	0	0	113.7
30	V	40.3	Very low	34.4	Very low	102 Å²	102	132.6 Å²	132.6	62%	0.618	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-10	-174.6	-173.3	0	0	0	0	113.3	N28	N28-V30 PolarHBondContact O-N 2.94Å
31	N	35.1	Very low	34.7	Very low	121 Å²	121	131.3 Å²	131.3	65%	0.647	72%	0.719	S	S	*	*	S	Bend	trans	-97.7	-6.6	-175.8	-84.2	-18.2	0	0	0	116.3
32	Q	34.3	Very low	34.7	Very low	179 Å²	179	128.7 Å²	128.7	84%	0.836	71%	0.713	S	S	*	*	S	Bend	trans	-84.2	-17.2	174.6	-96.4	-176.7	0.5	0	0	114.2
33	A	36.5	Very low	34.9	Very low	72 Å²	72	125.8 Å²	125.8	60%	0.595	70%	0.702	S	S	*	*	S	Bend	trans	-83.5	-21.7	178	0	0	0	0	0	113.6
34	R	40.3	Very low	35.2	Very low	203 Å²	203	123.9 Å²	123.9	77%	0.766	69%	0.693	S	S	*	*	S	Bend	trans	-85.6	-17.4	-178.2	-96.1	179.2	167.7	167.6	-2.9	114.8
35	A	36.5	Very low	35.4	Very low	71 Å²	71	131.1 Å²	131.1	59%	0.587	70%	0.702	S	S	*	*	S	Bend	trans	-81.7	-22.4	179	0	0	0	0	0	113.7
36	K	38.4	Very low	35.7	Very low	172 Å²	172	130.2 Å²	130.2	75%	0.748	70%	0.701	S	S	*	*	S	Bend	trans	-84.4	-10.4	178.3	-73	-174.2	177.3	-180	0	114.5
37	F	36.4	Very low	35.7	Very low	172 Å²	172	132.8 Å²	132.8	75%	0.754	70%	0.699	S	S	*	*	S	Bend	trans	-94.6	-6.2	178.4	-88.7	-83.7	0	0	0	114.9
38	R	35.6	Very low	35.4	Very low	205 Å²	205	130.6 Å²	130.6	77%	0.774	70%	0.696	S	S	*	*	S	Bend	trans	-93.8	-17.8	176.4	-101.1	-178.9	173.4	179.9	-2.2	114.8
39	T	33	Very low	35.3	Very low	98 Å²	98	129.7 Å²	129.7	60%	0.601	70%	0.699	S	S	*	*	S	Bend	trans	-82.1	-21.1	177.5	-47.5	0	0	0	0	112.9
40	V	35	Very low	35	Very low	110 Å²	110	131.9 Å²	131.9	67%	0.667	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-20.6	177.2	-175.1	0	0	0	0	112.2
41	A	35.6	Very low	34.5	Very low	64 Å²	64	131.8 Å²	131.8	53%	0.529	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.1	-11.8	-179.3	0	0	0	0	0	114.5
42	I	31.4	Very low	34.5	Very low	136 Å²	136	131.5 Å²	131.5	70%	0.697	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-21.1	-177.8	-66.2	175.6	0	0	0	112.2	A44	I42-A44 VanDerWaalsContact C-N 3.34Å
43	I	33.6	Very low	34.5	Very low	120 Å²	120	133.5 Å²	133.5	62%	0.615	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-81.4	-15.8	173.2	-61.5	176.1	0	0	0	111.9	R45	I43-R45 PolarHBondContact O-N 3.26Å
44	A	34.3	Very low	34.6	Very low	70 Å²	70	139.2 Å²	139.2	58%	0.579	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-76.5	-0.4	177.9	0	0	0	0	0	114.8	I42	I42-A44 VanDerWaalsContact C-N 3.34Å
45	R	35	Very low	34.8	Very low	235 Å²	235	135.8 Å²	135.8	89%	0.887	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-105.4	8.5	-179.5	-79.8	-172.6	176.7	179.5	-1	115.3	I43	I43-R45 PolarHBondContact O-N 3.26Å
46	S	33.8	Very low	34.9	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	71%	0.707	S	S	*	*	S	Bend	trans	-109.9	6.6	173.3	-161.5	0	0	0	0	114.4	G48	S46-G48 PolarHBondContact O-N 2.89Å
47	F	33.4	Very low	35	Very low	167 Å²	167	133.6 Å²	133.6	73%	0.732	70%	0.702	S	S	*	*	S	Bend	trans	-87.2	106.1	167.2	-75	-82	0	0	0	108.1
48	G	31.4	Very low	35.3	Very low	61 Å²	61	133.3 Å²	133.3	63%	0.629	70%	0.701	S	S	*	*			trans	-47.7	145.9	171.5	0	0	0	0	0	110.6	S46 F50	S46-G48 PolarHBondContact O-N 2.89Å; G48-F50 PolarHBondContact O-N 2.83Å
49	S	30.9	Very low	35.9	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	70%	0.695	S	S	*	*			trans	-50.2	104.8	177.3	61.6	0	0	0	0	110	T51	S49-T51 PolarHBondContact O-N 2.91Å
50	F	33.7	Very low	36.5	Very low	195 Å²	195	129.7 Å²	129.7	86%	0.855	70%	0.695	S	S	*	*			trans	-71.2	84.3	159.3	-100.3	-93.9	0	0	0	106	G48 P52	G48-F50 PolarHBondContact O-N 2.83Å; F50-P52 WeakPolarHBondContact O-CD 3.45Å
51	T	30.2	Very low	37.1	Very low	99 Å²	99	128.9 Å²	128.9	61%	0.607	69%	0.691	S	S	*	*			trans	-61.6	123.5	154.3	44.7	0	0	0	0	105.5	S49 R53	S49-T51 PolarHBondContact O-N 2.91Å; T51-R53 VanDerWaalsContact C-N 3.27Å; T51-R53 PolarHBondContact O-N 2.84Å
52	P	35.9	Very low	37.2	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	70%	0.696	S	S	*	*			trans	-61.1	104.9	164.8	-3.6	17.8	0	0	0	103.7	F50 H54	F50-P52 WeakPolarHBondContact O-CD 3.45Å; P52-H54 VanDerWaalsContact C-N 3.33Å; P52-H54 PolarHBondContact O-N 3.43Å
53	R	34.1	Very low	37.8	Very low	221 Å²	221	131.1 Å²	131.1	83%	0.834	70%	0.701	S	S	*	*			trans	-52.9	114.5	161	-79.6	-174.3	-179.4	-176.2	0.7	103.4	T51 I55	T51-R53 VanDerWaalsContact C-N 3.27Å; T51-R53 PolarHBondContact O-N 2.84Å; R53-I55 WeakPolarHBondContact O-CG1 3.42Å; R53-I55 PolarHBondContact O-N 3.2Å
54	H	37.4	Very low	38.9	Very low	192 Å²	192	135.2 Å²	135.2	89%	0.889	72%	0.717	S	S	*	*			trans	-54	97.2	168	-109.6	-88.2	0	0	0	105.7	P52 S56	P52-H54 VanDerWaalsContact C-N 3.33Å; P52-H54 PolarHBondContact O-N 3.43Å; H54-S56 PolarHBondContact O-N 3Å
55	I	45.8	Very low	40.7	Very low	131 Å²	131	134.4 Å²	134.4	67%	0.672	71%	0.705	S	S	*	*			trans	-66.5	108.9	179.2	-64.5	172.7	0	0	0	103.9	R53 L57	R53-I55 WeakPolarHBondContact O-CG1 3.42Å; R53-I55 PolarHBondContact O-N 3.2Å; I55-L57 PolarHBondContact O-N 2.72Å
56	S	37.8	Very low	43.1	Very low	72 Å²	72	124.4 Å²	124.4	50%	0.503	68%	0.675	S	S	.	*			trans	-58.4	126.1	-179.4	-175.7	0	0	0	0	108.6	H54 K58 E59	H54-S56 PolarHBondContact O-N 3Å; S56-K58 PolarHBondContact O-N 2.77Å; S56-K58 WeakPolarHBondContact OG-CB 3.5Å; S56-K58 PolarHBondContact OG-N 2.9Å; S56-E59 PolarHBondContact O-N 3.07Å
57	L	40.2	Very low	46	Very low	126 Å²	126	119.9 Å²	119.9	66%	0.66	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-48.1	-10	166.4	-93.8	131.8	0	0	0	114	I55 E59 S60 T61	I55-L57 PolarHBondContact O-N 2.72Å; L57-E59 VanDerWaalsContact C-N 3.27Å; L57-E59 PolarHBondContact O-N 3.18Å; L57-S60 PolarHBondContact O-N 3.35Å; L57-S60 PolarHBondContact O-OG 3.24Å; L57-S60 VanDerWaalsContact O-OG 3.07Å; L57-T61 PolarHBondContact O-N 3.39Å; L57-T61 PolarHBondContact O-OG1 2.83Å
58	K	42.7	Very low	48.9	Very low	166 Å²	166	117.8 Å²	117.8	72%	0.722	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-59.9	-29.6	173.4	-82.9	-174.4	171.4	-178.2	0	114.4	S56 S60	S56-K58 PolarHBondContact O-N 2.77Å; S56-K58 WeakPolarHBondContact OG-CB 3.5Å; S56-K58 PolarHBondContact OG-N 2.9Å; K58-S60 VanDerWaalsContact C-N 3.31Å
59	E	47.8	Very low	52	Low	140 Å²	140	119.3 Å²	119.3	65%	0.654	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-74.3	-21.9	176.5	-77.7	-173.5	178.8	0	0	113.3	S56 L57 R139	S56-E59 PolarHBondContact O-N 3.07Å; L57-E59 VanDerWaalsContact C-N 3.27Å; L57-E59 PolarHBondContact O-N 3.18Å; E59-R139 IonicContact OE2-CZ 3.78Å; E59-R139 IonicContact OE2-NH1 2.7Å; E59-R139 PolarHBondContact OE2-NH1 3.36Å
60	S	45.7	Very low	55.1	Low	86 Å²	86	116.7 Å²	116.7	60%	0.601	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-18.3	177.5	53.8	0	0	0	0	113.2	L57 K58	L57-S60 PolarHBondContact O-N 3.35Å; L57-S60 PolarHBondContact O-OG 3.24Å; L57-S60 VanDerWaalsContact O-OG 3.07Å; K58-S60 VanDerWaalsContact C-N 3.31Å
61	T	48.3	Very low	58.2	Low	94 Å²	94	110.5 Å²	110.5	58%	0.577	57%	0.57	S	S	*	*	S	Bend	trans	-148.4	97.1	-177	49.4	0	0	0	0	109.7	L57	L57-T61 PolarHBondContact O-N 3.39Å; L57-T61 PolarHBondContact O-OG1 2.83Å
62	G	38.4	Very low	61.4	Low	62 Å²	62	105.8 Å²	105.8	64%	0.639	54%	0.541	S	S	*	.	S	Bend	trans	-176	23.9	-171.6	0	0	0	0	0	120
63	K	43	Very low	64.4	Low	184 Å²	184	100.4 Å²	100.4	80%	0.8	51%	0.506	S	S	*	.			trans	-179.2	125.4	152.8	-102.6	170.3	-173.7	-178.5	0	105.4	T65	K63-T65 HydrophobicContact CB-CG2 4.23Å; K63-T65 PolarHBondContact O-N 2.7Å
64	H	57.6	Low	67.4	Low	206 Å²	206	95.9 Å²	95.9	95%	0.954	49%	0.492	S	S	*	.			trans	-69.8	81.9	168.2	-67.2	-67.1	0	0	0	107.5	G66	H64-G66 PolarHBondContact O-N 3.45Å
65	T	72	Confident	70.3	Confident	53 Å²	53	87.5 Å²	87.5	33%	0.325	46%	0.455	S	S	.	.			trans	-62.6	-6.7	-179.4	65.4	0	0	0	0	112.6	K63 M67 S109	K63-T65 HydrophobicContact CB-CG2 4.23Å; K63-T65 PolarHBondContact O-N 2.7Å; T65-M67 PolarHBondContact O-N 2.86Å; T65-M67 VanDerWaalsContact OG1-CB 3.27Å; T65-M67 WeakPolarHBondContact OG1-CB 3.48Å; T65-M67 PolarHBondContact OG1-N 3.46Å; T65-S109 WeakPolarHBondContact CB-O 3.37Å; T65-S109 PolarHBondContact OG1-O 2.8Å
66	G	85.6	Confident	72.9	Confident	25 Å²	25	84.1 Å²	84.1	26%	0.258	45%	0.453	S	S	.	.			trans	78	-12	-172.4	0	0	0	0	0	113	H64 K68 I367	H64-G66 PolarHBondContact O-N 3.45Å; G66-K68 PolarHBondContact O-N 3.34Å; G66-I367 WeakPolarHBondContact O-CG2 3.46Å
67	M	94.5	Very high	75.8	Confident	15 Å²	15	81.6 Å²	81.6	7%	0.074	43%	0.434	C	S	.	.			trans	-56.2	125.7	-177.2	-171.7	60.5	68.9	0	0	111.3	T65 Y69 L82 V111 L364 I367	T65-M67 PolarHBondContact O-N 2.86Å; T65-M67 VanDerWaalsContact OG1-CB 3.27Å; T65-M67 WeakPolarHBondContact OG1-CB 3.48Å; T65-M67 PolarHBondContact OG1-N 3.46Å; M67-Y69 HydrophobicContact CG-CE1 4.43Å; M67-Y69 HydrophobicContact CG-CE2 4.34Å; M67-L82 HydrophobicContact CE-CB 4.2Å; M67-L82 HydrophobicContact SD-CB 4.4Å; M67-V111 HydrophobicContact CE-CG2 3.61Å; M67-L364 HydrophobicContact CE-CD2 4.15Å; M67-I367 HydrophobicContact CE-CD1 3.55Å; M67-I367 HydrophobicContact SD-CD1 3.77Å
68	K	93.7	Very high	78.5	Confident	123 Å²	123	81.5 Å²	81.5	54%	0.535	43%	0.425	S	S	.	.			trans	-94.3	138.5	175.1	-57.6	-59.3	-177.8	178.9	0	108.8	G66 C81	G66-K68 PolarHBondContact O-N 3.34Å; K68-C81 HydrophobicContact CB-CB 4.37Å; K68-C81 WeakPolarHBondContact O-CB 3.38Å; K68-C81 PolarHBondContact O-N 3.15Å
69	Y	96.8	Very high	81.2	Confident	93 Å²	93	73.6 Å²	73.6	37%	0.365	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	138.2	172.9	-61.5	-86.8	0	0	0	109.5	M67 R78 V79 G110	M67-Y69 HydrophobicContact CG-CE1 4.43Å; M67-Y69 HydrophobicContact CG-CE2 4.34Å; Y69-R78 VanDerWaalsContact C-NH2 3.31Å; Y69-R78 PolarHBondContact O-NH2 3Å; Y69-V79 CarbonylContact C-O 3.51Å; Y69-V79 VanDerWaalsContact CA-O 3.26Å; Y69-V79 WeakPolarHBondContact CA-O 3.47Å; Y69-G110 WeakPolarHBondContact CE1-O 3.31Å; Y69-G110 WeakPolarHBondContact OH-CA 3.27Å; Y69-G110 PolarHBondContact OH-O 3.21Å
70	R	95.8	Very high	83.6	Confident	53 Å²	53	67 Å²	67	20%	0.2	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	155.5	179.8	-60.4	-180	-178.3	176.9	-0.8	109	R78 V79 L342 V347	R70-R78 CarbonylContact O-C 3.56Å; R70-R78 WeakPolarHBondContact O-CA 3.25Å; R70-V79 PolarHBondContact N-O 3.4Å; R70-V79 PolarHBondContact O-N 2.95Å; R70-L342 PolarHBondContact NH1-O 2.91Å; R70-L342 PolarHBondContact NH2-O 3.25Å; R70-V347 PolarHBondContact NH1-O 3.39Å
71	N	98.5	Very high	86.1	Confident	65 Å²	65	62.9 Å²	62.9	35%	0.348	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	142.5	168.8	-72.9	72.5	0	0	0	109.5	G73 S75 L77 R78 S348	N71-G73 PolarHBondContact O-N 2.94Å; N71-S75 PolarHBondContact ND2-O 3.43Å; N71-L77 CarbonylContact C-O 3.48Å; N71-L77 WeakPolarHBondContact CA-O 3.3Å; N71-R78 PolarHBondContact OD1-NH1 3.07Å; N71-S348 WeakPolarHBondContact O-CB 3.32Å; N71-S348 PolarHBondContact O-OG 3.27Å
72	L	98.6	Very high	88.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-79.7	98.1	171.1	-171.4	62.5	0	0	0	108.5	S75 L77 V79 V184 V241 C242 M271	L72-S75 WeakPolarHBondContact O-CB 3.4Å; L72-S75 PolarHBondContact O-N 3.35Å; L72-S75 PolarHBondContact O-OG 3.42Å; L72-L77 HydrophobicContact CB-CB 4.48Å; L72-L77 HydrophobicContact CD2-CD2 4.06Å; L72-L77 PolarHBondContact N-O 3.32Å; L72-V79 HydrophobicContact CB-CG1 4.39Å; L72-V79 HydrophobicContact CB-CG2 4.35Å; L72-V79 HydrophobicContact CD1-CG2 4.36Å; L72-V184 HydrophobicContact CD2-CG2 4.12Å; L72-V241 HydrophobicContact CD2-CG2 4.45Å; L72-C242 HydrophobicContact CD1-CB 4.11Å; L72-C242 VanDerWaalsContact CD1-SG 3.59Å; L72-C242 HydrophobicContact CD2-CB 3.87Å; L72-C242 HydrophobicContact CG-CB 3.89Å; L72-M271 HydrophobicContact CD1-CB 4.33Å; L72-M271 HydrophobicContact CD1-CE 3.92Å; L72-M271 HydrophobicContact CD2-CE 3.97Å
73	G	97.5	Very high	91.4	Very high	2 Å²	2	55.5 Å²	55.5	2%	0.021	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	-141.6	-168.3	0	0	0	0	0	111.9	N71 S75 G269 S348	N71-G73 PolarHBondContact O-N 2.94Å; G73-S75 VanDerWaalsContact C-N 3.31Å; G73-G269 VanDerWaalsContact CA-N 3.34Å; G73-S348 PolarHBondContact N-OG 3.38Å
74	K	98.3	Very high	94	Very high	125 Å²	125	46.9 Å²	46.9	54%	0.543	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	5	172.2	-67.7	-173.7	-176.2	170.2	0	113.3	Y263 H264 G267	K74-Y263 VanDerWaalsContact CE-O 3.3Å; K74-Y263 WeakPolarHBondContact CE-O 3.5Å; K74-Y263 HydrophobicContact CG-CE2 4.01Å; K74-Y263 PolarHBondContact NZ-O 2.79Å; K74-H264 PolarHBondContact NZ-O 3.22Å; K74-G267 PolarHBondContact N-O 2.86Å
75	S	98.6	Very high	96	Very high	16 Å²	16	37.5 Å²	37.5	11%	0.112	20%	0.195	C	C	.	.	S	Bend	trans	-70	164.8	176.9	78.9	0	0	0	0	111.9	N71 L72 G73 L77	N71-S75 PolarHBondContact ND2-O 3.43Å; L72-S75 WeakPolarHBondContact O-CB 3.4Å; L72-S75 PolarHBondContact O-N 3.35Å; L72-S75 PolarHBondContact O-OG 3.42Å; G73-S75 VanDerWaalsContact C-N 3.31Å; S75-L77 VanDerWaalsContact C-N 3.26Å; S75-L77 PolarHBondContact O-N 2.86Å; S75-L77 PolarHBondContact OG-N 3.17Å
76	G	98.6	Very high	97.2	Very high	60 Å²	60	35.1 Å²	35.1	62%	0.619	18%	0.18	S	C	*	.	S	Bend	trans	-75	-10.4	173.7	0	0	0	0	0	114.5	R78	G76-R78 PolarHBondContact O-N 3.46Å
77	L	98.8	Very high	97.6	Very high	20 Å²	20	37.5 Å²	37.5	11%	0.105	18%	0.182	C	C	.	.			trans	-71.6	119.3	-176.7	-176.5	63.2	0	0	0	110.4	N71 L72 S75 V79 V144 V184 Y214	N71-L77 CarbonylContact C-O 3.48Å; N71-L77 WeakPolarHBondContact CA-O 3.3Å; L72-L77 HydrophobicContact CB-CB 4.48Å; L72-L77 HydrophobicContact CD2-CD2 4.06Å; L72-L77 PolarHBondContact N-O 3.32Å; S75-L77 VanDerWaalsContact C-N 3.26Å; S75-L77 PolarHBondContact O-N 2.86Å; S75-L77 PolarHBondContact OG-N 3.17Å; L77-V79 HydrophobicContact CD2-CG1 4.5Å; L77-V79 HydrophobicContact CG-CG1 4.32Å; L77-V144 HydrophobicContact CD1-CG1 4.4Å; L77-V144 HydrophobicContact CD1-CG2 3.97Å; L77-V144 HydrophobicContact CD2-CG1 3.99Å; L77-V144 HydrophobicContact CG-CG1 4.5Å; L77-V184 HydrophobicContact CD2-CG2 3.77Å; L77-Y214 HydrophobicContact CB-CD2 4.42Å; L77-Y214 HydrophobicContact CB-CE2 3.89Å; L77-Y214 HydrophobicContact CD1-CE2 4.38Å; L77-Y214 HydrophobicContact CD2-CD2 4.01Å; L77-Y214 HydrophobicContact CD2-CE2 4.19Å; L77-Y214 HydrophobicContact CG-CE2 4.38Å
78	R	98.6	Very high	97.4	Very high	124 Å²	124	37.6 Å²	37.6	47%	0.468	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.1	176.7	-67.2	-172.8	63.3	80	-3.4	111.2	Y69 R70 N71 G76 N112	Y69-R78 VanDerWaalsContact C-NH2 3.31Å; Y69-R78 PolarHBondContact O-NH2 3Å; R70-R78 CarbonylContact O-C 3.56Å; R70-R78 WeakPolarHBondContact O-CA 3.25Å; N71-R78 PolarHBondContact OD1-NH1 3.07Å; G76-R78 PolarHBondContact O-N 3.46Å; R78-N112 PolarHBondContact O-ND2 3.47Å
79	V	98.8	Very high	97.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.7	179.2	-64.2	0	0	0	0	110.7	Y69 R70 L72 L77 N112 L113 V144	Y69-V79 CarbonylContact C-O 3.51Å; Y69-V79 VanDerWaalsContact CA-O 3.26Å; Y69-V79 WeakPolarHBondContact CA-O 3.47Å; R70-V79 PolarHBondContact N-O 3.4Å; R70-V79 PolarHBondContact O-N 2.95Å; L72-V79 HydrophobicContact CB-CG1 4.39Å; L72-V79 HydrophobicContact CB-CG2 4.35Å; L72-V79 HydrophobicContact CD1-CG2 4.36Å; L77-V79 HydrophobicContact CD2-CG1 4.5Å; L77-V79 HydrophobicContact CG-CG1 4.32Å; V79-N112 WeakPolarHBondContact CA-OD1 3.36Å; V79-L113 HydrophobicContact CB-CB 4.49Å; V79-L113 HydrophobicContact CB-CD2 4.44Å; V79-L113 HydrophobicContact CG1-CD1 4.45Å; V79-V144 HydrophobicContact CG1-CB 4.48Å; V79-V144 HydrophobicContact CG1-CG1 4.04Å; V79-V144 HydrophobicContact CG1-CG2 4.33Å
80	S	98.6	Very high	97.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	142.2	165.5	48.3	0	0	0	0	109.6	L82 V111 N112 L113 S349	S80-L82 VanDerWaalsContact CB-O 3.27Å; S80-L82 WeakPolarHBondContact CB-O 3.37Å; S80-L82 PolarHBondContact O-N 3.19Å; S80-L82 VanDerWaalsContact O-N 3.15Å; S80-L82 PolarHBondContact OG-O 3.03Å; S80-V111 WeakPolarHBondContact OG-CA 3.45Å; S80-N112 PolarHBondContact N-OD1 2.97Å; S80-N112 PolarHBondContact OG-N 2.81Å; S80-N112 PolarHBondContact OG-OD1 3.02Å; S80-L113 PolarHBondContact OG-N 3.06Å; S80-S349 VanDerWaalsContact O-CB 3.3Å; S80-S349 WeakPolarHBondContact O-CB 3.43Å; S80-S349 PolarHBondContact O-OG 2.93Å
81	C	97.8	Very high	97.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-64.9	-18.4	-179.5	68.2	0	0	0	0	112.3	K68 L342 S349 V350	K68-C81 HydrophobicContact CB-CB 4.37Å; K68-C81 WeakPolarHBondContact O-CB 3.38Å; K68-C81 PolarHBondContact O-N 3.15Å; C81-L342 HydrophobicContact CB-CD2 4.05Å; C81-L342 WeakPolarHBondContact O-CD2 3.14Å; C81-S349 CarbonylContact O-C 3.49Å; C81-S349 VanDerWaalsContact O-CA 3.26Å; C81-S349 WeakPolarHBondContact O-CA 3.27Å; C81-S349 PolarHBondContact O-OG 3.38Å; C81-V350 PolarHBondContact O-N 3.02Å
82	L	98.6	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.8	165.8	-63.4	175.7	0	0	0	109.5	M67 S80 V338 L342 V350 L352 L364 I367	M67-L82 HydrophobicContact CE-CB 4.2Å; M67-L82 HydrophobicContact SD-CB 4.4Å; S80-L82 VanDerWaalsContact CB-O 3.27Å; S80-L82 WeakPolarHBondContact CB-O 3.37Å; S80-L82 PolarHBondContact O-N 3.19Å; S80-L82 VanDerWaalsContact O-N 3.15Å; S80-L82 PolarHBondContact OG-O 3.03Å; L82-V338 HydrophobicContact CD2-CG1 3.62Å; L82-L342 HydrophobicContact CD2-CD1 3.71Å; L82-L342 HydrophobicContact CD2-CD2 4.45Å; L82-L342 HydrophobicContact CD2-CG 4.36Å; L82-L342 HydrophobicContact CG-CD1 4.14Å; L82-V350 WeakPolarHBondContact CA-O 3.36Å; L82-V350 HydrophobicContact CD2-CB 4.07Å; L82-L352 HydrophobicContact CB-CD1 4.34Å; L82-L352 HydrophobicContact CD1-CD1 4.24Å; L82-L352 HydrophobicContact CD2-CD1 4.41Å; L82-L352 HydrophobicContact CD2-CD2 4.18Å; L82-L352 HydrophobicContact CD2-CG 4.31Å; L82-L364 HydrophobicContact CD1-CD2 4Å; L82-I367 HydrophobicContact CD1-CD1 3.87Å; L82-I367 HydrophobicContact CD1-CG1 3.8Å
83	G	98.6	Very high	96.3	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	167.9	169.3	0	0	0	0	0	111.3	L113 S349 V350 L352	G83-L113 CarbonylContact C-O 3.55Å; G83-L113 VanDerWaalsContact CA-O 3.23Å; G83-L113 WeakPolarHBondContact CA-O 3.17Å; G83-S349 PolarHBondContact N-OG 3.12Å; G83-V350 PolarHBondContact N-O 3.15Å; G83-L352 WeakPolarHBondContact O-CB 3.4Å; G83-L352 PolarHBondContact O-N 3.38Å
84	L	98.8	Very high	96.1	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.1	175.2	-179	64.6	0	0	0	110.2	F90 L102 M103 A106 L113 F114 D115 L360	L84-F90 HydrophobicContact CD2-CZ 4.45Å; L84-L102 HydrophobicContact CD2-CB 4.31Å; L84-M103 HydrophobicContact CD2-CG 4.2Å; L84-A106 HydrophobicContact CB-CB 4.42Å; L84-A106 HydrophobicContact CD2-CB 4.05Å; L84-L113 PolarHBondContact N-O 3Å; L84-F114 HydrophobicContact CB-CD1 4.01Å; L84-F114 HydrophobicContact CB-CE1 4.25Å; L84-F114 HydrophobicContact CD2-CD1 4.27Å; L84-F114 HydrophobicContact CD2-CE1 4.21Å; L84-F114 WeakPolarHBondContact O-CA 3.41Å; L84-D115 PolarHBondContact O-N 2.76Å; L84-L360 HydrophobicContact CD1-CD1 4.29Å
85	G	98.2	Very high	96.1	Very high	9 Å²	9	26.2 Å²	26.2	9%	0.093	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	150.8	172.9	0	0	0	0	0	112.5	D115 L352	G85-D115 CarbonylContact C-O 3.51Å; G85-D115 WeakPolarHBondContact CA-O 3.38Å; G85-L352 PolarHBondContact N-O 2.88Å
86	T	97.4	Very high	96	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.018	17%	0.17	C	C	.	.			trans	-102.1	-0.3	-176.6	65	0	0	0	0	114.7	T89 F90 D115 T116	T86-T89 PolarHBondContact O-N 3.33Å; T86-T89 PolarHBondContact O-OG1 3.28Å; T86-F90 HydrophobicContact CG2-CB 4.33Å; T86-F90 HydrophobicContact CG2-CD1 3.81Å; T86-F90 HydrophobicContact CG2-CD2 3.81Å; T86-F90 HydrophobicContact CG2-CE1 4.06Å; T86-F90 HydrophobicContact CG2-CE2 4.05Å; T86-F90 HydrophobicContact CG2-CG 3.71Å; T86-F90 HydrophobicContact CG2-CZ 4.19Å; T86-F90 PolarHBondContact O-N 2.83Å; T86-D115 WeakPolarHBondContact CG2-O 3.17Å; T86-D115 PolarHBondContact N-O 3.14Å; T86-D115 PolarHBondContact OG1-O 3.45Å; T86-T116 WeakPolarHBondContact OG1-CA 3.3Å; T86-T116 VanDerWaalsContact OG1-CB 3.28Å; T86-T116 WeakPolarHBondContact OG1-CB 3.13Å; T86-T116 PolarHBondContact OG1-OG1 3.01Å
87	W	95.4	Very high	96	Very high	76 Å²	76	31.2 Å²	31.2	29%	0.288	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	137.1	-176.8	-176.2	45.5	0	0	0	112.2	T89 Y120 Y300 W302	W87-T89 PolarHBondContact O-N 2.76Å; W87-T89 PolarHBondContact O-OG1 3.05Å; W87-Y120 HydrophobicContact CB-CD1 4.47Å; W87-Y120 HydrophobicContact CB-CD2 4.11Å; W87-Y120 HydrophobicContact CB-CE1 4.06Å; W87-Y120 HydrophobicContact CB-CE2 3.66Å; W87-Y120 AromaticContact CD1-CD1 3.54Å; W87-Y120 AromaticContact CD1-CE1 3.37Å; W87-Y120 AromaticContact CD1-CZ 3.88Å; W87-Y120 HydrophobicContact CG-CD1 4.3Å; W87-Y120 AromaticContact CG-CE1 3.84Å; W87-Y120 HydrophobicContact CG-CE1 3.84Å; W87-Y120 HydrophobicContact CG-CE2 4.36Å; W87-Y120 AromaticContact CG-CZ 3.88Å; W87-Y300 HydrophobicContact CZ2-CE1 4.13Å; W87-W302 HydrophobicContact CH2-CZ2 4.36Å
88	V	90.4	Very high	95.9	Very high	16 Å²	16	31.9 Å²	31.9	10%	0.097	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	-37.9	-176.5	-168.4	0	0	0	0	113.8	Q93 R294 M297 Y300	V88-Q93 HydrophobicContact CG1-CB 4.39Å; V88-Q93 VanDerWaalsContact O-CB 3.3Å; V88-Q93 WeakPolarHBondContact O-CB 3.24Å; V88-Q93 PolarHBondContact O-N 2.81Å; V88-R294 HydrophobicContact CG1-CG 4.3Å; V88-M297 HydrophobicContact CG1-CE 4.24Å; V88-M297 HydrophobicContact CG1-SD 3.96Å; V88-Y300 HydrophobicContact CG1-CE1 4.46Å; V88-Y300 HydrophobicContact CG1-CE2 4.06Å; V88-Y300 HydrophobicContact CG2-CE1 3.9Å; V88-Y300 WeakPolarHBondContact CG2-OH 3.25Å
89	T	93	Very high	95.9	Very high	1 Å²	1	26 Å²	26	1%	0.006	15%	0.15	C	C	.	.	I	π-helix	trans	-85	-67.4	-167.7	46.3	0	0	0	0	111.8	T86 W87 G91 G92 Q93 I94 T354	T86-T89 PolarHBondContact O-N 3.33Å; T86-T89 PolarHBondContact O-OG1 3.28Å; W87-T89 PolarHBondContact O-N 2.76Å; W87-T89 PolarHBondContact O-OG1 3.05Å; T89-G91 PolarHBondContact O-N 2.93Å; T89-G92 CarbonylContact O-C 3.56Å; T89-G92 PolarHBondContact O-N 2.66Å; T89-G92 VanDerWaalsContact O-N 3.11Å; T89-Q93 PolarHBondContact O-N 3.35Å; T89-Q93 VanDerWaalsContact O-N 3.12Å; T89-I94 WeakPolarHBondContact O-CG1 3.43Å; T89-I94 PolarHBondContact O-N 3.44Å; T89-T354 WeakPolarHBondContact CG2-O 3.44Å
90	F	94.8	Very high	95.9	Very high	3 Å²	3	28.1 Å²	28.1	1%	0.013	16%	0.16	C	C	.	.	I	π-helix	trans	-68	126.8	-170.4	-71.8	50.6	0	0	0	110.3	L84 T86 G92 I94 A99 M103 A125 I128 I132	L84-F90 HydrophobicContact CD2-CZ 4.45Å; T86-F90 HydrophobicContact CG2-CB 4.33Å; T86-F90 HydrophobicContact CG2-CD1 3.81Å; T86-F90 HydrophobicContact CG2-CD2 3.81Å; T86-F90 HydrophobicContact CG2-CE1 4.06Å; T86-F90 HydrophobicContact CG2-CE2 4.05Å; T86-F90 HydrophobicContact CG2-CG 3.71Å; T86-F90 HydrophobicContact CG2-CZ 4.19Å; T86-F90 PolarHBondContact O-N 2.83Å; F90-G92 PolarHBondContact O-N 2.9Å; F90-I94 HydrophobicContact CD1-CD1 4.32Å; F90-I94 HydrophobicContact CE1-CD1 4.38Å; F90-A99 HydrophobicContact CD1-CB 4.37Å; F90-A99 HydrophobicContact CD2-CB 3.74Å; F90-A99 HydrophobicContact CE1-CB 4.26Å; F90-A99 HydrophobicContact CE2-CB 3.61Å; F90-A99 HydrophobicContact CG-CB 4.11Å; F90-A99 HydrophobicContact CZ-CB 3.88Å; F90-M103 HydrophobicContact CE2-CG 3.82Å; F90-M103 HydrophobicContact CE2-SD 3.86Å; F90-M103 HydrophobicContact CZ-CG 3.72Å; F90-M103 HydrophobicContact CZ-SD 4.36Å; F90-A125 HydrophobicContact CB-CB 3.9Å; F90-I128 HydrophobicContact CD2-CB 4.36Å; F90-I128 HydrophobicContact CD2-CG2 3.76Å; F90-I128 HydrophobicContact CE2-CG2 4.38Å; F90-I132 HydrophobicContact CE2-CD1 3.98Å
91	G	90.5	Very high	95.9	Very high	14 Å²	14	32.8 Å²	32.8	14%	0.144	18%	0.182	C	C	.	.	I	π-helix	trans	73.8	4.9	-179.7	0	0	0	0	0	114.6	T89	T89-G91 PolarHBondContact O-N 2.93Å
92	G	90.7	Very high	95.9	Very high	53 Å²	53	32.8 Å²	32.8	55%	0.546	18%	0.182	S	C	.	.	I	π-helix	trans	-131.6	-94.1	-178.7	0	0	0	0	0	111.9	T89 F90 I94	T89-G92 CarbonylContact O-C 3.56Å; T89-G92 PolarHBondContact O-N 2.66Å; T89-G92 VanDerWaalsContact O-N 3.11Å; F90-G92 PolarHBondContact O-N 2.9Å; G92-I94 PolarHBondContact O-N 3.2Å
93	Q	90	Very high	95.9	Very high	57 Å²	57	32.9 Å²	32.9	27%	0.266	18%	0.182	S	C	.	.	I	π-helix	trans	-68.2	-31.8	-170.6	-172.7	-174.6	11.9	0	0	114.2	V88 T89 M297	V88-Q93 HydrophobicContact CG1-CB 4.39Å; V88-Q93 VanDerWaalsContact O-CB 3.3Å; V88-Q93 WeakPolarHBondContact O-CB 3.24Å; V88-Q93 PolarHBondContact O-N 2.81Å; T89-Q93 PolarHBondContact O-N 3.35Å; T89-Q93 VanDerWaalsContact O-N 3.12Å; Q93-M297 HydrophobicContact CB-CE 4.2Å; Q93-M297 HydrophobicContact CB-SD 4.48Å; Q93-M297 HydrophobicContact CG-CE 4.41Å; Q93-M297 HydrophobicContact CG-SD 4.19Å
94	I	94.2	Very high	95.9	Very high	20 Å²	20	33.7 Å²	33.7	10%	0.103	19%	0.187	C	C	.	.	S	Bend	trans	-117.7	159.1	-173.8	65.1	170	0	0	0	111.2	T89 F90 G92 V98 A99 L102 S355	T89-I94 WeakPolarHBondContact O-CG1 3.43Å; T89-I94 PolarHBondContact O-N 3.44Å; F90-I94 HydrophobicContact CD1-CD1 4.32Å; F90-I94 HydrophobicContact CE1-CD1 4.38Å; G92-I94 PolarHBondContact O-N 3.2Å; I94-V98 HydrophobicContact CB-CB 4.21Å; I94-V98 HydrophobicContact CB-CG1 4.16Å; I94-V98 HydrophobicContact CD1-CB 4.32Å; I94-V98 HydrophobicContact CD1-CG1 3.99Å; I94-V98 HydrophobicContact CG2-CG1 4.4Å; I94-A99 HydrophobicContact CD1-CB 4Å; I94-L102 HydrophobicContact CD1-CD1 3.59Å; I94-S355 VanDerWaalsContact CG2-O 3.27Å; I94-S355 WeakPolarHBondContact CG2-O 3.31Å
95	T	96.8	Very high	95.9	Very high	74 Å²	74	35.5 Å²	35.5	45%	0.454	20%	0.196	S	C	.	.			trans	-74.7	162.1	174.4	80.6	0	0	0	0	111.5	E97 V98 A99	T95-E97 WeakPolarHBondContact CB-OE2 3.33Å; T95-E97 PolarHBondContact O-N 3.42Å; T95-E97 PolarHBondContact OG1-N 2.89Å; T95-E97 PolarHBondContact OG1-OE2 3.22Å; T95-V98 PolarHBondContact O-N 3.44Å; T95-V98 PolarHBondContact OG1-N 3.37Å; T95-A99 PolarHBondContact O-N 2.95Å
96	D	97.3	Very high	95.9	Very high	60 Å²	60	35.1 Å²	35.1	32%	0.321	19%	0.192	S	C	.	.	H	α-helix	trans	-64.5	-30.7	179.5	-66.2	11.2	0	0	0	111.1	A99 E100 I128	D96-A99 WeakPolarHBondContact O-CB 3.44Å; D96-A99 PolarHBondContact O-N 2.76Å; D96-E100 PolarHBondContact O-N 2.9Å; D96-I128 WeakPolarHBondContact OD1-CD1 3.26Å
97	E	97.8	Very high	95.9	Very high	121 Å²	121	37.5 Å²	37.5	57%	0.565	20%	0.201	S	C	*	.	H	α-helix	trans	-67.4	-42.9	175.1	-58.7	71.5	-153.5	0	0	111.7	T95 A99 E100 Q101	T95-E97 WeakPolarHBondContact CB-OE2 3.33Å; T95-E97 PolarHBondContact O-N 3.42Å; T95-E97 PolarHBondContact OG1-N 2.89Å; T95-E97 PolarHBondContact OG1-OE2 3.22Å; E97-A99 VanDerWaalsContact C-N 3.32Å; E97-E100 PolarHBondContact O-N 2.86Å; E97-Q101 WeakPolarHBondContact O-CG 3.32Å; E97-Q101 PolarHBondContact O-N 3.43Å
98	V	97.9	Very high	96	Very high	34 Å²	34	40 Å²	40	21%	0.206	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-40	175.3	178.2	0	0	0	0	109.8	I94 T95 E100 Q101 L102	I94-V98 HydrophobicContact CB-CB 4.21Å; I94-V98 HydrophobicContact CB-CG1 4.16Å; I94-V98 HydrophobicContact CD1-CB 4.32Å; I94-V98 HydrophobicContact CD1-CG1 3.99Å; I94-V98 HydrophobicContact CG2-CG1 4.4Å; T95-V98 PolarHBondContact O-N 3.44Å; T95-V98 PolarHBondContact OG1-N 3.37Å; V98-E100 VanDerWaalsContact C-N 3.33Å; V98-E100 PolarHBondContact O-N 2.88Å; V98-Q101 PolarHBondContact O-N 2.95Å; V98-L102 HydrophobicContact CG1-CD1 4.24Å; V98-L102 HydrophobicContact CG1-CG 4.32Å; V98-L102 VanDerWaalsContact O-CG 3.26Å; V98-L102 WeakPolarHBondContact O-CG 3.38Å; V98-L102 PolarHBondContact O-N 3.16Å
99	A	98.4	Very high	96.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.8	-43.4	174.7	0	0	0	0	0	112	F90 I94 T95 D96 E97 L102 M103 I128 I132	F90-A99 HydrophobicContact CD1-CB 4.37Å; F90-A99 HydrophobicContact CD2-CB 3.74Å; F90-A99 HydrophobicContact CE1-CB 4.26Å; F90-A99 HydrophobicContact CE2-CB 3.61Å; F90-A99 HydrophobicContact CG-CB 4.11Å; F90-A99 HydrophobicContact CZ-CB 3.88Å; I94-A99 HydrophobicContact CD1-CB 4Å; T95-A99 PolarHBondContact O-N 2.95Å; D96-A99 WeakPolarHBondContact O-CB 3.44Å; D96-A99 PolarHBondContact O-N 2.76Å; E97-A99 VanDerWaalsContact C-N 3.32Å; A99-L102 PolarHBondContact O-N 2.82Å; A99-M103 WeakPolarHBondContact O-CG 3.41Å; A99-M103 PolarHBondContact O-N 2.79Å; A99-I128 HydrophobicContact CB-CG2 3.81Å; A99-I132 HydrophobicContact CB-CD1 4.02Å
100	E	98.5	Very high	96.5	Very high	46 Å²	46	41.4 Å²	41.4	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-43	174.6	-176.8	177.4	151.6	0	0	112.6	D96 E97 V98 M103 T104 I132 K135	D96-E100 PolarHBondContact O-N 2.9Å; E97-E100 PolarHBondContact O-N 2.86Å; V98-E100 VanDerWaalsContact C-N 3.33Å; V98-E100 PolarHBondContact O-N 2.88Å; E100-M103 PolarHBondContact O-N 2.71Å; E100-T104 VanDerWaalsContact O-CB 3.29Å; E100-T104 WeakPolarHBondContact O-CB 3.44Å; E100-T104 PolarHBondContact O-N 3.14Å; E100-T104 PolarHBondContact O-OG1 2.79Å; E100-I132 HydrophobicContact CB-CD1 4.19Å; E100-I132 HydrophobicContact CB-CG1 3.99Å; E100-I132 HydrophobicContact CG-CG1 4.37Å; E100-I132 HydrophobicContact CG-CG2 4.25Å; E100-K135 IonicContact OE1-NZ 3.5Å; E100-K135 PolarHBondContact OE1-NZ 2.99Å; E100-K135 WeakPolarHBondContact OE2-CD 3.41Å; E100-K135 IonicContact OE2-NZ 3.91Å; E100-K135 PolarHBondContact OE2-NZ 3.31Å
101	Q	98.4	Very high	96.7	Very high	98 Å²	98	41.4 Å²	41.4	46%	0.458	23%	0.229	S	C	.	.	H	α-helix	trans	-61	-47.5	176.1	-73.1	173.9	2.1	0	0	111.2	E97 V98 M103 T104 I105 P357	E97-Q101 WeakPolarHBondContact O-CG 3.32Å; E97-Q101 PolarHBondContact O-N 3.43Å; V98-Q101 PolarHBondContact O-N 2.95Å; Q101-M103 PolarHBondContact O-N 2.81Å; Q101-T104 PolarHBondContact O-N 2.96Å; Q101-I105 VanDerWaalsContact O-CG1 3.32Å; Q101-I105 WeakPolarHBondContact O-CG1 3.32Å; Q101-I105 PolarHBondContact O-N 2.92Å; Q101-P357 HydrophobicContact CB-CG 4.36Å
102	L	98.7	Very high	97.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-48.6	178.1	-70.3	176.9	0	0	0	111.8	L84 I94 V98 A99 T104 I105 A106 T354 N356 L360	L84-L102 HydrophobicContact CD2-CB 4.31Å; I94-L102 HydrophobicContact CD1-CD1 3.59Å; V98-L102 HydrophobicContact CG1-CD1 4.24Å; V98-L102 HydrophobicContact CG1-CG 4.32Å; V98-L102 VanDerWaalsContact O-CG 3.26Å; V98-L102 WeakPolarHBondContact O-CG 3.38Å; V98-L102 PolarHBondContact O-N 3.16Å; A99-L102 PolarHBondContact O-N 2.82Å; L102-T104 VanDerWaalsContact C-N 3.31Å; L102-T104 PolarHBondContact O-N 3.03Å; L102-I105 PolarHBondContact O-N 2.77Å; L102-A106 WeakPolarHBondContact O-CB 3.48Å; L102-A106 PolarHBondContact O-N 3.28Å; L102-T354 WeakPolarHBondContact CD1-O 3.15Å; L102-N356 VanDerWaalsContact CD2-C 3.48Å; L102-N356 WeakPolarHBondContact CD2-O 3.35Å; L102-L360 HydrophobicContact CB-CD2 4.13Å; L102-L360 HydrophobicContact CD2-CB 3.8Å; L102-L360 HydrophobicContact CD2-CD2 3.76Å; L102-L360 HydrophobicContact CD2-CG 4.43Å; L102-L360 WeakPolarHBondContact O-CD2 3.19Å
103	M	98.6	Very high	97.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-62.3	-39.9	176.8	-75.7	-162.7	74.7	0	0	112.3	L84 F90 A99 E100 Q101 A106 Y107 F114 L129 I132 I133 W138	L84-M103 HydrophobicContact CD2-CG 4.2Å; F90-M103 HydrophobicContact CE2-CG 3.82Å; F90-M103 HydrophobicContact CE2-SD 3.86Å; F90-M103 HydrophobicContact CZ-CG 3.72Å; F90-M103 HydrophobicContact CZ-SD 4.36Å; A99-M103 WeakPolarHBondContact O-CG 3.41Å; A99-M103 PolarHBondContact O-N 2.79Å; E100-M103 PolarHBondContact O-N 2.71Å; Q101-M103 PolarHBondContact O-N 2.81Å; M103-A106 PolarHBondContact O-N 2.74Å; M103-Y107 WeakPolarHBondContact O-CB 3.22Å; M103-Y107 PolarHBondContact O-N 2.9Å; M103-F114 HydrophobicContact CB-CE1 4.45Å; M103-F114 HydrophobicContact CE-CD1 3.57Å; M103-F114 HydrophobicContact CE-CE1 3.79Å; M103-F114 HydrophobicContact CE-CG 3.99Å; M103-F114 HydrophobicContact CE-CZ 4.39Å; M103-F114 HydrophobicContact CG-CD1 4.42Å; M103-F114 HydrophobicContact CG-CE1 4.33Å; M103-L129 HydrophobicContact CE-CD1 3.19Å; M103-L129 HydrophobicContact SD-CD1 3.47Å; M103-L129 WeakPolarHBondContact SD-CD1 3.32Å; M103-I132 HydrophobicContact CB-CG2 3.98Å; M103-I132 HydrophobicContact CE-CG2 4.42Å; M103-I132 HydrophobicContact CG-CD1 4.21Å; M103-I132 HydrophobicContact CG-CG2 4.37Å; M103-I132 HydrophobicContact SD-CB 3.83Å; M103-I132 HydrophobicContact SD-CD1 3.6Å; M103-I132 VanDerWaalsContact SD-CD1 3.6Å; M103-I132 HydrophobicContact SD-CG1 4.33Å; M103-I132 HydrophobicContact SD-CG2 3.63Å; M103-I133 HydrophobicContact CE-CD1 4.24Å; M103-I133 HydrophobicContact CE-CG1 4.02Å; M103-W138 HydrophobicContact CB-CH2 4.1Å; M103-W138 HydrophobicContact CB-CZ3 4.32Å; M103-W138 HydrophobicContact CE-CZ3 4.01Å
104	T	98.4	Very high	97.9	Very high	19 Å²	19	36.7 Å²	36.7	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-49.5	178.8	-62.4	0	0	0	0	110.6	E100 Q101 L102 A106 Y107 E108 K136	E100-T104 VanDerWaalsContact O-CB 3.29Å; E100-T104 WeakPolarHBondContact O-CB 3.44Å; E100-T104 PolarHBondContact O-N 3.14Å; E100-T104 PolarHBondContact O-OG1 2.79Å; Q101-T104 PolarHBondContact O-N 2.96Å; L102-T104 VanDerWaalsContact C-N 3.31Å; L102-T104 PolarHBondContact O-N 3.03Å; T104-A106 VanDerWaalsContact C-N 3.33Å; T104-A106 PolarHBondContact O-N 3.07Å; T104-Y107 PolarHBondContact O-N 3.27Å; T104-E108 HydrophobicContact CG2-CG 4.29Å; T104-E108 VanDerWaalsContact CG2-OE1 3.25Å; T104-E108 WeakPolarHBondContact CG2-OE1 3.47Å; T104-E108 WeakPolarHBondContact O-CB 3.25Å; T104-E108 WeakPolarHBondContact O-CG 3.14Å; T104-E108 PolarHBondContact O-N 3.14Å; T104-K136 PolarHBondContact OG1-NZ 2.64Å; T104-K136 VanDerWaalsContact OG1-NZ 3.12Å
105	I	98.2	Very high	98.1	Very high	41 Å²	41	36 Å²	36	21%	0.21	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-45.4	177.4	-69.1	164.5	0	0	0	110.8	Q101 L102 S109 P357 L360 L364	Q101-I105 VanDerWaalsContact O-CG1 3.32Å; Q101-I105 WeakPolarHBondContact O-CG1 3.32Å; Q101-I105 PolarHBondContact O-N 2.92Å; L102-I105 PolarHBondContact O-N 2.77Å; I105-S109 WeakPolarHBondContact O-CB 3.5Å; I105-S109 PolarHBondContact O-N 3.09Å; I105-S109 PolarHBondContact O-OG 2.85Å; I105-P357 HydrophobicContact CD1-CB 3.65Å; I105-P357 HydrophobicContact CD1-CG 4.31Å; I105-L360 HydrophobicContact CB-CD2 3.95Å; I105-L360 HydrophobicContact CG2-CD2 3.84Å; I105-L360 HydrophobicContact CG2-CG 4.17Å; I105-L364 HydrophobicContact CG2-CD1 4.04Å
106	A	98.4	Very high	98.2	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-52.8	178.5	0	0	0	0	0	111.1	L84 L102 M103 T104 E108 S109 G110 V111 F114 L360	L84-A106 HydrophobicContact CB-CB 4.42Å; L84-A106 HydrophobicContact CD2-CB 4.05Å; L102-A106 WeakPolarHBondContact O-CB 3.48Å; L102-A106 PolarHBondContact O-N 3.28Å; M103-A106 PolarHBondContact O-N 2.74Å; T104-A106 VanDerWaalsContact C-N 3.33Å; T104-A106 PolarHBondContact O-N 3.07Å; A106-E108 PolarHBondContact O-N 3.26Å; A106-S109 CarbonylContact O-C 3.59Å; A106-S109 PolarHBondContact O-N 3.47Å; A106-S109 VanDerWaalsContact O-N 3.14Å; A106-G110 PolarHBondContact O-N 3.2Å; A106-V111 HydrophobicContact CB-CB 3.94Å; A106-V111 HydrophobicContact CB-CG1 4.29Å; A106-V111 HydrophobicContact CB-CG2 4.13Å; A106-V111 VanDerWaalsContact O-CB 3.22Å; A106-V111 WeakPolarHBondContact O-CB 3.25Å; A106-V111 WeakPolarHBondContact O-CG2 3.38Å; A106-V111 PolarHBondContact O-N 3.34Å; A106-F114 HydrophobicContact CB-CE1 4Å; A106-F114 HydrophobicContact CB-CZ 4.34Å; A106-L360 HydrophobicContact CB-CD2 4.24Å
107	Y	98.3	Very high	98.3	Very high	52 Å²	52	29.6 Å²	29.6	20%	0.204	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-46.1	-178.6	-173.6	-94.3	0	0	0	112.2	M103 T104 S109 G110 F114 W138 S142 L143	M103-Y107 WeakPolarHBondContact O-CB 3.22Å; M103-Y107 PolarHBondContact O-N 2.9Å; T104-Y107 PolarHBondContact O-N 3.27Å; Y107-S109 PolarHBondContact O-N 3.06Å; Y107-G110 WeakPolarHBondContact O-CA 3.45Å; Y107-G110 PolarHBondContact O-N 2.87Å; Y107-F114 HydrophobicContact CD2-CE2 4.38Å; Y107-F114 HydrophobicContact CD2-CZ 4.45Å; Y107-W138 AromaticContact CD1-CD1 3.89Å; Y107-W138 HydrophobicContact CD1-CD2 4.05Å; Y107-W138 AromaticContact CD1-CE2 3.51Å; Y107-W138 HydrophobicContact CD1-CG 4.26Å; Y107-W138 AromaticContact CD1-CZ2 3.9Å; Y107-W138 HydrophobicContact CD1-CZ2 3.9Å; Y107-W138 AromaticContact CD1-NE1 3.4Å; Y107-W138 HydrophobicContact CD2-CD2 4.13Å; Y107-W138 HydrophobicContact CD2-CE3 4.3Å; Y107-W138 HydrophobicContact CD2-CG 4.48Å; Y107-W138 AromaticContact CE1-CD1 3.51Å; Y107-W138 HydrophobicContact CE1-CD2 4.24Å; Y107-W138 AromaticContact CE1-CE2 3.98Å; Y107-W138 AromaticContact CE1-CG 3.96Å; Y107-W138 HydrophobicContact CE1-CG 3.96Å; Y107-W138 AromaticContact CE1-NE1 3.5Å; Y107-W138 HydrophobicContact CE2-CB 4.44Å; Y107-W138 HydrophobicContact CE2-CD2 4.31Å; Y107-W138 HydrophobicContact CE2-CG 4.19Å; Y107-W138 AromaticContact CG-CD2 3.98Å; Y107-W138 HydrophobicContact CG-CD2 3.98Å; Y107-W138 AromaticContact CG-CE2 3.7Å; Y107-W138 HydrophobicContact CG-CE3 4.35Å; Y107-W138 HydrophobicContact CG-CG 4.5Å; Y107-W138 HydrophobicContact CG-CH2 4.25Å; Y107-W138 AromaticContact CG-CZ2 3.85Å; Y107-W138 HydrophobicContact CG-CZ2 3.85Å; Y107-W138 HydrophobicContact CG-CZ3 4.49Å; Y107-W138 AromaticContact CZ-CD1 3.87Å; Y107-W138 AromaticContact CZ-CG 3.92Å; Y107-S142 PolarHBondContact OH-OG 3.48Å; Y107-L143 HydrophobicContact CD2-CD2 3.58Å; Y107-L143 HydrophobicContact CE2-CD2 3.53Å; Y107-L143 HydrophobicContact CE2-CG 4.31Å
108	E	96.5	Very high	98.3	Very high	128 Å²	128	24.1 Å²	24.1	60%	0.598	12%	0.123	S	C	*	.	H	α-helix	trans	-66.6	-22.2	177.7	-69.7	178.7	-176.7	0	0	112.9	T104 A106 G110	T104-E108 HydrophobicContact CG2-CG 4.29Å; T104-E108 VanDerWaalsContact CG2-OE1 3.25Å; T104-E108 WeakPolarHBondContact CG2-OE1 3.47Å; T104-E108 WeakPolarHBondContact O-CB 3.25Å; T104-E108 WeakPolarHBondContact O-CG 3.14Å; T104-E108 PolarHBondContact O-N 3.14Å; A106-E108 PolarHBondContact O-N 3.26Å; E108-G110 VanDerWaalsContact C-N 3.28Å
109	S	96.9	Very high	98.3	Very high	36 Å²	36	25.1 Å²	25.1	25%	0.252	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	2.6	171.7	-56.8	0	0	0	0	113.4	T65 I105 A106 Y107	T65-S109 WeakPolarHBondContact CB-O 3.37Å; T65-S109 PolarHBondContact OG1-O 2.8Å; I105-S109 WeakPolarHBondContact O-CB 3.5Å; I105-S109 PolarHBondContact O-N 3.09Å; I105-S109 PolarHBondContact O-OG 2.85Å; A106-S109 CarbonylContact O-C 3.59Å; A106-S109 PolarHBondContact O-N 3.47Å; A106-S109 VanDerWaalsContact O-N 3.14Å; Y107-S109 PolarHBondContact O-N 3.06Å
110	G	97.1	Very high	98.3	Very high	11 Å²	11	26.4 Å²	26.4	11%	0.113	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	6.4	178.3	0	0	0	0	0	114.7	Y69 A106 Y107 E108 N112	Y69-G110 WeakPolarHBondContact CE1-O 3.31Å; Y69-G110 WeakPolarHBondContact OH-CA 3.27Å; Y69-G110 PolarHBondContact OH-O 3.21Å; A106-G110 PolarHBondContact O-N 3.2Å; Y107-G110 WeakPolarHBondContact O-CA 3.45Å; Y107-G110 PolarHBondContact O-N 2.87Å; E108-G110 VanDerWaalsContact C-N 3.28Å; G110-N112 PolarHBondContact O-N 3.35Å
111	V	98.6	Very high	98.2	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.018	14%	0.144	C	C	.	.			trans	-66	122.5	170.4	176.2	0	0	0	0	108.7	M67 S80 A106 L113 F114 L364	M67-V111 HydrophobicContact CE-CG2 3.61Å; S80-V111 WeakPolarHBondContact OG-CA 3.45Å; A106-V111 HydrophobicContact CB-CB 3.94Å; A106-V111 HydrophobicContact CB-CG1 4.29Å; A106-V111 HydrophobicContact CB-CG2 4.13Å; A106-V111 VanDerWaalsContact O-CB 3.22Å; A106-V111 WeakPolarHBondContact O-CB 3.25Å; A106-V111 WeakPolarHBondContact O-CG2 3.38Å; A106-V111 PolarHBondContact O-N 3.34Å; V111-L113 WeakPolarHBondContact CG1-O 3.32Å; V111-F114 HydrophobicContact CG1-CE1 4.5Å; V111-F114 HydrophobicContact CG1-CZ 4.25Å; V111-L364 HydrophobicContact CG2-CD2 3.84Å
112	N	98.8	Very high	98.1	Very high	23 Å²	23	25.3 Å²	25.3	12%	0.123	16%	0.157	C	C	.	.			trans	-105.6	-16.2	172.6	74.7	-9.4	0	0	0	112.7	R78 V79 S80 G110 F114 V144	R78-N112 PolarHBondContact O-ND2 3.47Å; V79-N112 WeakPolarHBondContact CA-OD1 3.36Å; S80-N112 PolarHBondContact N-OD1 2.97Å; S80-N112 PolarHBondContact OG-N 2.81Å; S80-N112 PolarHBondContact OG-OD1 3.02Å; G110-N112 PolarHBondContact O-N 3.35Å; N112-F114 WeakPolarHBondContact O-CD2 3.39Å; N112-V144 WeakPolarHBondContact O-CA 3.46Å; N112-V144 PolarHBondContact O-N 2.92Å
113	L	98.9	Very high	98.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	119	-175.6	176.8	64.8	0	0	0	112	V79 S80 G83 L84 V111 V144 T146 M271 S349 L351	V79-L113 HydrophobicContact CB-CB 4.49Å; V79-L113 HydrophobicContact CB-CD2 4.44Å; V79-L113 HydrophobicContact CG1-CD1 4.45Å; S80-L113 PolarHBondContact OG-N 3.06Å; G83-L113 CarbonylContact C-O 3.55Å; G83-L113 VanDerWaalsContact CA-O 3.23Å; G83-L113 WeakPolarHBondContact CA-O 3.17Å; L84-L113 PolarHBondContact N-O 3Å; V111-L113 WeakPolarHBondContact CG1-O 3.32Å; L113-V144 WeakPolarHBondContact CA-O 3.24Å; L113-V144 HydrophobicContact CD1-CB 4.23Å; L113-V144 HydrophobicContact CD1-CG1 3.74Å; L113-T146 HydrophobicContact CD1-CG2 3.77Å; L113-M271 HydrophobicContact CD1-CE 3.76Å; L113-M271 HydrophobicContact CD1-SD 4.39Å; L113-M271 HydrophobicContact CD2-CE 3.58Å; L113-M271 HydrophobicContact CD2-CG 4.32Å; L113-M271 HydrophobicContact CD2-SD 3.9Å; L113-M271 HydrophobicContact CG-CE 4.31Å; L113-S349 WeakPolarHBondContact CD2-OG 3.33Å; L113-L351 HydrophobicContact CD2-CD2 3.83Å; L113-L351 HydrophobicContact CG-CD2 4.13Å
114	F	98.9	Very high	98.1	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.009	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.6	176.6	-58.3	-90.7	0	0	0	110.6	L84 M103 A106 Y107 V111 N112 L129 L143 V144 I145 T146	L84-F114 HydrophobicContact CB-CD1 4.01Å; L84-F114 HydrophobicContact CB-CE1 4.25Å; L84-F114 HydrophobicContact CD2-CD1 4.27Å; L84-F114 HydrophobicContact CD2-CE1 4.21Å; L84-F114 WeakPolarHBondContact O-CA 3.41Å; M103-F114 HydrophobicContact CB-CE1 4.45Å; M103-F114 HydrophobicContact CE-CD1 3.57Å; M103-F114 HydrophobicContact CE-CE1 3.79Å; M103-F114 HydrophobicContact CE-CG 3.99Å; M103-F114 HydrophobicContact CE-CZ 4.39Å; M103-F114 HydrophobicContact CG-CD1 4.42Å; M103-F114 HydrophobicContact CG-CE1 4.33Å; A106-F114 HydrophobicContact CB-CE1 4Å; A106-F114 HydrophobicContact CB-CZ 4.34Å; Y107-F114 HydrophobicContact CD2-CE2 4.38Å; Y107-F114 HydrophobicContact CD2-CZ 4.45Å; V111-F114 HydrophobicContact CG1-CE1 4.5Å; V111-F114 HydrophobicContact CG1-CZ 4.25Å; N112-F114 WeakPolarHBondContact O-CD2 3.39Å; F114-L129 HydrophobicContact CB-CD1 4.31Å; F114-L143 HydrophobicContact CD2-CD2 3.95Å; F114-L143 HydrophobicContact CE2-CD2 3.54Å; F114-V144 PolarHBondContact N-O 2.93Å; F114-I145 HydrophobicContact CB-CD1 3.92Å; F114-I145 HydrophobicContact CD2-CD1 4.13Å; F114-I145 HydrophobicContact CG-CD1 4.4Å; F114-I145 WeakPolarHBondContact O-CA 3.45Å; F114-T146 PolarHBondContact O-N 2.88Å
115	D	98.9	Very high	98.1	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.027	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.3	-169.7	175.1	80.9	0	0	0	112.7	L84 G85 T86 T146 K148 Q244 L351	L84-D115 PolarHBondContact O-N 2.76Å; G85-D115 CarbonylContact C-O 3.51Å; G85-D115 WeakPolarHBondContact CA-O 3.38Å; T86-D115 WeakPolarHBondContact CG2-O 3.17Å; T86-D115 PolarHBondContact N-O 3.14Å; T86-D115 PolarHBondContact OG1-O 3.45Å; D115-T146 WeakPolarHBondContact CA-OG1 3.29Å; D115-T146 VanDerWaalsContact CB-OG1 3.27Å; D115-T146 WeakPolarHBondContact CB-OG1 3.49Å; D115-T146 PolarHBondContact OD1-OG1 3.27Å; D115-K148 IonicContact OD1-NZ 3.76Å; D115-K148 PolarHBondContact OD1-NZ 2.95Å; D115-K148 IonicContact OD2-NZ 3.61Å; D115-K148 PolarHBondContact OD2-NZ 3.46Å; D115-Q244 PolarHBondContact OD1-NE2 2.73Å; D115-L351 HydrophobicContact CB-CD1 3.85Å; D115-L351 HydrophobicContact CB-CD2 3.78Å; D115-L351 HydrophobicContact CB-CG 4.47Å
116	T	98.9	Very high	98.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.164	C	C	.	.			trans	-142.5	-172	179.7	-166.4	0	0	0	0	111.8	T86 E126 L129 T146 T147 K148 M177	T86-T116 WeakPolarHBondContact OG1-CA 3.3Å; T86-T116 VanDerWaalsContact OG1-CB 3.28Å; T86-T116 WeakPolarHBondContact OG1-CB 3.13Å; T86-T116 PolarHBondContact OG1-OG1 3.01Å; T116-E126 HydrophobicContact CG2-CG 3.65Å; T116-L129 HydrophobicContact CG2-CD2 3.71Å; T116-T146 PolarHBondContact N-O 2.93Å; T116-T147 WeakPolarHBondContact O-CA 3.35Å; T116-K148 PolarHBondContact O-N 3.43Å; T116-K148 PolarHBondContact O-NZ 3.39Å; T116-M177 HydrophobicContact CG2-SD 3.99Å
117	A	98.8	Very high	98.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.			trans	-156.9	152.9	174.5	0	0	0	0	0	110.9	V119 Y120 T147 K148	A117-V119 HydrophobicContact CB-CG1 4.13Å; A117-V119 PolarHBondContact O-N 2.87Å; A117-V119 VanDerWaalsContact O-N 3.16Å; A117-Y120 HydrophobicContact CB-CD1 3.69Å; A117-Y120 HydrophobicContact CB-CD2 3.7Å; A117-Y120 HydrophobicContact CB-CE1 3.66Å; A117-Y120 HydrophobicContact CB-CE2 3.67Å; A117-Y120 HydrophobicContact CB-CG 3.71Å; A117-Y120 VanDerWaalsContact N-CD2 3.34Å; A117-Y120 PolarHBondContact O-N 3.36Å; A117-Y120 VanDerWaalsContact O-N 3.09Å; A117-T147 WeakPolarHBondContact CA-OG1 3.27Å; A117-K148 HydrophobicContact CB-CB 3.74Å
118	E	98.7	Very high	98.2	Very high	6 Å²	6	29 Å²	29	3%	0.028	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.6	175.9	65.5	177.3	162.9	0	0	112.8	G123 K148 L149 Y150 W151 G152 H165	E118-G123 WeakPolarHBondContact O-CA 3.48Å; E118-G123 PolarHBondContact O-N 2.8Å; E118-K148 PolarHBondContact N-O 3.41Å; E118-L149 HydrophobicContact CB-CD2 4.37Å; E118-L149 HydrophobicContact CG-CD2 4.25Å; E118-L149 VanDerWaalsContact OE1-CA 3.31Å; E118-L149 WeakPolarHBondContact OE1-CA 3.46Å; E118-Y150 PolarHBondContact OE1-N 2.91Å; E118-W151 WeakPolarHBondContact CG-O 3.38Å; E118-W151 PolarHBondContact OE1-N 3.47Å; E118-G152 VanDerWaalsContact CD-CA 3.47Å; E118-G152 PolarHBondContact OE1-N 3.1Å; E118-G152 WeakPolarHBondContact OE2-CA 3.36Å; E118-H165 IonicContact OE1-CD2 3.25Å; E118-H165 IonicContact OE1-CE1 2.83Å; E118-H165 IonicContact OE1-NE2 3.45Å; E118-H165 PolarHBondContact OE1-NE2 3.22Å; E118-H165 IonicContact OE2-CE1 2.76Å; E118-H165 IonicContact OE2-NE2 3.97Å; E118-H165 PolarHBondContact OE2-NE2 3.38Å
119	V	98.4	Very high	98.3	Very high	55 Å²	55	22.9 Å²	22.9	33%	0.333	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-19	-177.3	74.4	0	0	0	0	112.8	A117 A121 G122 W151	A117-V119 HydrophobicContact CB-CG1 4.13Å; A117-V119 PolarHBondContact O-N 2.87Å; A117-V119 VanDerWaalsContact O-N 3.16Å; V119-A121 PolarHBondContact O-N 3.3Å; V119-A121 VanDerWaalsContact O-N 3.1Å; V119-G122 PolarHBondContact O-N 3.04Å; V119-G122 VanDerWaalsContact O-N 3.08Å; V119-W151 HydrophobicContact CB-CB 3.94Å; V119-W151 HydrophobicContact CB-CE3 4.44Å; V119-W151 WeakPolarHBondContact CB-O 3.26Å; V119-W151 HydrophobicContact CG1-CE3 4.15Å; V119-W151 HydrophobicContact CG2-CB 3.63Å; V119-W151 HydrophobicContact CG2-CE3 4.47Å; V119-W151 HydrophobicContact CG2-CG 4.32Å
120	Y	98.1	Very high	98.4	Very high	27 Å²	27	21.3 Å²	21.3	11%	0.106	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-68.4	114.8	-173	-68.3	-8.5	0	0	0	110.7	W87 A117 G122 G123 R124 A125 K148	W87-Y120 HydrophobicContact CB-CD1 4.47Å; W87-Y120 HydrophobicContact CB-CD2 4.11Å; W87-Y120 HydrophobicContact CB-CE1 4.06Å; W87-Y120 HydrophobicContact CB-CE2 3.66Å; W87-Y120 AromaticContact CD1-CD1 3.54Å; W87-Y120 AromaticContact CD1-CE1 3.37Å; W87-Y120 AromaticContact CD1-CZ 3.88Å; W87-Y120 HydrophobicContact CG-CD1 4.3Å; W87-Y120 AromaticContact CG-CE1 3.84Å; W87-Y120 HydrophobicContact CG-CE1 3.84Å; W87-Y120 HydrophobicContact CG-CE2 4.36Å; W87-Y120 AromaticContact CG-CZ 3.88Å; A117-Y120 HydrophobicContact CB-CD1 3.69Å; A117-Y120 HydrophobicContact CB-CD2 3.7Å; A117-Y120 HydrophobicContact CB-CE1 3.66Å; A117-Y120 HydrophobicContact CB-CE2 3.67Å; A117-Y120 HydrophobicContact CB-CG 3.71Å; A117-Y120 VanDerWaalsContact N-CD2 3.34Å; A117-Y120 PolarHBondContact O-N 3.36Å; A117-Y120 VanDerWaalsContact O-N 3.09Å; Y120-G122 PolarHBondContact O-N 3.39Å; Y120-G123 PolarHBondContact O-N 2.97Å; Y120-G123 VanDerWaalsContact O-N 3.07Å; Y120-R124 PolarHBondContact O-N 2.88Å; Y120-A125 PolarHBondContact O-N 2.94Å; Y120-K148 WeakPolarHBondContact OH-CE 3.34Å
121	A	96.4	Very high	98.5	Very high	49 Å²	49	24.2 Å²	24.2	41%	0.405	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	50.6	36.4	-171.9	0	0	0	0	0	112.8	V119 G123 R124	V119-A121 PolarHBondContact O-N 3.3Å; V119-A121 VanDerWaalsContact O-N 3.1Å; A121-G123 VanDerWaalsContact C-N 3.3Å; A121-G123 PolarHBondContact O-N 2.76Å; A121-R124 HydrophobicContact CB-CB 3.91Å; A121-R124 WeakPolarHBondContact O-CB 3.41Å; A121-R124 WeakPolarHBondContact O-CG 3.48Å; A121-R124 PolarHBondContact O-N 3.45Å
122	G	96.7	Very high	98.5	Very high	72 Å²	72	24.4 Å²	24.4	74%	0.742	14%	0.144	S	C	*	.	G	3₁₀ helix	trans	60.4	37.6	-178.1	0	0	0	0	0	113.3	V119 Y120	V119-G122 PolarHBondContact O-N 3.04Å; V119-G122 VanDerWaalsContact O-N 3.08Å; Y120-G122 PolarHBondContact O-N 3.39Å
123	G	98	Very high	98.5	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	88.7	-8.8	-178.4	0	0	0	0	0	114.7	E118 Y120 A121 A125 E126 I127	E118-G123 WeakPolarHBondContact O-CA 3.48Å; E118-G123 PolarHBondContact O-N 2.8Å; Y120-G123 PolarHBondContact O-N 2.97Å; Y120-G123 VanDerWaalsContact O-N 3.07Å; A121-G123 VanDerWaalsContact C-N 3.3Å; A121-G123 PolarHBondContact O-N 2.76Å; G123-A125 VanDerWaalsContact C-N 3.26Å; G123-A125 PolarHBondContact O-N 3.46Å; G123-E126 WeakPolarHBondContact O-CB 3.34Å; G123-E126 PolarHBondContact O-N 3.4Å; G123-I127 PolarHBondContact O-N 3.33Å
124	R	98.2	Very high	98.4	Very high	124 Å²	124	30.5 Å²	30.5	47%	0.468	17%	0.171	S	C	.	.	H	α-helix	trans	-61.2	-33.9	177.8	-75.9	-108.3	-69.1	149.4	2.8	112.9	Y120 A121 E126 I127 I128	Y120-R124 PolarHBondContact O-N 2.88Å; A121-R124 HydrophobicContact CB-CB 3.91Å; A121-R124 WeakPolarHBondContact O-CB 3.41Å; A121-R124 WeakPolarHBondContact O-CG 3.48Å; A121-R124 PolarHBondContact O-N 3.45Å; R124-E126 VanDerWaalsContact C-N 3.29Å; R124-E126 PolarHBondContact O-N 3.49Å; R124-I127 PolarHBondContact O-N 3.41Å; R124-I128 WeakPolarHBondContact O-CG1 3.4Å; R124-I128 PolarHBondContact O-N 2.9Å
125	A	98.6	Very high	98.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-39.2	177.9	0	0	0	0	0	112.1	F90 Y120 G123 L129	F90-A125 HydrophobicContact CB-CB 3.9Å; Y120-A125 PolarHBondContact O-N 2.94Å; G123-A125 VanDerWaalsContact C-N 3.26Å; G123-A125 PolarHBondContact O-N 3.46Å; A125-L129 VanDerWaalsContact O-CB 3.3Å; A125-L129 WeakPolarHBondContact O-CB 3.26Å; A125-L129 PolarHBondContact O-N 2.84Å
126	E	98.9	Very high	98.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.6	-39.8	176.5	-72.5	-177.2	143.1	0	0	112.4	T116 G123 R124 G130 T147 S173 R176 M177	T116-E126 HydrophobicContact CG2-CG 3.65Å; G123-E126 WeakPolarHBondContact O-CB 3.34Å; G123-E126 PolarHBondContact O-N 3.4Å; R124-E126 VanDerWaalsContact C-N 3.29Å; R124-E126 PolarHBondContact O-N 3.49Å; E126-G130 PolarHBondContact O-N 3.23Å; E126-T147 PolarHBondContact OE1-OG1 3.47Å; E126-S173 VanDerWaalsContact OE1-CB 3.25Å; E126-S173 WeakPolarHBondContact OE1-CB 3.46Å; E126-S173 PolarHBondContact OE1-OG 3.28Å; E126-S173 WeakPolarHBondContact OE2-CA 3.15Å; E126-R176 HydrophobicContact CB-CB 3.95Å; E126-R176 IonicContact OE2-CZ 2.79Å; E126-R176 IonicContact OE2-NE 2.75Å; E126-R176 PolarHBondContact OE2-NE 2.96Å; E126-R176 IonicContact OE2-NH2 2.71Å; E126-R176 PolarHBondContact OE2-NH2 3.11Å; E126-M177 HydrophobicContact CB-CG 3.73Å; E126-M177 HydrophobicContact CG-CG 4.13Å; E126-M177 HydrophobicContact CG-SD 4.35Å; E126-M177 WeakPolarHBondContact O-CG 3.24Å
127	I	98.8	Very high	98.3	Very high	65 Å²	65	44.9 Å²	44.9	33%	0.333	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-47.7	176.1	-63.7	171.6	0	0	0	110.6	G123 R124 G130 N131 R176	G123-I127 PolarHBondContact O-N 3.33Å; R124-I127 PolarHBondContact O-N 3.41Å; I127-G130 PolarHBondContact O-N 2.95Å; I127-N131 WeakPolarHBondContact O-CB 3.46Å; I127-N131 PolarHBondContact O-N 2.91Å; I127-N131 PolarHBondContact O-ND2 3.22Å; I127-R176 WeakPolarHBondContact CA-O 3.39Å; I127-R176 HydrophobicContact CD1-CG 4.32Å; I127-R176 HydrophobicContact CG1-CB 3.79Å; I127-R176 HydrophobicContact CG1-CG 3.9Å
128	I	98.8	Very high	98.2	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-46.3	-179.3	-67.8	161.5	0	0	0	110.6	F90 D96 A99 R124 G130 N131 I132	F90-I128 HydrophobicContact CD2-CB 4.36Å; F90-I128 HydrophobicContact CD2-CG2 3.76Å; F90-I128 HydrophobicContact CE2-CG2 4.38Å; D96-I128 WeakPolarHBondContact OD1-CD1 3.26Å; A99-I128 HydrophobicContact CB-CG2 3.81Å; R124-I128 WeakPolarHBondContact O-CG1 3.4Å; R124-I128 PolarHBondContact O-N 2.9Å; I128-G130 VanDerWaalsContact C-N 3.34Å; I128-G130 PolarHBondContact O-N 2.96Å; I128-N131 PolarHBondContact O-N 3.03Å; I128-I132 HydrophobicContact CG2-CD1 3.68Å; I128-I132 HydrophobicContact CG2-CG1 4.42Å; I128-I132 WeakPolarHBondContact O-CD1 3.16Å; I128-I132 VanDerWaalsContact O-CG1 3.29Å; I128-I132 WeakPolarHBondContact O-CG1 3.36Å; I128-I132 PolarHBondContact O-N 3.07Å
129	L	98.8	Very high	98.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-53.8	-49.9	174.8	175.7	62.9	0	0	0	111.6	M103 F114 T116 A125 I132 I133 I145 M177	M103-L129 HydrophobicContact CE-CD1 3.19Å; M103-L129 HydrophobicContact SD-CD1 3.47Å; M103-L129 WeakPolarHBondContact SD-CD1 3.32Å; F114-L129 HydrophobicContact CB-CD1 4.31Å; T116-L129 HydrophobicContact CG2-CD2 3.71Å; A125-L129 VanDerWaalsContact O-CB 3.3Å; A125-L129 WeakPolarHBondContact O-CB 3.26Å; A125-L129 PolarHBondContact O-N 2.84Å; L129-I132 PolarHBondContact O-N 2.98Å; L129-I133 HydrophobicContact CD1-CD1 3.81Å; L129-I133 HydrophobicContact CG-CD1 4.05Å; L129-I133 WeakPolarHBondContact O-CG1 3.34Å; L129-I133 PolarHBondContact O-N 3.19Å; L129-I133 VanDerWaalsContact O-N 3.09Å; L129-I145 HydrophobicContact CD2-CG2 4.23Å; L129-M177 HydrophobicContact CD2-SD 4.08Å
130	G	98.8	Very high	98.2	Very high	2 Å²	2	51 Å²	51	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-44.5	178	0	0	0	0	0	113.2	E126 I127 I128 I132 I133 K134 M177	E126-G130 PolarHBondContact O-N 3.23Å; I127-G130 PolarHBondContact O-N 2.95Å; I128-G130 VanDerWaalsContact C-N 3.34Å; I128-G130 PolarHBondContact O-N 2.96Å; G130-I132 PolarHBondContact O-N 3.38Å; G130-I133 PolarHBondContact O-N 3.42Å; G130-K134 WeakPolarHBondContact O-CB 3.11Å; G130-K134 PolarHBondContact O-N 3.17Å; G130-M177 WeakPolarHBondContact CA-O 3.36Å
131	N	98.8	Very high	98.2	Very high	72 Å²	72	54.7 Å²	54.7	39%	0.385	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-43.9	177.4	-75.3	-17.3	0	0	0	112	I127 I128 K134 K135 Q178	I127-N131 WeakPolarHBondContact O-CB 3.46Å; I127-N131 PolarHBondContact O-N 2.91Å; I127-N131 PolarHBondContact O-ND2 3.22Å; I128-N131 PolarHBondContact O-N 3.03Å; N131-K134 PolarHBondContact O-N 3.23Å; N131-K135 WeakPolarHBondContact O-CB 3.45Å; N131-K135 PolarHBondContact O-N 2.81Å; N131-Q178 PolarHBondContact OD1-NE2 2.86Å
132	I	98.8	Very high	98.3	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-62.8	-50.2	178.1	-67.4	161.1	0	0	0	110.1	F90 A99 E100 M103 I128 L129 G130 K134 K135 K136 W138	F90-I132 HydrophobicContact CE2-CD1 3.98Å; A99-I132 HydrophobicContact CB-CD1 4.02Å; E100-I132 HydrophobicContact CB-CD1 4.19Å; E100-I132 HydrophobicContact CB-CG1 3.99Å; E100-I132 HydrophobicContact CG-CG1 4.37Å; E100-I132 HydrophobicContact CG-CG2 4.25Å; M103-I132 HydrophobicContact CB-CG2 3.98Å; M103-I132 HydrophobicContact CE-CG2 4.42Å; M103-I132 HydrophobicContact CG-CD1 4.21Å; M103-I132 HydrophobicContact CG-CG2 4.37Å; M103-I132 HydrophobicContact SD-CB 3.83Å; M103-I132 HydrophobicContact SD-CD1 3.6Å; M103-I132 VanDerWaalsContact SD-CD1 3.6Å; M103-I132 HydrophobicContact SD-CG1 4.33Å; M103-I132 HydrophobicContact SD-CG2 3.63Å; I128-I132 HydrophobicContact CG2-CD1 3.68Å; I128-I132 HydrophobicContact CG2-CG1 4.42Å; I128-I132 WeakPolarHBondContact O-CD1 3.16Å; I128-I132 VanDerWaalsContact O-CG1 3.29Å; I128-I132 WeakPolarHBondContact O-CG1 3.36Å; I128-I132 PolarHBondContact O-N 3.07Å; L129-I132 PolarHBondContact O-N 2.98Å; G130-I132 PolarHBondContact O-N 3.38Å; I132-K134 VanDerWaalsContact C-N 3.3Å; I132-K134 PolarHBondContact O-N 3.31Å; I132-K135 PolarHBondContact O-N 2.63Å; I132-K136 HydrophobicContact CG2-CG 4.01Å; I132-K136 WeakPolarHBondContact O-CB 3.34Å; I132-K136 VanDerWaalsContact O-CG 3.23Å; I132-K136 WeakPolarHBondContact O-CG 3.27Å; I132-K136 PolarHBondContact O-N 3.03Å; I132-W138 HydrophobicContact CG2-CH2 4.39Å; I132-W138 HydrophobicContact CG2-CZ3 4.21Å
133	I	98.6	Very high	98.4	Very high	16 Å²	16	50.5 Å²	50.5	8%	0.082	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-43.7	-178.9	-69.6	165.9	0	0	0	110.9	M103 L129 G130 C137 W138 L143 I145 M179	M103-I133 HydrophobicContact CE-CD1 4.24Å; M103-I133 HydrophobicContact CE-CG1 4.02Å; L129-I133 HydrophobicContact CD1-CD1 3.81Å; L129-I133 HydrophobicContact CG-CD1 4.05Å; L129-I133 WeakPolarHBondContact O-CG1 3.34Å; L129-I133 PolarHBondContact O-N 3.19Å; L129-I133 VanDerWaalsContact O-N 3.09Å; G130-I133 PolarHBondContact O-N 3.42Å; I133-C137 PolarHBondContact O-N 3.48Å; I133-C137 VanDerWaalsContact O-N 3.09Å; I133-W138 HydrophobicContact CG1-CE3 4.31Å; I133-L143 HydrophobicContact CD1-CD1 4.12Å; I133-L143 HydrophobicContact CG1-CD1 4.07Å; I133-L143 HydrophobicContact CG2-CD1 3.77Å; I133-I145 HydrophobicContact CD1-CD1 3.67Å; I133-I145 HydrophobicContact CD1-CG1 4.34Å; I133-M179 HydrophobicContact CB-CE 4.36Å; I133-M179 HydrophobicContact CD1-CE 3.28Å; I133-M179 HydrophobicContact CG1-CE 4.4Å; I133-M179 HydrophobicContact CG2-CE 4.26Å
134	K	98.1	Very high	98.5	Very high	136 Å²	136	50.8 Å²	50.8	59%	0.591	25%	0.25	S	C	*	.	H	α-helix	trans	-62.3	-47.8	176	-173.1	178.8	-173.8	179.6	0	112	G130 N131 I132 C137 Q178	G130-K134 WeakPolarHBondContact O-CB 3.11Å; G130-K134 PolarHBondContact O-N 3.17Å; N131-K134 PolarHBondContact O-N 3.23Å; I132-K134 VanDerWaalsContact C-N 3.3Å; I132-K134 PolarHBondContact O-N 3.31Å; K134-C137 PolarHBondContact O-N 2.71Å; K134-C137 PolarHBondContact O-SG 3.28Å; K134-C137 VanDerWaalsContact O-SG 3.35Å; K134-Q178 VanDerWaalsContact CD-OE1 3.26Å
135	K	98.4	Very high	98.5	Very high	135 Å²	135	44.9 Å²	44.9	59%	0.587	23%	0.227	S	C	*	.	H	α-helix	trans	-62.8	-41.7	-180	-175	-170.4	-177.3	-163.9	0	112.1	E100 N131 I132 C137	E100-K135 IonicContact OE1-NZ 3.5Å; E100-K135 PolarHBondContact OE1-NZ 2.99Å; E100-K135 WeakPolarHBondContact OE2-CD 3.41Å; E100-K135 IonicContact OE2-NZ 3.91Å; E100-K135 PolarHBondContact OE2-NZ 3.31Å; N131-K135 WeakPolarHBondContact O-CB 3.45Å; N131-K135 PolarHBondContact O-N 2.81Å; I132-K135 PolarHBondContact O-N 2.63Å; K135-C137 VanDerWaalsContact C-N 3.26Å; K135-C137 PolarHBondContact O-N 3.15Å
136	K	98.1	Very high	98.5	Very high	65 Å²	65	44.9 Å²	44.9	28%	0.283	23%	0.227	S	C	.	.	H	α-helix	trans	-77.1	-13.6	-179.7	-63	-65.3	-62.9	-156.6	0	113	T104 I132 W138	T104-K136 PolarHBondContact OG1-NZ 2.64Å; T104-K136 VanDerWaalsContact OG1-NZ 3.12Å; I132-K136 HydrophobicContact CG2-CG 4.01Å; I132-K136 WeakPolarHBondContact O-CB 3.34Å; I132-K136 VanDerWaalsContact O-CG 3.23Å; I132-K136 WeakPolarHBondContact O-CG 3.27Å; I132-K136 PolarHBondContact O-N 3.03Å; K136-W138 HydrophobicContact CB-CD2 3.67Å; K136-W138 HydrophobicContact CB-CE3 4.07Å; K136-W138 HydrophobicContact CB-CG 4.07Å; K136-W138 HydrophobicContact CB-CH2 4.3Å; K136-W138 HydrophobicContact CB-CZ2 3.94Å; K136-W138 HydrophobicContact CB-CZ3 4.35Å; K136-W138 HydrophobicContact CD-CZ2 4.29Å; K136-W138 HydrophobicContact CG-CD2 4.38Å; K136-W138 HydrophobicContact CG-CE3 4.49Å; K136-W138 HydrophobicContact CG-CH2 3.94Å; K136-W138 HydrophobicContact CG-CZ2 3.81Å; K136-W138 HydrophobicContact CG-CZ3 4.28Å; K136-W138 PolarHBondContact O-N 2.91Å; K136-W138 VanDerWaalsContact O-N 3.14Å
137	C	97.4	Very high	98.5	Very high	108 Å²	108	44.9 Å²	44.9	73%	0.73	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	33	-178.2	-56.6	0	0	0	0	113.2	I133 K134 K135	I133-C137 PolarHBondContact O-N 3.48Å; I133-C137 VanDerWaalsContact O-N 3.09Å; K134-C137 PolarHBondContact O-N 2.71Å; K134-C137 PolarHBondContact O-SG 3.28Å; K134-C137 VanDerWaalsContact O-SG 3.35Å; K135-C137 VanDerWaalsContact C-N 3.26Å; K135-C137 PolarHBondContact O-N 3.15Å
138	W	97.9	Very high	98.5	Very high	35 Å²	35	41.9 Å²	41.9	13%	0.133	21%	0.212	C	C	.	.			trans	-65	142.8	174.1	-66	-36.1	0	0	0	110	M103 Y107 I132 I133 K136 R140 L143	M103-W138 HydrophobicContact CB-CH2 4.1Å; M103-W138 HydrophobicContact CB-CZ3 4.32Å; M103-W138 HydrophobicContact CE-CZ3 4.01Å; Y107-W138 AromaticContact CD1-CD1 3.89Å; Y107-W138 HydrophobicContact CD1-CD2 4.05Å; Y107-W138 AromaticContact CD1-CE2 3.51Å; Y107-W138 HydrophobicContact CD1-CG 4.26Å; Y107-W138 AromaticContact CD1-CZ2 3.9Å; Y107-W138 HydrophobicContact CD1-CZ2 3.9Å; Y107-W138 AromaticContact CD1-NE1 3.4Å; Y107-W138 HydrophobicContact CD2-CD2 4.13Å; Y107-W138 HydrophobicContact CD2-CE3 4.3Å; Y107-W138 HydrophobicContact CD2-CG 4.48Å; Y107-W138 AromaticContact CE1-CD1 3.51Å; Y107-W138 HydrophobicContact CE1-CD2 4.24Å; Y107-W138 AromaticContact CE1-CE2 3.98Å; Y107-W138 AromaticContact CE1-CG 3.96Å; Y107-W138 HydrophobicContact CE1-CG 3.96Å; Y107-W138 AromaticContact CE1-NE1 3.5Å; Y107-W138 HydrophobicContact CE2-CB 4.44Å; Y107-W138 HydrophobicContact CE2-CD2 4.31Å; Y107-W138 HydrophobicContact CE2-CG 4.19Å; Y107-W138 AromaticContact CG-CD2 3.98Å; Y107-W138 HydrophobicContact CG-CD2 3.98Å; Y107-W138 AromaticContact CG-CE2 3.7Å; Y107-W138 HydrophobicContact CG-CE3 4.35Å; Y107-W138 HydrophobicContact CG-CG 4.5Å; Y107-W138 HydrophobicContact CG-CH2 4.25Å; Y107-W138 AromaticContact CG-CZ2 3.85Å; Y107-W138 HydrophobicContact CG-CZ2 3.85Å; Y107-W138 HydrophobicContact CG-CZ3 4.49Å; Y107-W138 AromaticContact CZ-CD1 3.87Å; Y107-W138 AromaticContact CZ-CG 3.92Å; I132-W138 HydrophobicContact CG2-CH2 4.39Å; I132-W138 HydrophobicContact CG2-CZ3 4.21Å; I133-W138 HydrophobicContact CG1-CE3 4.31Å; K136-W138 HydrophobicContact CB-CD2 3.67Å; K136-W138 HydrophobicContact CB-CE3 4.07Å; K136-W138 HydrophobicContact CB-CG 4.07Å; K136-W138 HydrophobicContact CB-CH2 4.3Å; K136-W138 HydrophobicContact CB-CZ2 3.94Å; K136-W138 HydrophobicContact CB-CZ3 4.35Å; K136-W138 HydrophobicContact CD-CZ2 4.29Å; K136-W138 HydrophobicContact CG-CD2 4.38Å; K136-W138 HydrophobicContact CG-CE3 4.49Å; K136-W138 HydrophobicContact CG-CH2 3.94Å; K136-W138 HydrophobicContact CG-CZ2 3.81Å; K136-W138 HydrophobicContact CG-CZ3 4.28Å; K136-W138 PolarHBondContact O-N 2.91Å; K136-W138 VanDerWaalsContact O-N 3.14Å; W138-R140 PolarHBondContact O-N 2.89Å; W138-L143 HydrophobicContact CB-CD1 4.14Å; W138-L143 HydrophobicContact CE3-CD1 4.47Å; W138-L143 HydrophobicContact CE3-CD2 4.38Å
139	R	98.1	Very high	98.5	Very high	106 Å²	106	41.8 Å²	41.8	40%	0.4	21%	0.211	S	C	.	.			trans	-62	125.3	177	-68.3	-171.2	-64.7	-81.7	-2.1	108.8	E59 S141 S142	E59-R139 IonicContact OE2-CZ 3.78Å; E59-R139 IonicContact OE2-NH1 2.7Å; E59-R139 PolarHBondContact OE2-NH1 3.36Å; R139-S141 PolarHBondContact O-N 3.07Å; R139-S141 VanDerWaalsContact O-N 3.07Å; R139-S142 PolarHBondContact O-N 3.3Å; R139-S142 PolarHBondContact O-OG 3.31Å
140	R	98.6	Very high	98.5	Very high	50 Å²	50	42.9 Å²	42.9	19%	0.189	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-54.3	-32.8	176.1	178.8	59.7	-172.3	88.6	-6.8	112.3	W138 S142 L143 Y181 D183	W138-R140 PolarHBondContact O-N 2.89Å; R140-S142 VanDerWaalsContact C-N 3.31Å; R140-S142 PolarHBondContact O-N 3.11Å; R140-L143 PolarHBondContact NH1-O 2.94Å; R140-L143 PolarHBondContact O-N 3.2Å; R140-Y181 HydrophobicContact CG-CE1 4.36Å; R140-Y181 VanDerWaalsContact NH2-CD2 3.26Å; R140-Y181 PolarHBondContact NH2-O 3.4Å; R140-D183 IonicContact CZ-OD2 2.71Å; R140-D183 IonicContact NH1-OD1 2.74Å; R140-D183 IonicContact NH1-OD2 3.15Å; R140-D183 PolarHBondContact NH1-OD2 3.34Å; R140-D183 IonicContact NH2-OD1 2.64Å; R140-D183 IonicContact NH2-OD2 2.71Å; R140-D183 PolarHBondContact NH2-OD2 2.98Å
141	S	98.3	Very high	98.5	Very high	103 Å²	103	46.6 Å²	46.6	72%	0.72	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-72.9	-11.9	178.3	56.5	0	0	0	0	115.4	R139	R139-S141 PolarHBondContact O-N 3.07Å; R139-S141 VanDerWaalsContact O-N 3.07Å
142	S	98.2	Very high	98.5	Very high	31 Å²	31	45 Å²	45	22%	0.217	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-95.4	-1.3	172.7	61.1	0	0	0	0	113.4	Y107 R139 R140	Y107-S142 PolarHBondContact OH-OG 3.48Å; R139-S142 PolarHBondContact O-N 3.3Å; R139-S142 PolarHBondContact O-OG 3.31Å; R140-S142 VanDerWaalsContact C-N 3.31Å; R140-S142 PolarHBondContact O-N 3.11Å
143	L	98.9	Very high	98.4	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	24%	0.244	C	C	.	.			trans	-111	145.3	-177.7	-64.3	170.4	0	0	0	110.8	Y107 F114 I133 W138 R140 I145	Y107-L143 HydrophobicContact CD2-CD2 3.58Å; Y107-L143 HydrophobicContact CE2-CD2 3.53Å; Y107-L143 HydrophobicContact CE2-CG 4.31Å; F114-L143 HydrophobicContact CD2-CD2 3.95Å; F114-L143 HydrophobicContact CE2-CD2 3.54Å; I133-L143 HydrophobicContact CD1-CD1 4.12Å; I133-L143 HydrophobicContact CG1-CD1 4.07Å; I133-L143 HydrophobicContact CG2-CD1 3.77Å; W138-L143 HydrophobicContact CB-CD1 4.14Å; W138-L143 HydrophobicContact CE3-CD1 4.47Å; W138-L143 HydrophobicContact CE3-CD2 4.38Å; R140-L143 PolarHBondContact NH1-O 2.94Å; R140-L143 PolarHBondContact O-N 3.2Å; L143-I145 HydrophobicContact CB-CD1 4.03Å; L143-I145 HydrophobicContact CB-CG1 4.21Å; L143-I145 HydrophobicContact CD1-CD1 4.46Å
144	V	98.9	Very high	98.3	Very high	6 Å²	6	55 Å²	55	4%	0.036	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	104.1	166.3	-177.9	0	0	0	0	107.6	L77 V79 N112 L113 F114 T146 D183	L77-V144 HydrophobicContact CD1-CG1 4.4Å; L77-V144 HydrophobicContact CD1-CG2 3.97Å; L77-V144 HydrophobicContact CD2-CG1 3.99Å; L77-V144 HydrophobicContact CG-CG1 4.5Å; V79-V144 HydrophobicContact CG1-CB 4.48Å; V79-V144 HydrophobicContact CG1-CG1 4.04Å; V79-V144 HydrophobicContact CG1-CG2 4.33Å; N112-V144 WeakPolarHBondContact O-CA 3.46Å; N112-V144 PolarHBondContact O-N 2.92Å; L113-V144 WeakPolarHBondContact CA-O 3.24Å; L113-V144 HydrophobicContact CD1-CB 4.23Å; L113-V144 HydrophobicContact CD1-CG1 3.74Å; F114-V144 PolarHBondContact N-O 2.93Å; V144-T146 HydrophobicContact CG1-CG2 4.38Å; V144-D183 WeakPolarHBondContact CA-OD2 3.47Å; V144-D183 HydrophobicContact CG1-CB 3.74Å
145	I	98.9	Very high	98.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.3	-178.9	-53.4	-56.4	0	0	0	109.3	F114 L129 I133 L143 M177 M179 V182 D183 V184	F114-I145 HydrophobicContact CB-CD1 3.92Å; F114-I145 HydrophobicContact CD2-CD1 4.13Å; F114-I145 HydrophobicContact CG-CD1 4.4Å; F114-I145 WeakPolarHBondContact O-CA 3.45Å; L129-I145 HydrophobicContact CD2-CG2 4.23Å; I133-I145 HydrophobicContact CD1-CD1 3.67Å; I133-I145 HydrophobicContact CD1-CG1 4.34Å; L143-I145 HydrophobicContact CB-CD1 4.03Å; L143-I145 HydrophobicContact CB-CG1 4.21Å; L143-I145 HydrophobicContact CD1-CD1 4.46Å; I145-M177 HydrophobicContact CG2-SD 3.98Å; I145-M179 HydrophobicContact CB-SD 4.37Å; I145-M179 HydrophobicContact CG1-CE 4.06Å; I145-M179 HydrophobicContact CG1-SD 4.1Å; I145-M179 HydrophobicContact CG2-CE 4.38Å; I145-M179 HydrophobicContact CG2-SD 4.14Å; I145-V182 HydrophobicContact CG2-CG1 4.33Å; I145-D183 PolarHBondContact N-OD2 3.25Å; I145-D183 PolarHBondContact O-N 3.17Å; I145-V184 PolarHBondContact O-N 3.43Å
146	T	98.9	Very high	98.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.1	177.3	65.3	0	0	0	0	111.1	L113 F114 D115 T116 V144 V184 F186	L113-T146 HydrophobicContact CD1-CG2 3.77Å; F114-T146 PolarHBondContact O-N 2.88Å; D115-T146 WeakPolarHBondContact CA-OG1 3.29Å; D115-T146 VanDerWaalsContact CB-OG1 3.27Å; D115-T146 WeakPolarHBondContact CB-OG1 3.49Å; D115-T146 PolarHBondContact OD1-OG1 3.27Å; T116-T146 PolarHBondContact N-O 2.93Å; V144-T146 HydrophobicContact CG1-CG2 4.38Å; T146-V184 VanDerWaalsContact CA-O 3.26Å; T146-V184 WeakPolarHBondContact CA-O 3.38Å; T146-V184 HydrophobicContact CG2-CB 3.71Å; T146-V184 HydrophobicContact CG2-CG2 3.92Å; T146-F186 HydrophobicContact CG2-CE2 3.99Å
147	T	98.9	Very high	98.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	160.3	170.4	-165.9	0	0	0	0	110.9	T116 A117 E126 L170 M177 V182 V184 F186	T116-T147 WeakPolarHBondContact O-CA 3.35Å; A117-T147 WeakPolarHBondContact CA-OG1 3.27Å; E126-T147 PolarHBondContact OE1-OG1 3.47Å; T147-L170 HydrophobicContact CG2-CD1 4.01Å; T147-M177 HydrophobicContact CG2-CE 4.14Å; T147-V182 HydrophobicContact CG2-CG1 4Å; T147-V182 HydrophobicContact CG2-CG2 4.38Å; T147-V184 PolarHBondContact N-O 3.48Å; T147-F186 PolarHBondContact O-N 3.28Å
148	K	98.9	Very high	98.4	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.009	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.8	-178	-80.2	175.9	-72.6	-75.9	0	110.9	D115 T116 A117 E118 Y120 F186 N188	D115-K148 IonicContact OD1-NZ 3.76Å; D115-K148 PolarHBondContact OD1-NZ 2.95Å; D115-K148 IonicContact OD2-NZ 3.61Å; D115-K148 PolarHBondContact OD2-NZ 3.46Å; T116-K148 PolarHBondContact O-N 3.43Å; T116-K148 PolarHBondContact O-NZ 3.39Å; A117-K148 HydrophobicContact CB-CB 3.74Å; E118-K148 PolarHBondContact N-O 3.41Å; Y120-K148 WeakPolarHBondContact OH-CE 3.34Å; K148-F186 CarbonylContact C-O 3.52Å; K148-F186 WeakPolarHBondContact CA-O 3.42Å; K148-F186 HydrophobicContact CB-CB 4.36Å; K148-F186 HydrophobicContact CG-CB 3.47Å; K148-F186 VanDerWaalsContact CG-CB 3.47Å; K148-F186 HydrophobicContact CG-CG 4.29Å; K148-N188 HydrophobicContact CB-CB 3.88Å; K148-N188 HydrophobicContact CD-CB 4.48Å; K148-N188 HydrophobicContact CG-CB 4.43Å
149	L	98.9	Very high	98.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.9	179.2	-54.9	176.5	0	0	0	111	E118 I166 L170 V185 F186 N188	E118-L149 HydrophobicContact CB-CD2 4.37Å; E118-L149 HydrophobicContact CG-CD2 4.25Å; E118-L149 VanDerWaalsContact OE1-CA 3.31Å; E118-L149 WeakPolarHBondContact OE1-CA 3.46Å; L149-I166 HydrophobicContact CD1-CG2 4.44Å; L149-I166 WeakPolarHBondContact CD1-O 3.48Å; L149-L170 HydrophobicContact CD1-CB 3.84Å; L149-V185 HydrophobicContact CD1-CG2 3.56Å; L149-V185 HydrophobicContact CG-CG2 3.92Å; L149-F186 PolarHBondContact N-O 3.02Å; L149-N188 WeakPolarHBondContact O-CB 3.42Å; L149-N188 PolarHBondContact O-N 2.85Å
150	Y	98.8	Very high	98.4	Very high	24 Å²	24	49 Å²	49	9%	0.094	26%	0.264	C	S	.	.	S	Bend	trans	-176.8	-31.9	163.1	-168.4	-83.4	0	0	0	111.6	E118 R159 G160 L161 R189 P190 D191	E118-Y150 PolarHBondContact OE1-N 2.91Å; Y150-R159 CarbonylContact O-C 3.55Å; Y150-R159 WeakPolarHBondContact O-CA 3.48Å; Y150-R159 WeakPolarHBondContact O-CB 3.36Å; Y150-G160 PolarHBondContact O-N 2.93Å; Y150-L161 HydrophobicContact CD2-CD2 4.25Å; Y150-L161 HydrophobicContact CD2-CG 4.01Å; Y150-L161 HydrophobicContact CE2-CG 4.4Å; Y150-R189 HydrophobicContact CD1-CG 3.97Å; Y150-R189 HydrophobicContact CD2-CG 3.27Å; Y150-R189 HydrophobicContact CE1-CG 4.08Å; Y150-R189 HydrophobicContact CE2-CG 3.36Å; Y150-R189 HydrophobicContact CG-CG 3.57Å; Y150-P190 WeakPolarHBondContact CE2-O 3.48Å; Y150-D191 HydrophobicContact CE2-CB 3.88Å
151	W	98.6	Very high	98.5	Very high	79 Å²	79	46.7 Å²	46.7	30%	0.299	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-129.3	85.8	-174.1	-61.5	-79.8	0	0	0	109.7	E118 V119 N188 R189	E118-W151 WeakPolarHBondContact CG-O 3.38Å; E118-W151 PolarHBondContact OE1-N 3.47Å; V119-W151 HydrophobicContact CB-CB 3.94Å; V119-W151 HydrophobicContact CB-CE3 4.44Å; V119-W151 WeakPolarHBondContact CB-O 3.26Å; V119-W151 HydrophobicContact CG1-CE3 4.15Å; V119-W151 HydrophobicContact CG2-CB 3.63Å; V119-W151 HydrophobicContact CG2-CE3 4.47Å; V119-W151 HydrophobicContact CG2-CG 4.32Å; W151-N188 HydrophobicContact CZ3-CB 4.16Å; W151-R189 VanDerWaalsContact CH2-CD 3.41Å; W151-R189 HydrophobicContact CH2-CG 3.88Å; W151-R189 HydrophobicContact CZ2-CG 4.18Å; W151-R189 HydrophobicContact CZ3-CG 4.49Å
152	G	97.8	Very high	98.5	Very high	38 Å²	38	43.1 Å²	43.1	39%	0.392	23%	0.23	S	C	.	.			trans	-96.8	-12.8	-178.8	0	0	0	0	0	114.8	E118 E158	E118-G152 VanDerWaalsContact CD-CA 3.47Å; E118-G152 PolarHBondContact OE1-N 3.1Å; E118-G152 WeakPolarHBondContact OE2-CA 3.36Å; G152-E158 WeakPolarHBondContact CA-O 3.21Å; G152-E158 PolarHBondContact N-O 2.98Å
153	G	96.7	Very high	98.5	Very high	33 Å²	33	45.9 Å²	45.9	34%	0.34	24%	0.236	S	C	.	.			trans	-173.6	-167.4	-178.1	0	0	0	0	0	114.8	E158	G153-E158 VanDerWaalsContact C-OE2 3.31Å; G153-E158 VanDerWaalsContact CA-OE2 3.25Å; G153-E158 WeakPolarHBondContact CA-OE2 3.5Å; G153-E158 PolarHBondContact N-O 3.14Å; G153-E158 VanDerWaalsContact N-O 3.07Å
154	K	97.4	Very high	98.5	Very high	202 Å²	202	50.2 Å²	50.2	88%	0.878	25%	0.254	S	S	*	.	S	Bend	trans	-93.9	-29.3	-175	-69.8	-174.9	-179.7	179.4	0	112.1	E158	K154-E158 PolarHBondContact N-OE2 3.49Å
155	A	98.3	Very high	98.5	Very high	45 Å²	45	50.1 Å²	50.1	37%	0.372	25%	0.254	S	S	.	.	S	Bend	trans	-67.1	156.1	-179.6	0	0	0	0	0	111	T157 E158	A155-T157 PolarHBondContact O-N 3.19Å; A155-E158 HydrophobicContact CB-CB 4.45Å; A155-E158 HydrophobicContact CB-CG 3.89Å; A155-E158 WeakPolarHBondContact CB-OE2 3.31Å; A155-E158 PolarHBondContact N-OE2 2.9Å; A155-E158 PolarHBondContact O-N 2.71Å
156	E	98.1	Very high	98.5	Very high	143 Å²	143	50.1 Å²	50.1	67%	0.668	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-59.1	-35.4	-177.9	-172.1	57.3	-154.6	0	0	112.1	E158 R159	E156-E158 VanDerWaalsContact C-N 3.32Å; E156-E158 PolarHBondContact O-N 2.98Å; E156-R159 WeakPolarHBondContact O-CG 3.48Å
157	T	98.4	Very high	98.5	Very high	75 Å²	75	51.2 Å²	51.2	46%	0.46	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-85.3	-1.1	-179.6	58.6	0	0	0	0	114.3	A155 R159 K164	A155-T157 PolarHBondContact O-N 3.19Å; T157-R159 VanDerWaalsContact C-N 3.32Å; T157-K164 HydrophobicContact CG2-CD 4.45Å
158	E	98.6	Very high	98.5	Very high	83 Å²	83	55.7 Å²	55.7	39%	0.388	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-98.8	23.2	179.5	-63.8	173.7	149.2	0	0	111.7	G152 G153 K154 A155 E156 H165	G152-E158 WeakPolarHBondContact CA-O 3.21Å; G152-E158 PolarHBondContact N-O 2.98Å; G153-E158 VanDerWaalsContact C-OE2 3.31Å; G153-E158 VanDerWaalsContact CA-OE2 3.25Å; G153-E158 WeakPolarHBondContact CA-OE2 3.5Å; G153-E158 PolarHBondContact N-O 3.14Å; G153-E158 VanDerWaalsContact N-O 3.07Å; K154-E158 PolarHBondContact N-OE2 3.49Å; A155-E158 HydrophobicContact CB-CB 4.45Å; A155-E158 HydrophobicContact CB-CG 3.89Å; A155-E158 WeakPolarHBondContact CB-OE2 3.31Å; A155-E158 PolarHBondContact N-OE2 2.9Å; A155-E158 PolarHBondContact O-N 2.71Å; E156-E158 VanDerWaalsContact C-N 3.32Å; E156-E158 PolarHBondContact O-N 2.98Å; E158-H165 PolarHBondContact O-CE1 2.95Å
159	R	98.3	Very high	98.5	Very high	108 Å²	108	55.9 Å²	55.9	41%	0.408	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-144.3	169.3	176.1	69.3	178.7	70.2	-177.9	6.4	112.6	Y150 E156 T157	Y150-R159 CarbonylContact O-C 3.55Å; Y150-R159 WeakPolarHBondContact O-CA 3.48Å; Y150-R159 WeakPolarHBondContact O-CB 3.36Å; E156-R159 WeakPolarHBondContact O-CG 3.48Å; T157-R159 VanDerWaalsContact C-N 3.32Å
160	G	98.7	Very high	98.5	Very high	5 Å²	5	55.9 Å²	55.9	5%	0.052	28%	0.283	C	S	.	.	S	Bend	trans	87.6	-162.2	176.9	0	0	0	0	0	112.7	Y150 H165 D191	Y150-G160 PolarHBondContact O-N 2.93Å; G160-H165 PolarHBondContact O-CD2 3.34Å; G160-D191 WeakPolarHBondContact CA-OD2 3.45Å
161	L	98.9	Very high	98.5	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-121.8	21.7	-178.9	-62.3	177.7	0	0	0	112.3	Y150 I166 A187 R189 D191 I199 W220	Y150-L161 HydrophobicContact CD2-CD2 4.25Å; Y150-L161 HydrophobicContact CD2-CG 4.01Å; Y150-L161 HydrophobicContact CE2-CG 4.4Å; L161-I166 HydrophobicContact CB-CD1 4.21Å; L161-I166 HydrophobicContact CD2-CG1 4.47Å; L161-I166 WeakPolarHBondContact O-CD1 3.42Å; L161-A187 HydrophobicContact CD1-CB 3.72Å; L161-A187 HydrophobicContact CD2-CB 3.79Å; L161-A187 HydrophobicContact CG-CB 4.44Å; L161-R189 WeakPolarHBondContact CD1-O 3.34Å; L161-D191 HydrophobicContact CB-CB 3.8Å; L161-D191 HydrophobicContact CD1-CB 3.83Å; L161-D191 HydrophobicContact CG-CB 3.8Å; L161-D191 PolarHBondContact N-OD2 2.75Å; L161-I199 HydrophobicContact CB-CD1 3.89Å; L161-I199 HydrophobicContact CB-CG1 3.82Å; L161-I199 HydrophobicContact CB-CG2 4.31Å; L161-I199 HydrophobicContact CD1-CD1 3.94Å; L161-I199 HydrophobicContact CD1-CG2 4.29Å; L161-W220 HydrophobicContact CD1-CZ2 3.71Å
162	S	98.9	Very high	98.5	Very high	29 Å²	29	57.4 Å²	57.4	20%	0.203	30%	0.296	C	S	.	.			trans	-56.1	151.2	169.1	69.2	0	0	0	0	110.6	K164 H165 I166 T194 E198	S162-K164 PolarHBondContact O-N 2.97Å; S162-H165 PolarHBondContact O-N 3.09Å; S162-H165 VanDerWaalsContact O-N 3.08Å; S162-H165 PolarHBondContact OG-N 3.41Å; S162-I166 PolarHBondContact O-N 3.41Å; S162-T194 PolarHBondContact N-OG1 3.44Å; S162-E198 WeakPolarHBondContact CA-OE1 3.18Å
163	R	98.9	Very high	98.6	Very high	89 Å²	89	55.6 Å²	55.6	34%	0.336	28%	0.278	S	S	.	.	H	α-helix	trans	-54.8	-38.1	176.3	177.7	177.5	178	76.4	5.6	111.7	I167 E198 A202 Y205	R163-I167 HydrophobicContact CG-CD1 3.71Å; R163-I167 WeakPolarHBondContact O-CB 3.33Å; R163-I167 VanDerWaalsContact O-CG1 3.29Å; R163-I167 WeakPolarHBondContact O-CG1 3.47Å; R163-I167 PolarHBondContact O-N 3.2Å; R163-I167 VanDerWaalsContact O-N 3.17Å; R163-E198 HydrophobicContact CB-CG 3.89Å; R163-E198 WeakPolarHBondContact CB-OE1 3.4Å; R163-E198 PolarHBondContact N-OE1 3.14Å; R163-A202 HydrophobicContact CB-CB 3.99Å; R163-A202 HydrophobicContact CG-CB 4.03Å; R163-Y205 VanDerWaalsContact NH2-CG 3.32Å
164	K	98.9	Very high	98.7	Very high	94 Å²	94	54.6 Å²	54.6	41%	0.409	27%	0.265	S	S	.	.	H	α-helix	trans	-57.1	-56.6	175	176.2	175.3	167.4	59.3	0	110.4	T157 S162 I167 E168	T157-K164 HydrophobicContact CG2-CD 4.45Å; S162-K164 PolarHBondContact O-N 2.97Å; K164-I167 PolarHBondContact O-N 2.9Å; K164-E168 WeakPolarHBondContact CE-OE2 3.44Å; K164-E168 WeakPolarHBondContact CG-OE2 3.37Å; K164-E168 IonicContact NZ-OE1 3.17Å; K164-E168 PolarHBondContact NZ-OE1 2.9Å; K164-E168 IonicContact NZ-OE2 2.75Å; K164-E168 PolarHBondContact NZ-OE2 3.23Å; K164-E168 WeakPolarHBondContact O-CB 3.22Å; K164-E168 WeakPolarHBondContact O-CG 3.4Å; K164-E168 PolarHBondContact O-N 3.42Å
165	H	98.9	Very high	98.8	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.019	26%	0.258	C	S	.	.	H	α-helix	trans	-67.5	-40.2	-176.4	-169.8	59.9	0	0	0	112.7	E118 E158 G160 S162 I167 E168 G169	E118-H165 IonicContact OE1-CD2 3.25Å; E118-H165 IonicContact OE1-CE1 2.83Å; E118-H165 IonicContact OE1-NE2 3.45Å; E118-H165 PolarHBondContact OE1-NE2 3.22Å; E118-H165 IonicContact OE2-CE1 2.76Å; E118-H165 IonicContact OE2-NE2 3.97Å; E118-H165 PolarHBondContact OE2-NE2 3.38Å; E158-H165 PolarHBondContact O-CE1 2.95Å; G160-H165 PolarHBondContact O-CD2 3.34Å; S162-H165 PolarHBondContact O-N 3.09Å; S162-H165 VanDerWaalsContact O-N 3.08Å; S162-H165 PolarHBondContact OG-N 3.41Å; H165-I167 VanDerWaalsContact C-N 3.33Å; H165-I167 PolarHBondContact O-N 3.49Å; H165-E168 PolarHBondContact O-N 3.37Å; H165-G169 VanDerWaalsContact O-CA 3.3Å; H165-G169 WeakPolarHBondContact O-CA 3.49Å; H165-G169 PolarHBondContact O-N 2.9Å
166	I	98.9	Very high	98.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.5	-46.3	177.6	-71.9	171	0	0	0	110.9	L149 L161 S162 L170 I199 A202 M203 V206	L149-I166 HydrophobicContact CD1-CG2 4.44Å; L149-I166 WeakPolarHBondContact CD1-O 3.48Å; L161-I166 HydrophobicContact CB-CD1 4.21Å; L161-I166 HydrophobicContact CD2-CG1 4.47Å; L161-I166 WeakPolarHBondContact O-CD1 3.42Å; S162-I166 PolarHBondContact O-N 3.41Å; I166-L170 WeakPolarHBondContact O-CB 3.22Å; I166-L170 PolarHBondContact O-N 3.41Å; I166-L170 VanDerWaalsContact O-N 3.11Å; I166-I199 HydrophobicContact CD1-CG2 4.25Å; I166-A202 HydrophobicContact CB-CB 4.09Å; I166-A202 HydrophobicContact CD1-CB 3.68Å; I166-A202 HydrophobicContact CG1-CB 4.48Å; I166-A202 HydrophobicContact CG2-CB 4.02Å; I166-M203 HydrophobicContact CD1-CE 3.99Å; I166-M203 HydrophobicContact CD1-CG 4.39Å; I166-M203 HydrophobicContact CD1-SD 4.46Å; I166-M203 HydrophobicContact CG1-CE 4.3Å; I166-M203 HydrophobicContact CG2-SD 4.11Å; I166-V206 HydrophobicContact CG2-CG1 4.2Å
167	I	98.9	Very high	98.8	Very high	23 Å²	23	46.7 Å²	46.7	12%	0.118	22%	0.22	C	C	.	.	H	α-helix	trans	-71.4	-48.4	-178.5	-64.9	170.3	0	0	0	110.7	R163 K164 H165 K171 Y205 V206	R163-I167 HydrophobicContact CG-CD1 3.71Å; R163-I167 WeakPolarHBondContact O-CB 3.33Å; R163-I167 VanDerWaalsContact O-CG1 3.29Å; R163-I167 WeakPolarHBondContact O-CG1 3.47Å; R163-I167 PolarHBondContact O-N 3.2Å; R163-I167 VanDerWaalsContact O-N 3.17Å; K164-I167 PolarHBondContact O-N 2.9Å; H165-I167 VanDerWaalsContact C-N 3.33Å; H165-I167 PolarHBondContact O-N 3.49Å; I167-K171 HydrophobicContact CG2-CD 4.34Å; I167-K171 WeakPolarHBondContact O-CB 3.47Å; I167-K171 VanDerWaalsContact O-CG 3.31Å; I167-K171 WeakPolarHBondContact O-CG 3.47Å; I167-K171 PolarHBondContact O-N 3.12Å; I167-Y205 HydrophobicContact CD1-CD1 3.58Å; I167-Y205 HydrophobicContact CD1-CE1 3.59Å; I167-Y205 HydrophobicContact CG1-CD1 3.86Å; I167-Y205 HydrophobicContact CG1-CE1 4Å; I167-Y205 HydrophobicContact CG2-CE1 4.49Å; I167-V206 HydrophobicContact CG1-CG1 4.02Å
168	E	98.9	Very high	98.8	Very high	93 Å²	93	47.3 Å²	47.3	44%	0.435	22%	0.218	S	C	.	.	H	α-helix	trans	-68.6	-45.4	-177.4	-70.1	177.3	174.3	0	0	112	K164 H165 K171 G172	K164-E168 WeakPolarHBondContact CE-OE2 3.44Å; K164-E168 WeakPolarHBondContact CG-OE2 3.37Å; K164-E168 IonicContact NZ-OE1 3.17Å; K164-E168 PolarHBondContact NZ-OE1 2.9Å; K164-E168 IonicContact NZ-OE2 2.75Å; K164-E168 PolarHBondContact NZ-OE2 3.23Å; K164-E168 WeakPolarHBondContact O-CB 3.22Å; K164-E168 WeakPolarHBondContact O-CG 3.4Å; K164-E168 PolarHBondContact O-N 3.42Å; H165-E168 PolarHBondContact O-N 3.37Å; E168-K171 PolarHBondContact O-N 3.37Å; E168-G172 PolarHBondContact O-N 2.85Å
169	G	98.9	Very high	98.8	Very high	7 Å²	7	44.7 Å²	44.7	7%	0.072	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-43	176.6	0	0	0	0	0	112.4	H165 G172 S173	H165-G169 VanDerWaalsContact O-CA 3.3Å; H165-G169 WeakPolarHBondContact O-CA 3.49Å; H165-G169 PolarHBondContact O-N 2.9Å; G169-G172 PolarHBondContact O-N 2.9Å; G169-S173 WeakPolarHBondContact O-CB 3.35Å; G169-S173 PolarHBondContact O-N 3.32Å; G169-S173 PolarHBondContact O-OG 3.38Å
170	L	98.9	Very high	98.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-42.9	175.5	-170.5	55.1	0	0	0	112	T147 L149 I166 G172 S173 L174 V182 V185 V206 M211 A212	T147-L170 HydrophobicContact CG2-CD1 4.01Å; L149-L170 HydrophobicContact CD1-CB 3.84Å; I166-L170 WeakPolarHBondContact O-CB 3.22Å; I166-L170 PolarHBondContact O-N 3.41Å; I166-L170 VanDerWaalsContact O-N 3.11Å; L170-G172 VanDerWaalsContact C-N 3.32Å; L170-G172 PolarHBondContact O-N 3.26Å; L170-S173 WeakPolarHBondContact O-CB 3.36Å; L170-S173 PolarHBondContact O-N 2.79Å; L170-L174 HydrophobicContact CD1-CG 4.28Å; L170-L174 HydrophobicContact CG-CD1 4.12Å; L170-L174 HydrophobicContact CG-CG 4.34Å; L170-L174 WeakPolarHBondContact O-CB 3.23Å; L170-L174 WeakPolarHBondContact O-CG 3.22Å; L170-L174 PolarHBondContact O-N 3.3Å; L170-V182 HydrophobicContact CD1-CG2 4.05Å; L170-V185 HydrophobicContact CD1-CB 4.35Å; L170-V185 HydrophobicContact CD1-CG2 3.97Å; L170-V185 HydrophobicContact CD2-CB 4.43Å; L170-V185 HydrophobicContact CD2-CG2 4.31Å; L170-V206 HydrophobicContact CD2-CB 3.7Å; L170-V206 HydrophobicContact CD2-CG1 4.01Å; L170-V206 HydrophobicContact CD2-CG2 3.85Å; L170-M211 HydrophobicContact CB-CE 3.9Å; L170-M211 HydrophobicContact CD2-CB 3.8Å; L170-M211 HydrophobicContact CD2-CE 3.9Å; L170-M211 HydrophobicContact CG-CB 4.47Å; L170-M211 HydrophobicContact CG-CE 3.82Å; L170-A212 HydrophobicContact CD2-CB 4.42Å
171	K	98.9	Very high	98.9	Very high	119 Å²	119	49.7 Å²	49.7	52%	0.517	23%	0.231	S	C	.	.	H	α-helix	trans	-57.4	-46.3	174.8	-77.1	179.8	179.6	-177.7	0	111.5	I167 E168 S173 L174 Q175 M211	I167-K171 HydrophobicContact CG2-CD 4.34Å; I167-K171 WeakPolarHBondContact O-CB 3.47Å; I167-K171 VanDerWaalsContact O-CG 3.31Å; I167-K171 WeakPolarHBondContact O-CG 3.47Å; I167-K171 PolarHBondContact O-N 3.12Å; E168-K171 PolarHBondContact O-N 3.37Å; K171-S173 VanDerWaalsContact C-N 3.33Å; K171-S173 PolarHBondContact O-N 2.95Å; K171-L174 PolarHBondContact O-N 2.83Å; K171-Q175 WeakPolarHBondContact O-CB 3.39Å; K171-Q175 PolarHBondContact O-N 3.46Å; K171-M211 HydrophobicContact CB-CE 4.37Å; K171-M211 HydrophobicContact CG-CE 3.45Å; K171-M211 VanDerWaalsContact CG-CE 3.45Å; K171-M211 HydrophobicContact CG-SD 4.48Å
172	G	98.9	Very high	98.9	Very high	15 Å²	15	49.7 Å²	49.7	16%	0.155	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-41.1	176.4	0	0	0	0	0	112.5	E168 G169 L170 Q175 R176	E168-G172 PolarHBondContact O-N 2.85Å; G169-G172 PolarHBondContact O-N 2.9Å; L170-G172 VanDerWaalsContact C-N 3.32Å; L170-G172 PolarHBondContact O-N 3.26Å; G172-Q175 PolarHBondContact O-N 2.62Å; G172-R176 WeakPolarHBondContact O-CG 3.49Å; G172-R176 PolarHBondContact O-N 2.81Å
173	S	98.9	Very high	98.9	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-46.8	177.6	-58.2	0	0	0	0	112.1	E126 G169 L170 K171 Q175 R176 M177	E126-S173 VanDerWaalsContact OE1-CB 3.25Å; E126-S173 WeakPolarHBondContact OE1-CB 3.46Å; E126-S173 PolarHBondContact OE1-OG 3.28Å; E126-S173 WeakPolarHBondContact OE2-CA 3.15Å; G169-S173 WeakPolarHBondContact O-CB 3.35Å; G169-S173 PolarHBondContact O-N 3.32Å; G169-S173 PolarHBondContact O-OG 3.38Å; L170-S173 WeakPolarHBondContact O-CB 3.36Å; L170-S173 PolarHBondContact O-N 2.79Å; K171-S173 VanDerWaalsContact C-N 3.33Å; K171-S173 PolarHBondContact O-N 2.95Å; S173-Q175 VanDerWaalsContact C-N 3.35Å; S173-Q175 PolarHBondContact O-N 2.89Å; S173-R176 PolarHBondContact O-N 3.29Å; S173-R176 PolarHBondContact OG-NH2 3.11Å; S173-R176 VanDerWaalsContact OG-NH2 3.1Å; S173-M177 WeakPolarHBondContact O-CE 3.5Å; S173-M177 WeakPolarHBondContact O-CG 3.29Å; S173-M177 PolarHBondContact O-N 3.2Å
174	L	98.9	Very high	98.9	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.068	21%	0.209	C	C	.	.	H	α-helix	trans	-61.6	-41.4	176.3	-72.5	174.3	0	0	0	112.2	L170 K171 M177 Q178 M179 V182 M211	L170-L174 HydrophobicContact CD1-CG 4.28Å; L170-L174 HydrophobicContact CG-CD1 4.12Å; L170-L174 HydrophobicContact CG-CG 4.34Å; L170-L174 WeakPolarHBondContact O-CB 3.23Å; L170-L174 WeakPolarHBondContact O-CG 3.22Å; L170-L174 PolarHBondContact O-N 3.3Å; K171-L174 PolarHBondContact O-N 2.83Å; L174-M177 CarbonylContact O-C 3.59Å; L174-M177 PolarHBondContact O-N 3.47Å; L174-Q178 PolarHBondContact O-N 2.93Å; L174-M179 WeakPolarHBondContact CB-O 3.48Å; L174-M179 HydrophobicContact CD2-CB 4.3Å; L174-M179 PolarHBondContact O-N 3.24Å; L174-V182 HydrophobicContact CD2-CG1 4Å; L174-M211 HydrophobicContact CD1-CB 3.85Å; L174-M211 HydrophobicContact CD1-CE 4.03Å; L174-M211 HydrophobicContact CD1-CG 4.19Å
175	Q	98.9	Very high	98.9	Very high	158 Å²	158	40.3 Å²	40.3	74%	0.738	19%	0.19	S	C	*	.	H	α-helix	trans	-61.1	-46.9	174.8	-174.7	-179	11.6	0	0	111.5	K171 G172 S173 M177 Q178	K171-Q175 WeakPolarHBondContact O-CB 3.39Å; K171-Q175 PolarHBondContact O-N 3.46Å; G172-Q175 PolarHBondContact O-N 2.62Å; S173-Q175 VanDerWaalsContact C-N 3.35Å; S173-Q175 PolarHBondContact O-N 2.89Å; Q175-M177 PolarHBondContact O-N 2.93Å; Q175-Q178 PolarHBondContact O-N 3.21Å
176	R	98.8	Very high	98.9	Very high	63 Å²	63	40.1 Å²	40.1	24%	0.238	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-43.2	177	-74.6	-174.4	-62.9	-95.2	1.6	111.9	E126 I127 G172 S173 Q178	E126-R176 HydrophobicContact CB-CB 3.95Å; E126-R176 IonicContact OE2-CZ 2.79Å; E126-R176 IonicContact OE2-NE 2.75Å; E126-R176 PolarHBondContact OE2-NE 2.96Å; E126-R176 IonicContact OE2-NH2 2.71Å; E126-R176 PolarHBondContact OE2-NH2 3.11Å; I127-R176 WeakPolarHBondContact CA-O 3.39Å; I127-R176 HydrophobicContact CD1-CG 4.32Å; I127-R176 HydrophobicContact CG1-CB 3.79Å; I127-R176 HydrophobicContact CG1-CG 3.9Å; G172-R176 WeakPolarHBondContact O-CG 3.49Å; G172-R176 PolarHBondContact O-N 2.81Å; S173-R176 PolarHBondContact O-N 3.29Å; S173-R176 PolarHBondContact OG-NH2 3.11Å; S173-R176 VanDerWaalsContact OG-NH2 3.1Å; R176-Q178 VanDerWaalsContact C-N 3.26Å; R176-Q178 PolarHBondContact O-N 3.26Å
177	M	98.8	Very high	98.9	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-75.6	-10.9	178.3	-70.1	-174	-78.4	0	0	114	T116 E126 L129 G130 I145 T147 S173 L174 Q175 M179 V182	T116-M177 HydrophobicContact CG2-SD 3.99Å; E126-M177 HydrophobicContact CB-CG 3.73Å; E126-M177 HydrophobicContact CG-CG 4.13Å; E126-M177 HydrophobicContact CG-SD 4.35Å; E126-M177 WeakPolarHBondContact O-CG 3.24Å; L129-M177 HydrophobicContact CD2-SD 4.08Å; G130-M177 WeakPolarHBondContact CA-O 3.36Å; I145-M177 HydrophobicContact CG2-SD 3.98Å; T147-M177 HydrophobicContact CG2-CE 4.14Å; S173-M177 WeakPolarHBondContact O-CE 3.5Å; S173-M177 WeakPolarHBondContact O-CG 3.29Å; S173-M177 PolarHBondContact O-N 3.2Å; L174-M177 CarbonylContact O-C 3.59Å; L174-M177 PolarHBondContact O-N 3.47Å; Q175-M177 PolarHBondContact O-N 2.93Å; M177-M179 VanDerWaalsContact C-N 3.33Å; M177-M179 HydrophobicContact CB-CB 4.45Å; M177-M179 HydrophobicContact CB-CE 4.32Å; M177-M179 HydrophobicContact CB-CG 4.07Å; M177-M179 HydrophobicContact CB-SD 4.24Å; M177-V182 HydrophobicContact CE-CG1 3.55Å; M177-V182 HydrophobicContact SD-CG1 4.46Å
178	Q	98.8	Very high	98.9	Very high	89 Å²	89	39.1 Å²	39.1	42%	0.416	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	45.5	-173.4	-58.9	164.8	76.8	0	0	112.1	N131 K134 L174 Q175 R176	N131-Q178 PolarHBondContact OD1-NE2 2.86Å; K134-Q178 VanDerWaalsContact CD-OE1 3.26Å; L174-Q178 PolarHBondContact O-N 2.93Å; Q175-Q178 PolarHBondContact O-N 3.21Å; R176-Q178 VanDerWaalsContact C-N 3.26Å; R176-Q178 PolarHBondContact O-N 3.26Å
179	M	98.4	Very high	98.8	Very high	27 Å²	27	39.6 Å²	39.6	13%	0.133	18%	0.182	C	C	.	.			trans	-127.9	152.7	-178.7	-63.7	-176.5	-168.9	0	0	111.6	I133 I145 L174 M177	I133-M179 HydrophobicContact CB-CE 4.36Å; I133-M179 HydrophobicContact CD1-CE 3.28Å; I133-M179 HydrophobicContact CG1-CE 4.4Å; I133-M179 HydrophobicContact CG2-CE 4.26Å; I145-M179 HydrophobicContact CB-SD 4.37Å; I145-M179 HydrophobicContact CG1-CE 4.06Å; I145-M179 HydrophobicContact CG1-SD 4.1Å; I145-M179 HydrophobicContact CG2-CE 4.38Å; I145-M179 HydrophobicContact CG2-SD 4.14Å; L174-M179 WeakPolarHBondContact CB-O 3.48Å; L174-M179 HydrophobicContact CD2-CB 4.3Å; L174-M179 PolarHBondContact O-N 3.24Å; M177-M179 VanDerWaalsContact C-N 3.33Å; M177-M179 HydrophobicContact CB-CB 4.45Å; M177-M179 HydrophobicContact CB-CE 4.32Å; M177-M179 HydrophobicContact CB-CG 4.07Å; M177-M179 HydrophobicContact CB-SD 4.24Å
180	E	98.7	Very high	98.8	Very high	170 Å²	170	40.4 Å²	40.4	79%	0.794	19%	0.186	S	C	*	.	S	Bend	trans	-78.9	-32.3	172.7	-63.8	179.8	170.8	0	0	111.9
181	Y	98.9	Very high	98.8	Very high	48 Å²	48	41.2 Å²	41.2	19%	0.188	19%	0.19	C	C	.	.			trans	-150.3	156	-179	67.3	-91.5	0	0	0	113.4	R140 G210 M211 M213	R140-Y181 HydrophobicContact CG-CE1 4.36Å; R140-Y181 VanDerWaalsContact NH2-CD2 3.26Å; R140-Y181 PolarHBondContact NH2-O 3.4Å; Y181-G210 VanDerWaalsContact CB-O 3.25Å; Y181-G210 WeakPolarHBondContact CB-O 3.45Å; Y181-M211 VanDerWaalsContact CA-O 3.25Å; Y181-M211 WeakPolarHBondContact CA-O 3.47Å; Y181-M213 HydrophobicContact CD1-CE 4Å; Y181-M213 HydrophobicContact CD2-CE 3.54Å; Y181-M213 HydrophobicContact CD2-CG 3.87Å; Y181-M213 HydrophobicContact CE1-CE 3.84Å; Y181-M213 HydrophobicContact CE2-CE 3.36Å; Y181-M213 HydrophobicContact CE2-CG 4.04Å; Y181-M213 HydrophobicContact CG-CE 3.86Å
182	V	98.9	Very high	98.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	154.4	161.6	-66.4	0	0	0	0	110.4	I145 T147 L170 L174 M177 V185 M211 A212 M213	I145-V182 HydrophobicContact CG2-CG1 4.33Å; T147-V182 HydrophobicContact CG2-CG1 4Å; T147-V182 HydrophobicContact CG2-CG2 4.38Å; L170-V182 HydrophobicContact CD1-CG2 4.05Å; L174-V182 HydrophobicContact CD2-CG1 4Å; M177-V182 HydrophobicContact CE-CG1 3.55Å; M177-V182 HydrophobicContact SD-CG1 4.46Å; V182-V185 HydrophobicContact CG2-CB 4.05Å; V182-M211 PolarHBondContact N-O 3Å; V182-M211 VanDerWaalsContact N-O 3.14Å; V182-A212 HydrophobicContact CG2-CB 3.94Å; V182-A212 CarbonylContact O-C 3.56Å; V182-A212 WeakPolarHBondContact O-CA 3.45Å; V182-M213 PolarHBondContact O-N 3.18Å
183	D	98.9	Very high	98.7	Very high	15 Å²	15	46.8 Å²	46.8	8%	0.08	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-40.4	175.9	-62.8	-89.8	0	0	0	110.7	R140 V144 I145 M213 Y214	R140-D183 IonicContact CZ-OD2 2.71Å; R140-D183 IonicContact NH1-OD1 2.74Å; R140-D183 IonicContact NH1-OD2 3.15Å; R140-D183 PolarHBondContact NH1-OD2 3.34Å; R140-D183 IonicContact NH2-OD1 2.64Å; R140-D183 IonicContact NH2-OD2 2.71Å; R140-D183 PolarHBondContact NH2-OD2 2.98Å; V144-D183 WeakPolarHBondContact CA-OD2 3.47Å; V144-D183 HydrophobicContact CG1-CB 3.74Å; I145-D183 PolarHBondContact N-OD2 3.25Å; I145-D183 PolarHBondContact O-N 3.17Å; D183-M213 WeakPolarHBondContact O-CB 3.23Å; D183-Y214 WeakPolarHBondContact O-CD2 3.34Å; D183-Y214 PolarHBondContact O-N 2.73Å
184	V	98.9	Very high	98.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	124.2	174.7	-164.3	0	0	0	0	110.5	L72 L77 I145 T146 T147 F186 Y214	L72-V184 HydrophobicContact CD2-CG2 4.12Å; L77-V184 HydrophobicContact CD2-CG2 3.77Å; I145-V184 PolarHBondContact O-N 3.43Å; T146-V184 VanDerWaalsContact CA-O 3.26Å; T146-V184 WeakPolarHBondContact CA-O 3.38Å; T146-V184 HydrophobicContact CG2-CB 3.71Å; T146-V184 HydrophobicContact CG2-CG2 3.92Å; T147-V184 PolarHBondContact N-O 3.48Å; V184-F186 HydrophobicContact CB-CD2 4.24Å; V184-F186 HydrophobicContact CB-CE2 3.76Å; V184-F186 HydrophobicContact CB-CZ 4.33Å; V184-F186 HydrophobicContact CG1-CD2 3.89Å; V184-F186 HydrophobicContact CG1-CE1 4.27Å; V184-F186 HydrophobicContact CG1-CE2 3.51Å; V184-F186 HydrophobicContact CG1-CG 4.43Å; V184-F186 HydrophobicContact CG1-CZ 3.72Å; V184-Y214 WeakPolarHBondContact CA-O 3.27Å
185	V	98.9	Very high	98.7	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.6	165.3	62.4	0	0	0	0	109.7	L149 L170 V182 M203 V206 A212 Y214 W215 G216	L149-V185 HydrophobicContact CD1-CG2 3.56Å; L149-V185 HydrophobicContact CG-CG2 3.92Å; L170-V185 HydrophobicContact CD1-CB 4.35Å; L170-V185 HydrophobicContact CD1-CG2 3.97Å; L170-V185 HydrophobicContact CD2-CB 4.43Å; L170-V185 HydrophobicContact CD2-CG2 4.31Å; V182-V185 HydrophobicContact CG2-CB 4.05Å; V185-M203 HydrophobicContact CG1-SD 3.91Å; V185-V206 HydrophobicContact CG1-CG2 4.16Å; V185-A212 HydrophobicContact CB-CB 4.1Å; V185-A212 HydrophobicContact CG1-CB 3.64Å; V185-Y214 PolarHBondContact N-O 2.75Å; V185-Y214 VanDerWaalsContact N-O 3.07Å; V185-W215 HydrophobicContact CG1-CB 3.85Å; V185-W215 CarbonylContact O-C 3.53Å; V185-W215 WeakPolarHBondContact O-CA 3.45Å; V185-W215 WeakPolarHBondContact O-CB 3.41Å; V185-G216 PolarHBondContact O-N 2.71Å
186	F	98.9	Very high	98.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	139.8	-178.6	-77.5	-85.4	0	0	0	111.7	T146 T147 K148 L149 V184 N188 G216 T217 C242 Q244 M271	T146-F186 HydrophobicContact CG2-CE2 3.99Å; T147-F186 PolarHBondContact O-N 3.28Å; K148-F186 CarbonylContact C-O 3.52Å; K148-F186 WeakPolarHBondContact CA-O 3.42Å; K148-F186 HydrophobicContact CB-CB 4.36Å; K148-F186 HydrophobicContact CG-CB 3.47Å; K148-F186 VanDerWaalsContact CG-CB 3.47Å; K148-F186 HydrophobicContact CG-CG 4.29Å; L149-F186 PolarHBondContact N-O 3.02Å; V184-F186 HydrophobicContact CB-CD2 4.24Å; V184-F186 HydrophobicContact CB-CE2 3.76Å; V184-F186 HydrophobicContact CB-CZ 4.33Å; V184-F186 HydrophobicContact CG1-CD2 3.89Å; V184-F186 HydrophobicContact CG1-CE1 4.27Å; V184-F186 HydrophobicContact CG1-CE2 3.51Å; V184-F186 HydrophobicContact CG1-CG 4.43Å; V184-F186 HydrophobicContact CG1-CZ 3.72Å; F186-N188 PolarHBondContact O-N 3.41Å; F186-G216 VanDerWaalsContact CA-O 3.3Å; F186-G216 WeakPolarHBondContact CA-O 3.3Å; F186-T217 VanDerWaalsContact CD1-O 3.25Å; F186-T217 WeakPolarHBondContact CD1-O 3.42Å; F186-C242 HydrophobicContact CE1-CB 4.04Å; F186-C242 HydrophobicContact CZ-CB 4.11Å; F186-Q244 HydrophobicContact CD1-CB 4.28Å; F186-Q244 HydrophobicContact CE1-CB 4.08Å; F186-M271 HydrophobicContact CE2-CE 4.49Å; F186-M271 HydrophobicContact CE2-SD 4.38Å; F186-M271 HydrophobicContact CZ-CE 4.24Å; F186-M271 HydrophobicContact CZ-SD 4.24Å
187	A	98.9	Very high	98.7	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	113.3	157.1	0	0	0	0	0	108.7	L161 R189 M203 G216 S218 W220	L161-A187 HydrophobicContact CD1-CB 3.72Å; L161-A187 HydrophobicContact CD2-CB 3.79Å; L161-A187 HydrophobicContact CG-CB 4.44Å; A187-R189 VanDerWaalsContact C-N 3.27Å; A187-R189 PolarHBondContact O-N 3.01Å; A187-M203 HydrophobicContact CB-CE 3.97Å; A187-G216 PolarHBondContact N-O 3.02Å; A187-S218 VanDerWaalsContact O-CB 3.31Å; A187-S218 WeakPolarHBondContact O-CB 3.23Å; A187-S218 PolarHBondContact O-N 3.39Å; A187-W220 HydrophobicContact CB-CZ2 3.9Å
188	N	98.6	Very high	98.7	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.016	25%	0.25	C	C	.	.	S	Bend	trans	-64	-31.2	-170.2	-157.9	-23.1	0	0	0	113.5	K148 L149 W151 F186 S218	K148-N188 HydrophobicContact CB-CB 3.88Å; K148-N188 HydrophobicContact CD-CB 4.48Å; K148-N188 HydrophobicContact CG-CB 4.43Å; L149-N188 WeakPolarHBondContact O-CB 3.42Å; L149-N188 PolarHBondContact O-N 2.85Å; W151-N188 HydrophobicContact CZ3-CB 4.16Å; F186-N188 PolarHBondContact O-N 3.41Å; N188-S218 CarbonylContact C-O 3.55Å; N188-S218 WeakPolarHBondContact O-CB 3.45Å; N188-S218 VanDerWaalsContact O-O 3.07Å; N188-S218 PolarHBondContact O-OG 2.83Å
189	R	98.5	Very high	98.7	Very high	103 Å²	103	44.4 Å²	44.4	39%	0.389	23%	0.231	S	C	.	.	S	Bend	trans	-155.1	168.2	176.1	60.2	168.1	-75.4	155.7	0.1	109.7	Y150 W151 L161 A187 S218 W220	Y150-R189 HydrophobicContact CD1-CG 3.97Å; Y150-R189 HydrophobicContact CD2-CG 3.27Å; Y150-R189 HydrophobicContact CE1-CG 4.08Å; Y150-R189 HydrophobicContact CE2-CG 3.36Å; Y150-R189 HydrophobicContact CG-CG 3.57Å; W151-R189 VanDerWaalsContact CH2-CD 3.41Å; W151-R189 HydrophobicContact CH2-CG 3.88Å; W151-R189 HydrophobicContact CZ2-CG 4.18Å; W151-R189 HydrophobicContact CZ3-CG 4.49Å; L161-R189 WeakPolarHBondContact CD1-O 3.34Å; A187-R189 VanDerWaalsContact C-N 3.27Å; A187-R189 PolarHBondContact O-N 3.01Å; R189-S218 VanDerWaalsContact CA-O 3.22Å; R189-S218 WeakPolarHBondContact CA-O 3.41Å; R189-S218 PolarHBondContact N-O 3.1Å; R189-W220 PolarHBondContact O-NE1 2.93Å
190	P	98.5	Very high	98.7	Very high	24 Å²	24	43.1 Å²	43.1	16%	0.156	22%	0.224	C	C	.	.			trans	-63.4	152	169.3	-21.1	33	0	0	0	112.1	Y150 W220 E224	Y150-P190 WeakPolarHBondContact CE2-O 3.48Å; P190-W220 VanDerWaalsContact CD-CD1 3.49Å; P190-W220 HydrophobicContact CG-CB 4.4Å; P190-W220 HydrophobicContact CG-CG 3.92Å; P190-E224 VanDerWaalsContact CB-OE1 3.31Å; P190-E224 WeakPolarHBondContact CB-OE1 3.28Å
191	D	98.6	Very high	98.7	Very high	17 Å²	17	39.5 Å²	39.5	9%	0.091	20%	0.204	C	C	.	.			trans	-121.6	110.5	172.2	-174.5	1.8	0	0	0	109.7	Y150 G160 L161 N193 T194	Y150-D191 HydrophobicContact CE2-CB 3.88Å; G160-D191 WeakPolarHBondContact CA-OD2 3.45Å; L161-D191 HydrophobicContact CB-CB 3.8Å; L161-D191 HydrophobicContact CD1-CB 3.83Å; L161-D191 HydrophobicContact CG-CB 3.8Å; L161-D191 PolarHBondContact N-OD2 2.75Å; D191-N193 PolarHBondContact O-N 2.9Å; D191-N193 WeakPolarHBondContact OD1-CB 3.49Å; D191-N193 PolarHBondContact OD1-N 2.56Å; D191-T194 WeakPolarHBondContact OD2-CB 3.33Å; D191-T194 PolarHBondContact OD2-OG1 2.89Å
192	S	97.2	Very high	98.7	Very high	116 Å²	116	37.2 Å²	37.2	81%	0.811	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-12.1	178.4	55.7	0	0	0	0	113.5
193	N	98.4	Very high	98.7	Very high	135 Å²	135	37.2 Å²	37.2	72%	0.722	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-10.5	-175.2	-61.3	-20.6	0	0	0	112.8	D191	D191-N193 PolarHBondContact O-N 2.9Å; D191-N193 WeakPolarHBondContact OD1-CB 3.49Å; D191-N193 PolarHBondContact OD1-N 2.56Å
194	T	98.8	Very high	98.7	Very high	17 Å²	17	36.9 Å²	36.9	10%	0.104	19%	0.193	C	C	.	.	S	Bend	trans	-114.5	125.8	179	-55.7	0	0	0	0	109.9	S162 D191 E198 I199	S162-T194 PolarHBondContact N-OG1 3.44Å; D191-T194 WeakPolarHBondContact OD2-CB 3.33Å; D191-T194 PolarHBondContact OD2-OG1 2.89Å; T194-E198 HydrophobicContact CG2-CB 3.98Å; T194-E198 HydrophobicContact CG2-CG 4.11Å; T194-I199 HydrophobicContact CG2-CD1 4.35Å; T194-I199 HydrophobicContact CG2-CG1 3.68Å
195	P	98.8	Very high	98.7	Very high	85 Å²	85	40.5 Å²	40.5	55%	0.552	21%	0.207	S	C	*	.			trans	-59.3	142.1	176.3	-24.1	34.1	0	0	0	112.8	E197 E198 I199	P195-E197 PolarHBondContact O-N 2.99Å; P195-E198 WeakPolarHBondContact O-CB 3.47Å; P195-E198 PolarHBondContact O-N 3.22Å; P195-I199 PolarHBondContact O-N 3.45Å
196	M	98.9	Very high	98.7	Very high	18 Å²	18	40.5 Å²	40.5	9%	0.089	21%	0.207	C	C	.	.	H	α-helix	trans	-54.7	-39.3	-179	-171	59.3	70.2	0	0	113.1	E198 I199 V200 W220 E224 E227 A228 V231	M196-E198 VanDerWaalsContact C-N 3.32Å; M196-E198 PolarHBondContact O-N 2.86Å; M196-I199 PolarHBondContact O-N 3.16Å; M196-V200 HydrophobicContact CG-CG2 4.21Å; M196-V200 WeakPolarHBondContact O-CG2 3.3Å; M196-V200 PolarHBondContact O-N 2.9Å; M196-V200 HydrophobicContact SD-CG2 4.17Å; M196-W220 HydrophobicContact CE-CE3 4.22Å; M196-W220 HydrophobicContact CE-CH2 3.66Å; M196-W220 HydrophobicContact CE-CZ3 3.28Å; M196-W220 HydrophobicContact SD-CH2 3.56Å; M196-W220 VanDerWaalsContact SD-CH2 3.56Å; M196-W220 HydrophobicContact SD-CZ3 3.48Å; M196-W220 WeakPolarHBondContact SD-CZ3 3.36Å; M196-E224 HydrophobicContact CE-CB 4.35Å; M196-E227 HydrophobicContact CB-CG 4.23Å; M196-E227 WeakPolarHBondContact CB-OE1 3.25Å; M196-E227 HydrophobicContact CE-CB 4.25Å; M196-E227 HydrophobicContact CE-CG 4.35Å; M196-E227 WeakPolarHBondContact CE-OE2 3.49Å; M196-E227 HydrophobicContact CG-CB 4.44Å; M196-E227 HydrophobicContact CG-CG 3.93Å; M196-A228 HydrophobicContact CG-CB 4.46Å; M196-A228 HydrophobicContact SD-CB 3.78Å; M196-V231 HydrophobicContact CB-CG2 4.2Å; M196-V231 HydrophobicContact CG-CB 4.44Å; M196-V231 HydrophobicContact CG-CG2 3.85Å
197	E	98.9	Very high	98.7	Very high	76 Å²	76	41.6 Å²	41.6	36%	0.355	21%	0.213	S	C	.	.	H	α-helix	trans	-57	-44.6	176.5	-172.5	-177.4	160.1	0	0	112.4	P195 V200 R201 V231 F235	P195-E197 PolarHBondContact O-N 2.99Å; E197-V200 PolarHBondContact O-N 2.87Å; E197-R201 HydrophobicContact CG-CG 4.39Å; E197-R201 WeakPolarHBondContact O-CB 3.09Å; E197-R201 VanDerWaalsContact O-CG 3.26Å; E197-R201 WeakPolarHBondContact O-CG 3.46Å; E197-R201 PolarHBondContact O-N 3.29Å; E197-R201 IonicContact OE1-CZ 3.68Å; E197-R201 IonicContact OE1-NE 2.84Å; E197-R201 PolarHBondContact OE1-NE 2.77Å; E197-R201 IonicContact OE1-NH2 2.76Å; E197-R201 PolarHBondContact OE1-NH2 2.83Å; E197-V231 HydrophobicContact CB-CG1 4.26Å; E197-V231 HydrophobicContact CG-CG1 4.37Å; E197-F235 HydrophobicContact CG-CD2 4.15Å; E197-F235 HydrophobicContact CG-CE2 3.96Å
198	E	98.9	Very high	98.7	Very high	75 Å²	75	47 Å²	47	35%	0.35	24%	0.242	S	C	.	.	H	α-helix	trans	-64.5	-44.2	178.9	-176.2	176.5	149.5	0	0	111.1	S162 R163 T194 P195 M196 R201 A202	S162-E198 WeakPolarHBondContact CA-OE1 3.18Å; R163-E198 HydrophobicContact CB-CG 3.89Å; R163-E198 WeakPolarHBondContact CB-OE1 3.4Å; R163-E198 PolarHBondContact N-OE1 3.14Å; T194-E198 HydrophobicContact CG2-CB 3.98Å; T194-E198 HydrophobicContact CG2-CG 4.11Å; P195-E198 WeakPolarHBondContact O-CB 3.47Å; P195-E198 PolarHBondContact O-N 3.22Å; M196-E198 VanDerWaalsContact C-N 3.32Å; M196-E198 PolarHBondContact O-N 2.86Å; E198-R201 PolarHBondContact O-N 3.28Å; E198-A202 VanDerWaalsContact O-CB 3.27Å; E198-A202 WeakPolarHBondContact O-CB 3.35Å; E198-A202 PolarHBondContact O-N 2.87Å
199	I	98.9	Very high	98.8	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-52.7	178.1	-58.1	173.9	0	0	0	110	L161 I166 T194 P195 M196 R201 A202 M203 W220	L161-I199 HydrophobicContact CB-CD1 3.89Å; L161-I199 HydrophobicContact CB-CG1 3.82Å; L161-I199 HydrophobicContact CB-CG2 4.31Å; L161-I199 HydrophobicContact CD1-CD1 3.94Å; L161-I199 HydrophobicContact CD1-CG2 4.29Å; I166-I199 HydrophobicContact CD1-CG2 4.25Å; T194-I199 HydrophobicContact CG2-CD1 4.35Å; T194-I199 HydrophobicContact CG2-CG1 3.68Å; P195-I199 PolarHBondContact O-N 3.45Å; M196-I199 PolarHBondContact O-N 3.16Å; I199-R201 PolarHBondContact O-N 2.84Å; I199-A202 PolarHBondContact O-N 3.38Å; I199-M203 HydrophobicContact CG2-CG 4.48Å; I199-M203 WeakPolarHBondContact O-CG 3.3Å; I199-M203 PolarHBondContact O-N 3.08Å; I199-W220 HydrophobicContact CD1-CH2 4.28Å; I199-W220 HydrophobicContact CG2-CH2 4.21Å; I199-W220 HydrophobicContact CG2-CZ2 4.49Å
200	V	98.9	Very high	98.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-38.4	-177.2	178.5	0	0	0	0	111.3	M196 E197 T204 W215 A228 V231 A232 L237	M196-V200 HydrophobicContact CG-CG2 4.21Å; M196-V200 WeakPolarHBondContact O-CG2 3.3Å; M196-V200 PolarHBondContact O-N 2.9Å; M196-V200 HydrophobicContact SD-CG2 4.17Å; E197-V200 PolarHBondContact O-N 2.87Å; V200-T204 VanDerWaalsContact O-CB 3.24Å; V200-T204 WeakPolarHBondContact O-CB 3.26Å; V200-T204 PolarHBondContact O-N 3.48Å; V200-T204 PolarHBondContact O-OG1 2.97Å; V200-W215 HydrophobicContact CG1-CZ2 4.27Å; V200-W215 HydrophobicContact CG2-CH2 4.03Å; V200-W215 HydrophobicContact CG2-CZ2 4.05Å; V200-A228 HydrophobicContact CG2-CB 4Å; V200-V231 HydrophobicContact CB-CG1 3.76Å; V200-V231 HydrophobicContact CG1-CG1 4.06Å; V200-V231 HydrophobicContact CG2-CB 4.29Å; V200-V231 HydrophobicContact CG2-CG1 3.89Å; V200-A232 HydrophobicContact CG1-CB 4.02Å; V200-L237 HydrophobicContact CB-CD1 4.35Å; V200-L237 HydrophobicContact CG1-CB 3.91Å; V200-L237 HydrophobicContact CG1-CD1 3.79Å
201	R	98.9	Very high	98.8	Very high	95 Å²	95	49.1 Å²	49.1	36%	0.358	27%	0.266	S	S	.	.	H	α-helix	trans	-65.3	-38.7	173.9	-75.5	-176.9	-174.5	-70	-0.9	112.3	E197 E198 I199 Y205 L237	E197-R201 HydrophobicContact CG-CG 4.39Å; E197-R201 WeakPolarHBondContact O-CB 3.09Å; E197-R201 VanDerWaalsContact O-CG 3.26Å; E197-R201 WeakPolarHBondContact O-CG 3.46Å; E197-R201 PolarHBondContact O-N 3.29Å; E197-R201 IonicContact OE1-CZ 3.68Å; E197-R201 IonicContact OE1-NE 2.84Å; E197-R201 PolarHBondContact OE1-NE 2.77Å; E197-R201 IonicContact OE1-NH2 2.76Å; E197-R201 PolarHBondContact OE1-NH2 2.83Å; E198-R201 PolarHBondContact O-N 3.28Å; I199-R201 PolarHBondContact O-N 2.84Å; R201-Y205 VanDerWaalsContact O-CB 3.25Å; R201-Y205 WeakPolarHBondContact O-CB 3.16Å; R201-Y205 PolarHBondContact O-N 3.12Å; R201-L237 HydrophobicContact CB-CD1 4.42Å; R201-L237 HydrophobicContact CG-CD1 3.47Å; R201-L237 VanDerWaalsContact CG-CD1 3.47Å; R201-L237 HydrophobicContact CG-CD2 4.22Å
202	A	98.9	Very high	98.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.9	-45.1	177.3	0	0	0	0	0	111.9	R163 I166 E198 I199 Y205 V206	R163-A202 HydrophobicContact CB-CB 3.99Å; R163-A202 HydrophobicContact CG-CB 4.03Å; I166-A202 HydrophobicContact CB-CB 4.09Å; I166-A202 HydrophobicContact CD1-CB 3.68Å; I166-A202 HydrophobicContact CG1-CB 4.48Å; I166-A202 HydrophobicContact CG2-CB 4.02Å; E198-A202 VanDerWaalsContact O-CB 3.27Å; E198-A202 WeakPolarHBondContact O-CB 3.35Å; E198-A202 PolarHBondContact O-N 2.87Å; I199-A202 PolarHBondContact O-N 3.38Å; A202-Y205 WeakPolarHBondContact O-CB 3.36Å; A202-Y205 PolarHBondContact O-N 3.26Å; A202-V206 PolarHBondContact O-N 2.9Å
203	M	98.9	Very high	98.9	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.7	-43.9	174.5	-69	-63.8	-173	0	0	111.8	I166 V185 A187 I199 Y205 V206 I207 W215	I166-M203 HydrophobicContact CD1-CE 3.99Å; I166-M203 HydrophobicContact CD1-CG 4.39Å; I166-M203 HydrophobicContact CD1-SD 4.46Å; I166-M203 HydrophobicContact CG1-CE 4.3Å; I166-M203 HydrophobicContact CG2-SD 4.11Å; V185-M203 HydrophobicContact CG1-SD 3.91Å; A187-M203 HydrophobicContact CB-CE 3.97Å; I199-M203 HydrophobicContact CG2-CG 4.48Å; I199-M203 WeakPolarHBondContact O-CG 3.3Å; I199-M203 PolarHBondContact O-N 3.08Å; M203-Y205 VanDerWaalsContact C-N 3.32Å; M203-Y205 PolarHBondContact O-N 3.24Å; M203-V206 WeakPolarHBondContact O-CG2 3.16Å; M203-V206 PolarHBondContact O-N 2.95Å; M203-I207 WeakPolarHBondContact O-CG1 3.41Å; M203-I207 PolarHBondContact O-N 3.19Å; M203-W215 HydrophobicContact CB-CB 4.14Å; M203-W215 HydrophobicContact CB-CD2 3.62Å; M203-W215 HydrophobicContact CB-CE3 4.02Å; M203-W215 HydrophobicContact CB-CG 3.69Å; M203-W215 HydrophobicContact CE-CE3 4.38Å; M203-W215 HydrophobicContact CG-CB 4.38Å; M203-W215 HydrophobicContact CG-CD2 3.77Å; M203-W215 HydrophobicContact CG-CE3 3.61Å; M203-W215 HydrophobicContact CG-CG 4.15Å; M203-W215 HydrophobicContact CG-CZ3 4.09Å; M203-W215 HydrophobicContact SD-CB 4.12Å; M203-W215 HydrophobicContact SD-CD2 4.49Å; M203-W215 HydrophobicContact SD-CE3 4.21Å
204	T	99	Very high	98.9	Very high	8 Å²	8	43.9 Å²	43.9	5%	0.049	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-41.4	174.3	-64	0	0	0	0	111.8	V200 I207 N208 L237 I238	V200-T204 VanDerWaalsContact O-CB 3.24Å; V200-T204 WeakPolarHBondContact O-CB 3.26Å; V200-T204 PolarHBondContact O-N 3.48Å; V200-T204 PolarHBondContact O-OG1 2.97Å; T204-I207 PolarHBondContact O-N 3.01Å; T204-N208 WeakPolarHBondContact O-CB 3.34Å; T204-N208 VanDerWaalsContact O-CG 3.31Å; T204-N208 PolarHBondContact O-N 3.2Å; T204-N208 PolarHBondContact O-ND2 2.59Å; T204-L237 HydrophobicContact CG2-CB 4.27Å; T204-L237 HydrophobicContact CG2-CD2 4.08Å; T204-L237 WeakPolarHBondContact OG1-CB 3.33Å; T204-I238 HydrophobicContact CG2-CB 4.39Å; T204-I238 HydrophobicContact CG2-CD1 4.04Å; T204-I238 HydrophobicContact CG2-CG1 3.93Å; T204-I238 PolarHBondContact OG1-N 3.2Å
205	Y	98.9	Very high	98.9	Very high	76 Å²	76	43.1 Å²	43.1	30%	0.298	22%	0.217	S	C	.	.	H	α-helix	trans	-61.1	-49.3	178	171.9	-92.7	0	0	0	112	R163 I167 R201 A202 M203 I207 N208 Q209	R163-Y205 VanDerWaalsContact NH2-CG 3.32Å; I167-Y205 HydrophobicContact CD1-CD1 3.58Å; I167-Y205 HydrophobicContact CD1-CE1 3.59Å; I167-Y205 HydrophobicContact CG1-CD1 3.86Å; I167-Y205 HydrophobicContact CG1-CE1 4Å; I167-Y205 HydrophobicContact CG2-CE1 4.49Å; R201-Y205 VanDerWaalsContact O-CB 3.25Å; R201-Y205 WeakPolarHBondContact O-CB 3.16Å; R201-Y205 PolarHBondContact O-N 3.12Å; A202-Y205 WeakPolarHBondContact O-CB 3.36Å; A202-Y205 PolarHBondContact O-N 3.26Å; M203-Y205 VanDerWaalsContact C-N 3.32Å; M203-Y205 PolarHBondContact O-N 3.24Å; Y205-I207 PolarHBondContact O-N 3.47Å; Y205-N208 PolarHBondContact O-N 2.89Å; Y205-N208 VanDerWaalsContact O-N 3.15Å; Y205-Q209 HydrophobicContact CD1-CG 4.1Å; Y205-Q209 HydrophobicContact CD2-CG 4.22Å; Y205-Q209 HydrophobicContact CE1-CG 3.63Å; Y205-Q209 HydrophobicContact CE2-CG 3.78Å; Y205-Q209 HydrophobicContact CG-CG 4.37Å; Y205-Q209 VanDerWaalsContact CZ-CG 3.45Å; Y205-Q209 VanDerWaalsContact O-CG 3.31Å; Y205-Q209 WeakPolarHBondContact O-CG 3.41Å; Y205-Q209 PolarHBondContact O-N 2.72Å
206	V	98.9	Very high	98.9	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.3	-29.4	-178.8	-63.6	0	0	0	0	112.5	I166 I167 L170 V185 A202 M203 G210 M211 A212	I166-V206 HydrophobicContact CG2-CG1 4.2Å; I167-V206 HydrophobicContact CG1-CG1 4.02Å; L170-V206 HydrophobicContact CD2-CB 3.7Å; L170-V206 HydrophobicContact CD2-CG1 4.01Å; L170-V206 HydrophobicContact CD2-CG2 3.85Å; V185-V206 HydrophobicContact CG1-CG2 4.16Å; A202-V206 PolarHBondContact O-N 2.9Å; M203-V206 WeakPolarHBondContact O-CG2 3.16Å; M203-V206 PolarHBondContact O-N 2.95Å; V206-G210 PolarHBondContact O-N 2.65Å; V206-M211 HydrophobicContact CB-CB 4.28Å; V206-M211 HydrophobicContact CB-SD 4.41Å; V206-M211 HydrophobicContact CG1-CE 4.43Å; V206-M211 HydrophobicContact CG1-SD 4.25Å; V206-M211 WeakPolarHBondContact O-CB 3.35Å; V206-M211 PolarHBondContact O-N 2.93Å; V206-A212 PolarHBondContact O-N 3.45Å
207	I	98.9	Very high	98.9	Very high	23 Å²	23	38.2 Å²	38.2	12%	0.118	19%	0.187	C	C	.	.	H	α-helix	trans	-67.9	-49.1	171.1	-66.4	166.8	0	0	0	111	M203 T204 Y205 Q209 G210 A212 W215 I238	M203-I207 WeakPolarHBondContact O-CG1 3.41Å; M203-I207 PolarHBondContact O-N 3.19Å; T204-I207 PolarHBondContact O-N 3.01Å; Y205-I207 PolarHBondContact O-N 3.47Å; I207-Q209 PolarHBondContact O-N 2.75Å; I207-G210 WeakPolarHBondContact O-CA 3.36Å; I207-G210 PolarHBondContact O-N 3.39Å; I207-A212 WeakPolarHBondContact CA-O 3.45Å; I207-A212 HydrophobicContact CG1-CB 4.15Å; I207-W215 HydrophobicContact CD1-CB 4.08Å; I207-W215 HydrophobicContact CD1-CG 4.18Å; I207-I238 HydrophobicContact CB-CD1 3.94Å; I207-I238 HydrophobicContact CD1-CB 4.44Å; I207-I238 HydrophobicContact CD1-CD1 4.2Å; I207-I238 HydrophobicContact CD1-CG2 3.96Å; I207-I238 HydrophobicContact CG2-CD1 3.57Å
208	N	98.9	Very high	98.9	Very high	114 Å²	114	34.6 Å²	34.6	61%	0.61	17%	0.17	S	C	*	.	H	α-helix	trans	-64.2	-24	179.1	-71.3	-18.8	0	0	0	113.2	T204 Y205 G210	T204-N208 WeakPolarHBondContact O-CB 3.34Å; T204-N208 VanDerWaalsContact O-CG 3.31Å; T204-N208 PolarHBondContact O-N 3.2Å; T204-N208 PolarHBondContact O-ND2 2.59Å; Y205-N208 PolarHBondContact O-N 2.89Å; Y205-N208 VanDerWaalsContact O-N 3.15Å; N208-G210 VanDerWaalsContact C-N 3.26Å
209	Q	98.9	Very high	98.9	Very high	110 Å²	110	36.4 Å²	36.4	51%	0.514	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-0.5	171.9	-67.6	-59.6	-68.4	0	0	113.5	Y205 I207 M211	Y205-Q209 HydrophobicContact CD1-CG 4.1Å; Y205-Q209 HydrophobicContact CD2-CG 4.22Å; Y205-Q209 HydrophobicContact CE1-CG 3.63Å; Y205-Q209 HydrophobicContact CE2-CG 3.78Å; Y205-Q209 HydrophobicContact CG-CG 4.37Å; Y205-Q209 VanDerWaalsContact CZ-CG 3.45Å; Y205-Q209 VanDerWaalsContact O-CG 3.31Å; Y205-Q209 WeakPolarHBondContact O-CG 3.41Å; Y205-Q209 PolarHBondContact O-N 2.72Å; I207-Q209 PolarHBondContact O-N 2.75Å; Q209-M211 VanDerWaalsContact C-N 3.27Å; Q209-M211 HydrophobicContact CB-CG 4.18Å; Q209-M211 HydrophobicContact CB-SD 4.24Å; Q209-M211 PolarHBondContact O-N 3.28Å
210	G	98.8	Very high	98.9	Very high	43 Å²	43	36.4 Å²	36.4	44%	0.443	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	15.7	-179.1	0	0	0	0	0	114.2	Y181 V206 I207 N208	Y181-G210 VanDerWaalsContact CB-O 3.25Å; Y181-G210 WeakPolarHBondContact CB-O 3.45Å; V206-G210 PolarHBondContact O-N 2.65Å; I207-G210 WeakPolarHBondContact O-CA 3.36Å; I207-G210 PolarHBondContact O-N 3.39Å; N208-G210 VanDerWaalsContact C-N 3.26Å
211	M	98.9	Very high	98.9	Very high	21 Å²	21	39.6 Å²	39.6	10%	0.103	19%	0.193	C	C	.	.	S	Bend	trans	-83.6	-20.5	178	-62.5	170.9	60.9	0	0	112.5	L170 K171 L174 Y181 V182 V206 Q209	L170-M211 HydrophobicContact CB-CE 3.9Å; L170-M211 HydrophobicContact CD2-CB 3.8Å; L170-M211 HydrophobicContact CD2-CE 3.9Å; L170-M211 HydrophobicContact CG-CB 4.47Å; L170-M211 HydrophobicContact CG-CE 3.82Å; K171-M211 HydrophobicContact CB-CE 4.37Å; K171-M211 HydrophobicContact CG-CE 3.45Å; K171-M211 VanDerWaalsContact CG-CE 3.45Å; K171-M211 HydrophobicContact CG-SD 4.48Å; L174-M211 HydrophobicContact CD1-CB 3.85Å; L174-M211 HydrophobicContact CD1-CE 4.03Å; L174-M211 HydrophobicContact CD1-CG 4.19Å; Y181-M211 VanDerWaalsContact CA-O 3.25Å; Y181-M211 WeakPolarHBondContact CA-O 3.47Å; V182-M211 PolarHBondContact N-O 3Å; V182-M211 VanDerWaalsContact N-O 3.14Å; V206-M211 HydrophobicContact CB-CB 4.28Å; V206-M211 HydrophobicContact CB-SD 4.41Å; V206-M211 HydrophobicContact CG1-CE 4.43Å; V206-M211 HydrophobicContact CG1-SD 4.25Å; V206-M211 WeakPolarHBondContact O-CB 3.35Å; V206-M211 PolarHBondContact O-N 2.93Å; Q209-M211 VanDerWaalsContact C-N 3.27Å; Q209-M211 HydrophobicContact CB-CG 4.18Å; Q209-M211 HydrophobicContact CB-SD 4.24Å; Q209-M211 PolarHBondContact O-N 3.28Å
212	A	98.9	Very high	98.8	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.008	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	150.3	172.5	0	0	0	0	0	110.2	L170 V182 V185 V206 I207	L170-A212 HydrophobicContact CD2-CB 4.42Å; V182-A212 HydrophobicContact CG2-CB 3.94Å; V182-A212 CarbonylContact O-C 3.56Å; V182-A212 WeakPolarHBondContact O-CA 3.45Å; V185-A212 HydrophobicContact CB-CB 4.1Å; V185-A212 HydrophobicContact CG1-CB 3.64Å; V206-A212 PolarHBondContact O-N 3.45Å; I207-A212 WeakPolarHBondContact CA-O 3.45Å; I207-A212 HydrophobicContact CG1-CB 4.15Å
213	M	98.9	Very high	98.8	Very high	87 Å²	87	43.3 Å²	43.3	43%	0.429	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-39.6	173.5	-62.1	-67.5	177.9	0	0	111.7	Y181 V182 D183	Y181-M213 HydrophobicContact CD1-CE 4Å; Y181-M213 HydrophobicContact CD2-CE 3.54Å; Y181-M213 HydrophobicContact CD2-CG 3.87Å; Y181-M213 HydrophobicContact CE1-CE 3.84Å; Y181-M213 HydrophobicContact CE2-CE 3.36Å; Y181-M213 HydrophobicContact CE2-CG 4.04Å; Y181-M213 HydrophobicContact CG-CE 3.86Å; V182-M213 PolarHBondContact O-N 3.18Å; D183-M213 WeakPolarHBondContact O-CB 3.23Å
214	Y	98.9	Very high	98.8	Very high	70 Å²	70	45.6 Å²	45.6	28%	0.275	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	171.5	178.8	-53.9	-86.5	0	0	0	110.3	L77 D183 V184 V185 V241	L77-Y214 HydrophobicContact CB-CD2 4.42Å; L77-Y214 HydrophobicContact CB-CE2 3.89Å; L77-Y214 HydrophobicContact CD1-CE2 4.38Å; L77-Y214 HydrophobicContact CD2-CD2 4.01Å; L77-Y214 HydrophobicContact CD2-CE2 4.19Å; L77-Y214 HydrophobicContact CG-CE2 4.38Å; D183-Y214 WeakPolarHBondContact O-CD2 3.34Å; D183-Y214 PolarHBondContact O-N 2.73Å; V184-Y214 WeakPolarHBondContact CA-O 3.27Å; V185-Y214 PolarHBondContact N-O 2.75Å; V185-Y214 VanDerWaalsContact N-O 3.07Å; Y214-V241 HydrophobicContact CD1-CG1 3.78Å; Y214-V241 HydrophobicContact CD1-CG2 4.39Å; Y214-V241 HydrophobicContact CG-CG1 4.41Å; Y214-V241 HydrophobicContact CG-CG2 4.24Å
215	W	98.9	Very high	98.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	160.9	167.3	77.9	-75.9	0	0	0	112.1	V185 V200 M203 I207 T217 A228 I238 P239 P240 V241	V185-W215 HydrophobicContact CG1-CB 3.85Å; V185-W215 CarbonylContact O-C 3.53Å; V185-W215 WeakPolarHBondContact O-CA 3.45Å; V185-W215 WeakPolarHBondContact O-CB 3.41Å; V200-W215 HydrophobicContact CG1-CZ2 4.27Å; V200-W215 HydrophobicContact CG2-CH2 4.03Å; V200-W215 HydrophobicContact CG2-CZ2 4.05Å; M203-W215 HydrophobicContact CB-CB 4.14Å; M203-W215 HydrophobicContact CB-CD2 3.62Å; M203-W215 HydrophobicContact CB-CE3 4.02Å; M203-W215 HydrophobicContact CB-CG 3.69Å; M203-W215 HydrophobicContact CE-CE3 4.38Å; M203-W215 HydrophobicContact CG-CB 4.38Å; M203-W215 HydrophobicContact CG-CD2 3.77Å; M203-W215 HydrophobicContact CG-CE3 3.61Å; M203-W215 HydrophobicContact CG-CG 4.15Å; M203-W215 HydrophobicContact CG-CZ3 4.09Å; M203-W215 HydrophobicContact SD-CB 4.12Å; M203-W215 HydrophobicContact SD-CD2 4.49Å; M203-W215 HydrophobicContact SD-CE3 4.21Å; I207-W215 HydrophobicContact CD1-CB 4.08Å; I207-W215 HydrophobicContact CD1-CG 4.18Å; W215-T217 HydrophobicContact CZ3-CG2 3.93Å; W215-A228 HydrophobicContact CH2-CB 3.94Å; W215-I238 PolarHBondContact NE1-O 3.25Å; W215-P239 VanDerWaalsContact NE1-C 3.3Å; W215-P239 PolarHBondContact NE1-O 3.37Å; W215-P240 HydrophobicContact CD2-CB 3.98Å; W215-P240 HydrophobicContact CE3-CB 4.03Å; W215-P240 HydrophobicContact CH2-CB 3.89Å; W215-P240 HydrophobicContact CH2-CG 3.96Å; W215-P240 HydrophobicContact CZ2-CB 3.83Å; W215-P240 VanDerWaalsContact CZ2-CD 3.4Å; W215-P240 HydrophobicContact CZ2-CG 3.93Å; W215-P240 HydrophobicContact CZ3-CB 3.98Å; W215-P240 HydrophobicContact CZ3-CG 4.47Å; W215-P240 WeakPolarHBondContact O-CA 3.49Å; W215-V241 PolarHBondContact O-N 3.22Å
216	G	98.9	Very high	98.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	176.4	177.7	0	0	0	0	0	112.9	V185 F186 A187 C242	V185-G216 PolarHBondContact O-N 2.71Å; F186-G216 VanDerWaalsContact CA-O 3.3Å; F186-G216 WeakPolarHBondContact CA-O 3.3Å; A187-G216 PolarHBondContact N-O 3.02Å; G216-C242 CarbonylContact C-O 3.57Å; G216-C242 WeakPolarHBondContact CA-O 3.31Å
217	T	98.9	Very high	98.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	160	178.1	56.7	0	0	0	0	110.3	F186 W215 W220 I225 P240 C242 E243 Q244	F186-T217 VanDerWaalsContact CD1-O 3.25Å; F186-T217 WeakPolarHBondContact CD1-O 3.42Å; W215-T217 HydrophobicContact CZ3-CG2 3.93Å; T217-W220 HydrophobicContact CG2-CB 4.5Å; T217-W220 HydrophobicContact CG2-CD2 3.53Å; T217-W220 HydrophobicContact CG2-CE3 3.52Å; T217-W220 HydrophobicContact CG2-CG 3.97Å; T217-W220 HydrophobicContact CG2-CH2 4.41Å; T217-W220 HydrophobicContact CG2-CZ2 4.4Å; T217-W220 HydrophobicContact CG2-CZ3 3.97Å; T217-I225 HydrophobicContact CG2-CG1 4.42Å; T217-P240 HydrophobicContact CG2-CB 4.25Å; T217-P240 HydrophobicContact CG2-CG 4.45Å; T217-C242 PolarHBondContact N-O 3.25Å; T217-E243 WeakPolarHBondContact CB-OE2 3.39Å; T217-E243 CarbonylContact O-C 3.42Å; T217-E243 WeakPolarHBondContact O-CA 3.42Å; T217-E243 VanDerWaalsContact O-OE2 3.08Å; T217-E243 PolarHBondContact OG1-OE2 3.21Å; T217-Q244 PolarHBondContact O-N 3.15Å
218	S	98.8	Very high	98.8	Very high	1 Å²	1	48 Å²	48	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	129.1	173	157.9	0	0	0	0	108.9	A187 N188 R189 W220 E243 Q244	A187-S218 VanDerWaalsContact O-CB 3.31Å; A187-S218 WeakPolarHBondContact O-CB 3.23Å; A187-S218 PolarHBondContact O-N 3.39Å; N188-S218 CarbonylContact C-O 3.55Å; N188-S218 WeakPolarHBondContact O-CB 3.45Å; N188-S218 VanDerWaalsContact O-O 3.07Å; N188-S218 PolarHBondContact O-OG 2.83Å; R189-S218 VanDerWaalsContact CA-O 3.22Å; R189-S218 WeakPolarHBondContact CA-O 3.41Å; R189-S218 PolarHBondContact N-O 3.1Å; S218-W220 PolarHBondContact O-N 2.92Å; S218-E243 WeakPolarHBondContact CA-OE2 3.37Å; S218-E243 PolarHBondContact N-OE2 3.32Å; S218-Q244 WeakPolarHBondContact CA-O 3.28Å
219	R	98.4	Very high	98.8	Very high	112 Å²	112	44.9 Å²	44.9	42%	0.423	23%	0.225	S	C	.	.	S	Bend	trans	66.6	14.2	-177	-50.3	168.6	-178.7	-176.4	-0.7	114.2	E243 Q244 W273	R219-E243 PolarHBondContact N-OE1 2.92Å; R219-Q244 PolarHBondContact N-O 2.64Å; R219-W273 HydrophobicContact CG-CZ2 4.26Å
220	W	98.7	Very high	98.8	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.011	22%	0.223	C	C	.	.			trans	-80.8	142.9	177.8	-73.1	35	0	0	0	111.1	L161 A187 R189 P190 M196 I199 T217 S218 E224 I225 A228 E243 K254	L161-W220 HydrophobicContact CD1-CZ2 3.71Å; A187-W220 HydrophobicContact CB-CZ2 3.9Å; R189-W220 PolarHBondContact O-NE1 2.93Å; P190-W220 VanDerWaalsContact CD-CD1 3.49Å; P190-W220 HydrophobicContact CG-CB 4.4Å; P190-W220 HydrophobicContact CG-CG 3.92Å; M196-W220 HydrophobicContact CE-CE3 4.22Å; M196-W220 HydrophobicContact CE-CH2 3.66Å; M196-W220 HydrophobicContact CE-CZ3 3.28Å; M196-W220 HydrophobicContact SD-CH2 3.56Å; M196-W220 VanDerWaalsContact SD-CH2 3.56Å; M196-W220 HydrophobicContact SD-CZ3 3.48Å; M196-W220 WeakPolarHBondContact SD-CZ3 3.36Å; I199-W220 HydrophobicContact CD1-CH2 4.28Å; I199-W220 HydrophobicContact CG2-CH2 4.21Å; I199-W220 HydrophobicContact CG2-CZ2 4.49Å; T217-W220 HydrophobicContact CG2-CB 4.5Å; T217-W220 HydrophobicContact CG2-CD2 3.53Å; T217-W220 HydrophobicContact CG2-CE3 3.52Å; T217-W220 HydrophobicContact CG2-CG 3.97Å; T217-W220 HydrophobicContact CG2-CH2 4.41Å; T217-W220 HydrophobicContact CG2-CZ2 4.4Å; T217-W220 HydrophobicContact CG2-CZ3 3.97Å; S218-W220 PolarHBondContact O-N 2.92Å; W220-E224 HydrophobicContact CB-CB 4.35Å; W220-E224 HydrophobicContact CD2-CB 4.26Å; W220-E224 HydrophobicContact CE3-CB 3.61Å; W220-E224 HydrophobicContact CZ3-CB 4.24Å; W220-I225 HydrophobicContact CB-CD1 4.21Å; W220-I225 HydrophobicContact CB-CG1 3.76Å; W220-A228 HydrophobicContact CZ3-CB 4.08Å; W220-E243 PolarHBondContact N-OE1 2.95Å; W220-K254 WeakPolarHBondContact O-CE 3.48Å; W220-K254 PolarHBondContact O-NZ 3.2Å
221	T	98.6	Very high	98.8	Very high	67 Å²	67	41.4 Å²	41.4	41%	0.411	21%	0.206	S	C	.	.			trans	-66	158.6	171.4	65.2	0	0	0	0	110.6	M223 E224 I225	T221-M223 PolarHBondContact O-N 3.1Å; T221-E224 WeakPolarHBondContact CB-OE2 3.25Å; T221-E224 WeakPolarHBondContact CG2-OE2 3.38Å; T221-E224 PolarHBondContact N-OE2 2.91Å; T221-E224 PolarHBondContact O-N 3.31Å; T221-E224 VanDerWaalsContact OG1-CD 3.3Å; T221-E224 VanDerWaalsContact OG1-CG 3.28Å; T221-E224 WeakPolarHBondContact OG1-CG 3.45Å; T221-E224 PolarHBondContact OG1-N 2.75Å; T221-E224 PolarHBondContact OG1-OE2 2.98Å; T221-I225 WeakPolarHBondContact O-CG1 3.5Å; T221-I225 PolarHBondContact O-N 3Å; T221-I225 VanDerWaalsContact O-N 3.11Å
222	A	98.1	Very high	98.8	Very high	25 Å²	25	40.5 Å²	40.5	21%	0.207	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-28.6	175.2	0	0	0	0	0	113	M226 Q258 L262	A222-M226 WeakPolarHBondContact O-CB 3.4Å; A222-M226 PolarHBondContact O-N 2.86Å; A222-M226 VanDerWaalsContact O-N 3.11Å; A222-Q258 HydrophobicContact CB-CB 4.18Å; A222-L262 HydrophobicContact CB-CD1 3.96Å; A222-L262 HydrophobicContact CB-CD2 4.36Å; A222-L262 HydrophobicContact CB-CG 4.31Å
223	M	98.6	Very high	98.8	Very high	149 Å²	149	47.7 Å²	47.7	73%	0.734	23%	0.228	S	C	*	.	H	α-helix	trans	-65.9	-51.6	175	-171.5	-146.3	-61.3	0	0	111.2	T221 I225 M226 E227	T221-M223 PolarHBondContact O-N 3.1Å; M223-I225 VanDerWaalsContact C-N 3.3Å; M223-I225 PolarHBondContact O-N 2.71Å; M223-M226 CarbonylContact O-C 3.56Å; M223-M226 WeakPolarHBondContact O-CB 3.1Å; M223-M226 PolarHBondContact O-N 3.44Å; M223-M226 VanDerWaalsContact O-N 3.11Å; M223-E227 PolarHBondContact O-N 3.44Å
224	E	98.9	Very high	98.8	Very high	47 Å²	47	50 Å²	50	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-36.9	-179.7	-67.9	159.8	140.9	0	0	111.6	P190 M196 W220 T221 M226 E227 A228	P190-E224 VanDerWaalsContact CB-OE1 3.31Å; P190-E224 WeakPolarHBondContact CB-OE1 3.28Å; M196-E224 HydrophobicContact CE-CB 4.35Å; W220-E224 HydrophobicContact CB-CB 4.35Å; W220-E224 HydrophobicContact CD2-CB 4.26Å; W220-E224 HydrophobicContact CE3-CB 3.61Å; W220-E224 HydrophobicContact CZ3-CB 4.24Å; T221-E224 WeakPolarHBondContact CB-OE2 3.25Å; T221-E224 WeakPolarHBondContact CG2-OE2 3.38Å; T221-E224 PolarHBondContact N-OE2 2.91Å; T221-E224 PolarHBondContact O-N 3.31Å; T221-E224 VanDerWaalsContact OG1-CD 3.3Å; T221-E224 VanDerWaalsContact OG1-CG 3.28Å; T221-E224 WeakPolarHBondContact OG1-CG 3.45Å; T221-E224 PolarHBondContact OG1-N 2.75Å; T221-E224 PolarHBondContact OG1-OE2 2.98Å; E224-M226 VanDerWaalsContact C-N 3.34Å; E224-E227 WeakPolarHBondContact O-CB 3.41Å; E224-E227 PolarHBondContact O-N 3.49Å; E224-A228 PolarHBondContact O-N 2.74Å
225	I	98.9	Very high	98.8	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-41.2	175.2	-62	165	0	0	0	110.7	T217 W220 T221 M223 A228 Y229 E243 L262 I266 V268	T217-I225 HydrophobicContact CG2-CG1 4.42Å; W220-I225 HydrophobicContact CB-CD1 4.21Å; W220-I225 HydrophobicContact CB-CG1 3.76Å; T221-I225 WeakPolarHBondContact O-CG1 3.5Å; T221-I225 PolarHBondContact O-N 3Å; T221-I225 VanDerWaalsContact O-N 3.11Å; M223-I225 VanDerWaalsContact C-N 3.3Å; M223-I225 PolarHBondContact O-N 2.71Å; I225-A228 PolarHBondContact O-N 3.42Å; I225-Y229 PolarHBondContact O-N 3.01Å; I225-E243 HydrophobicContact CD1-CB 3.88Å; I225-E243 HydrophobicContact CD1-CG 3.89Å; I225-L262 HydrophobicContact CB-CD1 4.18Å; I225-L262 HydrophobicContact CD1-CD1 3.73Å; I225-L262 HydrophobicContact CG2-CD1 4.12Å; I225-I266 HydrophobicContact CG2-CD1 4.01Å; I225-V268 HydrophobicContact CG2-CG1 4.42Å; I225-V268 HydrophobicContact CG2-CG2 4.02Å
226	M	98.8	Very high	98.8	Very high	66 Å²	66	57.3 Å²	57.3	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-68.1	-35.9	175.6	-172.5	61.4	65.4	0	0	111.8	A222 M223 E224 Y229 S230 L262 K265 I266	A222-M226 WeakPolarHBondContact O-CB 3.4Å; A222-M226 PolarHBondContact O-N 2.86Å; A222-M226 VanDerWaalsContact O-N 3.11Å; M223-M226 CarbonylContact O-C 3.56Å; M223-M226 WeakPolarHBondContact O-CB 3.1Å; M223-M226 PolarHBondContact O-N 3.44Å; M223-M226 VanDerWaalsContact O-N 3.11Å; E224-M226 VanDerWaalsContact C-N 3.34Å; M226-Y229 WeakPolarHBondContact O-CB 3.3Å; M226-Y229 PolarHBondContact O-N 3.49Å; M226-Y229 HydrophobicContact SD-CD1 4.22Å; M226-S230 WeakPolarHBondContact O-CB 3.49Å; M226-S230 PolarHBondContact O-N 3.2Å; M226-L262 HydrophobicContact CE-CD2 3.96Å; M226-K265 HydrophobicContact CE-CB 4.45Å; M226-K265 HydrophobicContact CE-CD 4.42Å; M226-I266 HydrophobicContact CE-CD1 4.26Å; M226-I266 HydrophobicContact CE-CG1 4.45Å; M226-I266 HydrophobicContact CE-CG2 3.77Å; M226-I266 HydrophobicContact SD-CG2 3.85Å
227	E	98.9	Very high	98.8	Very high	93 Å²	93	58.6 Å²	58.6	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-47.3	173.8	-168.2	-167.6	176.2	0	0	110.9	M196 M223 E224 Y229 S230 V231	M196-E227 HydrophobicContact CB-CG 4.23Å; M196-E227 WeakPolarHBondContact CB-OE1 3.25Å; M196-E227 HydrophobicContact CE-CB 4.25Å; M196-E227 HydrophobicContact CE-CG 4.35Å; M196-E227 WeakPolarHBondContact CE-OE2 3.49Å; M196-E227 HydrophobicContact CG-CB 4.44Å; M196-E227 HydrophobicContact CG-CG 3.93Å; M223-E227 PolarHBondContact O-N 3.44Å; E224-E227 WeakPolarHBondContact O-CB 3.41Å; E224-E227 PolarHBondContact O-N 3.49Å; E227-Y229 VanDerWaalsContact C-N 3.29Å; E227-Y229 PolarHBondContact O-N 3.01Å; E227-S230 WeakPolarHBondContact O-CB 3.32Å; E227-S230 PolarHBondContact O-N 2.91Å; E227-S230 VanDerWaalsContact O-N 3.1Å; E227-V231 WeakPolarHBondContact O-CG2 3.35Å; E227-V231 PolarHBondContact O-N 3.42Å
228	A	98.9	Very high	98.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57.3	-42.8	173.7	0	0	0	0	0	112.2	M196 V200 W215 W220 E224 I225 A232 P240	M196-A228 HydrophobicContact CG-CB 4.46Å; M196-A228 HydrophobicContact SD-CB 3.78Å; V200-A228 HydrophobicContact CG2-CB 4Å; W215-A228 HydrophobicContact CH2-CB 3.94Å; W220-A228 HydrophobicContact CZ3-CB 4.08Å; E224-A228 PolarHBondContact O-N 2.74Å; I225-A228 PolarHBondContact O-N 3.42Å; A228-A232 WeakPolarHBondContact O-CB 3.29Å; A228-A232 PolarHBondContact O-N 3.24Å; A228-P240 HydrophobicContact CB-CG 4.31Å
229	Y	98.9	Very high	98.8	Very high	47 Å²	47	62.4 Å²	62.4	18%	0.184	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-43.9	174.4	-178.2	-93.5	0	0	0	112	I225 M226 E227 A232 R233 P239 I266	I225-Y229 PolarHBondContact O-N 3.01Å; M226-Y229 WeakPolarHBondContact O-CB 3.3Å; M226-Y229 PolarHBondContact O-N 3.49Å; M226-Y229 HydrophobicContact SD-CD1 4.22Å; E227-Y229 VanDerWaalsContact C-N 3.29Å; E227-Y229 PolarHBondContact O-N 3.01Å; Y229-A232 PolarHBondContact O-N 3.25Å; Y229-R233 HydrophobicContact CD1-CG 4.06Å; Y229-R233 HydrophobicContact CE1-CG 3.64Å; Y229-R233 HydrophobicContact CE2-CG 4.4Å; Y229-R233 WeakPolarHBondContact O-CG 3.34Å; Y229-R233 PolarHBondContact O-N 2.93Å; Y229-R233 PolarHBondContact OH-NE 3.3Å; Y229-R233 PolarHBondContact OH-NH2 3.39Å; Y229-P239 HydrophobicContact CD2-CB 3.77Å; Y229-P239 HydrophobicContact CD2-CG 4.49Å; Y229-P239 HydrophobicContact CE2-CB 4.3Å; Y229-I266 HydrophobicContact CD1-CB 4.29Å; Y229-I266 HydrophobicContact CD1-CG2 3.51Å; Y229-I266 HydrophobicContact CD2-CB 3.68Å; Y229-I266 HydrophobicContact CD2-CD1 4.22Å; Y229-I266 HydrophobicContact CD2-CG2 3.86Å; Y229-I266 HydrophobicContact CE1-CB 4.3Å; Y229-I266 HydrophobicContact CE1-CG2 3.5Å; Y229-I266 HydrophobicContact CE2-CB 3.7Å; Y229-I266 HydrophobicContact CE2-CG2 3.85Å; Y229-I266 HydrophobicContact CG-CB 3.97Å; Y229-I266 HydrophobicContact CG-CD1 4.11Å; Y229-I266 HydrophobicContact CG-CG2 3.67Å
230	S	98.9	Very high	98.8	Very high	67 Å²	67	57.3 Å²	57.3	47%	0.469	29%	0.288	S	S	.	.	H	α-helix	trans	-60.2	-49.7	178.7	-173.8	0	0	0	0	111.3	M226 E227 A232 R233 Q234	M226-S230 WeakPolarHBondContact O-CB 3.49Å; M226-S230 PolarHBondContact O-N 3.2Å; E227-S230 WeakPolarHBondContact O-CB 3.32Å; E227-S230 PolarHBondContact O-N 2.91Å; E227-S230 VanDerWaalsContact O-N 3.1Å; S230-A232 VanDerWaalsContact C-N 3.3Å; S230-A232 PolarHBondContact O-N 2.97Å; S230-R233 PolarHBondContact O-N 3.41Å; S230-Q234 WeakPolarHBondContact O-CB 3.32Å; S230-Q234 PolarHBondContact O-N 3.35Å
231	V	98.9	Very high	98.8	Very high	14 Å²	14	58.2 Å²	58.2	9%	0.085	29%	0.294	C	S	.	.	H	α-helix	trans	-55.8	-46.1	173.7	165.6	0	0	0	0	110.7	M196 E197 V200 E227 R233 Q234 F235 L237	M196-V231 HydrophobicContact CB-CG2 4.2Å; M196-V231 HydrophobicContact CG-CB 4.44Å; M196-V231 HydrophobicContact CG-CG2 3.85Å; E197-V231 HydrophobicContact CB-CG1 4.26Å; E197-V231 HydrophobicContact CG-CG1 4.37Å; V200-V231 HydrophobicContact CB-CG1 3.76Å; V200-V231 HydrophobicContact CG1-CG1 4.06Å; V200-V231 HydrophobicContact CG2-CB 4.29Å; V200-V231 HydrophobicContact CG2-CG1 3.89Å; E227-V231 WeakPolarHBondContact O-CG2 3.35Å; E227-V231 PolarHBondContact O-N 3.42Å; V231-R233 VanDerWaalsContact C-N 3.33Å; V231-R233 PolarHBondContact O-N 3.28Å; V231-Q234 PolarHBondContact O-N 3.02Å; V231-F235 HydrophobicContact CG1-CD2 4.02Å; V231-F235 HydrophobicContact CG1-CE2 4.49Å; V231-F235 WeakPolarHBondContact O-CD2 3.49Å; V231-F235 PolarHBondContact O-N 2.92Å; V231-L237 HydrophobicContact CG1-CD1 4.39Å
232	A	98.9	Very high	98.8	Very high	1 Å²	1	55 Å²	55	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-41.4	179.4	0	0	0	0	0	112.4	V200 A228 Y229 S230 N236 L237 P239	V200-A232 HydrophobicContact CG1-CB 4.02Å; A228-A232 WeakPolarHBondContact O-CB 3.29Å; A228-A232 PolarHBondContact O-N 3.24Å; Y229-A232 PolarHBondContact O-N 3.25Å; S230-A232 VanDerWaalsContact C-N 3.3Å; S230-A232 PolarHBondContact O-N 2.97Å; A232-N236 CarbonylContact O-C 3.59Å; A232-N236 WeakPolarHBondContact O-CA 3.43Å; A232-N236 PolarHBondContact O-N 3.43Å; A232-L237 HydrophobicContact CB-CB 4.33Å; A232-L237 PolarHBondContact O-N 3.32Å; A232-P239 HydrophobicContact CB-CB 3.96Å
233	R	98.8	Very high	98.8	Very high	153 Å²	153	53.8 Å²	53.8	58%	0.577	27%	0.265	S	S	*	.	H	α-helix	trans	-69.4	-42.9	176.4	-66.1	-52.4	-174.4	-176.9	0.8	112.8	Y229 S230 V231 F235	Y229-R233 HydrophobicContact CD1-CG 4.06Å; Y229-R233 HydrophobicContact CE1-CG 3.64Å; Y229-R233 HydrophobicContact CE2-CG 4.4Å; Y229-R233 WeakPolarHBondContact O-CG 3.34Å; Y229-R233 PolarHBondContact O-N 2.93Å; Y229-R233 PolarHBondContact OH-NE 3.3Å; Y229-R233 PolarHBondContact OH-NH2 3.39Å; S230-R233 PolarHBondContact O-N 3.41Å; V231-R233 VanDerWaalsContact C-N 3.33Å; V231-R233 PolarHBondContact O-N 3.28Å; R233-F235 VanDerWaalsContact C-N 3.32Å; R233-F235 PolarHBondContact O-N 3.4Å
234	Q	98.9	Very high	98.8	Very high	136 Å²	136	46.9 Å²	46.9	64%	0.636	23%	0.231	S	C	*	.	H	α-helix	trans	-61.8	-40	-179.4	-179.1	176	-6.5	0	0	112.2	S230 V231	S230-Q234 WeakPolarHBondContact O-CB 3.32Å; S230-Q234 PolarHBondContact O-N 3.35Å; V231-Q234 PolarHBondContact O-N 3.02Å
235	F	98.8	Very high	98.8	Very high	68 Å²	68	44.7 Å²	44.7	30%	0.298	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	12.8	-173.7	-60.7	-66	0	0	0	114.2	E197 V231 R233 L237	E197-F235 HydrophobicContact CG-CD2 4.15Å; E197-F235 HydrophobicContact CG-CE2 3.96Å; V231-F235 HydrophobicContact CG1-CD2 4.02Å; V231-F235 HydrophobicContact CG1-CE2 4.49Å; V231-F235 WeakPolarHBondContact O-CD2 3.49Å; V231-F235 PolarHBondContact O-N 2.92Å; R233-F235 VanDerWaalsContact C-N 3.32Å; R233-F235 PolarHBondContact O-N 3.4Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 HydrophobicContact CB-CD1 3.83Å; F235-L237 HydrophobicContact CB-CG 3.84Å; F235-L237 PolarHBondContact O-N 2.98Å
236	N	98.8	Very high	98.8	Very high	154 Å²	154	47.2 Å²	47.2	82%	0.824	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	47.6	-177.5	-167.9	42.6	0	0	0	113.3	A232	A232-N236 CarbonylContact O-C 3.59Å; A232-N236 WeakPolarHBondContact O-CA 3.43Å; A232-N236 PolarHBondContact O-N 3.43Å
237	L	98.9	Very high	98.8	Very high	28 Å²	28	44.1 Å²	44.1	15%	0.147	22%	0.217	C	C	.	.			trans	-104	177.4	177.7	-51.1	171.2	0	0	0	110.5	V200 R201 T204 V231 A232 F235 P239	V200-L237 HydrophobicContact CB-CD1 4.35Å; V200-L237 HydrophobicContact CG1-CB 3.91Å; V200-L237 HydrophobicContact CG1-CD1 3.79Å; R201-L237 HydrophobicContact CB-CD1 4.42Å; R201-L237 HydrophobicContact CG-CD1 3.47Å; R201-L237 VanDerWaalsContact CG-CD1 3.47Å; R201-L237 HydrophobicContact CG-CD2 4.22Å; T204-L237 HydrophobicContact CG2-CB 4.27Å; T204-L237 HydrophobicContact CG2-CD2 4.08Å; T204-L237 WeakPolarHBondContact OG1-CB 3.33Å; V231-L237 HydrophobicContact CG1-CD1 4.39Å; A232-L237 HydrophobicContact CB-CB 4.33Å; A232-L237 PolarHBondContact O-N 3.32Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 HydrophobicContact CB-CD1 3.83Å; F235-L237 HydrophobicContact CB-CG 3.84Å; F235-L237 PolarHBondContact O-N 2.98Å; L237-P239 WeakPolarHBondContact O-CD 3.31Å
238	I	98.9	Very high	98.8	Very high	48 Å²	48	39.9 Å²	39.9	25%	0.246	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-88.1	121.4	-177.5	-58.9	172.4	0	0	0	108.8	T204 I207 W215	T204-I238 HydrophobicContact CG2-CB 4.39Å; T204-I238 HydrophobicContact CG2-CD1 4.04Å; T204-I238 HydrophobicContact CG2-CG1 3.93Å; T204-I238 PolarHBondContact OG1-N 3.2Å; I207-I238 HydrophobicContact CB-CD1 3.94Å; I207-I238 HydrophobicContact CD1-CB 4.44Å; I207-I238 HydrophobicContact CD1-CD1 4.2Å; I207-I238 HydrophobicContact CD1-CG2 3.96Å; I207-I238 HydrophobicContact CG2-CD1 3.57Å; W215-I238 PolarHBondContact NE1-O 3.25Å
239	P	98.9	Very high	98.8	Very high	32 Å²	32	40 Å²	40	21%	0.208	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-76.6	160	176.6	31.2	-34.6	0	0	0	112.2	W215 Y229 A232 L237	W215-P239 VanDerWaalsContact NE1-C 3.3Å; W215-P239 PolarHBondContact NE1-O 3.37Å; Y229-P239 HydrophobicContact CD2-CB 3.77Å; Y229-P239 HydrophobicContact CD2-CG 4.49Å; Y229-P239 HydrophobicContact CE2-CB 4.3Å; A232-P239 HydrophobicContact CB-CB 3.96Å; L237-P239 WeakPolarHBondContact O-CD 3.31Å
240	P	98.9	Very high	98.7	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.032	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-69.5	145.1	175.5	29.5	-31.7	0	0	0	110.6	W215 T217 A228 V268	W215-P240 HydrophobicContact CD2-CB 3.98Å; W215-P240 HydrophobicContact CE3-CB 4.03Å; W215-P240 HydrophobicContact CH2-CB 3.89Å; W215-P240 HydrophobicContact CH2-CG 3.96Å; W215-P240 HydrophobicContact CZ2-CB 3.83Å; W215-P240 VanDerWaalsContact CZ2-CD 3.4Å; W215-P240 HydrophobicContact CZ2-CG 3.93Å; W215-P240 HydrophobicContact CZ3-CB 3.98Å; W215-P240 HydrophobicContact CZ3-CG 4.47Å; W215-P240 WeakPolarHBondContact O-CA 3.49Å; T217-P240 HydrophobicContact CG2-CB 4.25Å; T217-P240 HydrophobicContact CG2-CG 4.45Å; A228-P240 HydrophobicContact CB-CG 4.31Å; P240-V268 WeakPolarHBondContact O-CG2 3.42Å
241	V	98.7	Very high	98.7	Very high	22 Å²	22	39.8 Å²	39.8	13%	0.133	19%	0.19	C	C	.	.			trans	-99.1	-17.1	-178.9	-58.2	0	0	0	0	113.8	L72 Y214 W215 G269	L72-V241 HydrophobicContact CD2-CG2 4.45Å; Y214-V241 HydrophobicContact CD1-CG1 3.78Å; Y214-V241 HydrophobicContact CD1-CG2 4.39Å; Y214-V241 HydrophobicContact CG-CG1 4.41Å; Y214-V241 HydrophobicContact CG-CG2 4.24Å; W215-V241 PolarHBondContact O-N 3.22Å; V241-G269 PolarHBondContact O-N 2.9Å
242	C	98.6	Very high	98.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	145.8	-171.6	-175.3	0	0	0	0	111.5	L72 F186 G216 T217 G269 M271	L72-C242 HydrophobicContact CD1-CB 4.11Å; L72-C242 VanDerWaalsContact CD1-SG 3.59Å; L72-C242 HydrophobicContact CD2-CB 3.87Å; L72-C242 HydrophobicContact CG-CB 3.89Å; F186-C242 HydrophobicContact CE1-CB 4.04Å; F186-C242 HydrophobicContact CZ-CB 4.11Å; G216-C242 CarbonylContact C-O 3.57Å; G216-C242 WeakPolarHBondContact CA-O 3.31Å; T217-C242 PolarHBondContact N-O 3.25Å; C242-G269 WeakPolarHBondContact CA-O 3.15Å; C242-M271 WeakPolarHBondContact SG-CB 3.44Å
243	E	98.9	Very high	98.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.5	162.7	165	58.5	-163.2	0	0	109.8	T217 S218 R219 W220 I225 A245 K254 L259 V268 G269 M271	T217-E243 WeakPolarHBondContact CB-OE2 3.39Å; T217-E243 CarbonylContact O-C 3.42Å; T217-E243 WeakPolarHBondContact O-CA 3.42Å; T217-E243 VanDerWaalsContact O-OE2 3.08Å; T217-E243 PolarHBondContact OG1-OE2 3.21Å; S218-E243 WeakPolarHBondContact CA-OE2 3.37Å; S218-E243 PolarHBondContact N-OE2 3.32Å; R219-E243 PolarHBondContact N-OE1 2.92Å; W220-E243 PolarHBondContact N-OE1 2.95Å; I225-E243 HydrophobicContact CD1-CB 3.88Å; I225-E243 HydrophobicContact CD1-CG 3.89Å; E243-A245 HydrophobicContact CG-CB 4.11Å; E243-K254 IonicContact OE1-NZ 3.61Å; E243-K254 PolarHBondContact OE1-NZ 3.32Å; E243-L259 HydrophobicContact CB-CD2 4.24Å; E243-L259 HydrophobicContact CG-CD1 4.32Å; E243-L259 HydrophobicContact CG-CD2 3.95Å; E243-V268 HydrophobicContact CB-CG1 4.16Å; E243-G269 PolarHBondContact N-O 2.8Å; E243-M271 PolarHBondContact O-N 2.77Å
244	Q	98.8	Very high	98.4	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.019	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	100.5	173.2	-132	-174	67.2	0	0	110.6	D115 F186 T217 S218 R219 M271 W273 L351	D115-Q244 PolarHBondContact OD1-NE2 2.73Å; F186-Q244 HydrophobicContact CD1-CB 4.28Å; F186-Q244 HydrophobicContact CE1-CB 4.08Å; T217-Q244 PolarHBondContact O-N 3.15Å; S218-Q244 WeakPolarHBondContact CA-O 3.28Å; R219-Q244 PolarHBondContact N-O 2.64Å; Q244-M271 CarbonylContact C-O 3.36Å; Q244-M271 WeakPolarHBondContact CA-O 3.11Å; Q244-M271 HydrophobicContact CG-CB 4.07Å; Q244-M271 HydrophobicContact CG-CG 3.97Å; Q244-M271 WeakPolarHBondContact CG-O 3.46Å; Q244-M271 HydrophobicContact CG-SD 3.98Å; Q244-M271 PolarHBondContact NE2-SD 3.48Å; Q244-W273 PolarHBondContact O-NE1 3.11Å; Q244-W273 VanDerWaalsContact O-NE1 3.08Å; Q244-L351 HydrophobicContact CG-CD1 4.16Å
245	A	98.6	Very high	98.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.4	-169.8	0	0	0	0	0	114	E243 Y247 K254 V255 L259 M271 T272 W273	E243-A245 HydrophobicContact CG-CB 4.11Å; A245-Y247 PolarHBondContact O-N 3.42Å; A245-K254 HydrophobicContact CB-CD 4.09Å; A245-V255 HydrophobicContact CB-CG2 3.74Å; A245-L259 HydrophobicContact CB-CD1 3.97Å; A245-M271 PolarHBondContact N-O 3.4Å; A245-M271 VanDerWaalsContact N-O 3.12Å; A245-T272 CarbonylContact O-C 3.38Å; A245-T272 WeakPolarHBondContact O-CA 3.36Å; A245-T272 WeakPolarHBondContact O-CB 3.15Å; A245-W273 PolarHBondContact O-N 2.82Å
246	E	98.6	Very high	98.2	Very high	54 Å²	54	30.5 Å²	30.5	25%	0.252	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	129.3	171.9	-162.4	162.4	-155.8	0	0	109.5	H248 Q251 W273	E246-H248 IonicContact OE1-CD2 2.59Å; E246-H248 IonicContact OE1-NE2 3.85Å; E246-H248 PolarHBondContact OE1-NE2 2.89Å; E246-Q251 HydrophobicContact CB-CG 4.01Å; E246-Q251 HydrophobicContact CG-CB 4.32Å; E246-Q251 HydrophobicContact CG-CG 3.94Å; E246-W273 HydrophobicContact CB-CD2 4.12Å; E246-W273 HydrophobicContact CB-CE3 4.04Å; E246-W273 HydrophobicContact CB-CH2 3.39Å; E246-W273 HydrophobicContact CB-CZ2 3.5Å; E246-W273 VanDerWaalsContact CB-CZ2 3.5Å; E246-W273 HydrophobicContact CB-CZ3 3.68Å; E246-W273 HydrophobicContact CG-CD2 4.42Å; E246-W273 HydrophobicContact CG-CE3 3.86Å; E246-W273 HydrophobicContact CG-CH2 3.59Å; E246-W273 HydrophobicContact CG-CZ2 4.2Å; E246-W273 HydrophobicContact CG-CZ3 3.39Å; E246-W273 VanDerWaalsContact N-CE2 3.26Å; E246-W273 WeakPolarHBondContact OE1-CZ3 3.46Å; E246-W273 WeakPolarHBondContact OE2-CH2 3.47Å
247	Y	98.7	Very high	98.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.			trans	-147.8	123.4	173.7	-167.5	-136.9	0	0	0	111.1	A245 Q251 R252 V255 E256 T272 W273 P275 W340 C341 R343 V347	A245-Y247 PolarHBondContact O-N 3.42Å; Y247-Q251 WeakPolarHBondContact CD2-O 3.32Å; Y247-R252 HydrophobicContact CE2-CB 4.37Å; Y247-R252 HydrophobicContact CE2-CG 4.48Å; Y247-V255 HydrophobicContact CD1-CG1 3.85Å; Y247-V255 HydrophobicContact CD2-CB 3.63Å; Y247-V255 HydrophobicContact CD2-CG1 3.77Å; Y247-V255 HydrophobicContact CD2-CG2 4.15Å; Y247-V255 HydrophobicContact CE1-CG1 4.1Å; Y247-V255 HydrophobicContact CE2-CB 4.11Å; Y247-V255 HydrophobicContact CE2-CG1 4.08Å; Y247-V255 HydrophobicContact CG-CB 3.93Å; Y247-V255 HydrophobicContact CG-CG1 3.69Å; Y247-V255 HydrophobicContact CG-CG2 4.15Å; Y247-E256 HydrophobicContact CE2-CG 3.77Å; Y247-E256 WeakPolarHBondContact CE2-OE1 3.38Å; Y247-E256 WeakPolarHBondContact OH-CG 3.4Å; Y247-E256 PolarHBondContact OH-OE1 3.4Å; Y247-T272 VanDerWaalsContact CB-CG2 3.5Å; Y247-T272 HydrophobicContact CD1-CG2 4.05Å; Y247-T272 HydrophobicContact CG-CG2 4.12Å; Y247-W273 PolarHBondContact N-O 2.99Å; Y247-P275 WeakPolarHBondContact O-CA 3.28Å; Y247-W340 HydrophobicContact CD2-CZ3 4.48Å; Y247-W340 HydrophobicContact CE1-CE3 4.49Å; Y247-W340 AromaticContact CE1-CZ3 3.94Å; Y247-W340 HydrophobicContact CE1-CZ3 3.94Å; Y247-W340 AromaticContact CE2-CH2 3.85Å; Y247-W340 HydrophobicContact CE2-CH2 3.85Å; Y247-W340 AromaticContact CE2-CZ3 3.74Å; Y247-W340 HydrophobicContact CE2-CZ3 3.74Å; Y247-W340 AromaticContact CZ-CH2 3.71Å; Y247-W340 AromaticContact CZ-CZ3 3.42Å; Y247-W340 VanDerWaalsContact CZ-CZ3 3.42Å; Y247-W340 VanDerWaalsContact OH-CH2 3.32Å; Y247-W340 WeakPolarHBondContact OH-CH2 3.11Å; Y247-W340 WeakPolarHBondContact OH-CZ3 3.4Å; Y247-C341 HydrophobicContact CD1-CB 3.94Å; Y247-C341 HydrophobicContact CE1-CB 4.11Å; Y247-R343 PolarHBondContact OH-NH1 3.3Å; Y247-V347 HydrophobicContact CD1-CG2 4.16Å; Y247-V347 HydrophobicContact CE1-CG2 4.16Å
248	H	98.5	Very high	98	Very high	5 Å²	5	26.4 Å²	26.4	2%	0.023	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	-164.9	177.2	173.9	52.4	70.1	0	0	0	109.4	E246 F250 Q251 S274 P275 I281	E246-H248 IonicContact OE1-CD2 2.59Å; E246-H248 IonicContact OE1-NE2 3.85Å; E246-H248 PolarHBondContact OE1-NE2 2.89Å; H248-F250 PolarHBondContact ND1-N 2.75Å; H248-F250 PolarHBondContact O-N 2.97Å; H248-Q251 WeakPolarHBondContact CE1-CB 3.38Å; H248-Q251 PolarHBondContact CE1-N 3.37Å; H248-Q251 PolarHBondContact N-O 3.12Å; H248-Q251 VanDerWaalsContact N-O 3.15Å; H248-Q251 PolarHBondContact ND1-N 2.92Å; H248-Q251 CarbonylContact O-C 3.32Å; H248-Q251 PolarHBondContact O-N 3.16Å; H248-S274 PolarHBondContact CD2-O 2.75Å; H248-P275 WeakPolarHBondContact CB-O 3.45Å; H248-I281 HydrophobicContact CB-CD1 3.76Å
249	L	98	Very high	97.9	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-33.9	-176.2	-60.9	172.6	0	0	0	113.8	R252 I281 L322 A337 W340 I381 L385 N387	L249-R252 WeakPolarHBondContact O-CD 3.41Å; L249-I281 HydrophobicContact CB-CD1 4.29Å; L249-I281 HydrophobicContact CD1-CD1 4.42Å; L249-I281 HydrophobicContact CD1-CG2 3.95Å; L249-I281 HydrophobicContact CG-CD1 4.41Å; L249-L322 HydrophobicContact CD1-CD1 3.8Å; L249-A337 HydrophobicContact CD1-CB 4.03Å; L249-A337 HydrophobicContact CG-CB 4.43Å; L249-W340 HydrophobicContact CD2-CB 4.25Å; L249-W340 HydrophobicContact CD2-CD2 3.36Å; L249-W340 HydrophobicContact CD2-CE3 3.62Å; L249-W340 HydrophobicContact CD2-CG 3.69Å; L249-W340 HydrophobicContact CD2-CH2 4.45Å; L249-W340 HydrophobicContact CD2-CZ2 4.21Å; L249-W340 HydrophobicContact CD2-CZ3 4.18Å; L249-W340 HydrophobicContact CG-CE3 4.42Å; L249-I381 HydrophobicContact CD2-CG2 4.07Å; L249-L385 HydrophobicContact CB-CD1 3.95Å; L249-L385 HydrophobicContact CB-CD2 3.94Å; L249-L385 HydrophobicContact CD2-CD1 3.9Å; L249-L385 HydrophobicContact CG-CD1 4.49Å; L249-N387 PolarHBondContact O-ND2 3Å
250	F	97.8	Very high	97.8	Very high	30 Å²	30	24.6 Å²	24.6	13%	0.132	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	3.1	179.1	-50.1	-59.5	0	0	0	116.1	H248 I281 Q315 K318 L319 L385	H248-F250 PolarHBondContact ND1-N 2.75Å; H248-F250 PolarHBondContact O-N 2.97Å; F250-I281 HydrophobicContact CD2-CD1 4.22Å; F250-I281 HydrophobicContact CD2-CG1 4.09Å; F250-I281 HydrophobicContact CE2-CD1 4.36Å; F250-I281 HydrophobicContact CE2-CG1 3.82Å; F250-Q315 HydrophobicContact CD1-CB 4.46Å; F250-Q315 HydrophobicContact CD1-CG 3.78Å; F250-Q315 HydrophobicContact CD2-CB 4.27Å; F250-Q315 HydrophobicContact CD2-CG 3.97Å; F250-Q315 HydrophobicContact CE1-CB 4.05Å; F250-Q315 HydrophobicContact CE1-CG 3.83Å; F250-Q315 HydrophobicContact CE2-CB 3.84Å; F250-Q315 HydrophobicContact CE2-CG 4.02Å; F250-Q315 HydrophobicContact CG-CG 3.85Å; F250-Q315 HydrophobicContact CZ-CB 3.72Å; F250-Q315 HydrophobicContact CZ-CG 3.95Å; F250-K318 HydrophobicContact CE1-CB 4.42Å; F250-K318 HydrophobicContact CE1-CD 4.34Å; F250-L319 HydrophobicContact CE2-CD2 3.92Å; F250-L319 HydrophobicContact CE2-CG 4.26Å; F250-L319 HydrophobicContact CZ-CD2 3.81Å; F250-L319 HydrophobicContact CZ-CG 4.03Å; F250-L385 HydrophobicContact CD1-CD2 4.07Å; F250-L385 HydrophobicContact CE1-CD2 3.63Å; F250-L385 HydrophobicContact CZ-CD2 4.41Å
251	Q	97.9	Very high	97.6	Very high	78 Å²	78	29.2 Å²	29.2	36%	0.364	14%	0.143	S	C	.	.	B	Isolated β-bridge	trans	-143.8	100.7	179	-177.4	62.5	26.8	0	0	108.9	E246 Y247 H248	E246-Q251 HydrophobicContact CB-CG 4.01Å; E246-Q251 HydrophobicContact CG-CB 4.32Å; E246-Q251 HydrophobicContact CG-CG 3.94Å; Y247-Q251 WeakPolarHBondContact CD2-O 3.32Å; H248-Q251 WeakPolarHBondContact CE1-CB 3.38Å; H248-Q251 PolarHBondContact CE1-N 3.37Å; H248-Q251 PolarHBondContact N-O 3.12Å; H248-Q251 VanDerWaalsContact N-O 3.15Å; H248-Q251 PolarHBondContact ND1-N 2.92Å; H248-Q251 CarbonylContact O-C 3.32Å; H248-Q251 PolarHBondContact O-N 3.16Å
252	R	97.6	Very high	97.6	Very high	9 Å²	9	28.5 Å²	28.5	3%	0.034	14%	0.138	C	C	.	.			trans	-126.3	-39	-162.9	-56.4	179.7	56.9	175.6	-0.8	114.9	Y247 L249 K254 V255 E256 W340 D382 N387 P389	Y247-R252 HydrophobicContact CE2-CB 4.37Å; Y247-R252 HydrophobicContact CE2-CG 4.48Å; L249-R252 WeakPolarHBondContact O-CD 3.41Å; R252-K254 PolarHBondContact O-N 2.64Å; R252-V255 PolarHBondContact O-N 3.08Å; R252-V255 VanDerWaalsContact O-N 3.15Å; R252-E256 HydrophobicContact CB-CG 4.49Å; R252-E256 IonicContact CZ-OE1 3.55Å; R252-E256 IonicContact CZ-OE2 2.94Å; R252-E256 IonicContact NE-OE1 3.3Å; R252-E256 PolarHBondContact NE-OE1 3.2Å; R252-E256 IonicContact NE-OE2 3.02Å; R252-E256 PolarHBondContact NE-OE2 2.94Å; R252-E256 IonicContact NH2-OE1 3.79Å; R252-E256 PolarHBondContact NH2-OE1 3.31Å; R252-E256 IonicContact NH2-OE2 3.18Å; R252-E256 PolarHBondContact NH2-OE2 2.77Å; R252-E256 WeakPolarHBondContact O-CB 3.22Å; R252-E256 PolarHBondContact O-N 2.79Å; R252-W340 HydrophobicContact CG-CH2 3.89Å; R252-D382 IonicContact CZ-OD1 3.58Å; R252-D382 IonicContact NH1-OD1 3.97Å; R252-D382 PolarHBondContact NH1-OD1 3.42Å; R252-D382 IonicContact NH2-OD1 3.37Å; R252-D382 PolarHBondContact NH2-OD1 3Å; R252-N387 WeakPolarHBondContact CD-OD1 3.48Å; R252-N387 PolarHBondContact NH1-OD1 2.96Å; R252-P389 HydrophobicContact CB-CG 4.23Å
253	E	96.1	Very high	97.5	Very high	98 Å²	98	32.3 Å²	32.3	46%	0.458	15%	0.153	S	C	.	.	H	α-helix	trans	-54	-53.6	-162.3	-177.4	-100.2	140.8	0	0	113.3	V255 V257 Q258 P389	E253-V255 PolarHBondContact O-N 3.23Å; E253-V257 VanDerWaalsContact O-CB 3.27Å; E253-V257 WeakPolarHBondContact O-CB 3.41Å; E253-V257 PolarHBondContact O-N 2.66Å; E253-Q258 PolarHBondContact OE1-NE2 3.46Å; E253-P389 HydrophobicContact CB-CB 4.33Å
254	K	97	Very high	97.4	Very high	31 Å²	31	38.2 Å²	38.2	14%	0.135	18%	0.181	C	C	.	.	I	π-helix	trans	-54.4	-48.6	178.2	-175.5	178.9	-177.7	-179.3	0	113.2	W220 E243 A245 R252 Q258 L259	W220-K254 WeakPolarHBondContact O-CE 3.48Å; W220-K254 PolarHBondContact O-NZ 3.2Å; E243-K254 IonicContact OE1-NZ 3.61Å; E243-K254 PolarHBondContact OE1-NZ 3.32Å; A245-K254 HydrophobicContact CB-CD 4.09Å; R252-K254 PolarHBondContact O-N 2.64Å; K254-Q258 WeakPolarHBondContact O-CA 3.21Å; K254-Q258 WeakPolarHBondContact O-CB 3.46Å; K254-Q258 PolarHBondContact O-N 3.24Å; K254-L259 HydrophobicContact CG-CD2 4.37Å; K254-L259 HydrophobicContact CG-CG 4.34Å; K254-L259 WeakPolarHBondContact O-CG 3.43Å; K254-L259 PolarHBondContact O-N 2.83Å
255	V	97.8	Very high	97.4	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.018	21%	0.207	C	C	.	.	I	π-helix	trans	-81.3	-32	-170.6	173.3	0	0	0	0	112	A245 Y247 R252 E253 L259 P260 T272 V347	A245-V255 HydrophobicContact CB-CG2 3.74Å; Y247-V255 HydrophobicContact CD1-CG1 3.85Å; Y247-V255 HydrophobicContact CD2-CB 3.63Å; Y247-V255 HydrophobicContact CD2-CG1 3.77Å; Y247-V255 HydrophobicContact CD2-CG2 4.15Å; Y247-V255 HydrophobicContact CE1-CG1 4.1Å; Y247-V255 HydrophobicContact CE2-CB 4.11Å; Y247-V255 HydrophobicContact CE2-CG1 4.08Å; Y247-V255 HydrophobicContact CG-CB 3.93Å; Y247-V255 HydrophobicContact CG-CG1 3.69Å; Y247-V255 HydrophobicContact CG-CG2 4.15Å; R252-V255 PolarHBondContact O-N 3.08Å; R252-V255 VanDerWaalsContact O-N 3.15Å; E253-V255 PolarHBondContact O-N 3.23Å; V255-L259 HydrophobicContact CB-CD1 4.31Å; V255-L259 HydrophobicContact CG2-CD1 3.75Å; V255-P260 VanDerWaalsContact O-CD 3.31Å; V255-P260 WeakPolarHBondContact O-CD 3.46Å; V255-T272 HydrophobicContact CG1-CG2 4.08Å; V255-T272 HydrophobicContact CG2-CG2 4.24Å; V255-V347 HydrophobicContact CG1-CG2 3.84Å
256	E	97.2	Very high	97.4	Very high	36 Å²	36	45.7 Å²	45.7	17%	0.168	21%	0.214	C	C	.	.	I	π-helix	trans	-86.3	-24	178.8	-69.7	-176.4	-158.7	0	0	113.3	Y247 R252 W340 R343 P389	Y247-E256 HydrophobicContact CE2-CG 3.77Å; Y247-E256 WeakPolarHBondContact CE2-OE1 3.38Å; Y247-E256 WeakPolarHBondContact OH-CG 3.4Å; Y247-E256 PolarHBondContact OH-OE1 3.4Å; R252-E256 HydrophobicContact CB-CG 4.49Å; R252-E256 IonicContact CZ-OE1 3.55Å; R252-E256 IonicContact CZ-OE2 2.94Å; R252-E256 IonicContact NE-OE1 3.3Å; R252-E256 PolarHBondContact NE-OE1 3.2Å; R252-E256 IonicContact NE-OE2 3.02Å; R252-E256 PolarHBondContact NE-OE2 2.94Å; R252-E256 IonicContact NH2-OE1 3.79Å; R252-E256 PolarHBondContact NH2-OE1 3.31Å; R252-E256 IonicContact NH2-OE2 3.18Å; R252-E256 PolarHBondContact NH2-OE2 2.77Å; R252-E256 WeakPolarHBondContact O-CB 3.22Å; R252-E256 PolarHBondContact O-N 2.79Å; E256-W340 WeakPolarHBondContact OE1-CH2 3.41Å; E256-R343 IonicContact OE1-NH2 3.94Å; E256-R343 PolarHBondContact OE1-NH2 3.49Å; E256-R343 IonicContact OE2-NH2 2.93Å; E256-P389 HydrophobicContact CB-CG 3.77Å; E256-P389 VanDerWaalsContact OE2-CD 3.31Å; E256-P389 WeakPolarHBondContact OE2-CD 3.36Å; E256-P389 WeakPolarHBondContact OE2-CG 3.3Å
257	V	95.4	Very high	97.4	Very high	41 Å²	41	43.5 Å²	43.5	25%	0.248	21%	0.206	C	C	.	.	I	π-helix	trans	-113.9	-49.6	-175.2	-174.6	0	0	0	0	112.7	E253 P389	E253-V257 VanDerWaalsContact O-CB 3.27Å; E253-V257 WeakPolarHBondContact O-CB 3.41Å; E253-V257 PolarHBondContact O-N 2.66Å; V257-P389 HydrophobicContact CG2-CB 3.67Å; V257-P389 HydrophobicContact CG2-CG 3.92Å
258	Q	96.4	Very high	97.3	Very high	56 Å²	56	43.6 Å²	43.6	26%	0.262	21%	0.206	S	C	.	.	I	π-helix	trans	-85.6	-46.5	-170.6	-53.6	-179.4	24.1	0	0	112.6	A222 E253 K254 E261 L262	A222-Q258 HydrophobicContact CB-CB 4.18Å; E253-Q258 PolarHBondContact OE1-NE2 3.46Å; K254-Q258 WeakPolarHBondContact O-CA 3.21Å; K254-Q258 WeakPolarHBondContact O-CB 3.46Å; K254-Q258 PolarHBondContact O-N 3.24Å; Q258-E261 PolarHBondContact O-N 3.43Å; Q258-L262 PolarHBondContact O-N 3.47Å
259	L	97.2	Very high	97.3	Very high	9 Å²	9	43.5 Å²	43.5	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-35.3	-176.2	-60	-169.3	0	0	0	114.6	E243 A245 K254 V255 E261 L262 Y263 A270	E243-L259 HydrophobicContact CB-CD2 4.24Å; E243-L259 HydrophobicContact CG-CD1 4.32Å; E243-L259 HydrophobicContact CG-CD2 3.95Å; A245-L259 HydrophobicContact CB-CD1 3.97Å; K254-L259 HydrophobicContact CG-CD2 4.37Å; K254-L259 HydrophobicContact CG-CG 4.34Å; K254-L259 WeakPolarHBondContact O-CG 3.43Å; K254-L259 PolarHBondContact O-N 2.83Å; V255-L259 HydrophobicContact CB-CD1 4.31Å; V255-L259 HydrophobicContact CG2-CD1 3.75Å; L259-E261 VanDerWaalsContact C-N 3.29Å; L259-E261 PolarHBondContact O-N 3.14Å; L259-L262 HydrophobicContact CD2-CD1 3.89Å; L259-L262 PolarHBondContact O-N 3.44Å; L259-Y263 PolarHBondContact O-N 3.1Å; L259-A270 HydrophobicContact CD1-CB 3.57Å
260	P	96.8	Very high	97.3	Very high	32 Å²	32	43.5 Å²	43.5	21%	0.208	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-39.3	174.7	-26.5	37.3	0	0	0	112.4	V255 Y263 H264	V255-P260 VanDerWaalsContact O-CD 3.31Å; V255-P260 WeakPolarHBondContact O-CD 3.46Å; P260-Y263 WeakPolarHBondContact O-CB 3.43Å; P260-Y263 PolarHBondContact O-N 3.42Å; P260-H264 PolarHBondContact O-CD2 2.93Å; P260-H264 PolarHBondContact O-N 3.21Å
261	E	95.8	Very high	97.4	Very high	103 Å²	103	42 Å²	42	48%	0.481	20%	0.201	S	C	.	.	H	α-helix	trans	-63.9	-42.1	175.7	-72.1	-64.5	132.8	0	0	111.8	Q258 L259 H264 K265	Q258-E261 PolarHBondContact O-N 3.43Å; L259-E261 VanDerWaalsContact C-N 3.29Å; L259-E261 PolarHBondContact O-N 3.14Å; E261-H264 PolarHBondContact O-N 3.16Å; E261-K265 WeakPolarHBondContact O-CB 3.31Å; E261-K265 VanDerWaalsContact O-CG 3.24Å; E261-K265 WeakPolarHBondContact O-CG 3.35Å; E261-K265 PolarHBondContact O-N 2.8Å; E261-K265 VanDerWaalsContact OE2-CE 3.24Å; E261-K265 WeakPolarHBondContact OE2-CE 3.04Å; E261-K265 IonicContact OE2-NZ 3.18Å
262	L	97.7	Very high	97.4	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-41.2	175.1	-67.4	175.9	0	0	0	111.9	A222 I225 M226 Q258 L259 H264 K265 I266 G267 V268	A222-L262 HydrophobicContact CB-CD1 3.96Å; A222-L262 HydrophobicContact CB-CD2 4.36Å; A222-L262 HydrophobicContact CB-CG 4.31Å; I225-L262 HydrophobicContact CB-CD1 4.18Å; I225-L262 HydrophobicContact CD1-CD1 3.73Å; I225-L262 HydrophobicContact CG2-CD1 4.12Å; M226-L262 HydrophobicContact CE-CD2 3.96Å; Q258-L262 PolarHBondContact O-N 3.47Å; L259-L262 HydrophobicContact CD2-CD1 3.89Å; L259-L262 PolarHBondContact O-N 3.44Å; L262-H264 PolarHBondContact O-N 3.03Å; L262-K265 PolarHBondContact O-N 3.39Å; L262-I266 HydrophobicContact CB-CG1 4.39Å; L262-I266 HydrophobicContact CD2-CD1 4.09Å; L262-I266 HydrophobicContact CD2-CG1 4.43Å; L262-I266 WeakPolarHBondContact O-CG1 3.38Å; L262-I266 PolarHBondContact O-N 2.93Å; L262-G267 PolarHBondContact O-N 2.87Å; L262-G267 VanDerWaalsContact O-N 3.14Å; L262-V268 HydrophobicContact CB-CB 4.43Å
263	Y	97.5	Very high	97.5	Very high	79 Å²	79	40 Å²	40	31%	0.31	19%	0.189	S	C	.	.	H	α-helix	trans	-58.4	-48	175.4	178.7	-91.1	0	0	0	111.4	K74 L259 P260 G267 V268	K74-Y263 VanDerWaalsContact CE-O 3.3Å; K74-Y263 WeakPolarHBondContact CE-O 3.5Å; K74-Y263 HydrophobicContact CG-CE2 4.01Å; K74-Y263 PolarHBondContact NZ-O 2.79Å; L259-Y263 PolarHBondContact O-N 3.1Å; P260-Y263 WeakPolarHBondContact O-CB 3.43Å; P260-Y263 PolarHBondContact O-N 3.42Å; Y263-G267 WeakPolarHBondContact O-CA 3.38Å; Y263-G267 PolarHBondContact O-N 3.27Å; Y263-V268 VanDerWaalsContact CA-O 3.3Å; Y263-V268 WeakPolarHBondContact CA-O 3.14Å; Y263-V268 WeakPolarHBondContact CB-O 3.33Å
264	H	97	Very high	97.5	Very high	125 Å²	125	36 Å²	36	58%	0.579	17%	0.173	S	C	*	.	H	α-helix	trans	-66.1	-45.3	-179.7	-70.1	-55.4	0	0	0	112.2	K74 P260 E261 L262	K74-H264 PolarHBondContact NZ-O 3.22Å; P260-H264 PolarHBondContact O-CD2 2.93Å; P260-H264 PolarHBondContact O-N 3.21Å; E261-H264 PolarHBondContact O-N 3.16Å; L262-H264 PolarHBondContact O-N 3.03Å
265	K	97.9	Very high	97.6	Very high	134 Å²	134	34.8 Å²	34.8	58%	0.583	17%	0.168	S	C	*	.	H	α-helix	trans	-74.6	-46.7	-174.8	-69	173.5	-171.6	-65.8	0	113.7	M226 E261 L262	M226-K265 HydrophobicContact CE-CB 4.45Å; M226-K265 HydrophobicContact CE-CD 4.42Å; E261-K265 WeakPolarHBondContact O-CB 3.31Å; E261-K265 VanDerWaalsContact O-CG 3.24Å; E261-K265 WeakPolarHBondContact O-CG 3.35Å; E261-K265 PolarHBondContact O-N 2.8Å; E261-K265 VanDerWaalsContact OE2-CE 3.24Å; E261-K265 WeakPolarHBondContact OE2-CE 3.04Å; E261-K265 IonicContact OE2-NZ 3.18Å; L262-K265 PolarHBondContact O-N 3.39Å
266	I	98.3	Very high	97.6	Very high	26 Å²	26	35.5 Å²	35.5	13%	0.133	17%	0.172	C	C	.	.	H	α-helix	trans	-127.8	-3.9	-169.7	61.7	165.8	0	0	0	114	I225 M226 Y229 L262 V268	I225-I266 HydrophobicContact CG2-CD1 4.01Å; M226-I266 HydrophobicContact CE-CD1 4.26Å; M226-I266 HydrophobicContact CE-CG1 4.45Å; M226-I266 HydrophobicContact CE-CG2 3.77Å; M226-I266 HydrophobicContact SD-CG2 3.85Å; Y229-I266 HydrophobicContact CD1-CB 4.29Å; Y229-I266 HydrophobicContact CD1-CG2 3.51Å; Y229-I266 HydrophobicContact CD2-CB 3.68Å; Y229-I266 HydrophobicContact CD2-CD1 4.22Å; Y229-I266 HydrophobicContact CD2-CG2 3.86Å; Y229-I266 HydrophobicContact CE1-CB 4.3Å; Y229-I266 HydrophobicContact CE1-CG2 3.5Å; Y229-I266 HydrophobicContact CE2-CB 3.7Å; Y229-I266 HydrophobicContact CE2-CG2 3.85Å; Y229-I266 HydrophobicContact CG-CB 3.97Å; Y229-I266 HydrophobicContact CG-CD1 4.11Å; Y229-I266 HydrophobicContact CG-CG2 3.67Å; L262-I266 HydrophobicContact CB-CG1 4.39Å; L262-I266 HydrophobicContact CD2-CD1 4.09Å; L262-I266 HydrophobicContact CD2-CG1 4.43Å; L262-I266 WeakPolarHBondContact O-CG1 3.38Å; L262-I266 PolarHBondContact O-N 2.93Å; I266-V268 HydrophobicContact CD1-CB 4.43Å; I266-V268 HydrophobicContact CD1-CG2 3.56Å; I266-V268 HydrophobicContact CG1-CB 4.38Å; I266-V268 HydrophobicContact CG1-CG2 3.83Å
267	G	98	Very high	97.5	Very high	8 Å²	8	34 Å²	34	8%	0.082	17%	0.165	C	C	.	.			trans	83.8	9.8	173.2	0	0	0	0	0	115.8	K74 L262 Y263 G269	K74-G267 PolarHBondContact N-O 2.86Å; L262-G267 PolarHBondContact O-N 2.87Å; L262-G267 VanDerWaalsContact O-N 3.14Å; Y263-G267 WeakPolarHBondContact O-CA 3.38Å; Y263-G267 PolarHBondContact O-N 3.27Å; G267-G269 PolarHBondContact O-N 3.15Å
268	V	98.4	Very high	97.5	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.018	16%	0.158	C	C	.	.			trans	-68.8	125.6	177.7	171.9	0	0	0	0	110.1	I225 P240 E243 L262 Y263 I266	I225-V268 HydrophobicContact CG2-CG1 4.42Å; I225-V268 HydrophobicContact CG2-CG2 4.02Å; P240-V268 WeakPolarHBondContact O-CG2 3.42Å; E243-V268 HydrophobicContact CB-CG1 4.16Å; L262-V268 HydrophobicContact CB-CB 4.43Å; Y263-V268 VanDerWaalsContact CA-O 3.3Å; Y263-V268 WeakPolarHBondContact CA-O 3.14Å; Y263-V268 WeakPolarHBondContact CB-O 3.33Å; I266-V268 HydrophobicContact CD1-CB 4.43Å; I266-V268 HydrophobicContact CD1-CG2 3.56Å; I266-V268 HydrophobicContact CG1-CB 4.38Å; I266-V268 HydrophobicContact CG1-CG2 3.83Å
269	G	97.6	Very high	97.3	Very high	2 Å²	2	30.5 Å²	30.5	2%	0.021	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	167.9	174.1	0	0	0	0	0	113.7	G73 V241 C242 E243 G267	G73-G269 VanDerWaalsContact CA-N 3.34Å; V241-G269 PolarHBondContact O-N 2.9Å; C242-G269 WeakPolarHBondContact CA-O 3.15Å; E243-G269 PolarHBondContact N-O 2.8Å; G267-G269 PolarHBondContact O-N 3.15Å
270	A	98.4	Very high	97.2	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.025	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.7	172.9	0	0	0	0	0	110.8	L259 S348	L259-A270 HydrophobicContact CD1-CB 3.57Å; A270-S348 WeakPolarHBondContact O-CB 3.22Å; A270-S348 PolarHBondContact O-N 3.28Å
271	M	98.8	Very high	97.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	112	166.6	178.6	-175.5	-60.5	0	0	107.5	L72 L113 F186 C242 E243 Q244 A245 S349 L351	L72-M271 HydrophobicContact CD1-CB 4.33Å; L72-M271 HydrophobicContact CD1-CE 3.92Å; L72-M271 HydrophobicContact CD2-CE 3.97Å; L113-M271 HydrophobicContact CD1-CE 3.76Å; L113-M271 HydrophobicContact CD1-SD 4.39Å; L113-M271 HydrophobicContact CD2-CE 3.58Å; L113-M271 HydrophobicContact CD2-CG 4.32Å; L113-M271 HydrophobicContact CD2-SD 3.9Å; L113-M271 HydrophobicContact CG-CE 4.31Å; F186-M271 HydrophobicContact CE2-CE 4.49Å; F186-M271 HydrophobicContact CE2-SD 4.38Å; F186-M271 HydrophobicContact CZ-CE 4.24Å; F186-M271 HydrophobicContact CZ-SD 4.24Å; C242-M271 WeakPolarHBondContact SG-CB 3.44Å; E243-M271 PolarHBondContact O-N 2.77Å; Q244-M271 CarbonylContact C-O 3.36Å; Q244-M271 WeakPolarHBondContact CA-O 3.11Å; Q244-M271 HydrophobicContact CG-CB 4.07Å; Q244-M271 HydrophobicContact CG-CG 3.97Å; Q244-M271 WeakPolarHBondContact CG-O 3.46Å; Q244-M271 HydrophobicContact CG-SD 3.98Å; Q244-M271 PolarHBondContact NE2-SD 3.48Å; A245-M271 PolarHBondContact N-O 3.4Å; A245-M271 VanDerWaalsContact N-O 3.12Å; M271-S349 CarbonylContact C-O 3.57Å; M271-S349 WeakPolarHBondContact CA-O 3.28Å; M271-L351 HydrophobicContact CG-CD1 4.05Å; M271-L351 HydrophobicContact CG-CD2 4.36Å; M271-L351 HydrophobicContact CG-CG 3.95Å; M271-L351 HydrophobicContact SD-CD1 3.91Å; M271-L351 HydrophobicContact SD-CD2 4.11Å; M271-L351 HydrophobicContact SD-CG 4.14Å
272	T	98.8	Very high	97.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	154.9	-169.5	66.8	0	0	0	0	112.8	A245 Y247 V255 V347 S349 V350 L351	A245-T272 CarbonylContact O-C 3.38Å; A245-T272 WeakPolarHBondContact O-CA 3.36Å; A245-T272 WeakPolarHBondContact O-CB 3.15Å; Y247-T272 VanDerWaalsContact CB-CG2 3.5Å; Y247-T272 HydrophobicContact CD1-CG2 4.05Å; Y247-T272 HydrophobicContact CG-CG2 4.12Å; V255-T272 HydrophobicContact CG1-CG2 4.08Å; V255-T272 HydrophobicContact CG2-CG2 4.24Å; T272-V347 HydrophobicContact CG2-CG1 3.9Å; T272-V347 HydrophobicContact CG2-CG2 4.02Å; T272-S349 PolarHBondContact N-O 3.12Å; T272-V350 WeakPolarHBondContact OG1-CG2 3.15Å; T272-L351 WeakPolarHBondContact O-CB 3.15Å; T272-L351 PolarHBondContact O-N 2.98Å
273	W	98.7	Very high	96.7	Very high	43 Å²	43	26.2 Å²	26.2	16%	0.163	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	164.4	179.7	55.7	-99.9	0	0	0	112.7	R219 Q244 A245 E246 Y247 L351	R219-W273 HydrophobicContact CG-CZ2 4.26Å; Q244-W273 PolarHBondContact O-NE1 3.11Å; Q244-W273 VanDerWaalsContact O-NE1 3.08Å; A245-W273 PolarHBondContact O-N 2.82Å; E246-W273 HydrophobicContact CB-CD2 4.12Å; E246-W273 HydrophobicContact CB-CE3 4.04Å; E246-W273 HydrophobicContact CB-CH2 3.39Å; E246-W273 HydrophobicContact CB-CZ2 3.5Å; E246-W273 VanDerWaalsContact CB-CZ2 3.5Å; E246-W273 HydrophobicContact CB-CZ3 3.68Å; E246-W273 HydrophobicContact CG-CD2 4.42Å; E246-W273 HydrophobicContact CG-CE3 3.86Å; E246-W273 HydrophobicContact CG-CH2 3.59Å; E246-W273 HydrophobicContact CG-CZ2 4.2Å; E246-W273 HydrophobicContact CG-CZ3 3.39Å; E246-W273 VanDerWaalsContact N-CE2 3.26Å; E246-W273 WeakPolarHBondContact OE1-CZ3 3.46Å; E246-W273 WeakPolarHBondContact OE2-CH2 3.47Å; Y247-W273 PolarHBondContact N-O 2.99Å; W273-L351 HydrophobicContact CB-CD1 4.48Å
274	S	97.8	Very high	96.5	Very high	16 Å²	16	26 Å²	26	11%	0.112	14%	0.136	C	C	.	.			trans	51.4	49.8	-174.3	-70.7	0	0	0	0	114.6	H248 L276 A277	H248-S274 PolarHBondContact CD2-O 2.75Å; S274-L276 PolarHBondContact O-N 2.84Å; S274-A277 PolarHBondContact O-N 3.39Å
275	P	98.3	Very high	96.3	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.032	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.5	-178.8	27.2	-37.1	0	0	0	114	Y247 H248 I281 V338 V350 L351 L352	Y247-P275 WeakPolarHBondContact O-CA 3.28Å; H248-P275 WeakPolarHBondContact CB-O 3.45Å; P275-I281 WeakPolarHBondContact O-CD1 3.19Å; P275-V338 HydrophobicContact CB-CG2 4.19Å; P275-V338 HydrophobicContact CG-CG2 4.31Å; P275-V350 HydrophobicContact CB-CG1 3.54Å; P275-V350 HydrophobicContact CG-CG1 3.59Å; P275-L351 WeakPolarHBondContact CD-O 3.29Å; P275-L352 HydrophobicContact CG-CD2 4.19Å
276	L	97.8	Very high	95.8	Very high	18 Å²	18	18.6 Å²	18.6	9%	0.094	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	14.9	177.6	-57.3	178.7	0	0	0	113.2	S274 C278 G279 I280 I281 T282 P334 A337 V338	S274-L276 PolarHBondContact O-N 2.84Å; L276-C278 PolarHBondContact O-N 3.5Å; L276-G279 CarbonylContact O-C 3.6Å; L276-G279 WeakPolarHBondContact O-CA 3.12Å; L276-G279 PolarHBondContact O-N 3.16Å; L276-I280 PolarHBondContact O-N 3.07Å; L276-I281 HydrophobicContact CB-CB 4.47Å; L276-I281 HydrophobicContact CD2-CB 4.38Å; L276-I281 HydrophobicContact CD2-CG2 4.23Å; L276-I281 PolarHBondContact O-N 2.88Å; L276-I281 VanDerWaalsContact O-N 3.12Å; L276-T282 HydrophobicContact CD1-CG2 4.08Å; L276-P334 HydrophobicContact CD1-CB 4.07Å; L276-P334 HydrophobicContact CD2-CB 4.01Å; L276-A337 HydrophobicContact CD2-CB 3.88Å; L276-V338 HydrophobicContact CD2-CG2 4.09Å; L276-V338 HydrophobicContact CG-CG2 4.4Å
277	A	95.9	Very high	95.3	Very high	4 Å²	4	24.7 Å²	24.7	3%	0.033	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	47	57.6	-177.6	0	0	0	0	0	112.3	S274 G279 I280 I281	S274-A277 PolarHBondContact O-N 3.39Å; A277-G279 PolarHBondContact O-N 2.84Å; A277-G279 VanDerWaalsContact O-N 3.15Å; A277-I280 HydrophobicContact CB-CB 4.08Å; A277-I280 HydrophobicContact CB-CD1 4.5Å; A277-I280 VanDerWaalsContact O-CB 3.31Å; A277-I280 WeakPolarHBondContact O-CB 3.29Å; A277-I280 WeakPolarHBondContact O-CD1 3.27Å; A277-I280 WeakPolarHBondContact O-CG1 3.29Å; A277-I280 PolarHBondContact O-N 3.06Å; A277-I280 VanDerWaalsContact O-N 3.12Å; A277-I281 HydrophobicContact CB-CD1 3.87Å; A277-I281 HydrophobicContact CB-CG1 4.09Å
278	C	93.9	Very high	95	Very high	14 Å²	14	26.2 Å²	26.2	10%	0.095	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	59	21.8	-175.1	-66.2	0	0	0	0	115.5	L276 L303	L276-C278 PolarHBondContact O-N 3.5Å; C278-L303 HydrophobicContact CB-CD1 3.85Å; C278-L303 HydrophobicContact CB-CD2 3.76Å; C278-L303 HydrophobicContact CB-CG 4.49Å
279	G	93.5	Very high	94.7	Very high	9 Å²	9	28.2 Å²	28.2	9%	0.093	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	98.9	-1.8	-179.2	0	0	0	0	0	114	L276 A277 I281 T282 K284 Y285	L276-G279 CarbonylContact O-C 3.6Å; L276-G279 WeakPolarHBondContact O-CA 3.12Å; L276-G279 PolarHBondContact O-N 3.16Å; A277-G279 PolarHBondContact O-N 2.84Å; A277-G279 VanDerWaalsContact O-N 3.15Å; G279-I281 VanDerWaalsContact C-N 3.26Å; G279-I281 PolarHBondContact O-N 3.4Å; G279-T282 PolarHBondContact O-N 3.49Å; G279-T282 PolarHBondContact O-OG1 2.93Å; G279-K284 WeakPolarHBondContact O-CE 3.34Å; G279-Y285 WeakPolarHBondContact O-CE2 3.34Å
280	I	94.7	Very high	94.5	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-57.4	-42.6	176.9	-68	174.3	0	0	0	111	L276 A277 T282 G283 Y285 L303 I307 Q316 L319	L276-I280 PolarHBondContact O-N 3.07Å; A277-I280 HydrophobicContact CB-CB 4.08Å; A277-I280 HydrophobicContact CB-CD1 4.5Å; A277-I280 VanDerWaalsContact O-CB 3.31Å; A277-I280 WeakPolarHBondContact O-CB 3.29Å; A277-I280 WeakPolarHBondContact O-CD1 3.27Å; A277-I280 WeakPolarHBondContact O-CG1 3.29Å; A277-I280 PolarHBondContact O-N 3.06Å; A277-I280 VanDerWaalsContact O-N 3.12Å; I280-T282 PolarHBondContact O-N 3.1Å; I280-G283 PolarHBondContact O-N 3.13Å; I280-Y285 HydrophobicContact CG1-CD2 4.39Å; I280-Y285 HydrophobicContact CG1-CE2 4.32Å; I280-L303 HydrophobicContact CD1-CD1 3.92Å; I280-L303 HydrophobicContact CG1-CD1 4.35Å; I280-I307 HydrophobicContact CD1-CG1 3.92Å; I280-I307 HydrophobicContact CG1-CD1 4.2Å; I280-I307 HydrophobicContact CG1-CG1 3.81Å; I280-Q316 PolarHBondContact O-NE2 2.91Å; I280-L319 HydrophobicContact CG2-CD1 4.46Å; I280-L319 WeakPolarHBondContact O-CD1 3.49Å
281	I	96.1	Very high	94	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-73.4	-9.1	-173.9	-64.8	168.5	0	0	0	112.5	H248 L249 F250 P275 L276 A277 G279 G283 L319 L333 A337	H248-I281 HydrophobicContact CB-CD1 3.76Å; L249-I281 HydrophobicContact CB-CD1 4.29Å; L249-I281 HydrophobicContact CD1-CD1 4.42Å; L249-I281 HydrophobicContact CD1-CG2 3.95Å; L249-I281 HydrophobicContact CG-CD1 4.41Å; F250-I281 HydrophobicContact CD2-CD1 4.22Å; F250-I281 HydrophobicContact CD2-CG1 4.09Å; F250-I281 HydrophobicContact CE2-CD1 4.36Å; F250-I281 HydrophobicContact CE2-CG1 3.82Å; P275-I281 WeakPolarHBondContact O-CD1 3.19Å; L276-I281 HydrophobicContact CB-CB 4.47Å; L276-I281 HydrophobicContact CD2-CB 4.38Å; L276-I281 HydrophobicContact CD2-CG2 4.23Å; L276-I281 PolarHBondContact O-N 2.88Å; L276-I281 VanDerWaalsContact O-N 3.12Å; A277-I281 HydrophobicContact CB-CD1 3.87Å; A277-I281 HydrophobicContact CB-CG1 4.09Å; G279-I281 VanDerWaalsContact C-N 3.26Å; G279-I281 PolarHBondContact O-N 3.4Å; I281-G283 PolarHBondContact O-N 2.89Å; I281-L319 HydrophobicContact CB-CD2 4.23Å; I281-L319 HydrophobicContact CG1-CD2 4.23Å; I281-L319 HydrophobicContact CG2-CD2 3.96Å; I281-L333 WeakPolarHBondContact O-CD2 3.16Å; I281-L333 VanDerWaalsContact O-CG 3.29Å; I281-L333 WeakPolarHBondContact O-CG 3.05Å; I281-A337 HydrophobicContact CG2-CB 3.46Å; I281-A337 VanDerWaalsContact CG2-CB 3.46Å
282	T	93.5	Very high	93.4	Very high	38 Å²	38	44.2 Å²	44.2	23%	0.233	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-78.2	-1.4	177.1	86.1	0	0	0	0	113.4	L276 G279 I280 K284 P334	L276-T282 HydrophobicContact CD1-CG2 4.08Å; G279-T282 PolarHBondContact O-N 3.49Å; G279-T282 PolarHBondContact O-OG1 2.93Å; I280-T282 PolarHBondContact O-N 3.1Å; T282-K284 PolarHBondContact O-N 3.27Å; T282-K284 VanDerWaalsContact O-N 3.14Å; T282-K284 WeakPolarHBondContact OG1-CB 3.25Å; T282-K284 WeakPolarHBondContact OG1-CE 3.46Å; T282-K284 WeakPolarHBondContact OG1-CG 3.34Å; T282-K284 PolarHBondContact OG1-N 3.09Å; T282-K284 PolarHBondContact OG1-NZ 3.16Å; T282-P334 HydrophobicContact CG2-CG 3.92Å
283	G	90.4	Very high	93	Very high	22 Å²	22	44.5 Å²	44.5	23%	0.227	25%	0.254	C	S	.	.	S	Bend	trans	72.9	-3.1	-175.6	0	0	0	0	0	114.9	I280 I281 Y285 E286	I280-G283 PolarHBondContact O-N 3.13Å; I281-G283 PolarHBondContact O-N 2.89Å; G283-Y285 PolarHBondContact O-N 2.86Å; G283-E286 WeakPolarHBondContact O-CB 3.33Å; G283-E286 PolarHBondContact O-N 3Å; G283-E286 VanDerWaalsContact O-N 3.13Å
284	K	92.1	Very high	92.6	Very high	74 Å²	74	44 Å²	44	32%	0.322	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-11.8	-173.3	75.5	-179.5	110.3	-139.6	0	114.9	G279 T282 P290	G279-K284 WeakPolarHBondContact O-CE 3.34Å; T282-K284 PolarHBondContact O-N 3.27Å; T282-K284 VanDerWaalsContact O-N 3.14Å; T282-K284 WeakPolarHBondContact OG1-CB 3.25Å; T282-K284 WeakPolarHBondContact OG1-CE 3.46Å; T282-K284 WeakPolarHBondContact OG1-CG 3.34Å; T282-K284 PolarHBondContact OG1-N 3.09Å; T282-K284 PolarHBondContact OG1-NZ 3.16Å; K284-P290 VanDerWaalsContact O-CG 3.24Å; K284-P290 WeakPolarHBondContact O-CG 3.36Å
285	Y	92.9	Very high	92.3	Very high	8 Å²	8	43.2 Å²	43.2	3%	0.031	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	5.8	-177.4	-59.8	-66.8	0	0	0	114	G279 I280 G283 N287 G288 I289 S293 A295 I307	G279-Y285 WeakPolarHBondContact O-CE2 3.34Å; I280-Y285 HydrophobicContact CG1-CD2 4.39Å; I280-Y285 HydrophobicContact CG1-CE2 4.32Å; G283-Y285 PolarHBondContact O-N 2.86Å; Y285-N287 PolarHBondContact O-N 2.88Å; Y285-G288 CarbonylContact C-O 3.54Å; Y285-G288 VanDerWaalsContact CA-O 3.26Å; Y285-G288 WeakPolarHBondContact CA-O 3.42Å; Y285-G288 PolarHBondContact O-N 3.46Å; Y285-I289 HydrophobicContact CD1-CD1 3.75Å; Y285-I289 HydrophobicContact CE1-CD1 4.17Å; Y285-I289 HydrophobicContact CE1-CG2 4.47Å; Y285-S293 WeakPolarHBondContact CE1-OG 3.26Å; Y285-S293 WeakPolarHBondContact OH-CB 3.45Å; Y285-A295 HydrophobicContact CE1-CB 3.8Å; Y285-I307 HydrophobicContact CD1-CD1 3.92Å; Y285-I307 HydrophobicContact CD1-CG2 4.43Å; Y285-I307 HydrophobicContact CD2-CD1 3.83Å; Y285-I307 HydrophobicContact CD2-CG1 4.39Å; Y285-I307 HydrophobicContact CE1-CD1 3.82Å; Y285-I307 HydrophobicContact CE2-CD1 3.72Å; Y285-I307 HydrophobicContact CG-CD1 3.92Å; Y285-I307 HydrophobicContact CG-CG1 4.5Å; Y285-I307 HydrophobicContact CG-CG2 4.08Å
286	E	88.5	Confident	92	Very high	95 Å²	95	45.5 Å²	45.5	44%	0.444	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-40.7	179.9	-176.9	179.5	-171.8	0	0	112.3	G283 K320	G283-E286 WeakPolarHBondContact O-CB 3.33Å; G283-E286 PolarHBondContact O-N 3Å; G283-E286 VanDerWaalsContact O-N 3.13Å; E286-K320 WeakPolarHBondContact OE1-CE 3.44Å; E286-K320 IonicContact OE1-NZ 2.72Å; E286-K320 PolarHBondContact OE1-NZ 3.13Å
287	N	87.7	Confident	91.6	Very high	154 Å²	154	47.1 Å²	47.1	82%	0.824	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	30.7	-175.7	-61.5	-44.6	0	0	0	112.9	Y285	Y285-N287 PolarHBondContact O-N 2.88Å
288	G	90.3	Very high	91.1	Very high	40 Å²	40	56.9 Å²	56.9	41%	0.412	31%	0.312	S	S	.	.	S	Bend	trans	105.6	-162.4	-179.7	0	0	0	0	0	113.5	Y285 P290	Y285-G288 CarbonylContact C-O 3.54Å; Y285-G288 VanDerWaalsContact CA-O 3.26Å; Y285-G288 WeakPolarHBondContact CA-O 3.42Å; Y285-G288 PolarHBondContact O-N 3.46Å; G288-P290 WeakPolarHBondContact O-CD 3.14Å
289	I	93.3	Very high	90.8	Very high	46 Å²	46	60.4 Å²	60.4	24%	0.236	34%	0.337	C	S	.	.			trans	-100.8	108.5	-175.3	-54.5	-61.1	0	0	0	109.8	Y285 A295 K304 I307	Y285-I289 HydrophobicContact CD1-CD1 3.75Å; Y285-I289 HydrophobicContact CE1-CD1 4.17Å; Y285-I289 HydrophobicContact CE1-CG2 4.47Å; I289-A295 HydrophobicContact CD1-CB 4.25Å; I289-A295 HydrophobicContact CG2-CB 3.96Å; I289-K304 HydrophobicContact CD1-CG 4.4Å; I289-K304 HydrophobicContact CG1-CD 4.48Å; I289-K304 HydrophobicContact CG1-CG 4.14Å; I289-I307 HydrophobicContact CD1-CB 4.17Å; I289-I307 HydrophobicContact CD1-CD1 4.08Å; I289-I307 HydrophobicContact CD1-CG2 3.69Å
290	P	92.8	Very high	90.7	Very high	48 Å²	48	61.2 Å²	61.2	31%	0.312	34%	0.337	S	S	.	.			trans	-64.6	142.7	176.6	-19.1	31.3	0	0	0	111.6	K284 G288 S292 S293	K284-P290 VanDerWaalsContact O-CG 3.24Å; K284-P290 WeakPolarHBondContact O-CG 3.36Å; G288-P290 WeakPolarHBondContact O-CD 3.14Å; P290-S292 VanDerWaalsContact C-N 3.3Å; P290-S292 PolarHBondContact O-N 2.86Å; P290-S293 WeakPolarHBondContact O-CB 3.14Å; P290-S293 PolarHBondContact O-N 3.31Å; P290-S293 PolarHBondContact O-OG 3.39Å
291	E	89.1	Confident	90.5	Very high	186 Å²	186	65.5 Å²	65.5	87%	0.869	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-33.6	-176.1	-66.8	-172.7	167	0	0	113.7	S293 S296	E291-S293 VanDerWaalsContact C-N 3.29Å; E291-S293 PolarHBondContact O-N 2.93Å; E291-S296 WeakPolarHBondContact O-CB 3.48Å; E291-S296 PolarHBondContact O-OG 3.2Å
292	S	86.3	Confident	90.4	Very high	106 Å²	106	71.1 Å²	71.1	74%	0.741	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	0.4	178.2	59.6	0	0	0	0	113.8	P290	P290-S292 VanDerWaalsContact C-N 3.3Å; P290-S292 PolarHBondContact O-N 2.86Å
293	S	89.8	Confident	90.3	Very high	7 Å²	7	69.4 Å²	69.4	5%	0.049	37%	0.368	C	S	.	.	S	Bend	trans	-80.7	161	-174.7	79.5	0	0	0	0	112.9	Y285 P290 E291 A295 S296	Y285-S293 WeakPolarHBondContact CE1-OG 3.26Å; Y285-S293 WeakPolarHBondContact OH-CB 3.45Å; P290-S293 WeakPolarHBondContact O-CB 3.14Å; P290-S293 PolarHBondContact O-N 3.31Å; P290-S293 PolarHBondContact O-OG 3.39Å; E291-S293 VanDerWaalsContact C-N 3.29Å; E291-S293 PolarHBondContact O-N 2.93Å; S293-A295 PolarHBondContact O-N 3.34Å; S293-A295 PolarHBondContact OG-N 3.47Å; S293-S296 PolarHBondContact O-N 3.36Å; S293-S296 PolarHBondContact O-OG 3.41Å
294	R	90.3	Very high	90.4	Very high	31 Å²	31	72.3 Å²	72.3	12%	0.117	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-58	-33.7	174.9	-175.4	176.2	-67.9	-175.8	-2.3	112.9	V88 S296 M297 Y300 L303	V88-R294 HydrophobicContact CG1-CG 4.3Å; R294-S296 VanDerWaalsContact C-N 3.3Å; R294-S296 PolarHBondContact O-N 3.26Å; R294-M297 WeakPolarHBondContact O-CB 3.31Å; R294-M297 PolarHBondContact O-N 3.31Å; R294-Y300 HydrophobicContact CG-CD1 3.87Å; R294-Y300 HydrophobicContact CG-CE1 4.14Å; R294-Y300 HydrophobicContact CG-CG 4.16Å; R294-Y300 VanDerWaalsContact O-CB 3.31Å; R294-Y300 WeakPolarHBondContact O-CB 3.27Å; R294-L303 HydrophobicContact CB-CD2 4.12Å; R294-L303 HydrophobicContact CG-CD2 3.85Å
295	A	92.3	Very high	90.5	Very high	1 Å²	1	74 Å²	74	1%	0.008	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-76.9	-12.1	-176.1	0	0	0	0	0	114	Y285 I289 S293 L303 I307	Y285-A295 HydrophobicContact CE1-CB 3.8Å; I289-A295 HydrophobicContact CD1-CB 4.25Å; I289-A295 HydrophobicContact CG2-CB 3.96Å; S293-A295 PolarHBondContact O-N 3.34Å; S293-A295 PolarHBondContact OG-N 3.47Å; A295-L303 HydrophobicContact CB-CD2 4.03Å; A295-L303 HydrophobicContact CB-CG 4.05Å; A295-I307 HydrophobicContact CB-CD1 3.53Å
296	S	91.5	Very high	90.5	Very high	53 Å²	53	77.5 Å²	77.5	37%	0.371	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-83.5	-15.6	172.8	67.7	0	0	0	0	112.7	E291 S293 R294	E291-S296 WeakPolarHBondContact O-CB 3.48Å; E291-S296 PolarHBondContact O-OG 3.2Å; S293-S296 PolarHBondContact O-N 3.36Å; S293-S296 PolarHBondContact O-OG 3.41Å; R294-S296 VanDerWaalsContact C-N 3.3Å; R294-S296 PolarHBondContact O-N 3.26Å
297	M	89.1	Confident	90.7	Very high	52 Å²	52	73.4 Å²	73.4	26%	0.256	38%	0.38	S	S	.	.	S	Bend	trans	-68.5	134.8	-178.2	-63.1	177.5	72.4	0	0	110.9	V88 Q93 R294 S299 Y300	V88-M297 HydrophobicContact CG1-CE 4.24Å; V88-M297 HydrophobicContact CG1-SD 3.96Å; Q93-M297 HydrophobicContact CB-CE 4.2Å; Q93-M297 HydrophobicContact CB-SD 4.48Å; Q93-M297 HydrophobicContact CG-CE 4.41Å; Q93-M297 HydrophobicContact CG-SD 4.19Å; R294-M297 WeakPolarHBondContact O-CB 3.31Å; R294-M297 PolarHBondContact O-N 3.31Å; M297-S299 VanDerWaalsContact C-N 3.26Å; M297-S299 PolarHBondContact O-N 3.37Å; M297-S299 VanDerWaalsContact O-N 3.12Å; M297-Y300 HydrophobicContact CB-CD2 3.62Å; M297-Y300 HydrophobicContact CB-CE2 4.43Å; M297-Y300 HydrophobicContact CB-CG 4.36Å; M297-Y300 HydrophobicContact CE-CD2 4.4Å; M297-Y300 HydrophobicContact CE-CE2 4.08Å; M297-Y300 HydrophobicContact CG-CD2 4.45Å; M297-Y300 PolarHBondContact O-N 3.31Å; M297-Y300 HydrophobicContact SD-CD2 4.1Å; M297-Y300 HydrophobicContact SD-CE2 4.12Å
298	K	85.9	Confident	91	Very high	208 Å²	208	69.7 Å²	69.7	90%	0.904	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-53.2	-38.2	-176.2	-68.4	-174.9	179.1	-179.1	0	114	Y300	K298-Y300 PolarHBondContact O-N 3.05Å
299	S	87.5	Confident	91.2	Very high	89 Å²	89	69.7 Å²	69.7	62%	0.622	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-77.3	-2	179.3	47.6	0	0	0	0	114.5	M297	M297-S299 VanDerWaalsContact C-N 3.26Å; M297-S299 PolarHBondContact O-N 3.37Å; M297-S299 VanDerWaalsContact O-N 3.12Å
300	Y	90.6	Very high	91.2	Very high	25 Å²	25	73 Å²	73	10%	0.098	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-117.6	26.9	-175.7	-68.4	-95	0	0	0	112.7	W87 V88 R294 M297 K298 W302 L303 K304	W87-Y300 HydrophobicContact CZ2-CE1 4.13Å; V88-Y300 HydrophobicContact CG1-CE1 4.46Å; V88-Y300 HydrophobicContact CG1-CE2 4.06Å; V88-Y300 HydrophobicContact CG2-CE1 3.9Å; V88-Y300 WeakPolarHBondContact CG2-OH 3.25Å; R294-Y300 HydrophobicContact CG-CD1 3.87Å; R294-Y300 HydrophobicContact CG-CE1 4.14Å; R294-Y300 HydrophobicContact CG-CG 4.16Å; R294-Y300 VanDerWaalsContact O-CB 3.31Å; R294-Y300 WeakPolarHBondContact O-CB 3.27Å; M297-Y300 HydrophobicContact CB-CD2 3.62Å; M297-Y300 HydrophobicContact CB-CE2 4.43Å; M297-Y300 HydrophobicContact CB-CG 4.36Å; M297-Y300 HydrophobicContact CE-CD2 4.4Å; M297-Y300 HydrophobicContact CE-CE2 4.08Å; M297-Y300 HydrophobicContact CG-CD2 4.45Å; M297-Y300 PolarHBondContact O-N 3.31Å; M297-Y300 HydrophobicContact SD-CD2 4.1Å; M297-Y300 HydrophobicContact SD-CE2 4.12Å; K298-Y300 PolarHBondContact O-N 3.05Å; Y300-W302 AromaticContact CD1-CZ2 3.99Å; Y300-W302 HydrophobicContact CD1-CZ2 3.99Å; Y300-W302 AromaticContact CD1-NE1 3.85Å; Y300-W302 HydrophobicContact CE1-CZ2 4.37Å; Y300-W302 PolarHBondContact O-N 3.07Å; Y300-L303 WeakPolarHBondContact O-CB 3.37Å; Y300-L303 PolarHBondContact O-N 3.27Å; Y300-K304 PolarHBondContact O-N 3.22Å
301	Q	91.1	Very high	91.2	Very high	93 Å²	93	75.6 Å²	75.6	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-54.9	-36.6	176.5	-177.5	57.9	28	0	0	112.5	L303 K304 E305	Q301-L303 PolarHBondContact O-N 3.19Å; Q301-K304 WeakPolarHBondContact O-CB 3.28Å; Q301-K304 PolarHBondContact O-N 3.5Å; Q301-K304 VanDerWaalsContact O-N 3.15Å; Q301-E305 WeakPolarHBondContact CG-OE1 3.43Å; Q301-E305 PolarHBondContact NE2-OE1 3.38Å; Q301-E305 WeakPolarHBondContact O-CG 3.31Å; Q301-E305 PolarHBondContact O-N 3.38Å
302	W	93.3	Very high	91.4	Very high	118 Å²	118	66.8 Å²	66.8	45%	0.447	34%	0.342	S	S	.	.	H	α-helix	trans	-57.9	-34.1	173.4	68.5	-93.3	0	0	0	113.2	W87 Y300 K306	W87-W302 HydrophobicContact CH2-CZ2 4.36Å; Y300-W302 AromaticContact CD1-CZ2 3.99Å; Y300-W302 HydrophobicContact CD1-CZ2 3.99Å; Y300-W302 AromaticContact CD1-NE1 3.85Å; Y300-W302 HydrophobicContact CE1-CZ2 4.37Å; Y300-W302 PolarHBondContact O-N 3.07Å; W302-K306 WeakPolarHBondContact O-CB 3.48Å; W302-K306 PolarHBondContact O-N 2.99Å
303	L	92.8	Very high	91.7	Very high	1 Å²	1	69.1 Å²	69.1	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-74.4	-40.1	178.7	178.6	61.9	0	0	0	110.2	C278 I280 R294 A295 Y300 Q301 E305 K306 I307	C278-L303 HydrophobicContact CB-CD1 3.85Å; C278-L303 HydrophobicContact CB-CD2 3.76Å; C278-L303 HydrophobicContact CB-CG 4.49Å; I280-L303 HydrophobicContact CD1-CD1 3.92Å; I280-L303 HydrophobicContact CG1-CD1 4.35Å; R294-L303 HydrophobicContact CB-CD2 4.12Å; R294-L303 HydrophobicContact CG-CD2 3.85Å; A295-L303 HydrophobicContact CB-CD2 4.03Å; A295-L303 HydrophobicContact CB-CG 4.05Å; Y300-L303 WeakPolarHBondContact O-CB 3.37Å; Y300-L303 PolarHBondContact O-N 3.27Å; Q301-L303 PolarHBondContact O-N 3.19Å; L303-E305 VanDerWaalsContact C-N 3.35Å; L303-K306 PolarHBondContact O-N 3.36Å; L303-I307 HydrophobicContact CD1-CD1 4.22Å; L303-I307 HydrophobicContact CD1-CG1 4.47Å; L303-I307 HydrophobicContact CG-CD1 3.94Å; L303-I307 WeakPolarHBondContact O-CD1 3.39Å; L303-I307 VanDerWaalsContact O-CG1 3.25Å; L303-I307 WeakPolarHBondContact O-CG1 3.12Å; L303-I307 PolarHBondContact O-N 3.37Å
304	K	92.3	Very high	91.9	Very high	84 Å²	84	73.8 Å²	73.8	37%	0.365	35%	0.353	S	S	.	.	H	α-helix	trans	-58.8	-47.8	173.3	-179.4	172.5	179.4	-178	0	110.9	I289 Y300 Q301 K306 I307 V308	I289-K304 HydrophobicContact CD1-CG 4.4Å; I289-K304 HydrophobicContact CG1-CD 4.48Å; I289-K304 HydrophobicContact CG1-CG 4.14Å; Y300-K304 PolarHBondContact O-N 3.22Å; Q301-K304 WeakPolarHBondContact O-CB 3.28Å; Q301-K304 PolarHBondContact O-N 3.5Å; Q301-K304 VanDerWaalsContact O-N 3.15Å; K304-K306 PolarHBondContact O-N 3.23Å; K304-I307 PolarHBondContact O-N 2.75Å; K304-V308 WeakPolarHBondContact O-CG2 3.42Å; K304-V308 PolarHBondContact O-N 3.05Å
305	E	93.4	Very high	92.2	Very high	108 Å²	108	74 Å²	74	51%	0.505	36%	0.356	S	S	.	.	H	α-helix	trans	-59	-44.4	176.3	-74.3	164.7	-166.1	0	0	112	Q301 L303 I307 V308 S309	Q301-E305 WeakPolarHBondContact CG-OE1 3.43Å; Q301-E305 PolarHBondContact NE2-OE1 3.38Å; Q301-E305 WeakPolarHBondContact O-CG 3.31Å; Q301-E305 PolarHBondContact O-N 3.38Å; L303-E305 VanDerWaalsContact C-N 3.35Å; E305-I307 VanDerWaalsContact C-N 3.34Å; E305-I307 PolarHBondContact O-N 3.49Å; E305-V308 PolarHBondContact O-N 2.95Å; E305-S309 WeakPolarHBondContact O-CB 3.38Å; E305-S309 PolarHBondContact O-N 3.38Å
306	K	93.2	Very high	92.2	Very high	82 Å²	82	75 Å²	75	36%	0.357	36%	0.36	S	S	.	.	H	α-helix	trans	-59.2	-43.3	174.5	-173.6	174.9	-178.2	175.4	0	112.2	W302 L303 K304 S309 G312	W302-K306 WeakPolarHBondContact O-CB 3.48Å; W302-K306 PolarHBondContact O-N 2.99Å; L303-K306 PolarHBondContact O-N 3.36Å; K304-K306 PolarHBondContact O-N 3.23Å; K306-S309 WeakPolarHBondContact O-CB 3.38Å; K306-S309 PolarHBondContact O-OG 2.77Å; K306-G312 WeakPolarHBondContact O-CA 3.49Å
307	I	92.9	Very high	92.4	Very high	9 Å²	9	74.9 Å²	74.9	5%	0.046	36%	0.362	C	S	.	.	H	α-helix	trans	-66.2	-44.5	-179.4	-70.8	161.5	0	0	0	111.7	I280 Y285 I289 A295 L303 K304 E305 S309	I280-I307 HydrophobicContact CD1-CG1 3.92Å; I280-I307 HydrophobicContact CG1-CD1 4.2Å; I280-I307 HydrophobicContact CG1-CG1 3.81Å; Y285-I307 HydrophobicContact CD1-CD1 3.92Å; Y285-I307 HydrophobicContact CD1-CG2 4.43Å; Y285-I307 HydrophobicContact CD2-CD1 3.83Å; Y285-I307 HydrophobicContact CD2-CG1 4.39Å; Y285-I307 HydrophobicContact CE1-CD1 3.82Å; Y285-I307 HydrophobicContact CE2-CD1 3.72Å; Y285-I307 HydrophobicContact CG-CD1 3.92Å; Y285-I307 HydrophobicContact CG-CG1 4.5Å; Y285-I307 HydrophobicContact CG-CG2 4.08Å; I289-I307 HydrophobicContact CD1-CB 4.17Å; I289-I307 HydrophobicContact CD1-CD1 4.08Å; I289-I307 HydrophobicContact CD1-CG2 3.69Å; A295-I307 HydrophobicContact CB-CD1 3.53Å; L303-I307 HydrophobicContact CD1-CD1 4.22Å; L303-I307 HydrophobicContact CD1-CG1 4.47Å; L303-I307 HydrophobicContact CG-CD1 3.94Å; L303-I307 WeakPolarHBondContact O-CD1 3.39Å; L303-I307 VanDerWaalsContact O-CG1 3.25Å; L303-I307 WeakPolarHBondContact O-CG1 3.12Å; L303-I307 PolarHBondContact O-N 3.37Å; K304-I307 PolarHBondContact O-N 2.75Å; E305-I307 VanDerWaalsContact C-N 3.34Å; E305-I307 PolarHBondContact O-N 3.49Å; I307-S309 VanDerWaalsContact C-N 3.31Å; I307-S309 PolarHBondContact O-N 3.44Å
308	V	93.1	Very high	92.8	Very high	76 Å²	76	75.4 Å²	75.4	46%	0.461	36%	0.364	S	S	.	.	H	α-helix	trans	-82.6	-7.9	-177	-55.2	0	0	0	0	113.5	K304 E305 R313	K304-V308 WeakPolarHBondContact O-CG2 3.42Å; K304-V308 PolarHBondContact O-N 3.05Å; E305-V308 PolarHBondContact O-N 2.95Å; V308-R313 PolarHBondContact O-NH1 2.85Å
309	S	94.4	Very high	93.3	Very high	41 Å²	41	65.7 Å²	65.7	29%	0.287	32%	0.321	S	S	.	.	S	Bend	trans	-61.3	164.6	174.2	74.6	0	0	0	0	112.5	E305 K306 I307 D311 G312 R313	E305-S309 WeakPolarHBondContact O-CB 3.38Å; E305-S309 PolarHBondContact O-N 3.38Å; K306-S309 WeakPolarHBondContact O-CB 3.38Å; K306-S309 PolarHBondContact O-OG 2.77Å; I307-S309 VanDerWaalsContact C-N 3.31Å; I307-S309 PolarHBondContact O-N 3.44Å; S309-D311 VanDerWaalsContact C-N 3.32Å; S309-D311 PolarHBondContact O-N 2.83Å; S309-G312 PolarHBondContact O-N 3.33Å; S309-G312 PolarHBondContact OG-N 2.91Å; S309-R313 PolarHBondContact O-N 3.47Å
310	E	94.4	Very high	93.7	Very high	115 Å²	115	66.6 Å²	66.6	54%	0.537	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-43.7	175.1	-169	-173.3	150.7	0	0	111.9	G312 R313 K314	E310-G312 VanDerWaalsContact C-N 3.33Å; E310-G312 PolarHBondContact O-N 2.91Å; E310-R313 PolarHBondContact O-N 3.11Å; E310-K314 WeakPolarHBondContact O-CG 3.27Å; E310-K314 PolarHBondContact O-N 3.47Å; E310-K314 WeakPolarHBondContact OE1-CE 3.33Å; E310-K314 IonicContact OE1-NZ 2.75Å; E310-K314 PolarHBondContact OE1-NZ 2.75Å
311	D	93	Very high	94	Very high	103 Å²	103	70.1 Å²	70.1	55%	0.551	33%	0.332	S	S	*	.	H	α-helix	trans	-65.4	-37.9	176.7	-71.1	-20.9	0	0	0	111.9	S309 R313 K314 Q315	S309-D311 VanDerWaalsContact C-N 3.32Å; S309-D311 PolarHBondContact O-N 2.83Å; D311-R313 PolarHBondContact O-N 3.4Å; D311-K314 PolarHBondContact O-N 2.75Å; D311-Q315 VanDerWaalsContact O-CG 3.28Å; D311-Q315 WeakPolarHBondContact O-CG 3.35Å; D311-Q315 PolarHBondContact O-N 2.83Å
312	G	93.2	Very high	94.3	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-59.1	-45.1	172.8	0	0	0	0	0	112.1	K306 S309 E310 Q315 Q316	K306-G312 WeakPolarHBondContact O-CA 3.49Å; S309-G312 PolarHBondContact O-N 3.33Å; S309-G312 PolarHBondContact OG-N 2.91Å; E310-G312 VanDerWaalsContact C-N 3.33Å; E310-G312 PolarHBondContact O-N 2.91Å; G312-Q315 WeakPolarHBondContact O-CB 3.34Å; G312-Q315 PolarHBondContact O-N 3.25Å; G312-Q316 WeakPolarHBondContact O-CG 3.31Å; G312-Q316 PolarHBondContact O-N 2.58Å
313	R	92.4	Very high	94.4	Very high	154 Å²	154	62.8 Å²	62.8	58%	0.581	30%	0.304	S	S	*	.	H	α-helix	trans	-64.4	-41.4	175.2	-69.2	-170.6	-65.4	-97.3	3.5	112.7	V308 S309 E310 D311 Q315 Q316 A317	V308-R313 PolarHBondContact O-NH1 2.85Å; S309-R313 PolarHBondContact O-N 3.47Å; E310-R313 PolarHBondContact O-N 3.11Å; D311-R313 PolarHBondContact O-N 3.4Å; R313-Q315 VanDerWaalsContact C-N 3.3Å; R313-Q315 PolarHBondContact O-N 3.37Å; R313-Q316 PolarHBondContact O-N 3.34Å; R313-A317 PolarHBondContact O-N 3.02Å
314	K	94.4	Very high	94.6	Very high	105 Å²	105	67.8 Å²	67.8	46%	0.457	33%	0.327	S	S	.	.	H	α-helix	trans	-60.1	-40.1	173.6	-73.8	169.7	-179	164.7	0	111.6	E310 D311 A317 K318	E310-K314 WeakPolarHBondContact O-CG 3.27Å; E310-K314 PolarHBondContact O-N 3.47Å; E310-K314 WeakPolarHBondContact OE1-CE 3.33Å; E310-K314 IonicContact OE1-NZ 2.75Å; E310-K314 PolarHBondContact OE1-NZ 2.75Å; D311-K314 PolarHBondContact O-N 2.75Å; K314-A317 PolarHBondContact O-N 2.93Å; K314-K318 PolarHBondContact O-N 2.99Å
315	Q	95.1	Very high	94.9	Very high	36 Å²	36	64.3 Å²	64.3	17%	0.168	31%	0.312	C	S	.	.	H	α-helix	trans	-63	-45.2	173.7	-71	171.4	16.5	0	0	111.2	F250 D311 G312 R313 A317 K318 L319	F250-Q315 HydrophobicContact CD1-CB 4.46Å; F250-Q315 HydrophobicContact CD1-CG 3.78Å; F250-Q315 HydrophobicContact CD2-CB 4.27Å; F250-Q315 HydrophobicContact CD2-CG 3.97Å; F250-Q315 HydrophobicContact CE1-CB 4.05Å; F250-Q315 HydrophobicContact CE1-CG 3.83Å; F250-Q315 HydrophobicContact CE2-CB 3.84Å; F250-Q315 HydrophobicContact CE2-CG 4.02Å; F250-Q315 HydrophobicContact CG-CG 3.85Å; F250-Q315 HydrophobicContact CZ-CB 3.72Å; F250-Q315 HydrophobicContact CZ-CG 3.95Å; D311-Q315 VanDerWaalsContact O-CG 3.28Å; D311-Q315 WeakPolarHBondContact O-CG 3.35Å; D311-Q315 PolarHBondContact O-N 2.83Å; G312-Q315 WeakPolarHBondContact O-CB 3.34Å; G312-Q315 PolarHBondContact O-N 3.25Å; R313-Q315 VanDerWaalsContact C-N 3.3Å; R313-Q315 PolarHBondContact O-N 3.37Å; Q315-A317 VanDerWaalsContact C-N 3.32Å; Q315-A317 PolarHBondContact O-N 2.94Å; Q315-K318 PolarHBondContact O-N 3.18Å; Q315-L319 WeakPolarHBondContact O-CG 3.43Å; Q315-L319 PolarHBondContact O-N 2.99Å
316	Q	93.5	Very high	95.1	Very high	21 Å²	21	59.2 Å²	59.2	10%	0.098	29%	0.288	C	S	.	.	H	α-helix	trans	-59.6	-40.2	177.2	-66.8	-55.2	-47.5	0	0	112.7	I280 G312 R313 K318 L319 K320	I280-Q316 PolarHBondContact O-NE2 2.91Å; G312-Q316 WeakPolarHBondContact O-CG 3.31Å; G312-Q316 PolarHBondContact O-N 2.58Å; R313-Q316 PolarHBondContact O-N 3.34Å; Q316-K318 PolarHBondContact O-N 3.15Å; Q316-L319 WeakPolarHBondContact O-CB 3.32Å; Q316-L319 PolarHBondContact O-N 3.45Å; Q316-K320 PolarHBondContact O-N 3.3Å
317	A	94.8	Very high	95.3	Very high	51 Å²	51	60.9 Å²	60.9	42%	0.421	30%	0.298	S	S	.	.	H	α-helix	trans	-59	-47.2	175.1	0	0	0	0	0	111.8	R313 K314 Q315 L319 K320 E321	R313-A317 PolarHBondContact O-N 3.02Å; K314-A317 PolarHBondContact O-N 2.93Å; Q315-A317 VanDerWaalsContact C-N 3.32Å; Q315-A317 PolarHBondContact O-N 2.94Å; A317-L319 VanDerWaalsContact C-N 3.28Å; A317-L319 PolarHBondContact O-N 3.05Å; A317-K320 WeakPolarHBondContact O-CB 3.22Å; A317-K320 PolarHBondContact O-N 3.37Å; A317-K320 VanDerWaalsContact O-N 3.1Å; A317-E321 PolarHBondContact O-N 2.83Å
318	K	97.1	Very high	95.5	Very high	64 Å²	64	68.9 Å²	68.9	28%	0.278	33%	0.332	S	S	.	.	H	α-helix	trans	-61.6	-34.6	175.7	-69	176.5	173.4	-178.1	0	112.7	F250 K314 Q315 Q316 K320 E321 L322 I384 L385	F250-K318 HydrophobicContact CE1-CB 4.42Å; F250-K318 HydrophobicContact CE1-CD 4.34Å; K314-K318 PolarHBondContact O-N 2.99Å; Q315-K318 PolarHBondContact O-N 3.18Å; Q316-K318 PolarHBondContact O-N 3.15Å; K318-K320 VanDerWaalsContact C-N 3.28Å; K318-K320 PolarHBondContact O-N 2.92Å; K318-E321 PolarHBondContact O-N 2.97Å; K318-L322 VanDerWaalsContact O-CG 3.28Å; K318-L322 WeakPolarHBondContact O-CG 3.38Å; K318-L322 PolarHBondContact O-N 3Å; K318-I384 HydrophobicContact CB-CG2 4.09Å; K318-I384 WeakPolarHBondContact CD-O 3.43Å; K318-I384 WeakPolarHBondContact CE-O 2.95Å; K318-I384 HydrophobicContact CG-CG2 4.35Å; K318-L385 PolarHBondContact NZ-O 3.46Å
319	L	97.1	Very high	95.7	Very high	4 Å²	4	66.4 Å²	66.4	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-32.7	176.2	-67.3	175.9	0	0	0	112.3	F250 I280 I281 Q315 Q316 A317 L322 N323 L333	F250-L319 HydrophobicContact CE2-CD2 3.92Å; F250-L319 HydrophobicContact CE2-CG 4.26Å; F250-L319 HydrophobicContact CZ-CD2 3.81Å; F250-L319 HydrophobicContact CZ-CG 4.03Å; I280-L319 HydrophobicContact CG2-CD1 4.46Å; I280-L319 WeakPolarHBondContact O-CD1 3.49Å; I281-L319 HydrophobicContact CB-CD2 4.23Å; I281-L319 HydrophobicContact CG1-CD2 4.23Å; I281-L319 HydrophobicContact CG2-CD2 3.96Å; Q315-L319 WeakPolarHBondContact O-CG 3.43Å; Q315-L319 PolarHBondContact O-N 2.99Å; Q316-L319 WeakPolarHBondContact O-CB 3.32Å; Q316-L319 PolarHBondContact O-N 3.45Å; A317-L319 VanDerWaalsContact C-N 3.28Å; A317-L319 PolarHBondContact O-N 3.05Å; L319-L322 HydrophobicContact CD2-CD1 4.11Å; L319-L322 PolarHBondContact O-N 3.05Å; L319-N323 WeakPolarHBondContact O-CB 3.44Å; L319-N323 PolarHBondContact O-N 2.99Å; L319-L333 HydrophobicContact CB-CD2 4.06Å; L319-L333 HydrophobicContact CD2-CD2 4.1Å
320	K	95	Very high	95.8	Very high	107 Å²	107	67.6 Å²	67.6	47%	0.465	34%	0.335	S	S	.	.	H	α-helix	trans	-63.6	-45.4	174.1	-56.4	-167.4	-167	-155.4	0	111.3	E286 Q316 A317 K318 L322 N323	E286-K320 WeakPolarHBondContact OE1-CE 3.44Å; E286-K320 IonicContact OE1-NZ 2.72Å; E286-K320 PolarHBondContact OE1-NZ 3.13Å; Q316-K320 PolarHBondContact O-N 3.3Å; A317-K320 WeakPolarHBondContact O-CB 3.22Å; A317-K320 PolarHBondContact O-N 3.37Å; A317-K320 VanDerWaalsContact O-N 3.1Å; K318-K320 VanDerWaalsContact C-N 3.28Å; K318-K320 PolarHBondContact O-N 2.92Å; K320-L322 PolarHBondContact O-N 3.27Å; K320-N323 WeakPolarHBondContact O-CB 3.45Å; K320-N323 PolarHBondContact O-N 2.97Å
321	E	96.8	Very high	96	Very high	100 Å²	100	62.9 Å²	62.9	47%	0.467	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-41.7	176.8	-64.5	178.9	-113.7	0	0	111.8	A317 K318 N323 H324 I384	A317-E321 PolarHBondContact O-N 2.83Å; K318-E321 PolarHBondContact O-N 2.97Å; E321-N323 VanDerWaalsContact C-N 3.27Å; E321-N323 PolarHBondContact O-N 3.2Å; E321-H324 WeakPolarHBondContact O-CB 3.43Å; E321-H324 PolarHBondContact O-N 3.48Å; E321-I384 HydrophobicContact CB-CD1 4.01Å; E321-I384 HydrophobicContact CB-CG1 4.2Å; E321-I384 HydrophobicContact CB-CG2 3.76Å
322	L	97.8	Very high	96.2	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-30.1	175.3	-69.9	166	0	0	0	112.8	L249 K318 L319 K320 H324 I325 A326 L333 I381 I384 L385	L249-L322 HydrophobicContact CD1-CD1 3.8Å; K318-L322 VanDerWaalsContact O-CG 3.28Å; K318-L322 WeakPolarHBondContact O-CG 3.38Å; K318-L322 PolarHBondContact O-N 3Å; L319-L322 HydrophobicContact CD2-CD1 4.11Å; L319-L322 PolarHBondContact O-N 3.05Å; K320-L322 PolarHBondContact O-N 3.27Å; L322-H324 PolarHBondContact O-N 3.17Å; L322-I325 HydrophobicContact CD2-CD1 4.46Å; L322-I325 WeakPolarHBondContact O-CB 3.43Å; L322-I325 PolarHBondContact O-N 3.34Å; L322-I325 VanDerWaalsContact O-N 3.08Å; L322-A326 PolarHBondContact O-N 3.14Å; L322-L333 HydrophobicContact CB-CD1 3.76Å; L322-I381 HydrophobicContact CD2-CB 4.24Å; L322-I381 HydrophobicContact CD2-CG1 3.94Å; L322-I381 HydrophobicContact CD2-CG2 3.97Å; L322-I384 HydrophobicContact CD2-CB 4.39Å; L322-I384 HydrophobicContact CD2-CD1 4.09Å; L322-I384 HydrophobicContact CD2-CG2 4.26Å; L322-I384 HydrophobicContact CG-CD1 4.5Å; L322-I384 HydrophobicContact CG-CG2 4Å; L322-L385 HydrophobicContact CD1-CD2 4.01Å
323	N	96.6	Very high	96.4	Very high	56 Å²	56	60.7 Å²	60.7	30%	0.299	30%	0.304	S	S	.	.	H	α-helix	trans	-62.4	-34.6	177	-165.6	66.4	0	0	0	111.6	L319 K320 E321 I325 A326 E327	L319-N323 WeakPolarHBondContact O-CB 3.44Å; L319-N323 PolarHBondContact O-N 2.99Å; K320-N323 WeakPolarHBondContact O-CB 3.45Å; K320-N323 PolarHBondContact O-N 2.97Å; E321-N323 VanDerWaalsContact C-N 3.27Å; E321-N323 PolarHBondContact O-N 3.2Å; N323-I325 VanDerWaalsContact C-N 3.28Å; N323-I325 PolarHBondContact O-N 3.34Å; N323-A326 WeakPolarHBondContact O-CB 3.46Å; N323-A326 PolarHBondContact O-N 3.25Å; N323-A326 VanDerWaalsContact O-N 3.12Å; N323-E327 PolarHBondContact ND2-OE1 2.98Å; N323-E327 WeakPolarHBondContact O-CG 3.43Å; N323-E327 PolarHBondContact O-N 2.57Å
324	H	96.9	Very high	96.7	Very high	106 Å²	106	53.7 Å²	53.7	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-32.9	173.7	-62.3	-42.6	0	0	0	113	E321 L322 E327 K328	E321-H324 WeakPolarHBondContact O-CB 3.43Å; E321-H324 PolarHBondContact O-N 3.48Å; L322-H324 PolarHBondContact O-N 3.17Å; H324-E327 IonicContact ND1-OE2 2.7Å; H324-E327 PolarHBondContact ND1-OE2 3.46Å; H324-K328 VanDerWaalsContact O-CG 3.27Å; H324-K328 WeakPolarHBondContact O-CG 3.13Å; H324-K328 PolarHBondContact O-N 3.08Å; H324-K328 VanDerWaalsContact O-N 3.14Å
325	I	97.7	Very high	96.9	Very high	11 Å²	11	50.2 Å²	50.2	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-68.7	-43.9	172.3	-61.2	-178.8	0	0	0	109.9	L322 N323 E327 K328 L329 L336 I377 D380 I381 I384	L322-I325 HydrophobicContact CD2-CD1 4.46Å; L322-I325 WeakPolarHBondContact O-CB 3.43Å; L322-I325 PolarHBondContact O-N 3.34Å; L322-I325 VanDerWaalsContact O-N 3.08Å; N323-I325 VanDerWaalsContact C-N 3.28Å; N323-I325 PolarHBondContact O-N 3.34Å; I325-E327 VanDerWaalsContact C-N 3.35Å; I325-E327 PolarHBondContact O-N 2.93Å; I325-K328 PolarHBondContact O-N 3.48Å; I325-L329 HydrophobicContact CG2-CD1 3.96Å; I325-L329 HydrophobicContact CG2-CG 4.45Å; I325-L329 WeakPolarHBondContact O-CG 3.27Å; I325-L329 PolarHBondContact O-N 3.17Å; I325-L336 HydrophobicContact CB-CD2 4.22Å; I325-L336 HydrophobicContact CG2-CD1 4.4Å; I325-L336 HydrophobicContact CG2-CD2 4.1Å; I325-I377 HydrophobicContact CG2-CD1 4.33Å; I325-I377 HydrophobicContact CG2-CG2 4.11Å; I325-D380 HydrophobicContact CD1-CB 3.73Å; I325-I381 HydrophobicContact CD1-CG1 3.88Å; I325-I384 HydrophobicContact CD1-CD1 3.55Å; I325-I384 HydrophobicContact CG1-CD1 4.3Å
326	A	97.9	Very high	97.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-45.3	178.1	0	0	0	0	0	111.7	L322 N323 L329 G330 C331 L336	L322-A326 PolarHBondContact O-N 3.14Å; N323-A326 WeakPolarHBondContact O-CB 3.46Å; N323-A326 PolarHBondContact O-N 3.25Å; N323-A326 VanDerWaalsContact O-N 3.12Å; A326-L329 CarbonylContact O-C 3.55Å; A326-L329 PolarHBondContact O-N 3.1Å; A326-G330 PolarHBondContact O-N 3.23Å; A326-C331 CarbonylContact C-O 3.37Å; A326-C331 VanDerWaalsContact C-O 3.32Å; A326-C331 WeakPolarHBondContact CB-O 3.38Å; A326-C331 PolarHBondContact O-N 3.24Å; A326-C331 VanDerWaalsContact O-O 3.09Å; A326-L336 HydrophobicContact CB-CB 4.27Å; A326-L336 HydrophobicContact CB-CD2 4.02Å
327	E	97.2	Very high	97.3	Very high	117 Å²	117	47.7 Å²	47.7	55%	0.547	25%	0.252	S	S	.	.	H	α-helix	trans	-58.1	-48.6	175.1	-73.6	168.7	173.6	0	0	111.9	N323 H324 I325 L329 G330	N323-E327 PolarHBondContact ND2-OE1 2.98Å; N323-E327 WeakPolarHBondContact O-CG 3.43Å; N323-E327 PolarHBondContact O-N 2.57Å; H324-E327 IonicContact ND1-OE2 2.7Å; H324-E327 PolarHBondContact ND1-OE2 3.46Å; I325-E327 VanDerWaalsContact C-N 3.35Å; I325-E327 PolarHBondContact O-N 2.93Å; E327-L329 PolarHBondContact O-N 2.87Å; E327-G330 PolarHBondContact O-N 3.46Å
328	K	96.7	Very high	97.5	Very high	177 Å²	177	45.2 Å²	45.2	77%	0.77	23%	0.232	S	C	*	.	H	α-helix	trans	-59	-34.5	176.7	-75.5	173.4	-177.7	179.4	0	112.8	H324 I325 G330	H324-K328 VanDerWaalsContact O-CG 3.27Å; H324-K328 WeakPolarHBondContact O-CG 3.13Å; H324-K328 PolarHBondContact O-N 3.08Å; H324-K328 VanDerWaalsContact O-N 3.14Å; I325-K328 PolarHBondContact O-N 3.48Å; K328-G330 VanDerWaalsContact C-N 3.3Å
329	L	97.1	Very high	97.5	Very high	25 Å²	25	42.2 Å²	42.2	13%	0.131	22%	0.219	C	C	.	.	H	α-helix	trans	-85	-5.3	178.9	-65.1	178.7	0	0	0	113.2	I325 A326 E327 L336 K372 I377	I325-L329 HydrophobicContact CG2-CD1 3.96Å; I325-L329 HydrophobicContact CG2-CG 4.45Å; I325-L329 WeakPolarHBondContact O-CG 3.27Å; I325-L329 PolarHBondContact O-N 3.17Å; A326-L329 CarbonylContact O-C 3.55Å; A326-L329 PolarHBondContact O-N 3.1Å; E327-L329 PolarHBondContact O-N 2.87Å; L329-L336 HydrophobicContact CD1-CD1 3.8Å; L329-K372 HydrophobicContact CD2-CB 4.24Å; L329-K372 PolarHBondContact O-NZ 3.44Å; L329-I377 HydrophobicContact CD1-CD1 4.29Å; L329-I377 HydrophobicContact CD1-CG1 4.43Å; L329-I377 HydrophobicContact CD1-CG2 3.94Å; L329-I377 HydrophobicContact CD2-CD1 3.99Å; L329-I377 HydrophobicContact CD2-CG1 4.27Å; L329-I377 HydrophobicContact CG-CD1 4.4Å
330	G	97.5	Very high	97.6	Very high	65 Å²	65	42 Å²	42	67%	0.67	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	41	-176.9	0	0	0	0	0	112.3	A326 E327 K328	A326-G330 PolarHBondContact O-N 3.23Å; E327-G330 PolarHBondContact O-N 3.46Å; K328-G330 VanDerWaalsContact C-N 3.3Å
331	C	98.1	Very high	97.8	Very high	16 Å²	16	36.9 Å²	36.9	11%	0.108	20%	0.196	C	C	.	.	S	Bend	trans	-135.6	168.1	177.4	69.9	0	0	0	0	111.5	A326 Q335 V369	A326-C331 CarbonylContact C-O 3.37Å; A326-C331 VanDerWaalsContact C-O 3.32Å; A326-C331 WeakPolarHBondContact CB-O 3.38Å; A326-C331 PolarHBondContact O-N 3.24Å; A326-C331 VanDerWaalsContact O-O 3.09Å; C331-Q335 HydrophobicContact CB-CB 4.12Å; C331-V369 HydrophobicContact CB-CG1 4.46Å; C331-V369 HydrophobicContact CB-CG2 3.41Å; C331-V369 VanDerWaalsContact CB-CG2 3.41Å
332	T	98.2	Very high	97.8	Very high	50 Å²	50	32.1 Å²	32.1	31%	0.307	17%	0.173	S	C	.	.			trans	-81.3	159.8	173.3	72.5	0	0	0	0	111.2	P334 Q335 L336 E362	T332-P334 WeakPolarHBondContact OG1-CD 3.29Å; T332-Q335 VanDerWaalsContact N-OE1 3.07Å; T332-Q335 WeakPolarHBondContact O-CB 3.3Å; T332-Q335 PolarHBondContact O-N 3.27Å; T332-Q335 VanDerWaalsContact O-N 3.17Å; T332-Q335 VanDerWaalsContact OG1-CG 3.29Å; T332-Q335 WeakPolarHBondContact OG1-CG 3.36Å; T332-Q335 PolarHBondContact OG1-N 3.12Å; T332-L336 PolarHBondContact O-N 3.02Å; T332-E362 WeakPolarHBondContact CB-OE1 3.47Å; T332-E362 HydrophobicContact CG2-CG 4.13Å; T332-E362 WeakPolarHBondContact CG2-OE1 3.34Å; T332-E362 PolarHBondContact OG1-OE1 2.98Å
333	L	97.7	Very high	97.6	Very high	8 Å²	8	34.7 Å²	34.7	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-40.2	175	-177	60.9	0	0	0	113	I281 L319 L322 Q335 L336 A337	I281-L333 WeakPolarHBondContact O-CD2 3.16Å; I281-L333 VanDerWaalsContact O-CG 3.29Å; I281-L333 WeakPolarHBondContact O-CG 3.05Å; L319-L333 HydrophobicContact CB-CD2 4.06Å; L319-L333 HydrophobicContact CD2-CD2 4.1Å; L322-L333 HydrophobicContact CB-CD1 3.76Å; L333-Q335 PolarHBondContact O-N 3.32Å; L333-L336 HydrophobicContact CD1-CD2 4.31Å; L333-L336 PolarHBondContact O-N 3.35Å; L333-A337 WeakPolarHBondContact O-CB 3.46Å; L333-A337 PolarHBondContact O-N 3.47Å
334	P	98.1	Very high	97.2	Very high	7 Å²	7	33.9 Å²	33.9	5%	0.045	18%	0.178	C	C	.	.	H	α-helix	trans	-57.5	-44	169.6	-28.9	37.4	0	0	0	113.9	L276 T282 T332 A337 V338 E362	L276-P334 HydrophobicContact CD1-CB 4.07Å; L276-P334 HydrophobicContact CD2-CB 4.01Å; T282-P334 HydrophobicContact CG2-CG 3.92Å; T332-P334 WeakPolarHBondContact OG1-CD 3.29Å; P334-A337 PolarHBondContact O-N 2.89Å; P334-V338 WeakPolarHBondContact O-CG2 3.47Å; P334-V338 PolarHBondContact O-N 3.3Å; P334-E362 VanDerWaalsContact CG-OE1 3.27Å; P334-E362 WeakPolarHBondContact CG-OE1 3.42Å
335	Q	98.4	Very high	96.6	Very high	33 Å²	33	37 Å²	37	15%	0.154	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-43.9	177	-73.3	173.3	-17.4	0	0	111.8	C331 T332 L333 A337 A339 E362 A366 V369	C331-Q335 HydrophobicContact CB-CB 4.12Å; T332-Q335 VanDerWaalsContact N-OE1 3.07Å; T332-Q335 WeakPolarHBondContact O-CB 3.3Å; T332-Q335 PolarHBondContact O-N 3.27Å; T332-Q335 VanDerWaalsContact O-N 3.17Å; T332-Q335 VanDerWaalsContact OG1-CG 3.29Å; T332-Q335 WeakPolarHBondContact OG1-CG 3.36Å; T332-Q335 PolarHBondContact OG1-N 3.12Å; L333-Q335 PolarHBondContact O-N 3.32Å; Q335-A337 PolarHBondContact O-N 3.11Å; Q335-A339 WeakPolarHBondContact O-CB 3.35Å; Q335-A339 PolarHBondContact O-N 3.43Å; Q335-E362 HydrophobicContact CG-CG 4.23Å; Q335-E362 WeakPolarHBondContact CG-O 3.47Å; Q335-E362 PolarHBondContact NE2-O 3.34Å; Q335-A366 HydrophobicContact CB-CB 4.38Å; Q335-A366 WeakPolarHBondContact O-CB 3.25Å; Q335-V369 HydrophobicContact CB-CG2 4Å
336	L	98.6	Very high	96.2	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-57.9	-48.4	175.7	-177.6	66.4	0	0	0	111.1	I325 A326 L329 T332 L333 A339 W340 V369 M373 I381	I325-L336 HydrophobicContact CB-CD2 4.22Å; I325-L336 HydrophobicContact CG2-CD1 4.4Å; I325-L336 HydrophobicContact CG2-CD2 4.1Å; A326-L336 HydrophobicContact CB-CB 4.27Å; A326-L336 HydrophobicContact CB-CD2 4.02Å; L329-L336 HydrophobicContact CD1-CD1 3.8Å; T332-L336 PolarHBondContact O-N 3.02Å; L333-L336 HydrophobicContact CD1-CD2 4.31Å; L333-L336 PolarHBondContact O-N 3.35Å; L336-A339 PolarHBondContact O-N 3.29Å; L336-W340 VanDerWaalsContact O-CB 3.22Å; L336-W340 WeakPolarHBondContact O-CB 3.27Å; L336-W340 PolarHBondContact O-N 2.86Å; L336-V369 HydrophobicContact CD1-CG1 4.45Å; L336-M373 HydrophobicContact CD1-CE 3.84Å; L336-I381 HydrophobicContact CD1-CD1 4.21Å; L336-I381 HydrophobicContact CG-CD1 4.46Å
337	A	98.4	Very high	96.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-42.8	-177.6	0	0	0	0	0	113.1	L249 L276 I281 L333 P334 Q335 W340 C341	L249-A337 HydrophobicContact CD1-CB 4.03Å; L249-A337 HydrophobicContact CG-CB 4.43Å; L276-A337 HydrophobicContact CD2-CB 3.88Å; I281-A337 HydrophobicContact CG2-CB 3.46Å; I281-A337 VanDerWaalsContact CG2-CB 3.46Å; L333-A337 WeakPolarHBondContact O-CB 3.46Å; L333-A337 PolarHBondContact O-N 3.47Å; P334-A337 PolarHBondContact O-N 2.89Å; Q335-A337 PolarHBondContact O-N 3.11Å; A337-W340 PolarHBondContact O-N 3.09Å; A337-C341 PolarHBondContact O-N 3.4Å; A337-C341 PolarHBondContact O-SG 3.48Å
338	V	98.4	Very high	96.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-44.3	176.6	172.6	0	0	0	0	110.7	L82 P275 L276 P334 W340 C341 L342 L352 A366	L82-V338 HydrophobicContact CD2-CG1 3.62Å; P275-V338 HydrophobicContact CB-CG2 4.19Å; P275-V338 HydrophobicContact CG-CG2 4.31Å; L276-V338 HydrophobicContact CD2-CG2 4.09Å; L276-V338 HydrophobicContact CG-CG2 4.4Å; P334-V338 WeakPolarHBondContact O-CG2 3.47Å; P334-V338 PolarHBondContact O-N 3.3Å; V338-W340 VanDerWaalsContact C-N 3.3Å; V338-W340 PolarHBondContact O-N 3.06Å; V338-C341 WeakPolarHBondContact O-CB 3.47Å; V338-C341 PolarHBondContact O-N 2.86Å; V338-C341 VanDerWaalsContact O-N 3.16Å; V338-L342 HydrophobicContact CG1-CD1 4.49Å; V338-L342 PolarHBondContact O-N 3.22Å; V338-L342 VanDerWaalsContact O-N 3.1Å; V338-L352 HydrophobicContact CG1-CD2 4.06Å; V338-L352 HydrophobicContact CG2-CD2 3.97Å; V338-A366 HydrophobicContact CB-CB 3.65Å; V338-A366 HydrophobicContact CG1-CB 3.54Å
339	A	98.1	Very high	96.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-39	176.2	0	0	0	0	0	111.8	Q335 L336 C341 L342 R343 A366 V369 M373	Q335-A339 WeakPolarHBondContact O-CB 3.35Å; Q335-A339 PolarHBondContact O-N 3.43Å; L336-A339 PolarHBondContact O-N 3.29Å; A339-C341 VanDerWaalsContact C-N 3.33Å; A339-C341 PolarHBondContact O-N 2.86Å; A339-L342 PolarHBondContact O-N 3.48Å; A339-L342 VanDerWaalsContact O-N 3.14Å; A339-R343 PolarHBondContact O-N 3.08Å; A339-A366 HydrophobicContact CB-CB 4.35Å; A339-A366 WeakPolarHBondContact CB-O 3.45Å; A339-V369 HydrophobicContact CB-CB 3.73Å; A339-V369 HydrophobicContact CB-CG1 3.86Å; A339-M373 HydrophobicContact CB-CE 4.17Å
340	W	98.5	Very high	96.4	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-42.1	174.1	180	95	0	0	0	111.1	Y247 L249 R252 E256 L336 A337 V338 L342 R343 M373 L385	Y247-W340 HydrophobicContact CD2-CZ3 4.48Å; Y247-W340 HydrophobicContact CE1-CE3 4.49Å; Y247-W340 AromaticContact CE1-CZ3 3.94Å; Y247-W340 HydrophobicContact CE1-CZ3 3.94Å; Y247-W340 AromaticContact CE2-CH2 3.85Å; Y247-W340 HydrophobicContact CE2-CH2 3.85Å; Y247-W340 AromaticContact CE2-CZ3 3.74Å; Y247-W340 HydrophobicContact CE2-CZ3 3.74Å; Y247-W340 AromaticContact CZ-CH2 3.71Å; Y247-W340 AromaticContact CZ-CZ3 3.42Å; Y247-W340 VanDerWaalsContact CZ-CZ3 3.42Å; Y247-W340 VanDerWaalsContact OH-CH2 3.32Å; Y247-W340 WeakPolarHBondContact OH-CH2 3.11Å; Y247-W340 WeakPolarHBondContact OH-CZ3 3.4Å; L249-W340 HydrophobicContact CD2-CB 4.25Å; L249-W340 HydrophobicContact CD2-CD2 3.36Å; L249-W340 HydrophobicContact CD2-CE3 3.62Å; L249-W340 HydrophobicContact CD2-CG 3.69Å; L249-W340 HydrophobicContact CD2-CH2 4.45Å; L249-W340 HydrophobicContact CD2-CZ2 4.21Å; L249-W340 HydrophobicContact CD2-CZ3 4.18Å; L249-W340 HydrophobicContact CG-CE3 4.42Å; R252-W340 HydrophobicContact CG-CH2 3.89Å; E256-W340 WeakPolarHBondContact OE1-CH2 3.41Å; L336-W340 VanDerWaalsContact O-CB 3.22Å; L336-W340 WeakPolarHBondContact O-CB 3.27Å; L336-W340 PolarHBondContact O-N 2.86Å; A337-W340 PolarHBondContact O-N 3.09Å; V338-W340 VanDerWaalsContact C-N 3.3Å; V338-W340 PolarHBondContact O-N 3.06Å; W340-L342 VanDerWaalsContact C-N 3.28Å; W340-L342 PolarHBondContact O-N 2.91Å; W340-R343 VanDerWaalsContact CE2-NH2 3.31Å; W340-R343 VanDerWaalsContact CZ2-CZ 3.4Å; W340-R343 VanDerWaalsContact CZ2-NH1 3.28Å; W340-R343 VanDerWaalsContact NE1-CZ 3.27Å; W340-R343 WeakPolarHBondContact O-CB 3.24Å; W340-R343 VanDerWaalsContact O-CD 3.28Å; W340-R343 WeakPolarHBondContact O-CD 3.4Å; W340-R343 WeakPolarHBondContact O-CG 3.44Å; W340-R343 PolarHBondContact O-N 3.37Å; W340-R343 PolarHBondContact O-NH1 3.33Å; W340-M373 HydrophobicContact CB-CE 3.95Å; W340-L385 HydrophobicContact CZ2-CD1 4.46Å
341	C	98.3	Very high	96.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61	-38.9	174.7	-65.2	0	0	0	0	111.8	Y247 A337 V338 A339 R343 V350	Y247-C341 HydrophobicContact CD1-CB 3.94Å; Y247-C341 HydrophobicContact CE1-CB 4.11Å; A337-C341 PolarHBondContact O-N 3.4Å; A337-C341 PolarHBondContact O-SG 3.48Å; V338-C341 WeakPolarHBondContact O-CB 3.47Å; V338-C341 PolarHBondContact O-N 2.86Å; V338-C341 VanDerWaalsContact O-N 3.16Å; A339-C341 VanDerWaalsContact C-N 3.33Å; A339-C341 PolarHBondContact O-N 2.86Å; C341-R343 VanDerWaalsContact C-N 3.34Å; C341-R343 PolarHBondContact O-N 3.04Å; C341-V350 HydrophobicContact CB-CG2 3.79Å
342	L	96.9	Very high	96.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-76.6	-14.6	-179.5	-70.7	177.5	0	0	0	115.5	R70 C81 L82 V338 A339 W340 N344 V350 L370	R70-L342 PolarHBondContact NH1-O 2.91Å; R70-L342 PolarHBondContact NH2-O 3.25Å; C81-L342 HydrophobicContact CB-CD2 4.05Å; C81-L342 WeakPolarHBondContact O-CD2 3.14Å; L82-L342 HydrophobicContact CD2-CD1 3.71Å; L82-L342 HydrophobicContact CD2-CD2 4.45Å; L82-L342 HydrophobicContact CD2-CG 4.36Å; L82-L342 HydrophobicContact CG-CD1 4.14Å; V338-L342 HydrophobicContact CG1-CD1 4.49Å; V338-L342 PolarHBondContact O-N 3.22Å; V338-L342 VanDerWaalsContact O-N 3.1Å; A339-L342 PolarHBondContact O-N 3.48Å; A339-L342 VanDerWaalsContact O-N 3.14Å; W340-L342 VanDerWaalsContact C-N 3.28Å; W340-L342 PolarHBondContact O-N 2.91Å; L342-N344 PolarHBondContact O-N 2.87Å; L342-V350 HydrophobicContact CD2-CB 4.1Å; L342-V350 HydrophobicContact CD2-CG2 3.44Å; L342-V350 VanDerWaalsContact CD2-CG2 3.44Å; L342-V350 HydrophobicContact CG-CG2 3.89Å; L342-L370 HydrophobicContact CB-CD1 4Å; L342-L370 HydrophobicContact CB-CD2 4.3Å
343	R	94.4	Very high	96.3	Very high	55 Å²	55	19 Å²	19	21%	0.208	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-30.5	179.4	90.8	-167.4	-179.3	-69.6	1.3	112	Y247 E256 A339 W340 C341 E345 L370 M373	Y247-R343 PolarHBondContact OH-NH1 3.3Å; E256-R343 IonicContact OE1-NH2 3.94Å; E256-R343 PolarHBondContact OE1-NH2 3.49Å; E256-R343 IonicContact OE2-NH2 2.93Å; A339-R343 PolarHBondContact O-N 3.08Å; W340-R343 VanDerWaalsContact CE2-NH2 3.31Å; W340-R343 VanDerWaalsContact CZ2-CZ 3.4Å; W340-R343 VanDerWaalsContact CZ2-NH1 3.28Å; W340-R343 VanDerWaalsContact NE1-CZ 3.27Å; W340-R343 WeakPolarHBondContact O-CB 3.24Å; W340-R343 VanDerWaalsContact O-CD 3.28Å; W340-R343 WeakPolarHBondContact O-CD 3.4Å; W340-R343 WeakPolarHBondContact O-CG 3.44Å; W340-R343 PolarHBondContact O-N 3.37Å; W340-R343 PolarHBondContact O-NH1 3.33Å; C341-R343 VanDerWaalsContact C-N 3.34Å; C341-R343 PolarHBondContact O-N 3.04Å; R343-E345 PolarHBondContact O-N 3.37Å; R343-L370 HydrophobicContact CB-CD1 4.39Å; R343-M373 HydrophobicContact CB-CG 3.8Å
344	N	89	Confident	96.1	Very high	38 Å²	38	18.7 Å²	18.7	20%	0.203	11%	0.105	C	C	.	.			trans	-77.9	113.2	177.6	-171.9	-15.1	0	0	0	108.7	L342 G346 V347	L342-N344 PolarHBondContact O-N 2.87Å; N344-G346 PolarHBondContact O-N 2.94Å; N344-G346 PolarHBondContact OD1-N 3.22Å; N344-V347 HydrophobicContact CB-CG2 4.02Å; N344-V347 WeakPolarHBondContact O-CB 3.18Å; N344-V347 PolarHBondContact O-N 3.12Å
345	E	83.6	Confident	95.9	Very high	173 Å²	173	19.9 Å²	19.9	81%	0.808	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.7	177.2	-64.2	-168.1	158	0	0	112.7	R343 V347	R343-E345 PolarHBondContact O-N 3.37Å; E345-V347 PolarHBondContact O-N 3.19Å
346	G	89.1	Confident	95.7	Very high	28 Å²	28	20.6 Å²	20.6	29%	0.289	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.6	172.4	0	0	0	0	0	114	N344	N344-G346 PolarHBondContact O-N 2.94Å; N344-G346 PolarHBondContact OD1-N 3.22Å
347	V	96.9	Very high	95.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	111.8	171.7	178.1	0	0	0	0	109	R70 Y247 V255 T272 N344 E345 V350	R70-V347 PolarHBondContact NH1-O 3.39Å; Y247-V347 HydrophobicContact CD1-CG2 4.16Å; Y247-V347 HydrophobicContact CE1-CG2 4.16Å; V255-V347 HydrophobicContact CG1-CG2 3.84Å; T272-V347 HydrophobicContact CG2-CG1 3.9Å; T272-V347 HydrophobicContact CG2-CG2 4.02Å; N344-V347 HydrophobicContact CB-CG2 4.02Å; N344-V347 WeakPolarHBondContact O-CB 3.18Å; N344-V347 PolarHBondContact O-N 3.12Å; E345-V347 PolarHBondContact O-N 3.19Å; V347-V350 HydrophobicContact CG1-CG2 3.86Å
348	S	98.1	Very high	95.6	Very high	6 Å²	6	27.6 Å²	27.6	4%	0.042	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-41.5	179.2	-62.1	0	0	0	0	111.7	N71 G73 A270	N71-S348 WeakPolarHBondContact O-CB 3.32Å; N71-S348 PolarHBondContact O-OG 3.27Å; G73-S348 PolarHBondContact N-OG 3.38Å; A270-S348 WeakPolarHBondContact O-CB 3.22Å; A270-S348 PolarHBondContact O-N 3.28Å
349	S	98.6	Very high	95.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	151	177.7	-166.5	0	0	0	0	112.3	S80 C81 G83 L113 M271 T272	S80-S349 VanDerWaalsContact O-CB 3.3Å; S80-S349 WeakPolarHBondContact O-CB 3.43Å; S80-S349 PolarHBondContact O-OG 2.93Å; C81-S349 CarbonylContact O-C 3.49Å; C81-S349 VanDerWaalsContact O-CA 3.26Å; C81-S349 WeakPolarHBondContact O-CA 3.27Å; C81-S349 PolarHBondContact O-OG 3.38Å; G83-S349 PolarHBondContact N-OG 3.12Å; L113-S349 WeakPolarHBondContact CD2-OG 3.33Å; M271-S349 CarbonylContact C-O 3.57Å; M271-S349 WeakPolarHBondContact CA-O 3.28Å; T272-S349 PolarHBondContact N-O 3.12Å
350	V	98.8	Very high	95.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.9	173.6	175.7	0	0	0	0	109	C81 L82 G83 T272 P275 C341 L342 V347 L352	C81-V350 PolarHBondContact O-N 3.02Å; L82-V350 WeakPolarHBondContact CA-O 3.36Å; L82-V350 HydrophobicContact CD2-CB 4.07Å; G83-V350 PolarHBondContact N-O 3.15Å; T272-V350 WeakPolarHBondContact OG1-CG2 3.15Å; P275-V350 HydrophobicContact CB-CG1 3.54Å; P275-V350 HydrophobicContact CG-CG1 3.59Å; C341-V350 HydrophobicContact CB-CG2 3.79Å; L342-V350 HydrophobicContact CD2-CB 4.1Å; L342-V350 HydrophobicContact CD2-CG2 3.44Å; L342-V350 VanDerWaalsContact CD2-CG2 3.44Å; L342-V350 HydrophobicContact CG-CG2 3.89Å; V347-V350 HydrophobicContact CG1-CG2 3.86Å; V350-L352 PolarHBondContact O-N 2.87Å
351	L	98.8	Very high	95.4	Very high	8 Å²	8	33.9 Å²	33.9	4%	0.042	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	115.5	176.7	-64.9	176.5	0	0	0	110.9	L113 D115 Q244 M271 T272 W273 P275	L113-L351 HydrophobicContact CD2-CD2 3.83Å; L113-L351 HydrophobicContact CG-CD2 4.13Å; D115-L351 HydrophobicContact CB-CD1 3.85Å; D115-L351 HydrophobicContact CB-CD2 3.78Å; D115-L351 HydrophobicContact CB-CG 4.47Å; Q244-L351 HydrophobicContact CG-CD1 4.16Å; M271-L351 HydrophobicContact CG-CD1 4.05Å; M271-L351 HydrophobicContact CG-CD2 4.36Å; M271-L351 HydrophobicContact CG-CG 3.95Å; M271-L351 HydrophobicContact SD-CD1 3.91Å; M271-L351 HydrophobicContact SD-CD2 4.11Å; M271-L351 HydrophobicContact SD-CG 4.14Å; T272-L351 WeakPolarHBondContact O-CB 3.15Å; T272-L351 PolarHBondContact O-N 2.98Å; W273-L351 HydrophobicContact CB-CD1 4.48Å; P275-L351 WeakPolarHBondContact CD-O 3.29Å
352	L	98.6	Very high	95.4	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	150.3	173.8	-57.7	-179.3	0	0	0	110.8	L82 G83 G85 P275 V338 V350 L360 N363 L364	L82-L352 HydrophobicContact CB-CD1 4.34Å; L82-L352 HydrophobicContact CD1-CD1 4.24Å; L82-L352 HydrophobicContact CD2-CD1 4.41Å; L82-L352 HydrophobicContact CD2-CD2 4.18Å; L82-L352 HydrophobicContact CD2-CG 4.31Å; G83-L352 WeakPolarHBondContact O-CB 3.4Å; G83-L352 PolarHBondContact O-N 3.38Å; G85-L352 PolarHBondContact N-O 2.88Å; P275-L352 HydrophobicContact CG-CD2 4.19Å; V338-L352 HydrophobicContact CG1-CD2 4.06Å; V338-L352 HydrophobicContact CG2-CD2 3.97Å; V350-L352 PolarHBondContact O-N 2.87Å; L352-L360 HydrophobicContact CD1-CD1 4.18Å; L352-N363 HydrophobicContact CD1-CB 3.88Å; L352-N363 HydrophobicContact CD2-CB 4.2Å; L352-L364 HydrophobicContact CD1-CD2 4.36Å
353	G	95.4	Very high	95.4	Very high	36 Å²	36	37 Å²	37	37%	0.371	20%	0.203	S	C	.	.			trans	-135.6	122.8	168.6	0	0	0	0	0	109.6
354	T	93.2	Very high	95.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	20%	0.198	C	C	.	.			trans	-139.5	142.2	-171.4	55.5	0	0	0	0	110.9	T89 L102 Q359 L360 N363	T89-T354 WeakPolarHBondContact CG2-O 3.44Å; L102-T354 WeakPolarHBondContact CD1-O 3.15Å; T354-Q359 HydrophobicContact CG2-CB 4Å; T354-L360 HydrophobicContact CG2-CB 4.15Å; T354-L360 HydrophobicContact CG2-CD1 4.38Å; T354-N363 VanDerWaalsContact CG2-ND2 3.29Å; T354-N363 WeakPolarHBondContact CG2-ND2 3.35Å
355	S	92.9	Very high	95.9	Very high	31 Å²	31	34.3 Å²	34.3	22%	0.217	20%	0.197	C	C	.	.	S	Bend	trans	-99.9	-5.2	-179.6	62.3	0	0	0	0	113.6	I94 Q359	I94-S355 VanDerWaalsContact CG2-O 3.27Å; I94-S355 WeakPolarHBondContact CG2-O 3.31Å; S355-Q359 PolarHBondContact OG-NE2 3.36Å; S355-Q359 PolarHBondContact OG-OE1 3.44Å
356	N	95.3	Very high	96.6	Very high	48 Å²	48	26.1 Å²	26.1	26%	0.257	16%	0.159	S	C	.	.	S	Bend	trans	-154.2	161.7	177	64.5	34.6	0	0	0	112.3	L102 E358 Q359 L360	L102-N356 VanDerWaalsContact CD2-C 3.48Å; L102-N356 WeakPolarHBondContact CD2-O 3.35Å; N356-E358 VanDerWaalsContact C-N 3.3Å; N356-E358 WeakPolarHBondContact CB-OE2 3.45Å; N356-E358 VanDerWaalsContact CG-OE2 3.3Å; N356-E358 PolarHBondContact O-N 2.96Å; N356-E358 PolarHBondContact OD1-N 3.49Å; N356-E358 PolarHBondContact OD1-OE2 3.29Å; N356-Q359 PolarHBondContact O-N 3.45Å; N356-Q359 VanDerWaalsContact OD1-CB 3.29Å; N356-Q359 WeakPolarHBondContact OD1-CB 3.4Å; N356-Q359 WeakPolarHBondContact OD1-CG 3.11Å; N356-Q359 PolarHBondContact OD1-N 3.14Å; N356-L360 PolarHBondContact O-N 2.73Å
357	P	97.4	Very high	96.9	Very high	23 Å²	23	25.3 Å²	25.3	15%	0.149	15%	0.148	C	C	.	.	H	α-helix	trans	-56.6	-35.5	179.1	-31.2	40.2	0	0	0	115.3	Q101 I105 L360 T361	Q101-P357 HydrophobicContact CB-CG 4.36Å; I105-P357 HydrophobicContact CD1-CB 3.65Å; I105-P357 HydrophobicContact CD1-CG 4.31Å; P357-L360 PolarHBondContact O-N 3.5Å; P357-T361 WeakPolarHBondContact O-CB 3.48Å; P357-T361 PolarHBondContact O-N 2.96Å; P357-T361 PolarHBondContact O-OG1 3.38Å
358	E	97.1	Very high	96.8	Very high	128 Å²	128	31 Å²	31	60%	0.598	17%	0.174	S	C	*	.	H	α-helix	trans	-65.8	-47.2	-176.9	-62.5	70.4	-150.7	0	0	110.6	N356 L360 T361 E362	N356-E358 VanDerWaalsContact C-N 3.3Å; N356-E358 WeakPolarHBondContact CB-OE2 3.45Å; N356-E358 VanDerWaalsContact CG-OE2 3.3Å; N356-E358 PolarHBondContact O-N 2.96Å; N356-E358 PolarHBondContact OD1-N 3.49Å; N356-E358 PolarHBondContact OD1-OE2 3.29Å; E358-L360 VanDerWaalsContact C-N 3.3Å; E358-L360 PolarHBondContact O-N 3.42Å; E358-T361 PolarHBondContact O-N 3.25Å; E358-E362 WeakPolarHBondContact O-CB 3.34Å; E358-E362 PolarHBondContact O-N 3.47Å
359	Q	96.5	Very high	96.8	Very high	47 Å²	47	30.9 Å²	30.9	22%	0.22	17%	0.174	C	C	.	.	H	α-helix	trans	-60.7	-39.3	175.4	-74.1	170.5	11.1	0	0	111.9	T354 S355 N356 N363	T354-Q359 HydrophobicContact CG2-CB 4Å; S355-Q359 PolarHBondContact OG-NE2 3.36Å; S355-Q359 PolarHBondContact OG-OE1 3.44Å; N356-Q359 PolarHBondContact O-N 3.45Å; N356-Q359 VanDerWaalsContact OD1-CB 3.29Å; N356-Q359 WeakPolarHBondContact OD1-CB 3.4Å; N356-Q359 WeakPolarHBondContact OD1-CG 3.11Å; N356-Q359 PolarHBondContact OD1-N 3.14Å; Q359-N363 VanDerWaalsContact O-CB 3.27Å; Q359-N363 WeakPolarHBondContact O-CB 3.28Å; Q359-N363 PolarHBondContact O-N 3.42Å; Q359-N363 PolarHBondContact O-ND2 3.38Å; Q359-N363 VanDerWaalsContact O-ND2 3.1Å
360	L	97.8	Very high	96.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-46.9	178.3	-179.9	60	0	0	0	111.1	L84 L102 I105 A106 L352 T354 N356 P357 E358 E362 N363 L364	L84-L360 HydrophobicContact CD1-CD1 4.29Å; L102-L360 HydrophobicContact CB-CD2 4.13Å; L102-L360 HydrophobicContact CD2-CB 3.8Å; L102-L360 HydrophobicContact CD2-CD2 3.76Å; L102-L360 HydrophobicContact CD2-CG 4.43Å; L102-L360 WeakPolarHBondContact O-CD2 3.19Å; I105-L360 HydrophobicContact CB-CD2 3.95Å; I105-L360 HydrophobicContact CG2-CD2 3.84Å; I105-L360 HydrophobicContact CG2-CG 4.17Å; A106-L360 HydrophobicContact CB-CD2 4.24Å; L352-L360 HydrophobicContact CD1-CD1 4.18Å; T354-L360 HydrophobicContact CG2-CB 4.15Å; T354-L360 HydrophobicContact CG2-CD1 4.38Å; N356-L360 PolarHBondContact O-N 2.73Å; P357-L360 PolarHBondContact O-N 3.5Å; E358-L360 VanDerWaalsContact C-N 3.3Å; E358-L360 PolarHBondContact O-N 3.42Å; L360-E362 VanDerWaalsContact C-N 3.32Å; L360-E362 PolarHBondContact O-N 3.29Å; L360-N363 PolarHBondContact O-N 3.2Å; L360-L364 HydrophobicContact CD1-CD1 4.12Å; L360-L364 HydrophobicContact CD1-CG 4.12Å; L360-L364 HydrophobicContact CG-CD1 3.94Å; L360-L364 HydrophobicContact CG-CG 4.39Å; L360-L364 WeakPolarHBondContact O-CB 3.5Å; L360-L364 VanDerWaalsContact O-CG 3.23Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 3.25Å
361	T	97.2	Very high	96.3	Very high	84 Å²	84	37.8 Å²	37.8	52%	0.515	22%	0.216	S	C	.	.	H	α-helix	trans	-61.4	-43.2	178.1	-55	0	0	0	0	111	P357 E358 L364 G365	P357-T361 WeakPolarHBondContact O-CB 3.48Å; P357-T361 PolarHBondContact O-N 2.96Å; P357-T361 PolarHBondContact O-OG1 3.38Å; E358-T361 PolarHBondContact O-N 3.25Å; T361-L364 PolarHBondContact O-N 3.48Å; T361-G365 PolarHBondContact O-N 3.27Å
362	E	97.4	Very high	96.2	Very high	60 Å²	60	41.8 Å²	41.8	28%	0.28	23%	0.233	S	C	.	.	H	α-helix	trans	-57.4	-53.3	173.4	-175.3	-169	163.5	0	0	111.1	T332 P334 Q335 E358 L360 L364 G365	T332-E362 WeakPolarHBondContact CB-OE1 3.47Å; T332-E362 HydrophobicContact CG2-CG 4.13Å; T332-E362 WeakPolarHBondContact CG2-OE1 3.34Å; T332-E362 PolarHBondContact OG1-OE1 2.98Å; P334-E362 VanDerWaalsContact CG-OE1 3.27Å; P334-E362 WeakPolarHBondContact CG-OE1 3.42Å; Q335-E362 HydrophobicContact CG-CG 4.23Å; Q335-E362 WeakPolarHBondContact CG-O 3.47Å; Q335-E362 PolarHBondContact NE2-O 3.34Å; E358-E362 WeakPolarHBondContact O-CB 3.34Å; E358-E362 PolarHBondContact O-N 3.47Å; L360-E362 VanDerWaalsContact C-N 3.32Å; L360-E362 PolarHBondContact O-N 3.29Å; E362-L364 VanDerWaalsContact C-N 3.35Å; E362-L364 PolarHBondContact O-N 3.19Å; E362-G365 WeakPolarHBondContact O-CA 3.14Å; E362-G365 PolarHBondContact O-N 2.9Å
363	N	97.9	Very high	96.1	Very high	5 Å²	5	42.6 Å²	42.6	3%	0.027	24%	0.237	C	C	.	.	H	α-helix	trans	-64.5	-36	-176.9	-71.3	-24.2	0	0	0	112.9	L352 T354 Q359 L360 G365 A366	L352-N363 HydrophobicContact CD1-CB 3.88Å; L352-N363 HydrophobicContact CD2-CB 4.2Å; T354-N363 VanDerWaalsContact CG2-ND2 3.29Å; T354-N363 WeakPolarHBondContact CG2-ND2 3.35Å; Q359-N363 VanDerWaalsContact O-CB 3.27Å; Q359-N363 WeakPolarHBondContact O-CB 3.28Å; Q359-N363 PolarHBondContact O-N 3.42Å; Q359-N363 PolarHBondContact O-ND2 3.38Å; Q359-N363 VanDerWaalsContact O-ND2 3.1Å; L360-N363 PolarHBondContact O-N 3.2Å; N363-G365 PolarHBondContact O-N 2.93Å; N363-A366 WeakPolarHBondContact O-CB 3.46Å; N363-A366 PolarHBondContact O-N 3.13Å; N363-A366 VanDerWaalsContact O-N 3.13Å
364	L	97.5	Very high	96.1	Very high	18 Å²	18	44.3 Å²	44.3	9%	0.094	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-31.4	173.6	-71.7	168.7	0	0	0	111.6	M67 L82 I105 V111 L352 L360 T361 E362 A366 I367	M67-L364 HydrophobicContact CE-CD2 4.15Å; L82-L364 HydrophobicContact CD1-CD2 4Å; I105-L364 HydrophobicContact CG2-CD1 4.04Å; V111-L364 HydrophobicContact CG2-CD2 3.84Å; L352-L364 HydrophobicContact CD1-CD2 4.36Å; L360-L364 HydrophobicContact CD1-CD1 4.12Å; L360-L364 HydrophobicContact CD1-CG 4.12Å; L360-L364 HydrophobicContact CG-CD1 3.94Å; L360-L364 HydrophobicContact CG-CG 4.39Å; L360-L364 WeakPolarHBondContact O-CB 3.5Å; L360-L364 VanDerWaalsContact O-CG 3.23Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 3.25Å; T361-L364 PolarHBondContact O-N 3.48Å; E362-L364 VanDerWaalsContact C-N 3.35Å; E362-L364 PolarHBondContact O-N 3.19Å; L364-A366 PolarHBondContact O-N 3.41Å; L364-A366 VanDerWaalsContact O-N 3.1Å; L364-I367 WeakPolarHBondContact O-CG1 3.24Å; L364-I367 PolarHBondContact O-N 3.2Å
365	G	96.6	Very high	96.2	Very high	19 Å²	19	49.4 Å²	49.4	20%	0.196	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-60	-15.8	173.3	0	0	0	0	0	114.6	T361 E362 N363 I367 Q368	T361-G365 PolarHBondContact O-N 3.27Å; E362-G365 WeakPolarHBondContact O-CA 3.14Å; E362-G365 PolarHBondContact O-N 2.9Å; N363-G365 PolarHBondContact O-N 2.93Å; G365-I367 PolarHBondContact O-N 3.47Å; G365-I367 VanDerWaalsContact O-N 3.12Å; G365-Q368 PolarHBondContact O-N 3.27Å
366	A	97.4	Very high	96.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-56.9	-26.6	174.4	0	0	0	0	0	113.3	Q335 V338 A339 N363 L364 Q368 V369 L370	Q335-A366 HydrophobicContact CB-CB 4.38Å; Q335-A366 WeakPolarHBondContact O-CB 3.25Å; V338-A366 HydrophobicContact CB-CB 3.65Å; V338-A366 HydrophobicContact CG1-CB 3.54Å; A339-A366 HydrophobicContact CB-CB 4.35Å; A339-A366 WeakPolarHBondContact CB-O 3.45Å; N363-A366 WeakPolarHBondContact O-CB 3.46Å; N363-A366 PolarHBondContact O-N 3.13Å; N363-A366 VanDerWaalsContact O-N 3.13Å; L364-A366 PolarHBondContact O-N 3.41Å; L364-A366 VanDerWaalsContact O-N 3.1Å; A366-Q368 PolarHBondContact O-N 2.87Å; A366-V369 WeakPolarHBondContact O-CB 3.34Å; A366-V369 PolarHBondContact O-N 3.34Å; A366-L370 PolarHBondContact O-N 3.05Å; A366-L370 VanDerWaalsContact O-N 3.16Å
367	I	95.6	Very high	96.4	Very high	11 Å²	11	52.4 Å²	52.4	6%	0.056	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-57.2	-33.5	175.3	-64.4	167	0	0	0	111	G66 M67 L82 L364 G365 V369 L370 P371	G66-I367 WeakPolarHBondContact O-CG2 3.46Å; M67-I367 HydrophobicContact CE-CD1 3.55Å; M67-I367 HydrophobicContact SD-CD1 3.77Å; L82-I367 HydrophobicContact CD1-CD1 3.87Å; L82-I367 HydrophobicContact CD1-CG1 3.8Å; L364-I367 WeakPolarHBondContact O-CG1 3.24Å; L364-I367 PolarHBondContact O-N 3.2Å; G365-I367 PolarHBondContact O-N 3.47Å; G365-I367 VanDerWaalsContact O-N 3.12Å; I367-V369 VanDerWaalsContact C-N 3.29Å; I367-V369 PolarHBondContact O-N 2.71Å; I367-L370 PolarHBondContact O-N 3.48Å; I367-P371 WeakPolarHBondContact O-CD 3.48Å
368	Q	95.2	Very high	96.4	Very high	120 Å²	120	52.6 Å²	52.6	56%	0.561	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-81.6	-13	-178.8	-46.9	-51.2	47	0	0	113	G365 A366	G365-Q368 PolarHBondContact O-N 3.27Å; A366-Q368 PolarHBondContact O-N 2.87Å
369	V	96.7	Very high	96.4	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.024	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-28.2	173.7	-174.9	0	0	0	0	111	C331 Q335 L336 A339 A366 I367 K372 M373	C331-V369 HydrophobicContact CB-CG1 4.46Å; C331-V369 HydrophobicContact CB-CG2 3.41Å; C331-V369 VanDerWaalsContact CB-CG2 3.41Å; Q335-V369 HydrophobicContact CB-CG2 4Å; L336-V369 HydrophobicContact CD1-CG1 4.45Å; A339-V369 HydrophobicContact CB-CB 3.73Å; A339-V369 HydrophobicContact CB-CG1 3.86Å; A366-V369 WeakPolarHBondContact O-CB 3.34Å; A366-V369 PolarHBondContact O-N 3.34Å; I367-V369 VanDerWaalsContact C-N 3.29Å; I367-V369 PolarHBondContact O-N 2.71Å; V369-K372 WeakPolarHBondContact O-CA 3.43Å; V369-K372 VanDerWaalsContact O-CB 3.3Å; V369-K372 WeakPolarHBondContact O-CB 3.31Å; V369-K372 PolarHBondContact O-N 2.79Å; V369-M373 PolarHBondContact O-N 3.22Å
370	L	94.3	Very high	96.4	Very high	35 Å²	35	50.3 Å²	50.3	18%	0.183	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-52.2	-44.2	-177.5	-177.9	63.2	0	0	0	113.9	L342 R343 A366 I367 K372 M373	L342-L370 HydrophobicContact CB-CD1 4Å; L342-L370 HydrophobicContact CB-CD2 4.3Å; R343-L370 HydrophobicContact CB-CD1 4.39Å; A366-L370 PolarHBondContact O-N 3.05Å; A366-L370 VanDerWaalsContact O-N 3.16Å; I367-L370 PolarHBondContact O-N 3.48Å; L370-K372 PolarHBondContact O-N 2.59Å; L370-M373 VanDerWaalsContact O-CB 3.28Å; L370-M373 WeakPolarHBondContact O-CB 3.2Å; L370-M373 PolarHBondContact O-N 3.3Å; L370-M373 VanDerWaalsContact O-N 3.14Å
371	P	94.1	Very high	96.4	Very high	109 Å²	109	50.3 Å²	50.3	71%	0.708	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-64.8	-20.2	175.7	-22	34.5	0	0	0	114.5	I367 M373	I367-P371 WeakPolarHBondContact O-CD 3.48Å; P371-M373 VanDerWaalsContact C-N 3.33Å
372	K	96.1	Very high	96.5	Very high	92 Å²	92	47.1 Å²	47.1	40%	0.4	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-85.7	-5.8	178.2	-54.1	178.3	178.1	176.7	0	112.7	L329 V369 L370 T374	L329-K372 HydrophobicContact CD2-CB 4.24Å; L329-K372 PolarHBondContact O-NZ 3.44Å; V369-K372 WeakPolarHBondContact O-CA 3.43Å; V369-K372 VanDerWaalsContact O-CB 3.3Å; V369-K372 WeakPolarHBondContact O-CB 3.31Å; V369-K372 PolarHBondContact O-N 2.79Å; L370-K372 PolarHBondContact O-N 2.59Å; K372-T374 PolarHBondContact O-N 3.36Å
373	M	95.5	Very high	96.5	Very high	23 Å²	23	52 Å²	52	11%	0.113	29%	0.287	C	S	.	.			trans	-78.6	66.4	-178.3	-164.8	62.9	61.7	0	0	111.3	L336 A339 W340 R343 V369 L370 P371 I377 V378 I381	L336-M373 HydrophobicContact CD1-CE 3.84Å; A339-M373 HydrophobicContact CB-CE 4.17Å; W340-M373 HydrophobicContact CB-CE 3.95Å; R343-M373 HydrophobicContact CB-CG 3.8Å; V369-M373 PolarHBondContact O-N 3.22Å; L370-M373 VanDerWaalsContact O-CB 3.28Å; L370-M373 WeakPolarHBondContact O-CB 3.2Å; L370-M373 PolarHBondContact O-N 3.3Å; L370-M373 VanDerWaalsContact O-N 3.14Å; P371-M373 VanDerWaalsContact C-N 3.33Å; M373-I377 HydrophobicContact SD-CG2 3.8Å; M373-V378 HydrophobicContact CG-CG2 3.67Å; M373-V378 HydrophobicContact SD-CG2 3.77Å; M373-I381 HydrophobicContact CE-CD1 4.47Å; M373-I381 HydrophobicContact SD-CD1 4.01Å
374	T	96.3	Very high	96.5	Very high	71 Å²	71	53 Å²	53	44%	0.436	29%	0.292	S	S	.	.			trans	-71.7	164.3	178.9	67.8	0	0	0	0	111.8	K372 H376 I377 V378	K372-T374 PolarHBondContact O-N 3.36Å; T374-H376 PolarHBondContact O-N 3.44Å; T374-I377 PolarHBondContact O-N 3.12Å; T374-I377 VanDerWaalsContact O-N 3.16Å; T374-I377 PolarHBondContact OG1-N 3.25Å; T374-V378 WeakPolarHBondContact O-CG2 3.42Å; T374-V378 PolarHBondContact O-N 3.48Å
375	S	94.9	Very high	96.5	Very high	108 Å²	108	52.1 Å²	52.1	76%	0.755	29%	0.288	S	S	*	.	H	α-helix	trans	-56	-36.2	175.7	52.4	0	0	0	0	112.9	V378 S379	S375-V378 PolarHBondContact O-N 3.1Å; S375-S379 WeakPolarHBondContact O-CB 3.45Å; S375-S379 PolarHBondContact O-N 3.26Å
376	H	96.4	Very high	96.5	Very high	120 Å²	120	54.3 Å²	54.3	56%	0.556	31%	0.311	S	S	*	.	H	α-helix	trans	-62.7	-51	175.2	-175.8	-69.5	0	0	0	111.6	T374 V378 S379 D380	T374-H376 PolarHBondContact O-N 3.44Å; H376-V378 VanDerWaalsContact C-N 3.29Å; H376-V378 PolarHBondContact O-N 3.18Å; H376-S379 WeakPolarHBondContact O-CB 3.4Å; H376-S379 PolarHBondContact O-N 2.9Å; H376-S379 VanDerWaalsContact O-N 3.11Å; H376-D380 IonicContact CE1-OD1 2.62Å; H376-D380 IonicContact CE1-OD2 3.33Å; H376-D380 PolarHBondContact CE1-OD2 3.24Å; H376-D380 IonicContact ND1-OD1 2.81Å; H376-D380 IonicContact ND1-OD2 2.63Å; H376-D380 PolarHBondContact ND1-OD2 3.48Å; H376-D380 PolarHBondContact O-N 3.5Å
377	I	97	Very high	96.4	Very high	23 Å²	23	56.8 Å²	56.8	12%	0.118	32%	0.324	C	S	.	.	H	α-helix	trans	-60.1	-42.1	178.3	-65.6	-61.5	0	0	0	111	I325 L329 M373 T374 S379 D380 I381	I325-I377 HydrophobicContact CG2-CD1 4.33Å; I325-I377 HydrophobicContact CG2-CG2 4.11Å; L329-I377 HydrophobicContact CD1-CD1 4.29Å; L329-I377 HydrophobicContact CD1-CG1 4.43Å; L329-I377 HydrophobicContact CD1-CG2 3.94Å; L329-I377 HydrophobicContact CD2-CD1 3.99Å; L329-I377 HydrophobicContact CD2-CG1 4.27Å; L329-I377 HydrophobicContact CG-CD1 4.4Å; M373-I377 HydrophobicContact SD-CG2 3.8Å; T374-I377 PolarHBondContact O-N 3.12Å; T374-I377 VanDerWaalsContact O-N 3.16Å; T374-I377 PolarHBondContact OG1-N 3.25Å; I377-S379 VanDerWaalsContact C-N 3.31Å; I377-S379 PolarHBondContact O-N 2.96Å; I377-D380 PolarHBondContact O-N 3.26Å; I377-I381 HydrophobicContact CG2-CD1 3.88Å; I377-I381 VanDerWaalsContact O-CG1 3.27Å; I377-I381 WeakPolarHBondContact O-CG1 3.45Å; I377-I381 PolarHBondContact O-N 3.02Å
378	V	96.3	Very high	96.4	Very high	26 Å²	26	63.6 Å²	63.6	16%	0.158	35%	0.349	C	S	.	.	H	α-helix	trans	-63.2	-40.4	176.8	176.7	0	0	0	0	111.1	M373 T374 S375 H376 I381 D382	M373-V378 HydrophobicContact CG-CG2 3.67Å; M373-V378 HydrophobicContact SD-CG2 3.77Å; T374-V378 WeakPolarHBondContact O-CG2 3.42Å; T374-V378 PolarHBondContact O-N 3.48Å; S375-V378 PolarHBondContact O-N 3.1Å; H376-V378 VanDerWaalsContact C-N 3.29Å; H376-V378 PolarHBondContact O-N 3.18Å; V378-I381 PolarHBondContact O-N 2.98Å; V378-D382 WeakPolarHBondContact O-CB 3.34Å; V378-D382 PolarHBondContact O-N 3.44Å
379	S	97	Very high	96.3	Very high	71 Å²	71	58.9 Å²	58.9	50%	0.497	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-42.1	176	-170.4	0	0	0	0	112.2	S375 H376 I377 D382 H383	S375-S379 WeakPolarHBondContact O-CB 3.45Å; S375-S379 PolarHBondContact O-N 3.26Å; H376-S379 WeakPolarHBondContact O-CB 3.4Å; H376-S379 PolarHBondContact O-N 2.9Å; H376-S379 VanDerWaalsContact O-N 3.11Å; I377-S379 VanDerWaalsContact C-N 3.31Å; I377-S379 PolarHBondContact O-N 2.96Å; S379-D382 PolarHBondContact O-N 3.31Å; S379-H383 WeakPolarHBondContact O-CB 3.49Å; S379-H383 PolarHBondContact O-N 3.5Å
380	D	97.7	Very high	95.8	Very high	57 Å²	57	68.7 Å²	68.7	31%	0.305	37%	0.367	S	S	.	.	H	α-helix	trans	-62.8	-44.6	176.3	-66.1	-22.6	0	0	0	111	I325 H376 I377 H383 I384	I325-D380 HydrophobicContact CD1-CB 3.73Å; H376-D380 IonicContact CE1-OD1 2.62Å; H376-D380 IonicContact CE1-OD2 3.33Å; H376-D380 PolarHBondContact CE1-OD2 3.24Å; H376-D380 IonicContact ND1-OD1 2.81Å; H376-D380 IonicContact ND1-OD2 2.63Å; H376-D380 PolarHBondContact ND1-OD2 3.48Å; H376-D380 PolarHBondContact O-N 3.5Å; I377-D380 PolarHBondContact O-N 3.26Å; D380-H383 PolarHBondContact O-N 3.42Å; D380-I384 WeakPolarHBondContact O-CG1 3.44Å; D380-I384 PolarHBondContact O-N 2.99Å
381	I	98.1	Very high	94.7	Very high	1 Å²	1	69.4 Å²	69.4	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-45.1	175.1	-67.4	167.7	0	0	0	110.3	L249 L322 I325 L336 M373 I377 V378 H383 I384 L385	L249-I381 HydrophobicContact CD2-CG2 4.07Å; L322-I381 HydrophobicContact CD2-CB 4.24Å; L322-I381 HydrophobicContact CD2-CG1 3.94Å; L322-I381 HydrophobicContact CD2-CG2 3.97Å; I325-I381 HydrophobicContact CD1-CG1 3.88Å; L336-I381 HydrophobicContact CD1-CD1 4.21Å; L336-I381 HydrophobicContact CG-CD1 4.46Å; M373-I381 HydrophobicContact CE-CD1 4.47Å; M373-I381 HydrophobicContact SD-CD1 4.01Å; I377-I381 HydrophobicContact CG2-CD1 3.88Å; I377-I381 VanDerWaalsContact O-CG1 3.27Å; I377-I381 WeakPolarHBondContact O-CG1 3.45Å; I377-I381 PolarHBondContact O-N 3.02Å; V378-I381 PolarHBondContact O-N 2.98Å; I381-H383 VanDerWaalsContact C-N 3.31Å; I381-H383 PolarHBondContact O-N 3.18Å; I381-I384 PolarHBondContact O-N 2.99Å; I381-L385 HydrophobicContact CG2-CD1 3.58Å; I381-L385 HydrophobicContact CG2-CG 4.11Å; I381-L385 WeakPolarHBondContact O-CB 3.4Å; I381-L385 WeakPolarHBondContact O-CG 3.43Å; I381-L385 PolarHBondContact O-N 3.45Å
382	D	97.6	Very high	92.9	Very high	16 Å²	16	73.2 Å²	73.2	9%	0.086	38%	0.38	C	S	.	.	H	α-helix	trans	-61.5	-39	177.7	-82.1	-27.3	0	0	0	112.2	R252 V378 S379 L385 G386 R388	R252-D382 IonicContact CZ-OD1 3.58Å; R252-D382 IonicContact NH1-OD1 3.97Å; R252-D382 PolarHBondContact NH1-OD1 3.42Å; R252-D382 IonicContact NH2-OD1 3.37Å; R252-D382 PolarHBondContact NH2-OD1 3Å; V378-D382 WeakPolarHBondContact O-CB 3.34Å; V378-D382 PolarHBondContact O-N 3.44Å; S379-D382 PolarHBondContact O-N 3.31Å; D382-L385 PolarHBondContact O-N 2.67Å; D382-G386 PolarHBondContact O-N 2.63Å; D382-R388 WeakPolarHBondContact OD2-CD 3.26Å; D382-R388 IonicContact OD2-NH1 3.2Å
383	H	97.8	Very high	90.9	Very high	162 Å²	162	77.3 Å²	77.3	75%	0.75	40%	0.398	S	S	*	.	H	α-helix	trans	-63.2	-50	176.8	-175.7	73.4	0	0	0	111.7	S379 D380 I381 L385 G386	S379-H383 WeakPolarHBondContact O-CB 3.49Å; S379-H383 PolarHBondContact O-N 3.5Å; D380-H383 PolarHBondContact O-N 3.42Å; I381-H383 VanDerWaalsContact C-N 3.31Å; I381-H383 PolarHBondContact O-N 3.18Å; H383-L385 VanDerWaalsContact C-N 3.33Å; H383-L385 PolarHBondContact O-N 2.95Å; H383-G386 PolarHBondContact O-N 3.32Å
384	I	97.9	Very high	88.9	Confident	26 Å²	26	79.8 Å²	79.8	13%	0.133	41%	0.411	C	S	.	.	H	α-helix	trans	-61.4	-43.7	177.4	-65.9	164.8	0	0	0	110.8	K318 E321 L322 I325 D380 I381	K318-I384 HydrophobicContact CB-CG2 4.09Å; K318-I384 WeakPolarHBondContact CD-O 3.43Å; K318-I384 WeakPolarHBondContact CE-O 2.95Å; K318-I384 HydrophobicContact CG-CG2 4.35Å; E321-I384 HydrophobicContact CB-CD1 4.01Å; E321-I384 HydrophobicContact CB-CG1 4.2Å; E321-I384 HydrophobicContact CB-CG2 3.76Å; L322-I384 HydrophobicContact CD2-CB 4.39Å; L322-I384 HydrophobicContact CD2-CD1 4.09Å; L322-I384 HydrophobicContact CD2-CG2 4.26Å; L322-I384 HydrophobicContact CG-CD1 4.5Å; L322-I384 HydrophobicContact CG-CG2 4Å; I325-I384 HydrophobicContact CD1-CD1 3.55Å; I325-I384 HydrophobicContact CG1-CD1 4.3Å; D380-I384 WeakPolarHBondContact O-CG1 3.44Å; D380-I384 PolarHBondContact O-N 2.99Å; I381-I384 PolarHBondContact O-N 2.99Å
385	L	97.6	Very high	86.5	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-70.9	-33.5	-177.7	-68.8	176.9	0	0	0	112.5	L249 F250 K318 L322 W340 I381 D382 H383 N387	L249-L385 HydrophobicContact CB-CD1 3.95Å; L249-L385 HydrophobicContact CB-CD2 3.94Å; L249-L385 HydrophobicContact CD2-CD1 3.9Å; L249-L385 HydrophobicContact CG-CD1 4.49Å; F250-L385 HydrophobicContact CD1-CD2 4.07Å; F250-L385 HydrophobicContact CE1-CD2 3.63Å; F250-L385 HydrophobicContact CZ-CD2 4.41Å; K318-L385 PolarHBondContact NZ-O 3.46Å; L322-L385 HydrophobicContact CD1-CD2 4.01Å; W340-L385 HydrophobicContact CZ2-CD1 4.46Å; I381-L385 HydrophobicContact CG2-CD1 3.58Å; I381-L385 HydrophobicContact CG2-CG 4.11Å; I381-L385 WeakPolarHBondContact O-CB 3.4Å; I381-L385 WeakPolarHBondContact O-CG 3.43Å; I381-L385 PolarHBondContact O-N 3.45Å; D382-L385 PolarHBondContact O-N 2.67Å; H383-L385 VanDerWaalsContact C-N 3.33Å; H383-L385 PolarHBondContact O-N 2.95Å; L385-N387 VanDerWaalsContact CB-OD1 3.24Å; L385-N387 WeakPolarHBondContact CB-OD1 3.4Å; L385-N387 PolarHBondContact O-N 3.03Å; L385-N387 VanDerWaalsContact O-N 3.09Å
386	G	96.9	Very high	84.2	Confident	66 Å²	66	93 Å²	93	68%	0.68	44%	0.438	S	S	*	.			trans	55.8	26.8	178.9	0	0	0	0	0	113.6	D382 H383	D382-G386 PolarHBondContact O-N 2.63Å; H383-G386 PolarHBondContact O-N 3.32Å
387	N	96.3	Very high	81.5	Confident	51 Å²	51	94.4 Å²	94.4	27%	0.273	46%	0.462	S	S	.	.			trans	-135.6	20.6	-171.7	74.3	-5.7	0	0	0	112.9	L249 R252 L385 P389	L249-N387 PolarHBondContact O-ND2 3Å; R252-N387 WeakPolarHBondContact CD-OD1 3.48Å; R252-N387 PolarHBondContact NH1-OD1 2.96Å; L385-N387 VanDerWaalsContact CB-OD1 3.24Å; L385-N387 WeakPolarHBondContact CB-OD1 3.4Å; L385-N387 PolarHBondContact O-N 3.03Å; L385-N387 VanDerWaalsContact O-N 3.09Å; N387-P389 WeakPolarHBondContact O-CD 3.19Å
388	R	95.3	Very high	80.7	Confident	154 Å²	154	98 Å²	98	58%	0.581	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-57.9	120.8	176	-178.9	176.3	173	171.1	-9.9	108.5	D382	D382-R388 WeakPolarHBondContact OD2-CD 3.26Å; D382-R388 IonicContact OD2-NH1 3.2Å
389	P	92	Very high	79.9	Confident	21 Å²	21	101.8 Å²	101.8	14%	0.136	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-71.5	144.4	-178.1	30	-33.4	0	0	0	110	R252 E253 E256 V257 N387	R252-P389 HydrophobicContact CB-CG 4.23Å; E253-P389 HydrophobicContact CB-CB 4.33Å; E256-P389 HydrophobicContact CB-CG 3.77Å; E256-P389 VanDerWaalsContact OE2-CD 3.31Å; E256-P389 WeakPolarHBondContact OE2-CD 3.36Å; E256-P389 WeakPolarHBondContact OE2-CG 3.3Å; V257-P389 HydrophobicContact CG2-CB 3.67Å; V257-P389 HydrophobicContact CG2-CG 3.92Å; N387-P389 WeakPolarHBondContact O-CD 3.19Å
390	Y	86.3	Confident	78.9	Confident	211 Å²	211	103.5 Å²	103.5	83%	0.827	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-68.2	133.5	178.4	-66.3	-80.8	0	0	0	110.9
391	S	70.8	Confident	77.8	Confident	50 Å²	50	106.2 Å²	106.2	35%	0.35	51%	0.507	S	S	.	.			trans	-105.9	142.2	173.1	-171.4	0	0	0	0	110.5	K393 D394	S391-K393 PolarHBondContact O-N 3.34Å; S391-D394 PolarHBondContact N-OD2 2.76Å; S391-D394 VanDerWaalsContact O-CB 3.31Å; S391-D394 WeakPolarHBondContact O-CB 3.41Å; S391-D394 PolarHBondContact O-N 2.7Å
392	K	56.7	Low	76.6	Confident	188 Å²	188	112.8 Å²	112.8	82%	0.817	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-58.4	-18.7	174.5	-76.8	-174.8	178.4	179.8	0	113.5	D394 Y395	K392-D394 PolarHBondContact O-N 3.21Å; K392-Y395 PolarHBondContact O-N 3.15Å
393	K	55.1	Low	75.2	Confident	179 Å²	179	119.3 Å²	119.3	78%	0.778	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-64.4	-23.1	173.4	-74.1	-176.2	178.3	177.7	0	112.9	S391 Y395	S391-K393 PolarHBondContact O-N 3.34Å; K393-Y395 PolarHBondContact O-N 3.3Å
394	D	52.7	Low	73.5	Confident	74 Å²	74	116.2 Å²	116.2	40%	0.396	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-75.3	-6.3	-178.7	-52.6	-33.4	0	0	0	112.9	S391 K392 S397	S391-D394 PolarHBondContact N-OD2 2.76Å; S391-D394 VanDerWaalsContact O-CB 3.31Å; S391-D394 WeakPolarHBondContact O-CB 3.41Å; S391-D394 PolarHBondContact O-N 2.7Å; K392-D394 PolarHBondContact O-N 3.21Å; D394-S397 PolarHBondContact O-OG 3.23Å
395	Y	46.6	Very low	71.7	Confident	212 Å²	212	123.2 Å²	123.2	83%	0.831	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-80.3	-12.1	177.9	-99.4	-92.6	0	0	0	114.8	K392 K393	K392-Y395 PolarHBondContact O-N 3.15Å; K393-Y395 PolarHBondContact O-N 3.3Å
396	R	45.5	Very low	69.5	Low	244 Å²	244	133.4 Å²	133.4	92%	0.921	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-112.4	6.2	-173.7	-70.8	-172.4	176.8	179.8	-1.3	113.9
397	S	40.3	Very low	67	Low	151 Å²	151	139.5 Å²	139.5	100%	1.056	63%	0.633	S	S	*	*			trans	-116.5	0	174.3	48.3	0	0	0	0	108.3	D394	D394-S397 PolarHBondContact O-OG 3.23Å

Retrieved 397 of 397 residues in 155.3 ms (Link to these results)

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