A0A060X533_ONCMY Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A060X533, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110529033, Length 404 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	35.2	Very low	29	Very low	236 Å²	236	165.4 Å²	165.4	100%	1.163	83%	0.825	S	S	*	*				0	83.4	0	-58.7	174.4	-175.8	0	0	106
2	D	28.1	Very low	28.8	Very low	150 Å²	150	172.2 Å²	172.2	80%	0.802	83%	0.834	S	S	*	*			cis	53.9	114.3	32.5	-152.8	24.5	0	0	0	109.5
3	T	31.7	Very low	28.4	Very low	124 Å²	124	167.1 Å²	167.1	76%	0.761	83%	0.827	S	S	*	*			cis	-136.1	166	32.7	52.8	0	0	0	0	111.5
4	G	26.6	Very low	28.3	Very low	70 Å²	70	165.6 Å²	165.6	72%	0.722	83%	0.831	S	S	*	*			cis	99.5	73.2	9.9	0	0	0	0	0	114.1
5	D	29.5	Very low	28.1	Very low	133 Å²	133	169.3 Å²	169.3	71%	0.711	83%	0.831	S	S	*	*			trans	-143	145.9	155.4	-151.1	-2.6	0	0	0	113.3	K7	D5-K7 WeakPolarHBondContact OD1-CD 3.48Å; D5-K7 IonicContact OD1-NZ 2.76Å; D5-K7 PolarHBondContact OD1-NZ 3.18Å; D5-K7 IonicContact OD2-NZ 3.18Å; D5-K7 PolarHBondContact OD2-NZ 2.76Å
6	N	27.2	Very low	27.9	Very low	147 Å²	147	163.5 Å²	163.5	79%	0.786	83%	0.829	S	S	*	*			trans	-152.9	103.5	-164	176.2	8.5	0	0	0	109.1
7	K	31.1	Very low	27.7	Very low	145 Å²	145	163.6 Å²	163.6	63%	0.63	82%	0.822	S	S	*	*			trans	-158.1	147	169.7	-79.4	111.3	-178.4	171.7	0	109.1	D5	D5-K7 WeakPolarHBondContact OD1-CD 3.48Å; D5-K7 IonicContact OD1-NZ 2.76Å; D5-K7 PolarHBondContact OD1-NZ 3.18Å; D5-K7 IonicContact OD2-NZ 3.18Å; D5-K7 PolarHBondContact OD2-NZ 2.76Å
8	R	28.9	Very low	27.5	Very low	225 Å²	225	162.4 Å²	162.4	85%	0.849	82%	0.817	S	S	*	*			cis	-159.8	128.6	-13	-116.8	172.7	-179.2	170.2	-2.3	107.4
9	R	28	Very low	27.3	Very low	250 Å²	250	161.2 Å²	161.2	94%	0.943	82%	0.819	S	S	*	*			trans	-62.9	139	166.1	-71.8	174.7	168.6	168	-5.7	109.8
10	R	27.8	Very low	27.1	Very low	243 Å²	243	156.4 Å²	156.4	92%	0.917	81%	0.811	S	S	*	*			trans	-117	93.6	164.3	-96.7	-174	168.5	176.4	-1.3	110.1
11	A	24.5	Very low	26.8	Very low	96 Å²	96	155.1 Å²	155.1	79%	0.793	81%	0.811	S	S	*	*			trans	-73.7	143.9	160.1	0	0	0	0	0	109.6
12	R	27.4	Very low	26.3	Very low	247 Å²	247	152.7 Å²	152.7	93%	0.932	80%	0.796	S	S	*	*			trans	-125.8	99.6	161.1	-92.6	-174.2	166.7	176.9	-4.6	109.3
13	S	23.5	Very low	26.1	Very low	106 Å²	106	153.3 Å²	153.3	74%	0.741	80%	0.8	S	S	*	*			trans	-85.8	131.5	162.3	173.8	0	0	0	0	108.5
14	V	27.4	Very low	25.9	Very low	146 Å²	146	151.9 Å²	151.9	89%	0.885	80%	0.801	S	S	*	*			trans	-133.4	122.7	156.8	-179.6	0	0	0	0	107
15	R	24.6	Very low	25.7	Very low	221 Å²	221	153.4 Å²	153.4	83%	0.834	80%	0.8	S	S	*	*			trans	-121.5	109	-175.9	-164.6	-175.1	-161.7	-174.6	7.7	107.8
16	G	25.3	Very low	25.7	Very low	77 Å²	77	152.3 Å²	152.3	79%	0.794	81%	0.81	S	S	*	*			trans	-113.7	143.7	168.5	0	0	0	0	0	109.4
17	K	23.6	Very low	25.6	Very low	165 Å²	165	153.7 Å²	153.7	72%	0.717	81%	0.809	S	S	*	*			trans	-145.4	126	-165.9	-136.3	-160.4	174.8	-165.2	0	112.1
18	I	24.5	Very low	25.4	Very low	143 Å²	143	158.8 Å²	158.8	73%	0.733	82%	0.824	S	S	*	*			trans	63.8	141.5	158.5	-20.6	-175.5	0	0	0	114.9
19	T	23.3	Very low	25.3	Very low	139 Å²	139	156.4 Å²	156.4	85%	0.853	82%	0.823	S	S	*	*			cis	-129.2	176.5	14.3	47	0	0	0	0	111.8
20	G	23	Very low	25.2	Very low	64 Å²	64	151.4 Å²	151.4	66%	0.66	82%	0.815	S	S	*	*			cis	162.2	170	-6.6	0	0	0	0	0	113.3
21	T	22.2	Very low	25.3	Very low	130 Å²	130	144.2 Å²	144.2	80%	0.798	81%	0.807	S	S	*	*			trans	46.2	120.1	165	50.6	0	0	0	0	122.4
22	Q	23.6	Very low	25.9	Very low	185 Å²	185	146.1 Å²	146.1	86%	0.864	80%	0.804	S	S	*	*			trans	53.3	128.5	139.3	-65	173	-20	0	0	118.3
23	D	24.6	Very low	26.7	Very low	163 Å²	163	138.8 Å²	138.8	87%	0.872	79%	0.787	S	S	*	*				-159.5	165	68.1	-149.8	-9.9	0	0	0	113.9
24	A	26.6	Very low	28	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	77%	0.769	S	S	*	*			trans	-104.5	121.8	-179.5	0	0	0	0	0	112.1
25	S	24.1	Very low	29.6	Very low	101 Å²	101	141.1 Å²	141.1	71%	0.706	77%	0.768	S	S	*	*			trans	-143.4	106	170.4	-167.6	0	0	0	0	111.3	K27	S25-K27 PolarHBondContact O-N 3.16Å
26	A	28.5	Very low	31.4	Very low	110 Å²	110	133.4 Å²	133.4	91%	0.909	75%	0.748	S	S	*	*			trans	-73.6	105	173	0	0	0	0	0	109.9
27	K	24.8	Very low	33.5	Very low	177 Å²	177	130 Å²	130	77%	0.77	71%	0.712	S	S	*	*			trans	-102	123.8	164.4	-73.6	-177.9	177.8	176.2	0	109	S25 E29	S25-K27 PolarHBondContact O-N 3.16Å; K27-E29 PolarHBondContact O-N 3.07Å; K27-E29 VanDerWaalsContact O-N 3.11Å
28	R	28.1	Very low	35.4	Very low	252 Å²	252	124.5 Å²	124.5	95%	0.951	69%	0.694	S	S	*	*			trans	-64.2	106.5	164.5	-80.4	176.7	166.4	170.3	-5.6	107.7
29	E	25.8	Very low	36.9	Very low	175 Å²	175	117.9 Å²	117.9	82%	0.818	66%	0.66	S	S	*	*			trans	-74.4	134.9	168.8	-66.8	-167	141.2	0	0	109.8	K27 A31	K27-E29 PolarHBondContact O-N 3.07Å; K27-E29 VanDerWaalsContact O-N 3.11Å; E29-A31 PolarHBondContact O-N 3.27Å
30	N	26.5	Very low	38.1	Very low	145 Å²	145	113.5 Å²	113.5	78%	0.775	64%	0.642	S	S	*	*			trans	-61.1	132.9	165.5	-75.4	-33.8	0	0	0	108.2	N32	N30-N32 PolarHBondContact O-N 3.36Å
31	A	30.3	Very low	38.8	Very low	92 Å²	92	114 Å²	114	76%	0.76	63%	0.63	S	S	*	*			trans	-62.2	100.6	175.1	0	0	0	0	0	109.9	E29 V33	E29-A31 PolarHBondContact O-N 3.27Å; A31-V33 PolarHBondContact O-N 2.86Å
32	N	37.4	Very low	39.6	Very low	135 Å²	135	113.9 Å²	113.9	72%	0.722	63%	0.629	S	S	*	*			trans	-65.1	103.8	174.7	-81.2	-36.3	0	0	0	108.8	N30 L34	N30-N32 PolarHBondContact O-N 3.36Å; N32-L34 PolarHBondContact O-N 2.92Å
33	V	42.9	Very low	39.9	Very low	94 Å²	94	110.6 Å²	110.6	57%	0.57	62%	0.618	S	S	*	*			trans	-61	111.7	177.1	178.6	0	0	0	0	109	A31	A31-V33 PolarHBondContact O-N 2.86Å
34	L	50.1	Low	40.7	Very low	73 Å²	73	109.5 Å²	109.5	38%	0.382	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.4	151.4	174.1	-63.9	173.3	0	0	0	109.4	N32 S36 L71 Y84	N32-L34 PolarHBondContact O-N 2.92Å; L34-S36 PolarHBondContact O-N 2.91Å; L34-L71 HydrophobicContact CB-CB 3.93Å; L34-L71 PolarHBondContact N-O 3.11Å; L34-Y84 HydrophobicContact CD1-CD1 4.09Å; L34-Y84 HydrophobicContact CD1-CE1 4.03Å
35	R	62.9	Low	40.9	Very low	228 Å²	228	112.4 Å²	112.4	86%	0.86	61%	0.614	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-39.4	129.7	-170	-72.1	-179.1	176.7	178.2	-1.1	113.3	L71	R35-L71 WeakPolarHBondContact O-CD1 3.32Å; R35-L71 VanDerWaalsContact O-CG 3.31Å; R35-L71 WeakPolarHBondContact O-CG 3.49Å
36	S	62.1	Low	41.2	Very low	59 Å²	59	115.2 Å²	115.2	41%	0.413	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.5	145.2	-174.4	62.9	0	0	0	0	113.9	L34 P67	L34-S36 PolarHBondContact O-N 2.91Å; S36-P67 VanDerWaalsContact CB-CB 3.43Å; S36-P67 VanDerWaalsContact CB-CG 3.44Å; S36-P67 WeakPolarHBondContact OG-CG 3.5Å
37	L	68.8	Low	41.4	Very low	5 Å²	5	114.8 Å²	114.8	3%	0.026	62%	0.618	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.8	113.1	-178.9	-176.4	65.3	0	0	0	111.7	P67 R68 Y69 W179	L37-P67 CarbonylContact O-C 3.41Å; L37-P67 WeakPolarHBondContact O-CA 3.21Å; L37-P67 WeakPolarHBondContact O-CB 3.33Å; L37-R68 PolarHBondContact O-N 3.01Å; L37-Y69 HydrophobicContact CD2-CD2 4.25Å; L37-Y69 PolarHBondContact N-O 3.26Å; L37-Y69 VanDerWaalsContact N-O 3.12Å; L37-Y69 PolarHBondContact O-N 3.08Å; L37-W179 HydrophobicContact CD1-CD2 4.16Å; L37-W179 HydrophobicContact CD1-CG 4.47Å; L37-W179 HydrophobicContact CD1-CZ2 4.23Å; L37-W179 HydrophobicContact CD2-CB 4.31Å; L37-W179 HydrophobicContact CD2-CD2 4.21Å; L37-W179 HydrophobicContact CD2-CE3 4.2Å; L37-W179 HydrophobicContact CD2-CG 4.33Å
38	S	62.5	Low	41.8	Very low	49 Å²	49	114.7 Å²	114.7	34%	0.343	62%	0.622	S	S	.	*			trans	-96.7	137.8	169.5	-64	0	0	0	0	110.3	M65 P67 A142	S38-M65 PolarHBondContact OG-O 3.42Å; S38-P67 VanDerWaalsContact OG-CA 3.25Å; S38-P67 WeakPolarHBondContact OG-CA 3.26Å; S38-A142 VanDerWaalsContact O-CB 3.24Å; S38-A142 WeakPolarHBondContact O-CB 3.36Å
39	V	56.1	Low	41.9	Very low	4 Å²	4	111.4 Å²	111.4	2%	0.024	62%	0.618	C	S	.	*			trans	-121.2	134.2	174.5	-171.9	0	0	0	0	107.6	M65 V135 K144	V39-M65 WeakPolarHBondContact O-CE 3.49Å; V39-V135 HydrophobicContact CG2-CG1 4.12Å; V39-V135 HydrophobicContact CG2-CG2 3.96Å; V39-K144 HydrophobicContact CG1-CB 4.15Å
40	G	49	Very low	42.3	Very low	47 Å²	47	111.1 Å²	111.1	49%	0.485	62%	0.621	S	S	.	*			trans	-75.2	134.4	173.2	0	0	0	0	0	111.4	A142	G40-A142 PolarHBondContact N-O 3.28Å
41	N	37.8	Very low	42.6	Very low	75 Å²	75	109.8 Å²	109.8	40%	0.401	61%	0.614	S	S	.	*			trans	-84.3	112	164.2	-99	47.4	0	0	0	108.2	D43 M65	N41-D43 PolarHBondContact ND2-OD1 3.04Å; N41-D43 PolarHBondContact ND2-OD2 2.96Å; N41-M65 HydrophobicContact CB-CE 4.33Å
42	T	38.5	Very low	42.8	Very low	127 Å²	127	110.7 Å²	110.7	78%	0.779	62%	0.622	S	S	*	*			trans	-107.2	93.6	151.6	50	0	0	0	0	105.5
43	D	29.8	Very low	42.4	Very low	117 Å²	117	107 Å²	107	63%	0.626	62%	0.615	S	S	*	*			trans	-81.2	128.4	177.2	-63.7	-53.4	0	0	0	109.4	N41	N41-D43 PolarHBondContact ND2-OD1 3.04Å; N41-D43 PolarHBondContact ND2-OD2 2.96Å
44	D	41.9	Very low	42.1	Very low	140 Å²	140	109.8 Å²	109.8	75%	0.749	62%	0.62	S	S	*	*	S	Bend	trans	53.4	144	159.1	-58.9	-24.8	0	0	0	123.3
45	N	32	Very low	41.5	Very low	156 Å²	156	114.4 Å²	114.4	83%	0.834	64%	0.644	S	S	*	*			trans	62.2	54.6	149	-65.7	-24.7	0	0	0	120.4
46	D	30.4	Very low	40	Very low	160 Å²	160	112.4 Å²	112.4	86%	0.856	64%	0.641	S	S	*	*			trans	-114.7	118.1	151.8	-83.3	-43.6	0	0	0	111	M48	D46-M48 PolarHBondContact O-N 2.91Å
47	A	32	Very low	38.5	Very low	100 Å²	100	116.4 Å²	116.4	83%	0.826	66%	0.658	S	S	*	*			trans	-72.3	121.3	168.8	0	0	0	0	0	108.7	E49	A47-E49 PolarHBondContact O-N 3.29Å
48	M	32.8	Very low	37	Very low	175 Å²	175	126.4 Å²	126.4	86%	0.862	70%	0.696	S	S	*	*			trans	-74.9	104.9	176.9	-79.5	-172.9	151	0	0	111	D46	D46-M48 PolarHBondContact O-N 2.91Å
49	E	30.1	Very low	35.8	Very low	184 Å²	184	128.7 Å²	128.7	86%	0.86	71%	0.712	S	S	*	*			trans	-98.4	127.2	153.3	-75.6	-171.2	153	0	0	110	A47	A47-E49 PolarHBondContact O-N 3.29Å
50	D	33.4	Very low	34.8	Very low	168 Å²	168	136.1 Å²	136.1	90%	0.898	75%	0.75	S	S	*	*			trans	33.5	122.2	162	-63.5	-13.6	0	0	0	122
51	D	33.7	Very low	34.1	Very low	117 Å²	117	142.5 Å²	142.5	63%	0.626	77%	0.767	S	S	*	*			trans	-101.1	121.7	177.3	-178.2	22.4	0	0	0	113	G53 F54	D51-G53 PolarHBondContact OD1-N 2.69Å; D51-G53 VanDerWaalsContact OD1-N 3.08Å; D51-F54 PolarHBondContact OD1-N 2.84Å
52	A	33.7	Very low	34.2	Very low	111 Å²	111	147.8 Å²	147.8	92%	0.917	78%	0.782	S	S	*	*	S	Bend	trans	-146.6	24.8	155.8	0	0	0	0	0	111.6
53	G	30.1	Very low	34.1	Very low	57 Å²	57	151.2 Å²	151.2	59%	0.588	79%	0.786	S	S	*	*			trans	-138.1	-6.1	-163	0	0	0	0	0	116.5	D51 I55 K56	D51-G53 PolarHBondContact OD1-N 2.69Å; D51-G53 VanDerWaalsContact OD1-N 3.08Å; G53-I55 PolarHBondContact O-N 3.24Å; G53-K56 PolarHBondContact O-N 3Å
54	F	36.4	Very low	34.7	Very low	154 Å²	154	152.1 Å²	152.1	68%	0.675	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-0.5	-159	-133.5	-96.7	0	0	0	118.8	D51	D51-F54 PolarHBondContact OD1-N 2.84Å
55	I	36.8	Very low	35.2	Very low	170 Å²	170	149.3 Å²	149.3	87%	0.872	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	-9	-172.9	-58.2	-179.2	0	0	0	113.1	G53	G53-I55 PolarHBondContact O-N 3.24Å
56	K	31.1	Very low	36.4	Very low	185 Å²	185	145.5 Å²	145.5	80%	0.804	77%	0.769	S	S	*	*	S	Bend	trans	-122.3	80.7	-179.3	-74	-176.2	177.5	176.8	0	113.6	G53	G53-K56 PolarHBondContact O-N 3Å
57	N	31.8	Very low	38.5	Very low	144 Å²	144	139 Å²	139	77%	0.77	74%	0.735	S	S	*	*			trans	167.6	71.3	137.3	-85.2	-14	0	0	0	111.9
58	W	36.2	Very low	41.1	Very low	215 Å²	215	136.5 Å²	136.5	81%	0.814	70%	0.704	S	S	*	*			trans	-110.6	52.4	169.5	-99.4	15.2	0	0	0	112	M141	W58-M141 HydrophobicContact CE3-CE 4.42Å; W58-M141 HydrophobicContact CE3-SD 3.95Å; W58-M141 HydrophobicContact CH2-CE 3.32Å; W58-M141 HydrophobicContact CH2-SD 3.51Å; W58-M141 VanDerWaalsContact CH2-SD 3.51Å; W58-M141 HydrophobicContact CZ2-CE 3.74Å; W58-M141 HydrophobicContact CZ2-SD 4.39Å; W58-M141 HydrophobicContact CZ3-CE 3.71Å; W58-M141 HydrophobicContact CZ3-SD 3.23Å; W58-M141 WeakPolarHBondContact CZ3-SD 3.27Å
59	S	38.1	Very low	43.8	Very low	97 Å²	97	128.4 Å²	128.4	68%	0.678	66%	0.664	S	S	*	*			trans	-127.8	72.2	175.7	58.1	0	0	0	0	110.8
60	L	34.3	Very low	46.8	Very low	159 Å²	159	120.4 Å²	120.4	83%	0.832	63%	0.629	S	S	*	*	S	Bend	trans	-150.2	114.7	161.8	-138.5	67.7	0	0	0	112
61	E	35.7	Very low	49.7	Very low	181 Å²	181	112.7 Å²	112.7	85%	0.846	59%	0.587	S	S	*	*			trans	33.9	83	154.5	-56.5	-169.6	165.5	0	0	119.5	K63	E61-K63 PolarHBondContact O-N 2.99Å
62	R	40.3	Very low	52.5	Low	186 Å²	186	110.1 Å²	110.1	70%	0.702	57%	0.573	S	S	*	*			trans	-70.3	89.7	165.2	-74.6	-175.9	177.4	177.1	-0	111.9	V64 M141	R62-V64 PolarHBondContact O-N 3.21Å; R62-V64 VanDerWaalsContact O-N 3.08Å; R62-M141 VanDerWaalsContact NH2-CG 3.33Å; R62-M141 PolarHBondContact NH2-SD 3.45Å
63	K	35.3	Very low	55.4	Low	199 Å²	199	111.2 Å²	111.2	87%	0.865	55%	0.554	S	S	*	*			trans	-64.3	104.4	160.4	-158	172.9	-168.8	172.7	0	108.1	E61 M65	E61-K63 PolarHBondContact O-N 2.99Å; K63-M65 PolarHBondContact O-N 3.32Å
64	V	41.8	Very low	58.6	Low	136 Å²	136	112.1 Å²	112.1	82%	0.824	54%	0.543	S	S	*	.			trans	-65.6	97.5	-174.2	-178.8	0	0	0	0	109.8	R62 A66	R62-V64 PolarHBondContact O-N 3.21Å; R62-V64 VanDerWaalsContact O-N 3.08Å; V64-A66 PolarHBondContact O-N 3.42Å
65	M	53.3	Low	61.2	Low	81 Å²	81	107.6 Å²	107.6	40%	0.399	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-64	135.7	174.5	-69.6	-135.2	-59.4	0	0	110.4	S38 V39 N41 K63	S38-M65 PolarHBondContact OG-O 3.42Å; V39-M65 WeakPolarHBondContact O-CE 3.49Å; N41-M65 HydrophobicContact CB-CE 4.33Å; K63-M65 PolarHBondContact O-N 3.32Å
66	A	57.5	Low	63.6	Low	76 Å²	76	100.8 Å²	100.8	63%	0.628	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-56.3	138.9	171.8	0	0	0	0	0	110.2	V64 R68	V64-A66 PolarHBondContact O-N 3.42Å; A66-R68 PolarHBondContact O-N 3.19Å
67	P	74.4	Confident	66.3	Low	23 Å²	23	99.6 Å²	99.6	15%	0.149	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-62	135.1	-176.5	25.8	-36.3	0	0	0	111.7	S36 L37 S38 Y69 R89	S36-P67 VanDerWaalsContact CB-CB 3.43Å; S36-P67 VanDerWaalsContact CB-CG 3.44Å; S36-P67 WeakPolarHBondContact OG-CG 3.5Å; L37-P67 CarbonylContact O-C 3.41Å; L37-P67 WeakPolarHBondContact O-CA 3.21Å; L37-P67 WeakPolarHBondContact O-CB 3.33Å; S38-P67 VanDerWaalsContact OG-CA 3.25Å; S38-P67 WeakPolarHBondContact OG-CA 3.26Å; P67-Y69 VanDerWaalsContact C-N 3.33Å; P67-Y69 PolarHBondContact O-N 3Å; P67-R89 WeakPolarHBondContact O-CD 3.43Å; P67-R89 WeakPolarHBondContact O-CG 3.38Å; P67-R89 PolarHBondContact O-NE 3.33Å
68	R	85.6	Confident	68.1	Low	48 Å²	48	94.9 Å²	94.9	18%	0.181	48%	0.475	C	S	.	.	S	Bend	trans	-70.1	-31.9	-178.3	-73.7	-175.5	60.8	-152.7	-14.9	112.4	L37 A66 R89 E133	L37-R68 PolarHBondContact O-N 3.01Å; A66-R68 PolarHBondContact O-N 3.19Å; R68-R89 PolarHBondContact O-N 3.06Å; R68-E133 IonicContact CZ-OE1 3.31Å; R68-E133 VanDerWaalsContact CZ-OE1 3.31Å; R68-E133 IonicContact CZ-OE2 3.34Å; R68-E133 VanDerWaalsContact NH1-CD 3.27Å; R68-E133 IonicContact NH1-OE1 3Å; R68-E133 PolarHBondContact NH1-OE1 3.39Å; R68-E133 IonicContact NH1-OE2 2.71Å; R68-E133 PolarHBondContact NH1-OE2 2.88Å; R68-E133 VanDerWaalsContact NH2-CD 3.3Å; R68-E133 IonicContact NH2-OE1 2.72Å; R68-E133 PolarHBondContact NH2-OE1 3.1Å; R68-E133 IonicContact NH2-OE2 3.4Å; R68-E133 PolarHBondContact NH2-OE2 3.27Å
69	Y	90.7	Very high	69.5	Low	6 Å²	6	89.7 Å²	89.7	2%	0.024	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.3	-177.6	-56.7	-84	0	0	0	111.1	L37 P67 I87 A88 V95 V181	L37-Y69 HydrophobicContact CD2-CD2 4.25Å; L37-Y69 PolarHBondContact N-O 3.26Å; L37-Y69 VanDerWaalsContact N-O 3.12Å; L37-Y69 PolarHBondContact O-N 3.08Å; P67-Y69 VanDerWaalsContact C-N 3.33Å; P67-Y69 PolarHBondContact O-N 3Å; Y69-I87 WeakPolarHBondContact CA-O 3.48Å; Y69-A88 HydrophobicContact CD1-CB 3.94Å; Y69-A88 HydrophobicContact CE1-CB 3.73Å; Y69-V95 HydrophobicContact CD1-CG2 3.74Å; Y69-V95 HydrophobicContact CE1-CG2 4Å; Y69-V181 HydrophobicContact CD1-CG1 4.27Å; Y69-V181 HydrophobicContact CD2-CG2 4.34Å; Y69-V181 HydrophobicContact CE1-CG1 3.57Å; Y69-V181 HydrophobicContact CE1-CG2 4.39Å; Y69-V181 HydrophobicContact CE2-CG1 4.5Å; Y69-V181 HydrophobicContact CE2-CG2 3.91Å
70	S	92.5	Very high	71.1	Confident	16 Å²	16	89.6 Å²	89.6	11%	0.112	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	112.7	172.2	-58.1	0	0	0	0	109.1	A86 I87 R89	S70-A86 CarbonylContact O-C 3.58Å; S70-A86 WeakPolarHBondContact O-CA 3.49Å; S70-A86 VanDerWaalsContact O-CB 3.26Å; S70-A86 WeakPolarHBondContact O-CB 3.27Å; S70-I87 PolarHBondContact N-O 3Å; S70-I87 PolarHBondContact O-N 3.2Å; S70-R89 PolarHBondContact OG-NE 3.11Å; S70-R89 PolarHBondContact OG-NH2 3.26Å
71	L	93.6	Very high	73.6	Confident	5 Å²	5	82.8 Å²	82.8	3%	0.026	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	129.6	174.6	-51.8	-175.3	0	0	0	109.2	L34 R35 Y84 A86 V97 W179	L34-L71 HydrophobicContact CB-CB 3.93Å; L34-L71 PolarHBondContact N-O 3.11Å; R35-L71 WeakPolarHBondContact O-CD1 3.32Å; R35-L71 VanDerWaalsContact O-CG 3.31Å; R35-L71 WeakPolarHBondContact O-CG 3.49Å; L71-Y84 HydrophobicContact CD1-CD1 4.5Å; L71-Y84 HydrophobicContact CD1-CD2 4.11Å; L71-Y84 HydrophobicContact CD1-CE2 4.48Å; L71-Y84 HydrophobicContact CD1-CG 4.12Å; L71-A86 HydrophobicContact CD2-CB 3.76Å; L71-V97 HydrophobicContact CD2-CB 4Å; L71-V97 HydrophobicContact CD2-CG1 4.02Å; L71-V97 HydrophobicContact CD2-CG2 4.16Å; L71-W179 HydrophobicContact CD1-CH2 4.35Å; L71-W179 HydrophobicContact CD1-CZ3 4Å
72	L	94.2	Very high	76.3	Confident	63 Å²	63	74.9 Å²	74.9	33%	0.33	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-61.8	-179.9	-60.2	-172.8	0	0	0	111	E85 I87	L72-E85 WeakPolarHBondContact CB-O 3.3Å; L72-E85 HydrophobicContact CD1-CG 4.27Å; L72-E85 PolarHBondContact N-O 2.76Å; L72-I87 HydrophobicContact CD1-CD1 3.95Å; L72-I87 HydrophobicContact CD1-CG1 3.97Å; L72-I87 HydrophobicContact CG-CG1 4.47Å
73	R	94.7	Very high	78.9	Confident	135 Å²	135	67.7 Å²	67.7	51%	0.509	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	156.4	-176.4	61.5	174.8	176	122.5	5.3	111.3	V75 Y84 E85	R73-V75 HydrophobicContact CG-CG1 4.09Å; R73-Y84 CarbonylContact O-C 3.58Å; R73-Y84 VanDerWaalsContact O-CA 3.22Å; R73-Y84 WeakPolarHBondContact O-CA 3.35Å; R73-E85 HydrophobicContact CG-CB 4.09Å; R73-E85 IonicContact CZ-OE2 3.03Å; R73-E85 IonicContact NE-OE2 3.78Å; R73-E85 PolarHBondContact NE-OE2 3.16Å; R73-E85 IonicContact NH2-OE2 3.96Å; R73-E85 PolarHBondContact NH2-OE2 3.37Å; R73-E85 PolarHBondContact O-N 3.4Å
74	E	95.4	Very high	81.8	Confident	76 Å²	76	60 Å²	60	36%	0.355	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	131.4	163.8	-173.5	162.8	144.4	0	0	108.9	R77 V82 Y84	E74-R77 IonicContact OE1-CZ 2.67Å; E74-R77 VanDerWaalsContact OE1-CZ 3.23Å; E74-R77 IonicContact OE1-NE 3.52Å; E74-R77 PolarHBondContact OE1-NE 2.87Å; E74-R77 IonicContact OE1-NH2 2.7Å; E74-R77 PolarHBondContact OE1-NH2 2.95Å; E74-R77 IonicContact OE2-CZ 3.4Å; E74-R77 IonicContact OE2-NH2 3.08Å; E74-R77 PolarHBondContact OE2-NH2 2.95Å; E74-V82 HydrophobicContact CG-CG1 3.55Å; E74-V82 WeakPolarHBondContact OE2-CG1 3.2Å; E74-Y84 HydrophobicContact CB-CD1 4.18Å; E74-Y84 HydrophobicContact CB-CE1 4.04Å; E74-Y84 HydrophobicContact CG-CE1 4.5Å
75	V	92.7	Very high	84.4	Confident	58 Å²	58	55 Å²	55	35%	0.352	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-20	177	-65.3	0	0	0	0	112.9	R73 V83 E85 F184	R73-V75 HydrophobicContact CG-CG1 4.09Å; V75-V83 HydrophobicContact CG2-CB 3.91Å; V75-V83 HydrophobicContact CG2-CG1 3.58Å; V75-V83 WeakPolarHBondContact CG2-O 3.25Å; V75-V83 PolarHBondContact N-O 2.83Å; V75-E85 HydrophobicContact CG1-CB 3.69Å; V75-F184 HydrophobicContact CG1-CE2 4.24Å
76	G	87.2	Confident	86.4	Confident	28 Å²	28	51.1 Å²	51.1	29%	0.289	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	155.4	175.8	0	0	0	0	0	111.9	V83	G76-V83 PolarHBondContact N-O 2.57Å; G76-V83 PolarHBondContact O-N 2.92Å
77	R	86.4	Confident	88.2	Confident	160 Å²	160	50.2 Å²	50.2	60%	0.604	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	111.1	176.3	178	177.3	-63.9	-98	-3	108.2	E74 V82	E74-R77 IonicContact OE1-CZ 2.67Å; E74-R77 VanDerWaalsContact OE1-CZ 3.23Å; E74-R77 IonicContact OE1-NE 3.52Å; E74-R77 PolarHBondContact OE1-NE 2.87Å; E74-R77 IonicContact OE1-NH2 2.7Å; E74-R77 PolarHBondContact OE1-NH2 2.95Å; E74-R77 IonicContact OE2-CZ 3.4Å; E74-R77 IonicContact OE2-NH2 3.08Å; E74-R77 PolarHBondContact OE2-NH2 2.95Å; R77-V82 HydrophobicContact CG-CG2 4.43Å
78	G	70.6	Confident	89.1	Confident	44 Å²	44	49.5 Å²	49.5	45%	0.454	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-179.3	172.1	0	0	0	0	0	111	Y80 G81	G78-Y80 PolarHBondContact O-N 3.42Å; G78-Y80 VanDerWaalsContact O-N 3.13Å; G78-G81 PolarHBondContact N-O 2.65Å
79	S	64.5	Low	89.3	Confident	106 Å²	106	53.6 Å²	53.6	74%	0.741	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.3	178.6	-44.8	0	0	0	0	113.7
80	Y	73.1	Confident	89.2	Confident	96 Å²	96	62.9 Å²	62.9	38%	0.376	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-6.3	-166.5	-43.7	-61.2	0	0	0	114.4	G78 L110	G78-Y80 PolarHBondContact O-N 3.42Å; G78-Y80 VanDerWaalsContact O-N 3.13Å; Y80-L110 HydrophobicContact CD1-CD1 3.24Å; Y80-L110 HydrophobicContact CD2-CD1 3.86Å; Y80-L110 HydrophobicContact CE1-CD1 3.35Å; Y80-L110 HydrophobicContact CE2-CD1 3.94Å; Y80-L110 HydrophobicContact CG-CD1 3.5Å
81	G	85.9	Confident	89.2	Confident	15 Å²	15	66.2 Å²	66.2	16%	0.155	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	175.9	-172.6	0	0	0	0	0	114.9	G78 K99	G78-G81 PolarHBondContact N-O 2.65Å; G81-K99 CarbonylContact C-O 3.36Å; G81-K99 WeakPolarHBondContact CA-O 3.14Å
82	V	92.6	Very high	89.1	Confident	16 Å²	16	68.3 Å²	68.3	10%	0.097	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.5	-177.6	-170.3	0	0	0	0	109.7	E74 R77 Y84 K99	E74-V82 HydrophobicContact CG-CG1 3.55Å; E74-V82 WeakPolarHBondContact OE2-CG1 3.2Å; R77-V82 HydrophobicContact CG-CG2 4.43Å; V82-Y84 HydrophobicContact CB-CE2 3.86Å; V82-Y84 HydrophobicContact CG1-CD2 4.37Å; V82-Y84 HydrophobicContact CG1-CE1 3.96Å; V82-Y84 HydrophobicContact CG1-CE2 3.71Å; V82-Y84 VanDerWaalsContact CG1-CZ 3.46Å; V82-Y84 WeakPolarHBondContact CG1-OH 3.43Å; V82-K99 PolarHBondContact N-O 2.75Å; V82-K99 PolarHBondContact O-N 3.39Å
83	V	94.9	Very high	89	Confident	35 Å²	35	67.3 Å²	67.3	21%	0.212	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.5	175.1	-169.6	0	0	0	0	109.1	V75 G76 A96 K98	V75-V83 HydrophobicContact CG2-CB 3.91Å; V75-V83 HydrophobicContact CG2-CG1 3.58Å; V75-V83 WeakPolarHBondContact CG2-O 3.25Å; V75-V83 PolarHBondContact N-O 2.83Å; G76-V83 PolarHBondContact N-O 2.57Å; G76-V83 PolarHBondContact O-N 2.92Å; V83-A96 HydrophobicContact CG1-CB 4.34Å; V83-K98 HydrophobicContact CG2-CB 4.22Å; V83-K98 HydrophobicContact CG2-CG 3.92Å
84	Y	96.1	Very high	89.1	Confident	37 Å²	37	63 Å²	63	15%	0.145	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	141.4	174.1	-60.5	-82.1	0	0	0	110.8	L34 L71 R73 E74 V82 A96 V97 K99	L34-Y84 HydrophobicContact CD1-CD1 4.09Å; L34-Y84 HydrophobicContact CD1-CE1 4.03Å; L71-Y84 HydrophobicContact CD1-CD1 4.5Å; L71-Y84 HydrophobicContact CD1-CD2 4.11Å; L71-Y84 HydrophobicContact CD1-CE2 4.48Å; L71-Y84 HydrophobicContact CD1-CG 4.12Å; R73-Y84 CarbonylContact O-C 3.58Å; R73-Y84 VanDerWaalsContact O-CA 3.22Å; R73-Y84 WeakPolarHBondContact O-CA 3.35Å; E74-Y84 HydrophobicContact CB-CD1 4.18Å; E74-Y84 HydrophobicContact CB-CE1 4.04Å; E74-Y84 HydrophobicContact CG-CE1 4.5Å; V82-Y84 HydrophobicContact CB-CE2 3.86Å; V82-Y84 HydrophobicContact CG1-CD2 4.37Å; V82-Y84 HydrophobicContact CG1-CE1 3.96Å; V82-Y84 HydrophobicContact CG1-CE2 3.71Å; V82-Y84 VanDerWaalsContact CG1-CZ 3.46Å; V82-Y84 WeakPolarHBondContact CG1-OH 3.43Å; Y84-A96 CarbonylContact O-C 3.34Å; Y84-V97 PolarHBondContact N-O 3.45Å; Y84-V97 PolarHBondContact O-N 3.42Å; Y84-K99 HydrophobicContact CE2-CB 4.34Å
85	E	96.4	Very high	89.1	Confident	30 Å²	30	59.4 Å²	59.4	14%	0.14	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	135.4	156.3	-177.3	-177.5	167.9	0	0	108	L72 R73 V75 F184	L72-E85 WeakPolarHBondContact CB-O 3.3Å; L72-E85 HydrophobicContact CD1-CG 4.27Å; L72-E85 PolarHBondContact N-O 2.76Å; R73-E85 HydrophobicContact CG-CB 4.09Å; R73-E85 IonicContact CZ-OE2 3.03Å; R73-E85 IonicContact NE-OE2 3.78Å; R73-E85 PolarHBondContact NE-OE2 3.16Å; R73-E85 IonicContact NH2-OE2 3.96Å; R73-E85 PolarHBondContact NH2-OE2 3.37Å; R73-E85 PolarHBondContact O-N 3.4Å; V75-E85 HydrophobicContact CG1-CB 3.69Å; E85-F184 HydrophobicContact CB-CD2 4.4Å; E85-F184 HydrophobicContact CB-CE2 3.81Å; E85-F184 HydrophobicContact CB-CZ 4.1Å; E85-F184 HydrophobicContact CG-CD2 4.18Å; E85-F184 HydrophobicContact CG-CE1 4.16Å; E85-F184 HydrophobicContact CG-CE2 3.8Å; E85-F184 HydrophobicContact CG-CZ 3.78Å
86	A	96.1	Very high	89.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	161.1	179.8	0	0	0	0	0	111.7	S70 L71 S94 V95 V97	S70-A86 CarbonylContact O-C 3.58Å; S70-A86 WeakPolarHBondContact O-CA 3.49Å; S70-A86 VanDerWaalsContact O-CB 3.26Å; S70-A86 WeakPolarHBondContact O-CB 3.27Å; L71-A86 HydrophobicContact CD2-CB 3.76Å; A86-S94 CarbonylContact O-C 3.58Å; A86-S94 WeakPolarHBondContact O-CA 3.18Å; A86-V95 HydrophobicContact CB-CG2 4.03Å; A86-V95 PolarHBondContact N-O 3.28Å; A86-V95 PolarHBondContact O-N 2.88Å; A86-V97 HydrophobicContact CB-CB 4.46Å; A86-V97 HydrophobicContact CB-CG2 3.65Å
87	I	95.3	Very high	89.7	Confident	57 Å²	57	55.8 Å²	55.8	29%	0.292	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.1	171.4	-69.3	176	0	0	0	110.3	Y69 S70 L72 R89 A93	Y69-I87 WeakPolarHBondContact CA-O 3.48Å; S70-I87 PolarHBondContact N-O 3Å; S70-I87 PolarHBondContact O-N 3.2Å; L72-I87 HydrophobicContact CD1-CD1 3.95Å; L72-I87 HydrophobicContact CD1-CG1 3.97Å; L72-I87 HydrophobicContact CG-CG1 4.47Å; I87-R89 PolarHBondContact O-N 3.09Å; I87-A93 WeakPolarHBondContact CA-O 3.41Å
88	A	93	Very high	90.1	Very high	9 Å²	9	49 Å²	49	7%	0.074	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	108.6	169.9	0	0	0	0	0	109.9	Y69 R90 S91 G92 A93 V95	Y69-A88 HydrophobicContact CD1-CB 3.94Å; Y69-A88 HydrophobicContact CE1-CB 3.73Å; A88-R90 PolarHBondContact O-N 3.22Å; A88-R90 VanDerWaalsContact O-N 3.09Å; A88-S91 PolarHBondContact O-N 3.47Å; A88-G92 PolarHBondContact O-N 3.43Å; A88-A93 PolarHBondContact N-O 3.31Å; A88-V95 HydrophobicContact CB-CG1 4.36Å
89	R	89.8	Confident	91.1	Very high	134 Å²	134	48.9 Å²	48.9	51%	0.506	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.2	-168.2	-67.9	-154.4	-176.7	-138.3	-8.1	115.3	P67 R68 S70 I87	P67-R89 WeakPolarHBondContact O-CD 3.43Å; P67-R89 WeakPolarHBondContact O-CG 3.38Å; P67-R89 PolarHBondContact O-NE 3.33Å; R68-R89 PolarHBondContact O-N 3.06Å; S70-R89 PolarHBondContact OG-NE 3.11Å; S70-R89 PolarHBondContact OG-NH2 3.26Å; I87-R89 PolarHBondContact O-N 3.09Å
90	R	88.5	Confident	92.2	Very high	200 Å²	200	44 Å²	44	76%	0.755	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-33.3	-179.1	-70.4	-171.7	-178.9	176.4	1.6	113.2	A88	A88-R90 PolarHBondContact O-N 3.22Å; A88-R90 VanDerWaalsContact O-N 3.09Å
91	S	91.7	Very high	92.8	Very high	86 Å²	86	45.2 Å²	45.2	60%	0.601	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-18.6	-175.3	54	0	0	0	0	113.8	A88 A93	A88-S91 PolarHBondContact O-N 3.47Å; S91-A93 PolarHBondContact O-N 3.08Å; S91-A93 WeakPolarHBondContact OG-CB 3.48Å; S91-A93 PolarHBondContact OG-N 3.25Å
92	G	92.3	Very high	92.5	Very high	50 Å²	50	45 Å²	45	52%	0.515	23%	0.232	S	C	.	.			trans	74	2.6	-169.4	0	0	0	0	0	114	A88	A88-G92 PolarHBondContact O-N 3.43Å
93	A	92.9	Very high	91.6	Very high	41 Å²	41	48 Å²	48	34%	0.339	25%	0.248	S	C	.	.			trans	-72.6	139.6	-177.2	0	0	0	0	0	112.4	I87 A88 S91	I87-A93 WeakPolarHBondContact CA-O 3.41Å; A88-A93 PolarHBondContact N-O 3.31Å; S91-A93 PolarHBondContact O-N 3.08Å; S91-A93 WeakPolarHBondContact OG-CB 3.48Å; S91-A93 PolarHBondContact OG-N 3.25Å
94	S	95.3	Very high	90.6	Very high	46 Å²	46	47.3 Å²	47.3	32%	0.322	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	129.9	168.5	-60.9	0	0	0	0	110.8	A86 F184	A86-S94 CarbonylContact O-C 3.58Å; A86-S94 WeakPolarHBondContact O-CA 3.18Å; S94-F184 WeakPolarHBondContact O-CB 3.4Å
95	V	96.1	Very high	89.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.1	180	-62.6	0	0	0	0	110.2	Y69 A86 A88 V97 V181 M182	Y69-V95 HydrophobicContact CD1-CG2 3.74Å; Y69-V95 HydrophobicContact CE1-CG2 4Å; A86-V95 HydrophobicContact CB-CG2 4.03Å; A86-V95 PolarHBondContact N-O 3.28Å; A86-V95 PolarHBondContact O-N 2.88Å; A88-V95 HydrophobicContact CB-CG1 4.36Å; V95-V97 HydrophobicContact CG2-CG2 4.11Å; V95-V181 HydrophobicContact CB-CG1 4.01Å; V95-V181 HydrophobicContact CG1-CG1 4.33Å; V95-V181 HydrophobicContact CG2-CG1 4Å; V95-M182 CarbonylContact C-O 3.52Å; V95-M182 WeakPolarHBondContact CA-O 3.43Å; V95-M182 WeakPolarHBondContact CB-O 3.29Å
96	A	96.5	Very high	88.6	Confident	9 Å²	9	52.9 Å²	52.9	7%	0.074	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.4	167.7	0	0	0	0	0	109.1	V83 Y84 V181 M182 F184	V83-A96 HydrophobicContact CG1-CB 4.34Å; Y84-A96 CarbonylContact O-C 3.34Å; A96-V181 WeakPolarHBondContact O-CA 3.26Å; A96-M182 HydrophobicContact CB-CB 4.38Å; A96-M182 PolarHBondContact N-O 3.05Å; A96-M182 PolarHBondContact O-N 3.02Å; A96-F184 HydrophobicContact CB-CD2 4.22Å
97	V	95.8	Very high	87.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	99.7	177.8	178.8	0	0	0	0	108.8	L71 Y84 A86 V95 W179 F180 V181	L71-V97 HydrophobicContact CD2-CB 4Å; L71-V97 HydrophobicContact CD2-CG1 4.02Å; L71-V97 HydrophobicContact CD2-CG2 4.16Å; Y84-V97 PolarHBondContact N-O 3.45Å; Y84-V97 PolarHBondContact O-N 3.42Å; A86-V97 HydrophobicContact CB-CB 4.46Å; A86-V97 HydrophobicContact CB-CG2 3.65Å; V95-V97 HydrophobicContact CG2-CG2 4.11Å; V97-W179 HydrophobicContact CG1-CE3 3.57Å; V97-W179 HydrophobicContact CG1-CZ3 4.06Å; V97-F180 CarbonylContact C-O 3.58Å; V97-F180 WeakPolarHBondContact CA-O 3.45Å; V97-V181 HydrophobicContact CG2-CG2 4.44Å
98	K	94.1	Very high	86.9	Confident	17 Å²	17	52 Å²	52	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.2	176.7	-170.4	-172.1	-167.1	-165.5	0	109.3	V83 L100 E114 W179 F180 M182 D248	V83-K98 HydrophobicContact CG2-CB 4.22Å; V83-K98 HydrophobicContact CG2-CG 3.92Å; K98-L100 HydrophobicContact CD-CD1 3.87Å; K98-L100 HydrophobicContact CG-CD1 3.67Å; K98-E114 WeakPolarHBondContact CD-OE1 3.5Å; K98-E114 WeakPolarHBondContact CD-OE2 3.49Å; K98-E114 WeakPolarHBondContact CE-OE2 3.48Å; K98-E114 IonicContact NZ-OE1 3.82Å; K98-E114 PolarHBondContact NZ-OE1 3.41Å; K98-E114 IonicContact NZ-OE2 3.78Å; K98-E114 PolarHBondContact NZ-OE2 3.3Å; K98-W179 CarbonylContact O-C 3.53Å; K98-W179 WeakPolarHBondContact O-CA 3.17Å; K98-F180 HydrophobicContact CB-CB 4.31Å; K98-F180 PolarHBondContact N-O 3.39Å; K98-F180 PolarHBondContact O-N 3.36Å; K98-M182 HydrophobicContact CB-CE 3.68Å; K98-M182 HydrophobicContact CD-CE 4.35Å; K98-D248 IonicContact NZ-OD1 3.26Å; K98-D248 PolarHBondContact NZ-OD1 3.43Å; K98-D248 IonicContact NZ-OD2 3.97Å; K98-D248 PolarHBondContact NZ-OD2 3.4Å
99	K	92	Very high	86.3	Confident	43 Å²	43	56.9 Å²	56.9	19%	0.187	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117	-178.7	-175.9	-172.3	-177.2	172.5	0	110.4	G81 V82 Y84 Y177 W179	G81-K99 CarbonylContact C-O 3.36Å; G81-K99 WeakPolarHBondContact CA-O 3.14Å; V82-K99 PolarHBondContact N-O 2.75Å; V82-K99 PolarHBondContact O-N 3.39Å; Y84-K99 HydrophobicContact CE2-CB 4.34Å; K99-Y177 HydrophobicContact CD-CD1 4.33Å; K99-Y177 VanDerWaalsContact CE-CG 3.45Å; K99-Y177 HydrophobicContact CG-CD1 4.32Å; K99-W179 HydrophobicContact CB-CD2 4.24Å; K99-W179 HydrophobicContact CB-CE3 3.87Å; K99-W179 HydrophobicContact CB-CZ3 4.11Å; K99-W179 HydrophobicContact CD-CD2 4.28Å; K99-W179 HydrophobicContact CD-CE3 4.16Å; K99-W179 HydrophobicContact CD-CH2 3.56Å; K99-W179 HydrophobicContact CD-CZ2 3.63Å; K99-W179 HydrophobicContact CD-CZ3 3.81Å; K99-W179 VanDerWaalsContact CE-CZ2 3.42Å; K99-W179 HydrophobicContact CG-CD2 3.89Å; K99-W179 HydrophobicContact CG-CE3 3.93Å; K99-W179 HydrophobicContact CG-CH2 4.23Å; K99-W179 HydrophobicContact CG-CZ2 4.14Å; K99-W179 HydrophobicContact CG-CZ3 4.09Å
100	L	88.1	Confident	86	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	145	173.7	-74.1	68.4	0	0	0	109.3	K98 A111 Y177 L178 F180	K98-L100 HydrophobicContact CD-CD1 3.87Å; K98-L100 HydrophobicContact CG-CD1 3.67Å; L100-A111 HydrophobicContact CB-CB 4.31Å; L100-A111 HydrophobicContact CD2-CB 3.55Å; L100-Y177 VanDerWaalsContact O-CA 3.25Å; L100-Y177 WeakPolarHBondContact O-CA 3.2Å; L100-Y177 WeakPolarHBondContact O-CB 3.38Å; L100-Y177 WeakPolarHBondContact O-CD1 3.24Å; L100-L178 PolarHBondContact N-O 3.2Å; L100-L178 PolarHBondContact O-N 3.04Å; L100-L178 VanDerWaalsContact O-N 3.08Å; L100-F180 HydrophobicContact CD1-CD2 3.93Å; L100-F180 HydrophobicContact CD1-CE2 3.91Å; L100-F180 HydrophobicContact CD2-CE2 4.3Å
101	R	85.6	Confident	85.8	Confident	121 Å²	121	42.1 Å²	42.1	46%	0.457	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.7	173.5	-172.6	179.3	-174.9	-159.7	-7.4	109	D103 N107 Y177	R101-D103 WeakPolarHBondContact CD-OD2 3.24Å; R101-D103 HydrophobicContact CG-CB 4.14Å; R101-D103 IonicContact CZ-OD2 3.91Å; R101-D103 IonicContact NE-OD2 2.84Å; R101-D103 PolarHBondContact NE-OD2 2.68Å; R101-D103 IonicContact NH1-OD2 3.46Å; R101-D103 PolarHBondContact NH1-OD2 3.08Å; R101-D103 VanDerWaalsContact NH1-OD2 3.08Å; R101-D103 IonicContact NH2-OD2 3.38Å; R101-D103 PolarHBondContact NH2-OD2 3.05Å; R101-N107 WeakPolarHBondContact O-CB 3.4Å; R101-Y177 HydrophobicContact CB-CD1 3.91Å; R101-Y177 HydrophobicContact CB-CE1 3.79Å; R101-Y177 HydrophobicContact CG-CD1 4.02Å; R101-Y177 HydrophobicContact CG-CE1 3.6Å
102	C	79.3	Confident	85.3	Confident	9 Å²	9	38.6 Å²	38.6	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	66.5	-174.3	-59.6	0	0	0	0	109.5	V108 L163 C176	C102-V108 HydrophobicContact CB-CG2 3.89Å; C102-L163 HydrophobicContact CB-CD2 3.65Å; C102-C176 HydrophobicContact CB-CB 4.08Å; C102-C176 PolarHBondContact N-O 2.79Å
103	D	74.3	Confident	85	Confident	80 Å²	80	37.3 Å²	37.3	43%	0.428	20%	0.201	S	C	.	.	S	Bend	trans	-115.1	-10.3	-177.3	60.1	-20.6	0	0	0	114.1	R101 N107	R101-D103 WeakPolarHBondContact CD-OD2 3.24Å; R101-D103 HydrophobicContact CG-CB 4.14Å; R101-D103 IonicContact CZ-OD2 3.91Å; R101-D103 IonicContact NE-OD2 2.84Å; R101-D103 PolarHBondContact NE-OD2 2.68Å; R101-D103 IonicContact NH1-OD2 3.46Å; R101-D103 PolarHBondContact NH1-OD2 3.08Å; R101-D103 VanDerWaalsContact NH1-OD2 3.08Å; R101-D103 IonicContact NH2-OD2 3.38Å; R101-D103 PolarHBondContact NH2-OD2 3.05Å; D103-N107 PolarHBondContact OD1-ND2 3.19Å
104	A	73.8	Confident	84.8	Confident	20 Å²	20	35.4 Å²	35.4	17%	0.165	19%	0.185	C	C	.	.	S	Bend	trans	-132.8	146.6	175.7	0	0	0	0	0	110.5	E106 N107 V108	A104-E106 VanDerWaalsContact C-N 3.26Å; A104-E106 HydrophobicContact CB-CG 4.06Å; A104-E106 PolarHBondContact O-N 3.16Å; A104-N107 PolarHBondContact O-N 2.76Å; A104-N107 VanDerWaalsContact O-N 3.11Å; A104-V108 WeakPolarHBondContact O-CG2 3.08Å; A104-V108 PolarHBondContact O-N 2.64Å
105	P	73.6	Confident	84.4	Confident	64 Å²	64	33.8 Å²	33.8	42%	0.416	17%	0.172	S	C	.	.	H	α-helix	trans	-52.9	-40.1	-179.9	-27.9	35.8	0	0	0	114	V108 E109	P105-V108 VanDerWaalsContact O-CB 3.3Å; P105-V108 WeakPolarHBondContact O-CB 3.2Å; P105-V108 PolarHBondContact O-N 3.31Å; P105-E109 WeakPolarHBondContact O-CG 3.23Å; P105-E109 PolarHBondContact O-N 3.09Å
106	E	76.9	Confident	83.9	Confident	121 Å²	121	37.3 Å²	37.3	57%	0.565	19%	0.185	S	C	*	.	H	α-helix	trans	-61.7	-47.1	176.3	50.3	-88.8	-150.1	0	0	112.5	A104 V108 E109 L110	A104-E106 VanDerWaalsContact C-N 3.26Å; A104-E106 HydrophobicContact CB-CG 4.06Å; A104-E106 PolarHBondContact O-N 3.16Å; E106-V108 PolarHBondContact O-N 2.79Å; E106-E109 PolarHBondContact O-N 3.23Å; E106-L110 VanDerWaalsContact O-CG 3.28Å; E106-L110 WeakPolarHBondContact O-CG 3.38Å; E106-L110 PolarHBondContact O-N 3.15Å; E106-L110 VanDerWaalsContact O-N 3.15Å
107	N	78.3	Confident	83.5	Confident	38 Å²	38	36.9 Å²	36.9	20%	0.203	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-33.4	176.4	-66	-22.7	0	0	0	111.9	R101 D103 A104 A111	R101-N107 WeakPolarHBondContact O-CB 3.4Å; D103-N107 PolarHBondContact OD1-ND2 3.19Å; A104-N107 PolarHBondContact O-N 2.76Å; A104-N107 VanDerWaalsContact O-N 3.11Å; N107-A111 WeakPolarHBondContact O-CB 3.27Å; N107-A111 PolarHBondContact O-N 2.64Å; N107-A111 VanDerWaalsContact O-N 3.08Å
108	V	78	Confident	83.2	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-66.9	-45.3	176.1	156	0	0	0	0	111.5	C102 A104 P105 E106 A111 L112 L163 K164	C102-V108 HydrophobicContact CB-CG2 3.89Å; A104-V108 WeakPolarHBondContact O-CG2 3.08Å; A104-V108 PolarHBondContact O-N 2.64Å; P105-V108 VanDerWaalsContact O-CB 3.3Å; P105-V108 WeakPolarHBondContact O-CB 3.2Å; P105-V108 PolarHBondContact O-N 3.31Å; E106-V108 PolarHBondContact O-N 2.79Å; V108-A111 PolarHBondContact O-N 3.03Å; V108-L112 HydrophobicContact CG1-CD1 3.93Å; V108-L112 WeakPolarHBondContact O-CB 3.45Å; V108-L112 VanDerWaalsContact O-CG 3.29Å; V108-L112 WeakPolarHBondContact O-CG 3.47Å; V108-L112 PolarHBondContact O-N 2.84Å; V108-L163 HydrophobicContact CB-CB 4.18Å; V108-L163 HydrophobicContact CG1-CB 3.43Å; V108-L163 VanDerWaalsContact CG1-CB 3.43Å; V108-L163 HydrophobicContact CG2-CB 3.87Å; V108-L163 VanDerWaalsContact CG2-O 3.25Å; V108-L163 WeakPolarHBondContact CG2-O 3.46Å; V108-K164 HydrophobicContact CG1-CG 3.76Å
109	E	80.3	Confident	82.8	Confident	110 Å²	110	37.5 Å²	37.5	51%	0.514	19%	0.188	S	C	.	.	H	α-helix	trans	-64.7	-39.4	179	-74.9	-176.6	172.2	0	0	112	P105 E106 L112 A113 K164	P105-E109 WeakPolarHBondContact O-CG 3.23Å; P105-E109 PolarHBondContact O-N 3.09Å; E106-E109 PolarHBondContact O-N 3.23Å; E109-L112 PolarHBondContact O-N 2.85Å; E109-A113 WeakPolarHBondContact O-CB 3.4Å; E109-A113 PolarHBondContact O-N 3.36Å; E109-K164 IonicContact OE1-NZ 2.72Å
110	L	82.9	Confident	82.5	Confident	24 Å²	24	37.2 Å²	37.2	13%	0.126	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-42.8	175.3	-62.9	168.2	0	0	0	112.1	Y80 E106 L112 A113 E114 G250 L251	Y80-L110 HydrophobicContact CD1-CD1 3.24Å; Y80-L110 HydrophobicContact CD2-CD1 3.86Å; Y80-L110 HydrophobicContact CE1-CD1 3.35Å; Y80-L110 HydrophobicContact CE2-CD1 3.94Å; Y80-L110 HydrophobicContact CG-CD1 3.5Å; E106-L110 VanDerWaalsContact O-CG 3.28Å; E106-L110 WeakPolarHBondContact O-CG 3.38Å; E106-L110 PolarHBondContact O-N 3.15Å; E106-L110 VanDerWaalsContact O-N 3.15Å; L110-L112 VanDerWaalsContact C-N 3.34Å; L110-L112 PolarHBondContact O-N 2.87Å; L110-A113 PolarHBondContact O-N 2.83Å; L110-E114 PolarHBondContact O-N 3.46Å; L110-G250 WeakPolarHBondContact CA-O 3.46Å; L110-G250 WeakPolarHBondContact CD2-O 3.33Å; L110-L251 HydrophobicContact CD2-CD2 3.54Å; L110-L251 HydrophobicContact CD2-CG 4.31Å
111	A	83.9	Confident	82.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-35.8	176.4	0	0	0	0	0	112.4	L100 N107 V108 F115 L178 F180	L100-A111 HydrophobicContact CB-CB 4.31Å; L100-A111 HydrophobicContact CD2-CB 3.55Å; N107-A111 WeakPolarHBondContact O-CB 3.27Å; N107-A111 PolarHBondContact O-N 2.64Å; N107-A111 VanDerWaalsContact O-N 3.08Å; V108-A111 PolarHBondContact O-N 3.03Å; A111-F115 WeakPolarHBondContact O-CB 3.28Å; A111-F115 PolarHBondContact O-N 2.99Å; A111-L178 HydrophobicContact CB-CB 4.47Å; A111-L178 HydrophobicContact CB-CD1 3.6Å; A111-F180 WeakPolarHBondContact O-CZ 3.26Å
112	L	81.5	Confident	82.3	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.063	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-42.4	171.6	-77.3	171.6	0	0	0	111.8	V108 E109 L110 F115 W116 V159 L163	V108-L112 HydrophobicContact CG1-CD1 3.93Å; V108-L112 WeakPolarHBondContact O-CB 3.45Å; V108-L112 VanDerWaalsContact O-CG 3.29Å; V108-L112 WeakPolarHBondContact O-CG 3.47Å; V108-L112 PolarHBondContact O-N 2.84Å; E109-L112 PolarHBondContact O-N 2.85Å; L110-L112 VanDerWaalsContact C-N 3.34Å; L110-L112 PolarHBondContact O-N 2.87Å; L112-F115 PolarHBondContact O-N 3.07Å; L112-W116 HydrophobicContact CD2-CZ2 4.03Å; L112-W116 WeakPolarHBondContact O-CB 3.22Å; L112-W116 VanDerWaalsContact O-CG 3.27Å; L112-W116 PolarHBondContact O-N 2.7Å; L112-V159 HydrophobicContact CD2-CG1 3.74Å; L112-L163 HydrophobicContact CD1-CD1 4.31Å; L112-L163 HydrophobicContact CD2-CD1 3.64Å; L112-L163 HydrophobicContact CG-CD1 3.78Å
113	A	85.1	Confident	82.8	Confident	24 Å²	24	47.3 Å²	47.3	20%	0.198	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-47.8	177.7	0	0	0	0	0	111.7	E109 L110 F115 W116 A117 G250	E109-A113 WeakPolarHBondContact O-CB 3.4Å; E109-A113 PolarHBondContact O-N 3.36Å; L110-A113 PolarHBondContact O-N 2.83Å; A113-F115 PolarHBondContact O-N 2.88Å; A113-W116 PolarHBondContact O-N 3.45Å; A113-A117 WeakPolarHBondContact O-CB 3.26Å; A113-A117 PolarHBondContact O-N 3.07Å; A113-G250 WeakPolarHBondContact CB-O 3.33Å
114	E	89.9	Confident	83.7	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-43.7	175.8	-177.6	157.8	-142.5	0	0	112	K98 L110 L118 F180 F249	K98-E114 WeakPolarHBondContact CD-OE1 3.5Å; K98-E114 WeakPolarHBondContact CD-OE2 3.49Å; K98-E114 WeakPolarHBondContact CE-OE2 3.48Å; K98-E114 IonicContact NZ-OE1 3.82Å; K98-E114 PolarHBondContact NZ-OE1 3.41Å; K98-E114 IonicContact NZ-OE2 3.78Å; K98-E114 PolarHBondContact NZ-OE2 3.3Å; L110-E114 PolarHBondContact O-N 3.46Å; E114-L118 HydrophobicContact CG-CD1 3.96Å; E114-L118 WeakPolarHBondContact O-CB 3.39Å; E114-L118 PolarHBondContact O-N 2.54Å; E114-L118 VanDerWaalsContact O-N 3.09Å; E114-F180 HydrophobicContact CB-CE1 4.42Å; E114-F180 HydrophobicContact CB-CZ 4.14Å; E114-F180 HydrophobicContact CG-CD1 4.28Å; E114-F180 HydrophobicContact CG-CE1 4.01Å; E114-F180 HydrophobicContact CG-CE2 4.33Å; E114-F180 HydrophobicContact CG-CZ 4.05Å; E114-F249 WeakPolarHBondContact CA-O 3.27Å; E114-F249 HydrophobicContact CB-CB 4.46Å; E114-F249 HydrophobicContact CG-CB 4.26Å; E114-F249 PolarHBondContact N-O 3.45Å
115	F	86.4	Confident	84.8	Confident	12 Å²	12	53.8 Å²	53.8	5%	0.053	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-46.8	176	-176.7	-121	0	0	0	112.3	A111 L112 A113 A119 C134 M145 F180	A111-F115 WeakPolarHBondContact O-CB 3.28Å; A111-F115 PolarHBondContact O-N 2.99Å; L112-F115 PolarHBondContact O-N 3.07Å; A113-F115 PolarHBondContact O-N 2.88Å; F115-A119 HydrophobicContact CD2-CB 4.22Å; F115-A119 HydrophobicContact CE2-CB 3.99Å; F115-A119 HydrophobicContact CZ-CB 4.26Å; F115-A119 WeakPolarHBondContact O-CA 3.34Å; F115-A119 WeakPolarHBondContact O-CB 3.44Å; F115-A119 PolarHBondContact O-N 2.83Å; F115-C134 HydrophobicContact CD2-CB 3.71Å; F115-C134 HydrophobicContact CE2-CB 3.7Å; F115-M145 HydrophobicContact CD1-CE 4.37Å; F115-M145 HydrophobicContact CE1-CE 3.92Å; F115-M145 HydrophobicContact CE2-CB 3.92Å; F115-M145 HydrophobicContact CZ-CB 3.81Å; F115-M145 HydrophobicContact CZ-CE 4.16Å; F115-F180 HydrophobicContact CB-CE1 3.81Å; F115-F180 HydrophobicContact CB-CZ 4.06Å; F115-F180 HydrophobicContact CD2-CE1 4.2Å; F115-F180 HydrophobicContact CG-CE1 4.49Å
116	W	85.3	Confident	85.9	Confident	73 Å²	73	57 Å²	57	28%	0.277	27%	0.267	S	S	.	.	H	α-helix	trans	-68.4	-40.1	-179	-62.9	132.6	0	0	0	112.6	L112 A113 S120 L156 V254	L112-W116 HydrophobicContact CD2-CZ2 4.03Å; L112-W116 WeakPolarHBondContact O-CB 3.22Å; L112-W116 VanDerWaalsContact O-CG 3.27Å; L112-W116 PolarHBondContact O-N 2.7Å; A113-W116 PolarHBondContact O-N 3.45Å; W116-S120 WeakPolarHBondContact O-CB 3.3Å; W116-S120 PolarHBondContact O-N 3Å; W116-S120 PolarHBondContact O-OG 3.3Å; W116-L156 HydrophobicContact CE3-CD2 4.23Å; W116-L156 HydrophobicContact CH2-CD2 3.11Å; W116-L156 HydrophobicContact CH2-CG 4.42Å; W116-L156 HydrophobicContact CZ2-CD2 3.76Å; W116-L156 HydrophobicContact CZ3-CD2 3.36Å; W116-V254 HydrophobicContact CB-CG2 4.04Å
117	A	88.9	Confident	87	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-60.2	175.9	0	0	0	0	0	110.9	A113 A119 S120 I223 F249 V254	A113-A117 WeakPolarHBondContact O-CB 3.26Å; A113-A117 PolarHBondContact O-N 3.07Å; A117-A119 PolarHBondContact O-N 2.9Å; A117-S120 PolarHBondContact O-N 3.44Å; A117-S120 PolarHBondContact O-OG 3.48Å; A117-I223 HydrophobicContact CB-CG2 4.18Å; A117-I223 WeakPolarHBondContact O-CD1 3.38Å; A117-F249 HydrophobicContact CB-CB 3.77Å; A117-F249 HydrophobicContact CB-CD1 3.72Å; A117-F249 HydrophobicContact CB-CG 4.05Å; A117-V254 HydrophobicContact CB-CG2 4.25Å
118	L	89.9	Confident	87.9	Confident	11 Å²	11	50 Å²	50	6%	0.058	23%	0.234	C	C	.	.	H	α-helix	trans	-66.2	-38.8	-176.7	-70.4	172.3	0	0	0	112.7	E114 V129 L131 M182 F249	E114-L118 HydrophobicContact CG-CD1 3.96Å; E114-L118 WeakPolarHBondContact O-CB 3.39Å; E114-L118 PolarHBondContact O-N 2.54Å; E114-L118 VanDerWaalsContact O-N 3.09Å; L118-V129 HydrophobicContact CD2-CG1 4.18Å; L118-L131 HydrophobicContact CB-CB 4.12Å; L118-L131 HydrophobicContact CB-CD2 3.91Å; L118-L131 HydrophobicContact CD1-CB 4.41Å; L118-L131 HydrophobicContact CD1-CD1 4.36Å; L118-M182 HydrophobicContact CD1-SD 4.19Å; L118-F249 HydrophobicContact CD1-CD2 4.37Å; L118-F249 HydrophobicContact CD2-CD2 3.54Å; L118-F249 HydrophobicContact CD2-CE2 3.7Å; L118-F249 HydrophobicContact CD2-CG 4.18Å; L118-F249 HydrophobicContact CD2-CZ 4.43Å; L118-F249 HydrophobicContact CG-CB 4.38Å; L118-F249 HydrophobicContact CG-CD2 3.88Å; L118-F249 HydrophobicContact CG-CG 4.17Å
119	A	84.9	Confident	88.8	Confident	19 Å²	19	50.1 Å²	50.1	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-71.9	-31.7	177.5	0	0	0	0	0	112.4	F115 A117 L121 K150	F115-A119 HydrophobicContact CD2-CB 4.22Å; F115-A119 HydrophobicContact CE2-CB 3.99Å; F115-A119 HydrophobicContact CZ-CB 4.26Å; F115-A119 WeakPolarHBondContact O-CA 3.34Å; F115-A119 WeakPolarHBondContact O-CB 3.44Å; F115-A119 PolarHBondContact O-N 2.83Å; A117-A119 PolarHBondContact O-N 2.9Å; A119-L121 VanDerWaalsContact C-N 3.27Å; A119-L121 PolarHBondContact O-N 3.05Å; A119-K150 WeakPolarHBondContact O-CE 3.49Å; A119-K150 PolarHBondContact O-NZ 2.82Å
120	S	84.9	Confident	89.4	Confident	38 Å²	38	47.2 Å²	47.2	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-65.9	-28.4	-176.1	65.8	0	0	0	0	113.9	W116 A117 E122	W116-S120 WeakPolarHBondContact O-CB 3.3Å; W116-S120 PolarHBondContact O-N 3Å; W116-S120 PolarHBondContact O-OG 3.3Å; A117-S120 PolarHBondContact O-N 3.44Å; A117-S120 PolarHBondContact O-OG 3.48Å; S120-E122 PolarHBondContact O-N 3.19Å
121	L	87.8	Confident	89.9	Confident	30 Å²	30	47.9 Å²	47.9	16%	0.157	23%	0.225	C	C	.	.			trans	-54.5	117.5	177.8	-63	177.7	0	0	0	111.7	A119 V128 F217 L218 N221 I223	A119-L121 VanDerWaalsContact C-N 3.27Å; A119-L121 PolarHBondContact O-N 3.05Å; L121-V128 HydrophobicContact CD1-CG1 4.15Å; L121-F217 HydrophobicContact CD1-CE1 4.19Å; L121-F217 HydrophobicContact CD2-CE1 3.58Å; L121-F217 HydrophobicContact CD2-CZ 3.87Å; L121-F217 HydrophobicContact CG-CE1 4.44Å; L121-L218 HydrophobicContact CD2-CD2 4.5Å; L121-N221 HydrophobicContact CD2-CB 3.93Å; L121-I223 HydrophobicContact CD2-CD1 3.52Å; L121-I223 HydrophobicContact CG-CD1 4.06Å
122	E	83.3	Confident	90.1	Very high	166 Å²	166	51.8 Å²	51.8	78%	0.776	24%	0.243	S	C	*	.	S	Bend	trans	-84.2	-25.6	176.2	-63.3	-170.1	162.8	0	0	112.5	S120	S120-E122 PolarHBondContact O-N 3.19Å
123	K	89.8	Confident	90.4	Very high	149 Å²	149	51.7 Å²	51.7	65%	0.648	24%	0.242	S	C	*	.	S	Bend	trans	-117.6	153.2	179.1	-62.5	177.1	-173.6	169.7	0	109.9	F217	K123-F217 HydrophobicContact CB-CE2 4.32Å; K123-F217 WeakPolarHBondContact O-CZ 3.37Å
124	R	93.3	Very high	90.6	Very high	193 Å²	193	50.7 Å²	50.7	73%	0.728	23%	0.234	S	C	*	.			trans	-82.5	146.8	166.1	-61.8	-176.8	-176.1	-179	8.8	109.2	Q130	R124-Q130 VanDerWaalsContact CD-OE1 3.29Å; R124-Q130 VanDerWaalsContact CZ-CD 3.46Å
125	H	96.9	Very high	90.4	Very high	43 Å²	43	50.6 Å²	50.6	20%	0.199	23%	0.233	C	C	.	.			trans	-123.1	141.5	171.1	-167.5	-93.5	0	0	0	108.5	N127 V128 S213 F217	H125-N127 VanDerWaalsContact C-N 3.27Å; H125-N127 PolarHBondContact ND1-N 3.37Å; H125-N127 PolarHBondContact O-N 3.26Å; H125-V128 HydrophobicContact CB-CB 4.26Å; H125-V128 HydrophobicContact CB-CG2 4.17Å; H125-V128 PolarHBondContact O-N 3.12Å; H125-S213 PolarHBondContact CE1-OG 3.44Å; H125-S213 PolarHBondContact NE2-OG 2.96Å; H125-F217 HydrophobicContact CB-CD1 3.53Å; H125-F217 HydrophobicContact CB-CD2 4.08Å; H125-F217 HydrophobicContact CB-CE1 3.56Å; H125-F217 HydrophobicContact CB-CE2 4.1Å; H125-F217 HydrophobicContact CB-CG 3.79Å; H125-F217 HydrophobicContact CB-CZ 3.85Å; H125-F217 AromaticContact CD2-CD2 3.65Å; H125-F217 AromaticContact CD2-CG 3.5Å; H125-F217 AromaticContact CG-CD1 3.79Å; H125-F217 AromaticContact CG-CG 3.66Å
126	E	96.8	Very high	90.3	Very high	131 Å²	131	51.2 Å²	51.2	61%	0.612	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-42.7	-177.3	-178	167.8	-121	0	0	111.2	V128 V243 K245	E126-V128 PolarHBondContact O-N 3.04Å; E126-V243 HydrophobicContact CG-CG1 3.77Å; E126-K245 PolarHBondContact O-NZ 3.41Å
127	N	98.2	Very high	90.1	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.037	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	20	-173.8	-47.7	115.7	0	0	0	115.6	H125 Q210 A214 L244 K245 V246	H125-N127 VanDerWaalsContact C-N 3.27Å; H125-N127 PolarHBondContact ND1-N 3.37Å; H125-N127 PolarHBondContact O-N 3.26Å; N127-Q210 HydrophobicContact CB-CB 4.39Å; N127-Q210 WeakPolarHBondContact CB-O 3.37Å; N127-Q210 WeakPolarHBondContact ND2-CB 3.38Å; N127-Q210 WeakPolarHBondContact ND2-CG 3.42Å; N127-Q210 PolarHBondContact ND2-OE1 2.92Å; N127-A214 HydrophobicContact CB-CB 3.82Å; N127-A214 WeakPolarHBondContact O-CB 3.36Å; N127-L244 WeakPolarHBondContact CA-O 3.44Å; N127-L244 WeakPolarHBondContact CB-O 3.25Å; N127-L244 PolarHBondContact ND2-O 2.85Å; N127-K245 WeakPolarHBondContact O-CA 3.38Å; N127-V246 PolarHBondContact O-N 3.37Å
128	V	97.9	Very high	89.5	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.03	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-124.2	139.7	171.1	176	0	0	0	0	108.5	L121 H125 E126 Q130 A214 F217 L218 F249	L121-V128 HydrophobicContact CD1-CG1 4.15Å; H125-V128 HydrophobicContact CB-CB 4.26Å; H125-V128 HydrophobicContact CB-CG2 4.17Å; H125-V128 PolarHBondContact O-N 3.12Å; E126-V128 PolarHBondContact O-N 3.04Å; V128-Q130 PolarHBondContact O-N 3.39Å; V128-A214 HydrophobicContact CG2-CB 4.22Å; V128-F217 HydrophobicContact CG2-CD1 4Å; V128-F217 HydrophobicContact CG2-CE1 4.39Å; V128-L218 HydrophobicContact CG1-CD2 4.44Å; V128-L218 HydrophobicContact CG2-CD2 4.22Å; V128-L218 HydrophobicContact CG2-CG 4.27Å; V128-F249 HydrophobicContact CG1-CE2 4.17Å; V128-F249 HydrophobicContact CG1-CZ 3.77Å
129	V	96.3	Very high	88.6	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.03	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-63.4	128.7	179.7	73.8	0	0	0	0	111.1	L118 M182 E183 V246 A247 F249	L118-V129 HydrophobicContact CD2-CG1 4.18Å; V129-M182 HydrophobicContact CG1-SD 4.25Å; V129-M182 HydrophobicContact CG2-CB 4.17Å; V129-M182 HydrophobicContact CG2-SD 4.46Å; V129-E183 HydrophobicContact CG2-CG 3.86Å; V129-V246 PolarHBondContact N-O 3.5Å; V129-A247 HydrophobicContact CB-CB 4.1Å; V129-A247 HydrophobicContact CG1-CB 3.88Å; V129-F249 HydrophobicContact CG1-CE2 4.11Å
130	Q	93.5	Very high	87.9	Confident	49 Å²	49	59.5 Å²	59.5	23%	0.229	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-83.4	123	-179.2	-164.6	-160.8	-73.8	0	0	111.7	R124 V128 M182 E183	R124-Q130 VanDerWaalsContact CD-OE1 3.29Å; R124-Q130 VanDerWaalsContact CZ-CD 3.46Å; V128-Q130 PolarHBondContact O-N 3.39Å; Q130-M182 CarbonylContact O-C 3.6Å; Q130-M182 VanDerWaalsContact O-CA 3.23Å; Q130-M182 WeakPolarHBondContact O-CA 3.24Å; Q130-E183 HydrophobicContact CB-CG 4.21Å; Q130-E183 WeakPolarHBondContact CB-OE1 3.42Å; Q130-E183 PolarHBondContact N-OE1 3.03Å; Q130-E183 PolarHBondContact O-N 2.96Å
131	L	92.6	Very high	87.1	Confident	38 Å²	38	60.9 Å²	60.9	20%	0.199	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	125.6	164.9	-174.3	70.3	0	0	0	110.2	L118 E133 F180 V181 M182	L118-L131 HydrophobicContact CB-CB 4.12Å; L118-L131 HydrophobicContact CB-CD2 3.91Å; L118-L131 HydrophobicContact CD1-CB 4.41Å; L118-L131 HydrophobicContact CD1-CD1 4.36Å; L131-E133 WeakPolarHBondContact CD1-O 3.29Å; L131-F180 HydrophobicContact CD1-CB 4.01Å; L131-F180 HydrophobicContact CD1-CD1 3.9Å; L131-F180 HydrophobicContact CD1-CG 4.48Å; L131-V181 WeakPolarHBondContact CD1-O 3.26Å; L131-M182 HydrophobicContact CD1-CG 3.96Å
132	E	89.4	Confident	86.6	Confident	82 Å²	82	60.2 Å²	60.2	38%	0.383	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-47.6	170.2	-61.4	-163.8	155.7	0	0	111.5	V181	E132-V181 HydrophobicContact CB-CB 4.46Å; E132-V181 HydrophobicContact CB-CG1 4.21Å; E132-V181 PolarHBondContact N-O 2.95Å
133	E	88	Confident	86.2	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	157.6	174.1	58	-174.5	59.1	0	0	112.5	R68 L131 V135 K144 V181	R68-E133 IonicContact CZ-OE1 3.31Å; R68-E133 VanDerWaalsContact CZ-OE1 3.31Å; R68-E133 IonicContact CZ-OE2 3.34Å; R68-E133 VanDerWaalsContact NH1-CD 3.27Å; R68-E133 IonicContact NH1-OE1 3Å; R68-E133 PolarHBondContact NH1-OE1 3.39Å; R68-E133 IonicContact NH1-OE2 2.71Å; R68-E133 PolarHBondContact NH1-OE2 2.88Å; R68-E133 VanDerWaalsContact NH2-CD 3.3Å; R68-E133 IonicContact NH2-OE1 2.72Å; R68-E133 PolarHBondContact NH2-OE1 3.1Å; R68-E133 IonicContact NH2-OE2 3.4Å; R68-E133 PolarHBondContact NH2-OE2 3.27Å; L131-E133 WeakPolarHBondContact CD1-O 3.29Å; E133-V135 HydrophobicContact CG-CG2 4.45Å; E133-K144 HydrophobicContact CB-CD 4.14Å; E133-K144 VanDerWaalsContact CB-CE 3.49Å; E133-K144 HydrophobicContact CB-CG 4.39Å; E133-K144 WeakPolarHBondContact OE1-CE 3.47Å; E133-K144 IonicContact OE1-NZ 2.74Å; E133-K144 PolarHBondContact OE1-NZ 3.43Å; E133-V181 HydrophobicContact CG-CB 3.95Å; E133-V181 HydrophobicContact CG-CG2 3.92Å; E133-V181 PolarHBondContact N-O 3.48Å; E133-V181 PolarHBondContact O-N 3.41Å
134	C	88.1	Confident	85.7	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	143.1	166.4	-177.5	0	0	0	0	109	F115 M145 W179 F180	F115-C134 HydrophobicContact CD2-CB 3.71Å; F115-C134 HydrophobicContact CE2-CB 3.7Å; C134-M145 HydrophobicContact CB-CB 4.02Å; C134-M145 HydrophobicContact CB-CG 4.16Å; C134-M145 WeakPolarHBondContact O-CB 3.05Å; C134-M145 WeakPolarHBondContact O-CG 3.29Å; C134-M145 PolarHBondContact O-N 3.35Å; C134-W179 CarbonylContact C-O 3.57Å; C134-W179 VanDerWaalsContact CA-O 3.3Å; C134-W179 WeakPolarHBondContact CA-O 3.47Å; C134-F180 HydrophobicContact CB-CD1 4.13Å; C134-F180 HydrophobicContact CB-CE1 4.27Å
135	V	86.7	Confident	84.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124.6	-177.7	179.5	0	0	0	0	109.5	V39 E133 A142 Q143 W179	V39-V135 HydrophobicContact CG2-CG1 4.12Å; V39-V135 HydrophobicContact CG2-CG2 3.96Å; E133-V135 HydrophobicContact CG-CG2 4.45Å; V135-A142 HydrophobicContact CG1-CB 3.9Å; V135-Q143 CarbonylContact C-O 3.5Å; V135-Q143 WeakPolarHBondContact CA-O 3.23Å; V135-Q143 WeakPolarHBondContact CG1-O 3.5Å; V135-W179 HydrophobicContact CB-CB 4.26Å; V135-W179 PolarHBondContact N-O 3.26Å; V135-W179 PolarHBondContact O-N 3.25Å
136	L	82.9	Confident	83.3	Confident	24 Å²	24	47.8 Å²	47.8	13%	0.126	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.1	171.7	-179.3	66.8	0	0	0	109.3	A142 Q143 M145 L163 C176 L178	L136-A142 CarbonylContact O-C 3.53Å; L136-A142 VanDerWaalsContact O-CA 3.3Å; L136-A142 WeakPolarHBondContact O-CA 3.37Å; L136-Q143 PolarHBondContact N-O 3.46Å; L136-Q143 PolarHBondContact O-N 3.42Å; L136-M145 HydrophobicContact CB-CG 4.33Å; L136-M145 HydrophobicContact CB-SD 3.67Å; L136-M145 HydrophobicContact CD2-SD 4.43Å; L136-L163 HydrophobicContact CD1-CD2 4.02Å; L136-C176 VanDerWaalsContact CD1-SG 3.56Å; L136-L178 HydrophobicContact CB-CD2 4.09Å; L136-L178 HydrophobicContact CD1-CD2 3.84Å; L136-L178 HydrophobicContact CD1-CG 4.09Å
137	Q	82.3	Confident	81.1	Confident	46 Å²	46	47.5 Å²	47.5	22%	0.215	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.9	177.4	-172.9	-172.3	26.3	0	0	111.3	M141 A142 C176 Y177 W179	Q137-M141 CarbonylContact C-O 3.58Å; Q137-M141 WeakPolarHBondContact CA-O 3.4Å; Q137-M141 VanDerWaalsContact CG-O 3.28Å; Q137-M141 WeakPolarHBondContact CG-O 3.43Å; Q137-A142 HydrophobicContact CG-CB 4.43Å; Q137-C176 CarbonylContact O-C 3.6Å; Q137-C176 WeakPolarHBondContact O-CA 3.5Å; Q137-Y177 PolarHBondContact N-O 3.13Å; Q137-Y177 PolarHBondContact O-N 3.08Å; Q137-W179 VanDerWaalsContact OE1-CZ2 3.27Å
138	R	75.5	Confident	78.5	Confident	80 Å²	80	50.9 Å²	50.9	30%	0.302	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	144.7	175.5	-169.5	174.5	-180	-161.8	-0.5	109.5	G140 M141 E173	R138-G140 VanDerWaalsContact C-N 3.29Å; R138-G140 PolarHBondContact O-N 2.89Å; R138-M141 PolarHBondContact N-O 3.15Å; R138-M141 WeakPolarHBondContact O-CB 3.48Å; R138-M141 PolarHBondContact O-N 2.9Å; R138-E173 IonicContact CZ-OE2 3.78Å; R138-E173 IonicContact NE-OE2 3.12Å; R138-E173 IonicContact NH2-OE1 2.73Å; R138-E173 PolarHBondContact NH2-OE1 2.77Å; R138-E173 IonicContact NH2-OE2 2.97Å; R138-E173 PolarHBondContact NH2-OE2 3.12Å
139	N	72.2	Confident	76	Confident	92 Å²	92	54.2 Å²	54.2	49%	0.492	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	42.5	176.7	-57.6	-7	0	0	0	114.1	M141 E174	N139-M141 PolarHBondContact O-N 3.26Å; N139-M141 VanDerWaalsContact O-N 3.08Å; N139-E174 WeakPolarHBondContact CA-OE2 3.47Å
140	G	68.9	Low	73.7	Confident	59 Å²	59	56.9 Å²	56.9	61%	0.608	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	0.9	-175.2	0	0	0	0	0	116.2	R138	R138-G140 VanDerWaalsContact C-N 3.29Å; R138-G140 PolarHBondContact O-N 2.89Å
141	M	69.1	Low	71.5	Confident	67 Å²	67	65.7 Å²	65.7	33%	0.33	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	152.5	176.8	-64.5	-175.3	58.8	0	0	111.1	W58 R62 Q137 R138 N139	W58-M141 HydrophobicContact CE3-CE 4.42Å; W58-M141 HydrophobicContact CE3-SD 3.95Å; W58-M141 HydrophobicContact CH2-CE 3.32Å; W58-M141 HydrophobicContact CH2-SD 3.51Å; W58-M141 VanDerWaalsContact CH2-SD 3.51Å; W58-M141 HydrophobicContact CZ2-CE 3.74Å; W58-M141 HydrophobicContact CZ2-SD 4.39Å; W58-M141 HydrophobicContact CZ3-CE 3.71Å; W58-M141 HydrophobicContact CZ3-SD 3.23Å; W58-M141 WeakPolarHBondContact CZ3-SD 3.27Å; R62-M141 VanDerWaalsContact NH2-CG 3.33Å; R62-M141 PolarHBondContact NH2-SD 3.45Å; Q137-M141 CarbonylContact C-O 3.58Å; Q137-M141 WeakPolarHBondContact CA-O 3.4Å; Q137-M141 VanDerWaalsContact CG-O 3.28Å; Q137-M141 WeakPolarHBondContact CG-O 3.43Å; R138-M141 PolarHBondContact N-O 3.15Å; R138-M141 WeakPolarHBondContact O-CB 3.48Å; R138-M141 PolarHBondContact O-N 2.9Å; N139-M141 PolarHBondContact O-N 3.26Å; N139-M141 VanDerWaalsContact O-N 3.08Å
142	A	76	Confident	69.3	Low	17 Å²	17	64.7 Å²	64.7	14%	0.14	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	124.3	-178.2	0	0	0	0	0	111	S38 G40 V135 L136 Q137	S38-A142 VanDerWaalsContact O-CB 3.24Å; S38-A142 WeakPolarHBondContact O-CB 3.36Å; G40-A142 PolarHBondContact N-O 3.28Å; V135-A142 HydrophobicContact CG1-CB 3.9Å; L136-A142 CarbonylContact O-C 3.53Å; L136-A142 VanDerWaalsContact O-CA 3.3Å; L136-A142 WeakPolarHBondContact O-CA 3.37Å; Q137-A142 HydrophobicContact CG-CB 4.43Å
143	Q	75.4	Confident	67.3	Low	122 Å²	122	69.1 Å²	69.1	57%	0.57	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.4	-174.9	-176.1	177.3	6.8	0	0	110.2	V135 L136 M145	V135-Q143 CarbonylContact C-O 3.5Å; V135-Q143 WeakPolarHBondContact CA-O 3.23Å; V135-Q143 WeakPolarHBondContact CG1-O 3.5Å; L136-Q143 PolarHBondContact N-O 3.46Å; L136-Q143 PolarHBondContact O-N 3.42Å; Q143-M145 PolarHBondContact O-N 2.88Å
144	K	80.6	Confident	65	Low	90 Å²	90	76 Å²	76	39%	0.391	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	127.8	173.4	-179.9	166.6	178.6	158.6	0	110.2	V39 E133 S146	V39-K144 HydrophobicContact CG1-CB 4.15Å; E133-K144 HydrophobicContact CB-CD 4.14Å; E133-K144 VanDerWaalsContact CB-CE 3.49Å; E133-K144 HydrophobicContact CB-CG 4.39Å; E133-K144 WeakPolarHBondContact OE1-CE 3.47Å; E133-K144 IonicContact OE1-NZ 2.74Å; E133-K144 PolarHBondContact OE1-NZ 3.43Å; K144-S146 PolarHBondContact O-N 3.36Å
145	M	75.3	Confident	63.4	Low	15 Å²	15	77.5 Å²	77.5	7%	0.074	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	113.8	172.9	-57.6	-71.2	-76.7	0	0	108.1	F115 C134 L136 Q143 Y155 V159 L178	F115-M145 HydrophobicContact CD1-CE 4.37Å; F115-M145 HydrophobicContact CE1-CE 3.92Å; F115-M145 HydrophobicContact CE2-CB 3.92Å; F115-M145 HydrophobicContact CZ-CB 3.81Å; F115-M145 HydrophobicContact CZ-CE 4.16Å; C134-M145 HydrophobicContact CB-CB 4.02Å; C134-M145 HydrophobicContact CB-CG 4.16Å; C134-M145 WeakPolarHBondContact O-CB 3.05Å; C134-M145 WeakPolarHBondContact O-CG 3.29Å; C134-M145 PolarHBondContact O-N 3.35Å; L136-M145 HydrophobicContact CB-CG 4.33Å; L136-M145 HydrophobicContact CB-SD 3.67Å; L136-M145 HydrophobicContact CD2-SD 4.43Å; Q143-M145 PolarHBondContact O-N 2.88Å; M145-Y155 VanDerWaalsContact CA-OH 3.25Å; M145-Y155 WeakPolarHBondContact CA-OH 3.44Å; M145-Y155 WeakPolarHBondContact CB-OH 3.23Å; M145-V159 HydrophobicContact CE-CB 4.19Å; M145-V159 HydrophobicContact CE-CG1 3.59Å; M145-V159 HydrophobicContact CE-CG2 3.41Å; M145-V159 VanDerWaalsContact CE-CG2 3.41Å; M145-V159 HydrophobicContact SD-CG2 4.41Å; M145-L178 HydrophobicContact CE-CD2 4.42Å; M145-L178 HydrophobicContact CG-CD2 4.43Å
146	S	64.8	Low	62	Low	63 Å²	63	80 Å²	80	44%	0.441	41%	0.411	S	S	.	.			trans	-105	142.2	-170.1	71.8	0	0	0	0	113.4	K144 G148 Y155	K144-S146 PolarHBondContact O-N 3.36Å; S146-G148 VanDerWaalsContact C-N 3.28Å; S146-G148 PolarHBondContact O-N 2.72Å; S146-Y155 PolarHBondContact N-OH 2.81Å
147	H	49.2	Very low	60.5	Low	124 Å²	124	87.3 Å²	87.3	57%	0.574	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-71	-21.5	179	179.7	-35.4	0	0	0	112.4	N149 K150	H147-N149 PolarHBondContact O-N 2.89Å; H147-K150 WeakPolarHBondContact CD2-CE 3.11Å; H147-K150 PolarHBondContact CD2-NZ 3.15Å; H147-K150 VanDerWaalsContact CE1-CD 3.4Å; H147-K150 WeakPolarHBondContact CE1-CD 3.44Å; H147-K150 VanDerWaalsContact CE1-CE 3.43Å; H147-K150 WeakPolarHBondContact CE1-CE 3.5Å; H147-K150 PolarHBondContact CE1-NZ 2.94Å; H147-K150 WeakPolarHBondContact ND1-CD 3.26Å; H147-K150 VanDerWaalsContact NE2-CE 3.3Å; H147-K150 WeakPolarHBondContact NE2-CE 3.48Å; H147-K150 PolarHBondContact NE2-NZ 3.18Å; H147-K150 WeakPolarHBondContact O-CG 3.39Å; H147-K150 PolarHBondContact O-N 3.29Å
148	G	43.6	Very low	59.2	Low	78 Å²	78	90.2 Å²	90.2	80%	0.804	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-54.4	-23.2	-174.3	0	0	0	0	0	114.4	S146	S146-G148 VanDerWaalsContact C-N 3.28Å; S146-G148 PolarHBondContact O-N 2.72Å
149	N	46.3	Very low	58.6	Low	76 Å²	76	86.6 Å²	86.6	41%	0.406	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-113.3	23.9	-179.7	-132.1	-2.5	0	0	0	114.9	H147 R151 S152 Y155	H147-N149 PolarHBondContact O-N 2.89Å; N149-R151 PolarHBondContact O-N 3.38Å; N149-S152 PolarHBondContact O-N 3.27Å; N149-S152 WeakPolarHBondContact OD1-CB 3.42Å; N149-Y155 HydrophobicContact CB-CD1 4.43Å; N149-Y155 HydrophobicContact CB-CG 4.07Å
150	K	47.1	Very low	58.1	Low	61 Å²	61	86.2 Å²	86.2	27%	0.265	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-24.4	-180	-95.7	-166.2	-172.3	171.2	0	115.8	A119 H147	A119-K150 WeakPolarHBondContact O-CE 3.49Å; A119-K150 PolarHBondContact O-NZ 2.82Å; H147-K150 WeakPolarHBondContact CD2-CE 3.11Å; H147-K150 PolarHBondContact CD2-NZ 3.15Å; H147-K150 VanDerWaalsContact CE1-CD 3.4Å; H147-K150 WeakPolarHBondContact CE1-CD 3.44Å; H147-K150 VanDerWaalsContact CE1-CE 3.43Å; H147-K150 WeakPolarHBondContact CE1-CE 3.5Å; H147-K150 PolarHBondContact CE1-NZ 2.94Å; H147-K150 WeakPolarHBondContact ND1-CD 3.26Å; H147-K150 VanDerWaalsContact NE2-CE 3.3Å; H147-K150 WeakPolarHBondContact NE2-CE 3.48Å; H147-K150 PolarHBondContact NE2-NZ 3.18Å; H147-K150 WeakPolarHBondContact O-CG 3.39Å; H147-K150 PolarHBondContact O-N 3.29Å
151	R	46.9	Very low	57.5	Low	233 Å²	233	86.9 Å²	86.9	88%	0.879	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-9.9	178.6	-68.6	-174.6	-179.6	174.4	2.5	114.3	N149 K153	N149-R151 PolarHBondContact O-N 3.38Å; R151-K153 PolarHBondContact O-N 3.12Å
152	S	46.1	Very low	56.9	Low	17 Å²	17	85.4 Å²	85.4	12%	0.119	42%	0.424	C	S	.	.			trans	-77.5	110.8	176.9	174.6	0	0	0	0	110.3	N149 Q154 Y155 L156	N149-S152 PolarHBondContact O-N 3.27Å; N149-S152 WeakPolarHBondContact OD1-CB 3.42Å; S152-Q154 PolarHBondContact O-N 3.43Å; S152-Q154 WeakPolarHBondContact OG-CB 3.43Å; S152-Q154 PolarHBondContact OG-N 3.23Å; S152-Q154 PolarHBondContact OG-OE1 3.49Å; S152-Q154 VanDerWaalsContact OG-OE1 3.07Å; S152-Y155 PolarHBondContact O-N 2.93Å; S152-Y155 VanDerWaalsContact O-N 3.08Å; S152-Y155 PolarHBondContact OG-N 3.34Å; S152-L156 WeakPolarHBondContact O-CG 3.5Å; S152-L156 PolarHBondContact O-N 3.1Å; S152-L156 VanDerWaalsContact O-N 3.13Å
153	K	47.9	Very low	56.2	Low	175 Å²	175	85.2 Å²	85.2	76%	0.761	42%	0.42	S	S	*	.	H	α-helix	trans	-52.4	-25.5	167.5	-64.1	-177.1	178.4	-177.5	0	112.2	R151 R157	R151-K153 PolarHBondContact O-N 3.12Å; K153-R157 WeakPolarHBondContact O-CB 3.36Å; K153-R157 PolarHBondContact O-N 2.97Å
154	Q	39.6	Very low	55.5	Low	156 Å²	156	83.5 Å²	83.5	73%	0.729	41%	0.411	S	S	*	.	H	α-helix	trans	-74.5	-40.3	177.8	-60.2	143.6	-45.8	0	0	112.1	S152 R157 L158	S152-Q154 PolarHBondContact O-N 3.43Å; S152-Q154 WeakPolarHBondContact OG-CB 3.43Å; S152-Q154 PolarHBondContact OG-N 3.23Å; S152-Q154 PolarHBondContact OG-OE1 3.49Å; S152-Q154 VanDerWaalsContact OG-OE1 3.07Å; Q154-R157 PolarHBondContact O-N 3.36Å; Q154-L158 WeakPolarHBondContact O-CB 3.4Å; Q154-L158 PolarHBondContact O-N 2.76Å
155	Y	55.3	Low	54.3	Low	33 Å²	33	81.2 Å²	81.2	13%	0.129	41%	0.413	C	S	.	.	H	α-helix	trans	-66.9	-45.2	173.4	175.7	-99.8	0	0	0	111.1	M145 S146 N149 S152 R157 L158 V159	M145-Y155 VanDerWaalsContact CA-OH 3.25Å; M145-Y155 WeakPolarHBondContact CA-OH 3.44Å; M145-Y155 WeakPolarHBondContact CB-OH 3.23Å; S146-Y155 PolarHBondContact N-OH 2.81Å; N149-Y155 HydrophobicContact CB-CD1 4.43Å; N149-Y155 HydrophobicContact CB-CG 4.07Å; S152-Y155 PolarHBondContact O-N 2.93Å; S152-Y155 VanDerWaalsContact O-N 3.08Å; S152-Y155 PolarHBondContact OG-N 3.34Å; Y155-R157 VanDerWaalsContact C-N 3.33Å; Y155-R157 PolarHBondContact O-N 2.86Å; Y155-L158 PolarHBondContact O-N 3.45Å; Y155-V159 HydrophobicContact CD1-CG2 4.46Å; Y155-V159 HydrophobicContact CD2-CG2 4.5Å; Y155-V159 HydrophobicContact CE1-CG2 4.11Å; Y155-V159 HydrophobicContact CE2-CG2 4.16Å; Y155-V159 WeakPolarHBondContact O-CG2 3.43Å; Y155-V159 PolarHBondContact O-N 2.69Å
156	L	56.5	Low	53	Low	51 Å²	51	88.8 Å²	88.8	27%	0.267	45%	0.448	S	S	.	.	H	α-helix	trans	-57.8	-46.8	175.4	-55.6	179.6	0	0	0	110.9	W116 S152 V159 E160	W116-L156 HydrophobicContact CE3-CD2 4.23Å; W116-L156 HydrophobicContact CH2-CD2 3.11Å; W116-L156 HydrophobicContact CH2-CG 4.42Å; W116-L156 HydrophobicContact CZ2-CD2 3.76Å; W116-L156 HydrophobicContact CZ3-CD2 3.36Å; S152-L156 WeakPolarHBondContact O-CG 3.5Å; S152-L156 PolarHBondContact O-N 3.1Å; S152-L156 VanDerWaalsContact O-N 3.13Å; L156-V159 PolarHBondContact O-N 3.2Å; L156-E160 VanDerWaalsContact O-CB 3.28Å; L156-E160 WeakPolarHBondContact O-CB 3.45Å; L156-E160 PolarHBondContact O-N 3.34Å
157	R	53	Low	52.1	Low	178 Å²	178	96.2 Å²	96.2	67%	0.672	47%	0.467	S	S	*	.	H	α-helix	trans	-66.7	-35.6	176.1	-171.4	179.2	-170.8	-164.2	2.4	112.5	K153 Q154 Y155 E160 T161	K153-R157 WeakPolarHBondContact O-CB 3.36Å; K153-R157 PolarHBondContact O-N 2.97Å; Q154-R157 PolarHBondContact O-N 3.36Å; Y155-R157 VanDerWaalsContact C-N 3.33Å; Y155-R157 PolarHBondContact O-N 2.86Å; R157-E160 PolarHBondContact O-N 2.75Å; R157-T161 WeakPolarHBondContact O-CB 3.22Å; R157-T161 PolarHBondContact O-N 3.5Å; R157-T161 PolarHBondContact O-OG1 2.8Å
158	L	54.1	Low	51.7	Low	107 Å²	107	95.1 Å²	95.1	56%	0.56	47%	0.468	S	S	*	.	H	α-helix	trans	-65.5	-43.8	176	178.3	63.8	0	0	0	110.8	Q154 Y155 S162	Q154-L158 WeakPolarHBondContact O-CB 3.4Å; Q154-L158 PolarHBondContact O-N 2.76Å; Y155-L158 PolarHBondContact O-N 3.45Å; L158-S162 WeakPolarHBondContact O-CB 3.35Å; L158-S162 PolarHBondContact O-N 3.42Å; L158-S162 PolarHBondContact O-OG 3.21Å
159	V	62.6	Low	51.7	Low	5 Å²	5	99.5 Å²	99.5	3%	0.03	47%	0.473	C	S	.	.	H	α-helix	trans	-65.3	-47.3	174.9	178	0	0	0	0	110.1	L112 M145 Y155 L156 T161 S162 L163	L112-V159 HydrophobicContact CD2-CG1 3.74Å; M145-V159 HydrophobicContact CE-CB 4.19Å; M145-V159 HydrophobicContact CE-CG1 3.59Å; M145-V159 HydrophobicContact CE-CG2 3.41Å; M145-V159 VanDerWaalsContact CE-CG2 3.41Å; M145-V159 HydrophobicContact SD-CG2 4.41Å; Y155-V159 HydrophobicContact CD1-CG2 4.46Å; Y155-V159 HydrophobicContact CD2-CG2 4.5Å; Y155-V159 HydrophobicContact CE1-CG2 4.11Å; Y155-V159 HydrophobicContact CE2-CG2 4.16Å; Y155-V159 WeakPolarHBondContact O-CG2 3.43Å; Y155-V159 PolarHBondContact O-N 2.69Å; L156-V159 PolarHBondContact O-N 3.2Å; V159-T161 PolarHBondContact O-N 3.35Å; V159-S162 PolarHBondContact O-N 2.76Å; V159-L163 HydrophobicContact CG1-CD1 3.66Å; V159-L163 HydrophobicContact CG1-CG 4.45Å; V159-L163 WeakPolarHBondContact O-CB 3.24Å; V159-L163 WeakPolarHBondContact O-CD1 3.4Å; V159-L163 WeakPolarHBondContact O-CG 3.25Å; V159-L163 PolarHBondContact O-N 3.4Å
160	E	62.4	Low	51.3	Low	83 Å²	83	99.7 Å²	99.7	39%	0.388	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-43.6	177.7	-176.5	172.1	-155.8	0	0	112.4	L156 R157 L163 K164	L156-E160 VanDerWaalsContact O-CB 3.28Å; L156-E160 WeakPolarHBondContact O-CB 3.45Å; L156-E160 PolarHBondContact O-N 3.34Å; R157-E160 PolarHBondContact O-N 2.75Å; E160-L163 PolarHBondContact O-N 2.98Å; E160-K164 HydrophobicContact CG-CD 3.7Å; E160-K164 HydrophobicContact CG-CG 4.21Å; E160-K164 WeakPolarHBondContact O-CB 3.47Å; E160-K164 WeakPolarHBondContact O-CG 3.42Å; E160-K164 PolarHBondContact O-N 2.67Å; E160-K164 WeakPolarHBondContact OE1-CE 3.37Å; E160-K164 IonicContact OE1-NZ 3.89Å; E160-K164 PolarHBondContact OE1-NZ 2.77Å
161	T	56.3	Low	51.1	Low	73 Å²	73	103.8 Å²	103.8	45%	0.448	50%	0.5	S	S	.	.	H	α-helix	trans	-72.4	-36.9	177.3	-60.8	0	0	0	0	112.1	R157 V159 L163 G165	R157-T161 WeakPolarHBondContact O-CB 3.22Å; R157-T161 PolarHBondContact O-N 3.5Å; R157-T161 PolarHBondContact O-OG1 2.8Å; V159-T161 PolarHBondContact O-N 3.35Å; T161-L163 PolarHBondContact O-N 2.89Å; T161-G165 VanDerWaalsContact O-CA 3.31Å; T161-G165 WeakPolarHBondContact O-CA 3.5Å; T161-G165 PolarHBondContact O-N 3.35Å
162	S	56.1	Low	51.1	Low	36 Å²	36	99 Å²	99	25%	0.252	50%	0.499	S	S	.	.	H	α-helix	trans	-67.5	-24	176	-63.4	0	0	0	0	113.2	L158 V159	L158-S162 WeakPolarHBondContact O-CB 3.35Å; L158-S162 PolarHBondContact O-N 3.42Å; L158-S162 PolarHBondContact O-OG 3.21Å; V159-S162 PolarHBondContact O-N 2.76Å
163	L	60.3	Low	51.8	Low	13 Å²	13	104.5 Å²	104.5	7%	0.068	52%	0.523	C	S	.	.	H	α-helix	trans	-97.3	-48.6	178.6	-65.1	171.7	0	0	0	111.6	C102 V108 L112 L136 V159 E160 T161 L178	C102-L163 HydrophobicContact CB-CD2 3.65Å; V108-L163 HydrophobicContact CB-CB 4.18Å; V108-L163 HydrophobicContact CG1-CB 3.43Å; V108-L163 VanDerWaalsContact CG1-CB 3.43Å; V108-L163 HydrophobicContact CG2-CB 3.87Å; V108-L163 VanDerWaalsContact CG2-O 3.25Å; V108-L163 WeakPolarHBondContact CG2-O 3.46Å; L112-L163 HydrophobicContact CD1-CD1 4.31Å; L112-L163 HydrophobicContact CD2-CD1 3.64Å; L112-L163 HydrophobicContact CG-CD1 3.78Å; L136-L163 HydrophobicContact CD1-CD2 4.02Å; V159-L163 HydrophobicContact CG1-CD1 3.66Å; V159-L163 HydrophobicContact CG1-CG 4.45Å; V159-L163 WeakPolarHBondContact O-CB 3.24Å; V159-L163 WeakPolarHBondContact O-CD1 3.4Å; V159-L163 WeakPolarHBondContact O-CG 3.25Å; V159-L163 PolarHBondContact O-N 3.4Å; E160-L163 PolarHBondContact O-N 2.98Å; T161-L163 PolarHBondContact O-N 2.89Å; L163-L178 HydrophobicContact CD1-CD1 3.79Å; L163-L178 HydrophobicContact CD2-CD1 4.09Å; L163-L178 HydrophobicContact CD2-CG 4.41Å
164	K	62.3	Low	52.7	Low	87 Å²	87	101.7 Å²	101.7	38%	0.378	51%	0.512	S	S	.	.	H	α-helix	trans	-72	-34.6	-179.3	-68	-173.1	175.1	176.1	0	113	V108 E109 E160	V108-K164 HydrophobicContact CG1-CG 3.76Å; E109-K164 IonicContact OE1-NZ 2.72Å; E160-K164 HydrophobicContact CG-CD 3.7Å; E160-K164 HydrophobicContact CG-CG 4.21Å; E160-K164 WeakPolarHBondContact O-CB 3.47Å; E160-K164 WeakPolarHBondContact O-CG 3.42Å; E160-K164 PolarHBondContact O-N 2.67Å; E160-K164 WeakPolarHBondContact OE1-CE 3.37Å; E160-K164 IonicContact OE1-NZ 3.89Å; E160-K164 PolarHBondContact OE1-NZ 2.77Å
165	G	54	Low	54.1	Low	42 Å²	42	96.7 Å²	96.7	43%	0.433	49%	0.493	S	S	.	.			trans	65.2	128	174.1	0	0	0	0	0	115.6	T161 R167	T161-G165 VanDerWaalsContact O-CA 3.31Å; T161-G165 WeakPolarHBondContact O-CA 3.5Å; T161-G165 PolarHBondContact O-N 3.35Å; G165-R167 PolarHBondContact O-N 2.99Å
166	E	48.1	Very low	55.3	Low	174 Å²	174	95.5 Å²	95.5	81%	0.813	49%	0.49	S	S	*	.			trans	-67.3	121.7	151.8	-74.2	-170.7	164.7	0	0	107.7	V168	E166-V168 VanDerWaalsContact C-N 3.3Å; E166-V168 PolarHBondContact O-N 3Å
167	R	45.5	Very low	56.6	Low	218 Å²	218	95.5 Å²	95.5	82%	0.823	49%	0.487	S	S	*	.			trans	-68.6	83.8	179	-80.4	-174.4	168.6	-172.1	-2	111	G165 L169	G165-R167 PolarHBondContact O-N 2.99Å; R167-L169 PolarHBondContact O-N 2.8Å; R167-L169 VanDerWaalsContact O-N 3.1Å
168	V	41.2	Very low	58.2	Low	101 Å²	101	87.1 Å²	87.1	61%	0.612	46%	0.455	S	S	*	.			trans	-76.3	95.8	168.8	-174.8	0	0	0	0	108.6	E166 S170	E166-V168 VanDerWaalsContact C-N 3.3Å; E166-V168 PolarHBondContact O-N 3Å; V168-S170 PolarHBondContact O-N 3.49Å
169	L	43.7	Very low	60	Low	170 Å²	170	82.6 Å²	82.6	89%	0.89	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	14.8	-170.7	-78.6	160.9	0	0	0	116.5	R167	R167-L169 PolarHBondContact O-N 2.8Å; R167-L169 VanDerWaalsContact O-N 3.1Å
170	S	39	Very low	61.4	Low	81 Å²	81	82.3 Å²	82.3	57%	0.566	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-15.4	-166.6	61.4	0	0	0	0	116.5	V168	V168-S170 PolarHBondContact O-N 3.49Å
171	H	42.2	Very low	62.9	Low	147 Å²	147	78.4 Å²	78.4	68%	0.681	41%	0.411	S	S	*	.	S	Bend	trans	-141.8	143.4	-178.1	-65.1	81.5	0	0	0	112.3	E173	H171-E173 PolarHBondContact O-N 3.41Å; H171-E173 VanDerWaalsContact O-N 3.1Å
172	P	47.3	Very low	64.7	Low	133 Å²	133	75.6 Å²	75.6	86%	0.864	39%	0.393	S	S	*	.			trans	-73.2	98.9	169.5	30.2	-32	0	0	0	109.4
173	E	60.2	Low	66.6	Low	131 Å²	131	75.2 Å²	75.2	61%	0.612	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-67.8	144.1	176.9	-63.6	-154.9	154.2	0	0	112.3	R138 H171	R138-E173 IonicContact CZ-OE2 3.78Å; R138-E173 IonicContact NE-OE2 3.12Å; R138-E173 IonicContact NH2-OE1 2.73Å; R138-E173 PolarHBondContact NH2-OE1 2.77Å; R138-E173 IonicContact NH2-OE2 2.97Å; R138-E173 PolarHBondContact NH2-OE2 3.12Å; H171-E173 PolarHBondContact O-N 3.41Å; H171-E173 VanDerWaalsContact O-N 3.1Å
174	E	66.1	Low	68.3	Low	117 Å²	117	75.4 Å²	75.4	55%	0.547	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-65.8	143.5	170.3	-68.8	-168.4	179	0	0	110.7	N139 C176	N139-E174 WeakPolarHBondContact CA-OE2 3.47Å; E174-C176 PolarHBondContact O-N 3.3Å
175	P	70.8	Confident	69.9	Low	50 Å²	50	71.8 Å²	71.8	33%	0.325	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.2	-176.1	24.6	-34.1	0	0	0	112.5	Y177	P175-Y177 HydrophobicContact CB-CE2 3.92Å; P175-Y177 HydrophobicContact CG-CE2 3.83Å; P175-Y177 WeakPolarHBondContact CG-OH 3.49Å; P175-Y177 WeakPolarHBondContact O-CD2 3.34Å; P175-Y177 VanDerWaalsContact O-CE2 3.3Å; P175-Y177 WeakPolarHBondContact O-CE2 3.4Å
176	C	79.1	Confident	71.9	Confident	9 Å²	9	73.9 Å²	73.9	6%	0.061	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	146.9	171.3	-168.1	0	0	0	0	110.6	C102 L136 Q137 E174	C102-C176 HydrophobicContact CB-CB 4.08Å; C102-C176 PolarHBondContact N-O 2.79Å; L136-C176 VanDerWaalsContact CD1-SG 3.56Å; Q137-C176 CarbonylContact O-C 3.6Å; Q137-C176 WeakPolarHBondContact O-CA 3.5Å; E174-C176 PolarHBondContact O-N 3.3Å
177	Y	84.4	Confident	74.1	Confident	51 Å²	51	66.2 Å²	66.2	20%	0.2	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142.8	176.7	-58.2	-82.8	0	0	0	111.7	K99 L100 R101 Q137 P175	K99-Y177 HydrophobicContact CD-CD1 4.33Å; K99-Y177 VanDerWaalsContact CE-CG 3.45Å; K99-Y177 HydrophobicContact CG-CD1 4.32Å; L100-Y177 VanDerWaalsContact O-CA 3.25Å; L100-Y177 WeakPolarHBondContact O-CA 3.2Å; L100-Y177 WeakPolarHBondContact O-CB 3.38Å; L100-Y177 WeakPolarHBondContact O-CD1 3.24Å; R101-Y177 HydrophobicContact CB-CD1 3.91Å; R101-Y177 HydrophobicContact CB-CE1 3.79Å; R101-Y177 HydrophobicContact CG-CD1 4.02Å; R101-Y177 HydrophobicContact CG-CE1 3.6Å; Q137-Y177 PolarHBondContact N-O 3.13Å; Q137-Y177 PolarHBondContact O-N 3.08Å; P175-Y177 HydrophobicContact CB-CE2 3.92Å; P175-Y177 HydrophobicContact CG-CE2 3.83Å; P175-Y177 WeakPolarHBondContact CG-OH 3.49Å; P175-Y177 WeakPolarHBondContact O-CD2 3.34Å; P175-Y177 VanDerWaalsContact O-CE2 3.3Å; P175-Y177 WeakPolarHBondContact O-CE2 3.4Å
178	L	86.5	Confident	76.5	Confident	1 Å²	1	57 Å²	57	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.5	164.1	-81.9	167.7	0	0	0	109.9	L100 A111 L136 M145 L163 F180	L100-L178 PolarHBondContact N-O 3.2Å; L100-L178 PolarHBondContact O-N 3.04Å; L100-L178 VanDerWaalsContact O-N 3.08Å; A111-L178 HydrophobicContact CB-CB 4.47Å; A111-L178 HydrophobicContact CB-CD1 3.6Å; L136-L178 HydrophobicContact CB-CD2 4.09Å; L136-L178 HydrophobicContact CD1-CD2 3.84Å; L136-L178 HydrophobicContact CD1-CG 4.09Å; M145-L178 HydrophobicContact CE-CD2 4.42Å; M145-L178 HydrophobicContact CG-CD2 4.43Å; L163-L178 HydrophobicContact CD1-CD1 3.79Å; L163-L178 HydrophobicContact CD2-CD1 4.09Å; L163-L178 HydrophobicContact CD2-CG 4.41Å; L178-F180 HydrophobicContact CB-CE2 4.08Å; L178-F180 HydrophobicContact CB-CZ 4.46Å
179	W	90.9	Very high	79.2	Confident	12 Å²	12	53.2 Å²	53.2	5%	0.045	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	115.3	-178.5	-59.9	78.4	0	0	0	109.4	L37 L71 V97 K98 K99 C134 V135 Q137	L37-W179 HydrophobicContact CD1-CD2 4.16Å; L37-W179 HydrophobicContact CD1-CG 4.47Å; L37-W179 HydrophobicContact CD1-CZ2 4.23Å; L37-W179 HydrophobicContact CD2-CB 4.31Å; L37-W179 HydrophobicContact CD2-CD2 4.21Å; L37-W179 HydrophobicContact CD2-CE3 4.2Å; L37-W179 HydrophobicContact CD2-CG 4.33Å; L71-W179 HydrophobicContact CD1-CH2 4.35Å; L71-W179 HydrophobicContact CD1-CZ3 4Å; V97-W179 HydrophobicContact CG1-CE3 3.57Å; V97-W179 HydrophobicContact CG1-CZ3 4.06Å; K98-W179 CarbonylContact O-C 3.53Å; K98-W179 WeakPolarHBondContact O-CA 3.17Å; K99-W179 HydrophobicContact CB-CD2 4.24Å; K99-W179 HydrophobicContact CB-CE3 3.87Å; K99-W179 HydrophobicContact CB-CZ3 4.11Å; K99-W179 HydrophobicContact CD-CD2 4.28Å; K99-W179 HydrophobicContact CD-CE3 4.16Å; K99-W179 HydrophobicContact CD-CH2 3.56Å; K99-W179 HydrophobicContact CD-CZ2 3.63Å; K99-W179 HydrophobicContact CD-CZ3 3.81Å; K99-W179 VanDerWaalsContact CE-CZ2 3.42Å; K99-W179 HydrophobicContact CG-CD2 3.89Å; K99-W179 HydrophobicContact CG-CE3 3.93Å; K99-W179 HydrophobicContact CG-CH2 4.23Å; K99-W179 HydrophobicContact CG-CZ2 4.14Å; K99-W179 HydrophobicContact CG-CZ3 4.09Å; C134-W179 CarbonylContact C-O 3.57Å; C134-W179 VanDerWaalsContact CA-O 3.3Å; C134-W179 WeakPolarHBondContact CA-O 3.47Å; V135-W179 HydrophobicContact CB-CB 4.26Å; V135-W179 PolarHBondContact N-O 3.26Å; V135-W179 PolarHBondContact O-N 3.25Å; Q137-W179 VanDerWaalsContact OE1-CZ2 3.27Å
180	F	92.1	Very high	81.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.5	175.2	-59.3	-91.3	0	0	0	109.1	V97 K98 L100 A111 E114 F115 L131 C134 L178 M182	V97-F180 CarbonylContact C-O 3.58Å; V97-F180 WeakPolarHBondContact CA-O 3.45Å; K98-F180 HydrophobicContact CB-CB 4.31Å; K98-F180 PolarHBondContact N-O 3.39Å; K98-F180 PolarHBondContact O-N 3.36Å; L100-F180 HydrophobicContact CD1-CD2 3.93Å; L100-F180 HydrophobicContact CD1-CE2 3.91Å; L100-F180 HydrophobicContact CD2-CE2 4.3Å; A111-F180 WeakPolarHBondContact O-CZ 3.26Å; E114-F180 HydrophobicContact CB-CE1 4.42Å; E114-F180 HydrophobicContact CB-CZ 4.14Å; E114-F180 HydrophobicContact CG-CD1 4.28Å; E114-F180 HydrophobicContact CG-CE1 4.01Å; E114-F180 HydrophobicContact CG-CE2 4.33Å; E114-F180 HydrophobicContact CG-CZ 4.05Å; F115-F180 HydrophobicContact CB-CE1 3.81Å; F115-F180 HydrophobicContact CB-CZ 4.06Å; F115-F180 HydrophobicContact CD2-CE1 4.2Å; F115-F180 HydrophobicContact CG-CE1 4.49Å; L131-F180 HydrophobicContact CD1-CB 4.01Å; L131-F180 HydrophobicContact CD1-CD1 3.9Å; L131-F180 HydrophobicContact CD1-CG 4.48Å; C134-F180 HydrophobicContact CB-CD1 4.13Å; C134-F180 HydrophobicContact CB-CE1 4.27Å; L178-F180 HydrophobicContact CB-CE2 4.08Å; L178-F180 HydrophobicContact CB-CZ 4.46Å; F180-M182 HydrophobicContact CB-CE 4.42Å; F180-M182 HydrophobicContact CB-CG 4.36Å; F180-M182 HydrophobicContact CB-SD 4.42Å
181	V	94.3	Very high	84.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.4	170.9	-173.7	0	0	0	0	107.6	Y69 V95 A96 V97 L131 E132 E133	Y69-V181 HydrophobicContact CD1-CG1 4.27Å; Y69-V181 HydrophobicContact CD2-CG2 4.34Å; Y69-V181 HydrophobicContact CE1-CG1 3.57Å; Y69-V181 HydrophobicContact CE1-CG2 4.39Å; Y69-V181 HydrophobicContact CE2-CG1 4.5Å; Y69-V181 HydrophobicContact CE2-CG2 3.91Å; V95-V181 HydrophobicContact CB-CG1 4.01Å; V95-V181 HydrophobicContact CG1-CG1 4.33Å; V95-V181 HydrophobicContact CG2-CG1 4Å; A96-V181 WeakPolarHBondContact O-CA 3.26Å; V97-V181 HydrophobicContact CG2-CG2 4.44Å; L131-V181 WeakPolarHBondContact CD1-O 3.26Å; E132-V181 HydrophobicContact CB-CB 4.46Å; E132-V181 HydrophobicContact CB-CG1 4.21Å; E132-V181 PolarHBondContact N-O 2.95Å; E133-V181 HydrophobicContact CG-CB 3.95Å; E133-V181 HydrophobicContact CG-CG2 3.92Å; E133-V181 PolarHBondContact N-O 3.48Å; E133-V181 PolarHBondContact O-N 3.41Å
182	M	95.1	Very high	87	Confident	14 Å²	14	39.9 Å²	39.9	7%	0.069	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	165.3	-175.6	-61.4	175.6	-67	0	0	110	V95 A96 K98 L118 V129 Q130 L131 F180	V95-M182 CarbonylContact C-O 3.52Å; V95-M182 WeakPolarHBondContact CA-O 3.43Å; V95-M182 WeakPolarHBondContact CB-O 3.29Å; A96-M182 HydrophobicContact CB-CB 4.38Å; A96-M182 PolarHBondContact N-O 3.05Å; A96-M182 PolarHBondContact O-N 3.02Å; K98-M182 HydrophobicContact CB-CE 3.68Å; K98-M182 HydrophobicContact CD-CE 4.35Å; L118-M182 HydrophobicContact CD1-SD 4.19Å; V129-M182 HydrophobicContact CG1-SD 4.25Å; V129-M182 HydrophobicContact CG2-CB 4.17Å; V129-M182 HydrophobicContact CG2-SD 4.46Å; Q130-M182 CarbonylContact O-C 3.6Å; Q130-M182 VanDerWaalsContact O-CA 3.23Å; Q130-M182 WeakPolarHBondContact O-CA 3.24Å; L131-M182 HydrophobicContact CD1-CG 3.96Å; F180-M182 HydrophobicContact CB-CE 4.42Å; F180-M182 HydrophobicContact CB-CG 4.36Å; F180-M182 HydrophobicContact CB-SD 4.42Å
183	E	94.8	Very high	89.4	Confident	28 Å²	28	33.9 Å²	33.9	13%	0.131	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	140.5	168.8	66.7	-178.9	133.2	0	0	111.5	V129 Q130 K245	V129-E183 HydrophobicContact CG2-CG 3.86Å; Q130-E183 HydrophobicContact CB-CG 4.21Å; Q130-E183 WeakPolarHBondContact CB-OE1 3.42Å; Q130-E183 PolarHBondContact N-OE1 3.03Å; Q130-E183 PolarHBondContact O-N 2.96Å; E183-K245 VanDerWaalsContact CD-CE 3.41Å; E183-K245 VanDerWaalsContact CD-NZ 3.26Å; E183-K245 HydrophobicContact CG-CD 4.48Å; E183-K245 WeakPolarHBondContact OE1-CD 3.3Å; E183-K245 WeakPolarHBondContact OE1-CE 3.49Å; E183-K245 IonicContact OE1-NZ 3.42Å; E183-K245 PolarHBondContact OE1-NZ 2.87Å; E183-K245 WeakPolarHBondContact OE2-CE 3.32Å; E183-K245 IonicContact OE2-NZ 2.9Å; E183-K245 PolarHBondContact OE2-NZ 2.92Å; E183-K245 VanDerWaalsContact OE2-NZ 3.12Å
184	F	96.4	Very high	91.1	Very high	18 Å²	18	27.9 Å²	27.9	8%	0.079	15%	0.145	C	C	.	.			trans	-80.2	144.2	171.5	-168.8	-116	0	0	0	110.9	V75 E85 S94 A96 E186 K238	V75-F184 HydrophobicContact CG1-CE2 4.24Å; E85-F184 HydrophobicContact CB-CD2 4.4Å; E85-F184 HydrophobicContact CB-CE2 3.81Å; E85-F184 HydrophobicContact CB-CZ 4.1Å; E85-F184 HydrophobicContact CG-CD2 4.18Å; E85-F184 HydrophobicContact CG-CE1 4.16Å; E85-F184 HydrophobicContact CG-CE2 3.8Å; E85-F184 HydrophobicContact CG-CZ 3.78Å; S94-F184 WeakPolarHBondContact O-CB 3.4Å; A96-F184 HydrophobicContact CB-CD2 4.22Å; F184-E186 HydrophobicContact CD1-CG 3.91Å; F184-E186 HydrophobicContact CE1-CB 4.46Å; F184-E186 HydrophobicContact CE1-CG 4Å; F184-K238 WeakPolarHBondContact O-CE 3.41Å; F184-K238 PolarHBondContact O-NZ 2.79Å
185	C	96.7	Very high	92.5	Very high	11 Å²	11	24.6 Å²	24.6	7%	0.074	13%	0.131	C	C	.	.			trans	-121.8	108	177.7	-64.6	0	0	0	0	108.5	G187 L234 I235	C185-G187 PolarHBondContact O-N 3.38Å; C185-L234 HydrophobicContact CB-CB 3.74Å; C185-L234 HydrophobicContact CB-CD1 4.28Å; C185-I235 CarbonylContact C-O 3.57Å; C185-I235 WeakPolarHBondContact CB-O 3.27Å
186	E	94.9	Very high	93.6	Very high	86 Å²	86	26.3 Å²	26.3	40%	0.402	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-25.6	-167	-62.3	73.1	-163	0	0	113.9	F184 G188 I235 K238	F184-E186 HydrophobicContact CD1-CG 3.91Å; F184-E186 HydrophobicContact CE1-CB 4.46Å; F184-E186 HydrophobicContact CE1-CG 4Å; E186-G188 PolarHBondContact O-N 3.39Å; E186-I235 PolarHBondContact N-O 2.7Å; E186-K238 VanDerWaalsContact CD-CE 3.4Å; E186-K238 WeakPolarHBondContact OE1-CE 3.24Å; E186-K238 IonicContact OE1-NZ 3.7Å; E186-K238 WeakPolarHBondContact OE2-CE 3.46Å; E186-K238 WeakPolarHBondContact OE2-CG 3.41Å
187	G	95.5	Very high	94.3	Very high	13 Å²	13	30.8 Å²	30.8	13%	0.134	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-1	-175.2	0	0	0	0	0	115	C185 I235	C185-G187 PolarHBondContact O-N 3.38Å; G187-I235 VanDerWaalsContact CA-O 3.29Å; G187-I235 WeakPolarHBondContact CA-O 3.32Å; G187-I235 PolarHBondContact N-O 2.96Å
188	G	95.4	Very high	94.6	Very high	23 Å²	23	39 Å²	39	24%	0.237	19%	0.19	C	C	.	.			trans	77.4	-156.9	-176.8	0	0	0	0	0	113.1	E186 L234 I235	E186-G188 PolarHBondContact O-N 3.39Å; G188-L234 CarbonylContact O-C 3.58Å; G188-L234 WeakPolarHBondContact O-CA 3.31Å; G188-I235 PolarHBondContact O-N 3.33Å
189	D	96.7	Very high	94.7	Very high	22 Å²	22	43.3 Å²	43.3	12%	0.118	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-87	161.3	174.9	68.6	62.2	0	0	0	112.6	N191 Q192 F193 I233 L234 R330	D189-N191 PolarHBondContact O-N 2.86Å; D189-N191 WeakPolarHBondContact OD1-CA 3.28Å; D189-N191 WeakPolarHBondContact OD1-CB 3.16Å; D189-N191 PolarHBondContact OD1-N 3.04Å; D189-Q192 PolarHBondContact O-N 3.29Å; D189-Q192 PolarHBondContact OD1-N 3.15Å; D189-F193 VanDerWaalsContact O-CB 3.25Å; D189-F193 WeakPolarHBondContact O-CB 3.35Å; D189-F193 PolarHBondContact O-N 3.43Å; D189-I233 CarbonylContact C-O 3.53Å; D189-I233 WeakPolarHBondContact CA-O 3.47Å; D189-L234 HydrophobicContact CB-CD2 4.36Å; D189-R330 IonicContact OD2-NH2 2.64Å; D189-R330 PolarHBondContact OD2-NH2 3.47Å
190	L	97.7	Very high	94.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-34.3	-177.5	178.1	67.3	0	0	0	111.9	F193 I194 F207 P230 I233 I235 L244 I313 M317	L190-F193 PolarHBondContact O-N 3.19Å; L190-I194 HydrophobicContact CD1-CD1 4.16Å; L190-I194 HydrophobicContact CD1-CG1 3.67Å; L190-I194 HydrophobicContact CG-CG1 4.18Å; L190-I194 WeakPolarHBondContact O-CB 3.46Å; L190-I194 VanDerWaalsContact O-CG1 3.26Å; L190-I194 WeakPolarHBondContact O-CG1 3.49Å; L190-I194 PolarHBondContact O-N 3.38Å; L190-F207 HydrophobicContact CD1-CD2 3.6Å; L190-F207 HydrophobicContact CD1-CE2 3.71Å; L190-P230 HydrophobicContact CB-CB 4.34Å; L190-P230 WeakPolarHBondContact CB-O 3.45Å; L190-P230 HydrophobicContact CD2-CB 4.49Å; L190-P230 PolarHBondContact N-O 3.48Å; L190-I233 HydrophobicContact CB-CB 3.92Å; L190-I233 HydrophobicContact CB-CG2 3.84Å; L190-I233 HydrophobicContact CD2-CB 4.35Å; L190-I233 HydrophobicContact CD2-CD1 4.02Å; L190-I233 HydrophobicContact CD2-CG2 4.06Å; L190-I233 HydrophobicContact CG-CG2 4.45Å; L190-I233 PolarHBondContact N-O 3.36Å; L190-I235 HydrophobicContact CD1-CD1 4.27Å; L190-L244 HydrophobicContact CD1-CD1 4.35Å; L190-I313 HydrophobicContact CD2-CG2 3.91Å; L190-M317 HydrophobicContact CD1-SD 4.34Å
191	N	96.3	Very high	94.6	Very high	5 Å²	5	48.7 Å²	48.7	3%	0.027	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-54.4	178.6	-173.5	59.4	0	0	0	110.6	D189 F193 I194 L195 P230 E331 L332 L333	D189-N191 PolarHBondContact O-N 2.86Å; D189-N191 WeakPolarHBondContact OD1-CA 3.28Å; D189-N191 WeakPolarHBondContact OD1-CB 3.16Å; D189-N191 PolarHBondContact OD1-N 3.04Å; N191-F193 VanDerWaalsContact C-N 3.31Å; N191-F193 PolarHBondContact O-N 3.11Å; N191-I194 PolarHBondContact O-N 3.24Å; N191-L195 WeakPolarHBondContact O-CB 3.44Å; N191-L195 VanDerWaalsContact O-CG 3.24Å; N191-L195 WeakPolarHBondContact O-CG 3.28Å; N191-L195 PolarHBondContact O-N 3.4Å; N191-L195 WeakPolarHBondContact OD1-CD1 3.38Å; N191-P230 HydrophobicContact CB-CB 3.79Å; N191-E331 PolarHBondContact ND2-O 3.14Å; N191-L332 WeakPolarHBondContact ND2-CD2 3.16Å; N191-L332 WeakPolarHBondContact OD1-CA 3.49Å; N191-L333 PolarHBondContact OD1-N 3.34Å
192	Q	95.7	Very high	94.5	Very high	114 Å²	114	55.4 Å²	55.4	53%	0.533	29%	0.286	S	S	.	.	H	α-helix	trans	-59.9	-42.7	176.1	-176.6	176.8	-5.4	0	0	111.2	D189 S196	D189-Q192 PolarHBondContact O-N 3.29Å; D189-Q192 PolarHBondContact OD1-N 3.15Å; Q192-S196 WeakPolarHBondContact O-CB 3.46Å; Q192-S196 PolarHBondContact O-N 3.45Å; Q192-S196 PolarHBondContact O-OG 3.29Å
193	F	97.1	Very high	94.5	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-48.9	-178.6	-175	-83.5	0	0	0	112.4	D189 L190 N191 S196 R197 T203 F207 I235 E237 P242	D189-F193 VanDerWaalsContact O-CB 3.25Å; D189-F193 WeakPolarHBondContact O-CB 3.35Å; D189-F193 PolarHBondContact O-N 3.43Å; L190-F193 PolarHBondContact O-N 3.19Å; N191-F193 VanDerWaalsContact C-N 3.31Å; N191-F193 PolarHBondContact O-N 3.11Å; F193-S196 PolarHBondContact O-OG 3.1Å; F193-R197 VanDerWaalsContact CZ-NH1 3.26Å; F193-R197 WeakPolarHBondContact O-CG 3.4Å; F193-T203 HydrophobicContact CE1-CG2 4.05Å; F193-F207 AromaticContact CD1-CE2 3.79Å; F193-F207 HydrophobicContact CD1-CE2 3.79Å; F193-F207 HydrophobicContact CD1-CZ 4.13Å; F193-F207 AromaticContact CE1-CE2 3.65Å; F193-F207 HydrophobicContact CE1-CE2 3.65Å; F193-F207 AromaticContact CE1-CZ 3.69Å; F193-F207 HydrophobicContact CE1-CZ 3.69Å; F193-F207 HydrophobicContact CZ-CE2 4.47Å; F193-F207 HydrophobicContact CZ-CZ 4.07Å; F193-I235 HydrophobicContact CB-CG1 3.92Å; F193-I235 HydrophobicContact CD1-CG1 4.46Å; F193-I235 HydrophobicContact CD2-CB 3.93Å; F193-I235 HydrophobicContact CD2-CG1 3.81Å; F193-I235 HydrophobicContact CD2-CG2 3.75Å; F193-I235 HydrophobicContact CE2-CB 4.31Å; F193-I235 HydrophobicContact CE2-CG1 4.44Å; F193-I235 HydrophobicContact CE2-CG2 3.61Å; F193-I235 HydrophobicContact CG-CB 4.45Å; F193-I235 HydrophobicContact CG-CG1 3.82Å; F193-I235 HydrophobicContact CG-CG2 4.49Å; F193-I235 HydrophobicContact CZ-CG2 4.28Å; F193-E237 HydrophobicContact CE2-CG 4.48Å; F193-P242 HydrophobicContact CE2-CB 4.15Å; F193-P242 HydrophobicContact CE2-CG 4.27Å; F193-P242 HydrophobicContact CZ-CB 3.71Å; F193-P242 HydrophobicContact CZ-CG 3.67Å
194	I	96	Very high	94.4	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-70.1	-45.8	-179.7	-65.4	-67.8	0	0	0	110.8	L190 N191 S196 R197 F207 M317 R320 L333	L190-I194 HydrophobicContact CD1-CD1 4.16Å; L190-I194 HydrophobicContact CD1-CG1 3.67Å; L190-I194 HydrophobicContact CG-CG1 4.18Å; L190-I194 WeakPolarHBondContact O-CB 3.46Å; L190-I194 VanDerWaalsContact O-CG1 3.26Å; L190-I194 WeakPolarHBondContact O-CG1 3.49Å; L190-I194 PolarHBondContact O-N 3.38Å; N191-I194 PolarHBondContact O-N 3.24Å; I194-S196 PolarHBondContact O-N 2.92Å; I194-R197 PolarHBondContact O-N 3.32Å; I194-F207 HydrophobicContact CD1-CD2 4.34Å; I194-F207 HydrophobicContact CD1-CE2 4.3Å; I194-M317 HydrophobicContact CD1-CG 3.93Å; I194-M317 HydrophobicContact CD1-SD 4.17Å; I194-M317 HydrophobicContact CG1-CG 4.2Å; I194-R320 VanDerWaalsContact O-CZ 3.27Å; I194-R320 PolarHBondContact O-NH1 3.31Å; I194-R320 PolarHBondContact O-NH2 3.32Å; I194-L333 HydrophobicContact CB-CD1 3.92Å; I194-L333 HydrophobicContact CG1-CD1 4.2Å; I194-L333 HydrophobicContact CG2-CD1 3.97Å; I194-L333 HydrophobicContact CG2-CD2 4.38Å
195	L	95.1	Very high	94.3	Very high	48 Å²	48	55.8 Å²	55.8	25%	0.251	29%	0.291	S	S	.	.	H	α-helix	trans	-71.3	-31.4	-175	-62.5	-178.1	0	0	0	113.2	N191 R197 T322 E331 L333	N191-L195 WeakPolarHBondContact O-CB 3.44Å; N191-L195 VanDerWaalsContact O-CG 3.24Å; N191-L195 WeakPolarHBondContact O-CG 3.28Å; N191-L195 PolarHBondContact O-N 3.4Å; N191-L195 WeakPolarHBondContact OD1-CD1 3.38Å; L195-R197 VanDerWaalsContact C-N 3.29Å; L195-R197 PolarHBondContact O-N 3Å; L195-T322 HydrophobicContact CD1-CG2 4.32Å; L195-T322 HydrophobicContact CD2-CG2 3.59Å; L195-E331 HydrophobicContact CD1-CB 4.24Å; L195-E331 HydrophobicContact CD1-CG 3.96Å; L195-E331 WeakPolarHBondContact CD1-O 3.28Å; L195-L333 HydrophobicContact CD2-CD2 4.06Å; L195-L333 HydrophobicContact CD2-CG 4.32Å; L195-L333 HydrophobicContact CG-CG 4.48Å
196	S	94.9	Very high	94.2	Very high	86 Å²	86	57.6 Å²	57.6	60%	0.601	30%	0.304	S	S	*	.	H	α-helix	trans	-74	-14.8	176.8	62.2	0	0	0	0	114.6	Q192 F193 I194	Q192-S196 WeakPolarHBondContact O-CB 3.46Å; Q192-S196 PolarHBondContact O-N 3.45Å; Q192-S196 PolarHBondContact O-OG 3.29Å; F193-S196 PolarHBondContact O-OG 3.1Å; I194-S196 PolarHBondContact O-N 2.92Å
197	R	93.4	Very high	94.4	Very high	103 Å²	103	53.5 Å²	53.5	39%	0.389	29%	0.285	S	S	.	.	S	Bend	trans	-113.7	164.1	-174	-61.4	-179.9	-171.8	-152.4	2.3	111.5	F193 I194 L195 E237 R320	F193-R197 VanDerWaalsContact CZ-NH1 3.26Å; F193-R197 WeakPolarHBondContact O-CG 3.4Å; I194-R197 PolarHBondContact O-N 3.32Å; L195-R197 VanDerWaalsContact C-N 3.29Å; L195-R197 PolarHBondContact O-N 3Å; R197-E237 IonicContact CZ-OE1 3.59Å; R197-E237 VanDerWaalsContact CZ-OE1 3.26Å; R197-E237 IonicContact CZ-OE2 2.75Å; R197-E237 IonicContact NH1-OE1 2.69Å; R197-E237 PolarHBondContact NH1-OE1 3.4Å; R197-E237 IonicContact NH2-OE1 2.73Å; R197-E237 PolarHBondContact NH2-OE1 2.88Å; R197-E237 IonicContact NH2-OE2 3.23Å; R197-E237 PolarHBondContact NH2-OE2 3.25Å; R197-R320 VanDerWaalsContact O-CZ 3.29Å; R197-R320 PolarHBondContact O-NH1 2.9Å; R197-R320 PolarHBondContact O-NH2 2.77Å
198	R	91.4	Very high	94.4	Very high	223 Å²	223	53 Å²	53	84%	0.842	28%	0.279	S	S	*	.			trans	-70.2	157.9	168.8	-74.1	-175	177.2	177	0.6	110.4	D200 R320	R198-D200 PolarHBondContact O-N 2.85Å; R198-R320 PolarHBondContact O-NH2 2.92Å; R198-R320 VanDerWaalsContact O-NH2 3.12Å
199	P	87.2	Confident	94.5	Very high	92 Å²	92	53.9 Å²	53.9	60%	0.597	28%	0.278	S	S	*	.			trans	-56.2	127.9	173.2	-20.4	30.3	0	0	0	110.9
200	D	91.8	Very high	94.6	Very high	64 Å²	64	53.7 Å²	53.7	34%	0.342	28%	0.277	S	S	.	.			trans	-129.1	100.7	177.5	178.3	-1.7	0	0	0	109	R198 L202 T203 N204	R198-D200 PolarHBondContact O-N 2.85Å; D200-L202 VanDerWaalsContact C-N 3.27Å; D200-L202 PolarHBondContact O-N 2.84Å; D200-L202 PolarHBondContact OD1-N 3.1Å; D200-T203 PolarHBondContact OD1-N 3.45Å; D200-T203 VanDerWaalsContact OD2-CB 3.25Å; D200-T203 WeakPolarHBondContact OD2-CB 3.32Å; D200-T203 PolarHBondContact OD2-OG1 3.34Å; D200-N204 WeakPolarHBondContact O-CB 3.47Å; D200-N204 VanDerWaalsContact O-CG 3.26Å; D200-N204 PolarHBondContact O-N 3.37Å; D200-N204 PolarHBondContact O-OD1 2.93Å
201	P	90.7	Very high	94.6	Very high	61 Å²	61	53.7 Å²	53.7	40%	0.396	28%	0.277	S	S	.	.	H	α-helix	trans	-58.7	-33.2	177.5	-28.6	38.2	0	0	0	114.4	N205	P201-N205 WeakPolarHBondContact O-CB 3.45Å; P201-N205 PolarHBondContact O-N 3.11Å; P201-N205 PolarHBondContact O-OD1 2.86Å
202	L	91.7	Very high	94.7	Very high	141 Å²	141	53.5 Å²	53.5	74%	0.738	28%	0.276	S	S	*	.	H	α-helix	trans	-72.3	-46.9	-176.6	-63.5	176.8	0	0	0	110.3	D200 N205 S206	D200-L202 VanDerWaalsContact C-N 3.27Å; D200-L202 PolarHBondContact O-N 2.84Å; D200-L202 PolarHBondContact OD1-N 3.1Å; L202-N205 PolarHBondContact O-N 2.96Å; L202-S206 PolarHBondContact O-N 3.16Å
203	T	94.1	Very high	94.9	Very high	24 Å²	24	49.2 Å²	49.2	15%	0.147	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-42.1	173.3	-63.5	0	0	0	0	111.2	F193 D200 N205 S206 F207	F193-T203 HydrophobicContact CE1-CG2 4.05Å; D200-T203 PolarHBondContact OD1-N 3.45Å; D200-T203 VanDerWaalsContact OD2-CB 3.25Å; D200-T203 WeakPolarHBondContact OD2-CB 3.32Å; D200-T203 PolarHBondContact OD2-OG1 3.34Å; T203-N205 PolarHBondContact O-N 3.03Å; T203-S206 PolarHBondContact O-N 3.06Å; T203-F207 HydrophobicContact CG2-CD1 4.21Å; T203-F207 HydrophobicContact CG2-CD2 3.99Å; T203-F207 HydrophobicContact CG2-CE1 3.84Å; T203-F207 HydrophobicContact CG2-CE2 3.6Å; T203-F207 HydrophobicContact CG2-CG 4.29Å; T203-F207 HydrophobicContact CG2-CZ 3.53Å; T203-F207 WeakPolarHBondContact O-CB 3.31Å; T203-F207 WeakPolarHBondContact O-CG 3.37Å; T203-F207 PolarHBondContact O-N 3.45Å
204	N	94.3	Very high	94.9	Very high	6 Å²	6	49 Å²	49	3%	0.032	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-44.9	175.5	-78.6	4.8	0	0	0	112.3	D200 F207 M208 M317 L318	D200-N204 WeakPolarHBondContact O-CB 3.47Å; D200-N204 VanDerWaalsContact O-CG 3.26Å; D200-N204 PolarHBondContact O-N 3.37Å; D200-N204 PolarHBondContact O-OD1 2.93Å; N204-F207 PolarHBondContact O-N 3.5Å; N204-M208 WeakPolarHBondContact O-CG 3.48Å; N204-M208 PolarHBondContact O-N 2.9Å; N204-M317 HydrophobicContact CB-CE 4.22Å; N204-M317 WeakPolarHBondContact O-CE 3.31Å; N204-L318 HydrophobicContact CB-CD2 4.1Å
205	N	93.7	Very high	95	Very high	39 Å²	39	48.7 Å²	48.7	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-43	177.1	-73.7	-1.2	0	0	0	111.6	P201 L202 T203 F207 M208 L209 T401	P201-N205 WeakPolarHBondContact O-CB 3.45Å; P201-N205 PolarHBondContact O-N 3.11Å; P201-N205 PolarHBondContact O-OD1 2.86Å; L202-N205 PolarHBondContact O-N 2.96Å; T203-N205 PolarHBondContact O-N 3.03Å; N205-F207 PolarHBondContact O-N 3.27Å; N205-M208 HydrophobicContact CB-CE 4.39Å; N205-M208 PolarHBondContact O-N 2.81Å; N205-M208 VanDerWaalsContact OD1-CE 3.27Å; N205-M208 WeakPolarHBondContact OD1-CE 3.47Å; N205-L209 PolarHBondContact O-N 2.96Å; N205-T401 HydrophobicContact CB-CG2 4.32Å
206	S	95.6	Very high	95.2	Very high	49 Å²	49	47 Å²	47	34%	0.343	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-43.6	174.2	-169.7	0	0	0	0	112	L202 T203 M208 L209 Q210	L202-S206 PolarHBondContact O-N 3.16Å; T203-S206 PolarHBondContact O-N 3.06Å; S206-M208 PolarHBondContact O-N 3.34Å; S206-L209 PolarHBondContact O-N 3.22Å; S206-Q210 VanDerWaalsContact O-CG 3.31Å; S206-Q210 WeakPolarHBondContact O-CG 3.44Å; S206-Q210 PolarHBondContact O-N 2.75Å; S206-Q210 PolarHBondContact OG-NE2 3.25Å
207	F	97.4	Very high	95.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-33.6	178.4	-73.7	-3.8	0	0	0	113.2	L190 F193 I194 T203 N204 N205 L209 Q210 L211 I235 P242 L244 M317	L190-F207 HydrophobicContact CD1-CD2 3.6Å; L190-F207 HydrophobicContact CD1-CE2 3.71Å; F193-F207 AromaticContact CD1-CE2 3.79Å; F193-F207 HydrophobicContact CD1-CE2 3.79Å; F193-F207 HydrophobicContact CD1-CZ 4.13Å; F193-F207 AromaticContact CE1-CE2 3.65Å; F193-F207 HydrophobicContact CE1-CE2 3.65Å; F193-F207 AromaticContact CE1-CZ 3.69Å; F193-F207 HydrophobicContact CE1-CZ 3.69Å; F193-F207 HydrophobicContact CZ-CE2 4.47Å; F193-F207 HydrophobicContact CZ-CZ 4.07Å; I194-F207 HydrophobicContact CD1-CD2 4.34Å; I194-F207 HydrophobicContact CD1-CE2 4.3Å; T203-F207 HydrophobicContact CG2-CD1 4.21Å; T203-F207 HydrophobicContact CG2-CD2 3.99Å; T203-F207 HydrophobicContact CG2-CE1 3.84Å; T203-F207 HydrophobicContact CG2-CE2 3.6Å; T203-F207 HydrophobicContact CG2-CG 4.29Å; T203-F207 HydrophobicContact CG2-CZ 3.53Å; T203-F207 WeakPolarHBondContact O-CB 3.31Å; T203-F207 WeakPolarHBondContact O-CG 3.37Å; T203-F207 PolarHBondContact O-N 3.45Å; N204-F207 PolarHBondContact O-N 3.5Å; N205-F207 PolarHBondContact O-N 3.27Å; F207-L209 VanDerWaalsContact C-N 3.34Å; F207-L209 PolarHBondContact O-N 2.69Å; F207-Q210 PolarHBondContact O-N 3.37Å; F207-L211 VanDerWaalsContact O-CB 3.29Å; F207-L211 WeakPolarHBondContact O-CB 3.26Å; F207-L211 VanDerWaalsContact O-CG 3.31Å; F207-L211 WeakPolarHBondContact O-CG 3.32Å; F207-L211 PolarHBondContact O-N 2.73Å; F207-I235 HydrophobicContact CE1-CD1 4.21Å; F207-I235 HydrophobicContact CE2-CD1 3.9Å; F207-I235 HydrophobicContact CZ-CD1 3.61Å; F207-I235 HydrophobicContact CZ-CG1 4.4Å; F207-I235 HydrophobicContact CZ-CG2 4.37Å; F207-P242 HydrophobicContact CE1-CB 3.88Å; F207-P242 HydrophobicContact CZ-CB 3.79Å; F207-L244 HydrophobicContact CB-CD1 3.96Å; F207-L244 HydrophobicContact CD1-CB 3.99Å; F207-L244 HydrophobicContact CD1-CD1 4.1Å; F207-L244 HydrophobicContact CD2-CD1 4.23Å; F207-L244 HydrophobicContact CE1-CB 4.12Å; F207-L244 HydrophobicContact CG-CD1 3.86Å; F207-M317 HydrophobicContact CB-CE 4.14Å; F207-M317 HydrophobicContact CB-SD 4.02Å; F207-M317 HydrophobicContact CD2-SD 4.09Å
208	M	97.1	Very high	95.5	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-41.8	171.9	-71.2	-168.2	-68.9	0	0	112.2	N204 N205 S206 T212 I314 M317 L318 V372 M397	N204-M208 WeakPolarHBondContact O-CG 3.48Å; N204-M208 PolarHBondContact O-N 2.9Å; N205-M208 HydrophobicContact CB-CE 4.39Å; N205-M208 PolarHBondContact O-N 2.81Å; N205-M208 VanDerWaalsContact OD1-CE 3.27Å; N205-M208 WeakPolarHBondContact OD1-CE 3.47Å; S206-M208 PolarHBondContact O-N 3.34Å; M208-T212 VanDerWaalsContact O-CG2 3.31Å; M208-T212 WeakPolarHBondContact O-CG2 3.39Å; M208-T212 PolarHBondContact O-N 2.97Å; M208-T212 VanDerWaalsContact O-N 3.13Å; M208-T212 PolarHBondContact O-OG1 3.3Å; M208-I314 HydrophobicContact CG-CD1 4.27Å; M208-I314 HydrophobicContact CG-CG1 4.2Å; M208-I314 HydrophobicContact CG-CG2 3.79Å; M208-I314 HydrophobicContact SD-CG2 3.46Å; M208-I314 WeakPolarHBondContact SD-CG2 3.36Å; M208-M317 HydrophobicContact CG-CE 3.83Å; M208-L318 HydrophobicContact CE-CD2 4.2Å; M208-L318 HydrophobicContact SD-CD1 3.82Å; M208-L318 HydrophobicContact SD-CD2 4.26Å; M208-L318 HydrophobicContact SD-CG 4.31Å; M208-V372 HydrophobicContact CE-CG2 4.44Å; M208-V372 HydrophobicContact SD-CG1 4.13Å; M208-M397 HydrophobicContact CB-CE 4Å; M208-M397 HydrophobicContact CB-CG 4.11Å; M208-M397 HydrophobicContact CB-SD 3.8Å; M208-M397 HydrophobicContact CE-SD 4.26Å; M208-M397 HydrophobicContact CG-CE 4.36Å; M208-M397 HydrophobicContact CG-SD 4.43Å; M208-M397 HydrophobicContact SD-CE 3.97Å; M208-M397 HydrophobicContact SD-SD 3.91Å
209	L	97.1	Very high	95.7	Very high	42 Å²	42	28.9 Å²	28.9	22%	0.22	17%	0.168	C	C	.	.	H	α-helix	trans	-66.8	-48.9	175.4	-69.5	169.8	0	0	0	112	N205 S206 F207 L211 T212 S213 M397 D398 T401	N205-L209 PolarHBondContact O-N 2.96Å; S206-L209 PolarHBondContact O-N 3.22Å; F207-L209 VanDerWaalsContact C-N 3.34Å; F207-L209 PolarHBondContact O-N 2.69Å; L209-L211 VanDerWaalsContact C-N 3.31Å; L209-L211 PolarHBondContact O-N 2.95Å; L209-T212 PolarHBondContact O-N 2.82Å; L209-T212 PolarHBondContact O-OG1 2.87Å; L209-T212 VanDerWaalsContact O-OG1 3.07Å; L209-S213 WeakPolarHBondContact O-CB 3.47Å; L209-S213 PolarHBondContact O-N 2.96Å; L209-M397 HydrophobicContact CD2-CB 4.33Å; L209-M397 HydrophobicContact CD2-CG 3.91Å; L209-D398 HydrophobicContact CD2-CB 4.06Å; L209-T401 HydrophobicContact CD1-CG2 4.23Å; L209-T401 WeakPolarHBondContact CD1-OG1 3.2Å; L209-T401 HydrophobicContact CD2-CG2 4.32Å; L209-T401 VanDerWaalsContact CD2-OG1 3.31Å; L209-T401 WeakPolarHBondContact CD2-OG1 3.26Å; L209-T401 HydrophobicContact CG-CG2 4.07Å
210	Q	98.3	Very high	96	Very high	18 Å²	18	31.4 Å²	31.4	8%	0.084	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-39.8	-179.2	-69.5	-178.1	58.4	0	0	112	N127 S206 F207 A214 L244	N127-Q210 HydrophobicContact CB-CB 4.39Å; N127-Q210 WeakPolarHBondContact CB-O 3.37Å; N127-Q210 WeakPolarHBondContact ND2-CB 3.38Å; N127-Q210 WeakPolarHBondContact ND2-CG 3.42Å; N127-Q210 PolarHBondContact ND2-OE1 2.92Å; S206-Q210 VanDerWaalsContact O-CG 3.31Å; S206-Q210 WeakPolarHBondContact O-CG 3.44Å; S206-Q210 PolarHBondContact O-N 2.75Å; S206-Q210 PolarHBondContact OG-NE2 3.25Å; F207-Q210 PolarHBondContact O-N 3.37Å; Q210-A214 WeakPolarHBondContact O-CB 2.81Å; Q210-A214 PolarHBondContact O-N 3.48Å; Q210-L244 HydrophobicContact CB-CB 4.15Å; Q210-L244 HydrophobicContact CB-CD2 4.33Å
211	L	98.3	Very high	96.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.1	-49	175.4	-80.2	167.2	0	0	0	112.9	F207 L209 S213 A214 V215 I233 L244 L310 I313 I314	F207-L211 VanDerWaalsContact O-CB 3.29Å; F207-L211 WeakPolarHBondContact O-CB 3.26Å; F207-L211 VanDerWaalsContact O-CG 3.31Å; F207-L211 WeakPolarHBondContact O-CG 3.32Å; F207-L211 PolarHBondContact O-N 2.73Å; L209-L211 VanDerWaalsContact C-N 3.31Å; L209-L211 PolarHBondContact O-N 2.95Å; L211-S213 VanDerWaalsContact C-N 3.33Å; L211-S213 PolarHBondContact O-N 3.3Å; L211-A214 PolarHBondContact O-N 3.42Å; L211-V215 PolarHBondContact O-N 2.94Å; L211-V215 VanDerWaalsContact O-N 3.12Å; L211-I233 HydrophobicContact CD2-CD1 3.63Å; L211-I233 HydrophobicContact CD2-CG1 4.11Å; L211-I233 HydrophobicContact CD2-CG2 4.21Å; L211-L244 HydrophobicContact CD1-CD1 4.12Å; L211-L244 HydrophobicContact CD2-CD1 4.05Å; L211-L244 HydrophobicContact CD2-CD2 3.66Å; L211-L244 HydrophobicContact CD2-CG 4.47Å; L211-L244 HydrophobicContact CG-CD1 3.73Å; L211-L244 HydrophobicContact CG-CD2 3.82Å; L211-L244 HydrophobicContact CG-CG 4.47Å; L211-L310 HydrophobicContact CB-CD2 4.06Å; L211-L310 HydrophobicContact CD2-CD2 4.12Å; L211-I313 HydrophobicContact CD1-CG2 4.18Å; L211-I314 HydrophobicContact CD1-CG1 4.5Å
212	T	98.4	Very high	96.1	Very high	1 Å²	1	29 Å²	29	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-37.3	-179.2	54.5	0	0	0	0	111.6	M208 L209 A216 L393 H394 M397	M208-T212 VanDerWaalsContact O-CG2 3.31Å; M208-T212 WeakPolarHBondContact O-CG2 3.39Å; M208-T212 PolarHBondContact O-N 2.97Å; M208-T212 VanDerWaalsContact O-N 3.13Å; M208-T212 PolarHBondContact O-OG1 3.3Å; L209-T212 PolarHBondContact O-N 2.82Å; L209-T212 PolarHBondContact O-OG1 2.87Å; L209-T212 VanDerWaalsContact O-OG1 3.07Å; T212-A216 VanDerWaalsContact O-CB 3.32Å; T212-A216 WeakPolarHBondContact O-CB 3.49Å; T212-A216 PolarHBondContact O-N 2.91Å; T212-L393 HydrophobicContact CG2-CD1 4.13Å; T212-L393 HydrophobicContact CG2-CD2 3.93Å; T212-L393 HydrophobicContact CG2-CG 3.7Å; T212-H394 PolarHBondContact OG1-ND1 2.76Å; T212-H394 VanDerWaalsContact OG1-ND1 3.15Å; T212-M397 HydrophobicContact CG2-CB 4.26Å; T212-M397 HydrophobicContact CG2-CE 4.31Å; T212-M397 HydrophobicContact CG2-CG 4.39Å
213	S	98.5	Very high	96.2	Very high	24 Å²	24	22.3 Å²	22.3	17%	0.168	12%	0.121	C	C	.	.	H	α-helix	trans	-62	-48.4	173.3	-169.9	0	0	0	0	111.9	H125 L209 L211 V215 A216 F217 H394	H125-S213 PolarHBondContact CE1-OG 3.44Å; H125-S213 PolarHBondContact NE2-OG 2.96Å; L209-S213 WeakPolarHBondContact O-CB 3.47Å; L209-S213 PolarHBondContact O-N 2.96Å; L211-S213 VanDerWaalsContact C-N 3.33Å; L211-S213 PolarHBondContact O-N 3.3Å; S213-V215 PolarHBondContact O-N 3.29Å; S213-A216 PolarHBondContact O-N 3.1Å; S213-F217 WeakPolarHBondContact O-CB 3.16Å; S213-F217 PolarHBondContact O-N 2.86Å; S213-H394 PolarHBondContact N-ND1 3.41Å
214	A	98.6	Very high	96.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-56.8	-47.3	177.3	0	0	0	0	0	112.7	N127 V128 Q210 L211 F217 L218 V246	N127-A214 HydrophobicContact CB-CB 3.82Å; N127-A214 WeakPolarHBondContact O-CB 3.36Å; V128-A214 HydrophobicContact CG2-CB 4.22Å; Q210-A214 WeakPolarHBondContact O-CB 2.81Å; Q210-A214 PolarHBondContact O-N 3.48Å; L211-A214 PolarHBondContact O-N 3.42Å; A214-F217 PolarHBondContact O-N 3.24Å; A214-L218 WeakPolarHBondContact O-CG 3.48Å; A214-L218 PolarHBondContact O-N 3.16Å; A214-V246 HydrophobicContact CB-CB 4.44Å; A214-V246 HydrophobicContact CB-CG2 3.6Å
215	V	98.4	Very high	96.3	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-72.6	-35.8	-178	176.5	0	0	0	0	111.7	L211 S213 F217 L218 H219 L228 D306 L310 A390	L211-V215 PolarHBondContact O-N 2.94Å; L211-V215 VanDerWaalsContact O-N 3.12Å; S213-V215 PolarHBondContact O-N 3.29Å; V215-F217 VanDerWaalsContact C-N 3.35Å; V215-F217 PolarHBondContact O-N 3.45Å; V215-L218 PolarHBondContact O-N 2.86Å; V215-H219 WeakPolarHBondContact O-CB 3.43Å; V215-H219 PolarHBondContact O-CD2 3.36Å; V215-H219 PolarHBondContact O-N 3.35Å; V215-L228 HydrophobicContact CG2-CD1 3.78Å; V215-D306 HydrophobicContact CG1-CB 4.25Å; V215-L310 HydrophobicContact CB-CD1 3.95Å; V215-L310 HydrophobicContact CG1-CD1 4.17Å; V215-L310 HydrophobicContact CG2-CD1 3.82Å; V215-L310 HydrophobicContact CG2-CD2 4.15Å; V215-L310 HydrophobicContact CG2-CG 4.21Å; V215-A390 HydrophobicContact CG1-CB 4.11Å
216	A	98.2	Very high	96.3	Very high	12 Å²	12	20.8 Å²	20.8	10%	0.099	11%	0.109	C	C	.	.	H	α-helix	trans	-58.7	-46	171.1	0	0	0	0	0	111.6	T212 S213 H219 E220 A390 H394	T212-A216 VanDerWaalsContact O-CB 3.32Å; T212-A216 WeakPolarHBondContact O-CB 3.49Å; T212-A216 PolarHBondContact O-N 2.91Å; S213-A216 PolarHBondContact O-N 3.1Å; A216-H219 PolarHBondContact O-N 2.71Å; A216-E220 WeakPolarHBondContact O-CB 3.25Å; A216-E220 PolarHBondContact O-N 3.44Å; A216-A390 HydrophobicContact CB-CB 4.29Å; A216-H394 HydrophobicContact CB-CB 4.19Å
217	F	97.9	Very high	96.3	Very high	17 Å²	17	19.1 Å²	19.1	8%	0.075	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-43.8	175.4	170.9	-97.1	0	0	0	112.8	L121 K123 H125 V128 S213 A214 V215 E220 N221	L121-F217 HydrophobicContact CD1-CE1 4.19Å; L121-F217 HydrophobicContact CD2-CE1 3.58Å; L121-F217 HydrophobicContact CD2-CZ 3.87Å; L121-F217 HydrophobicContact CG-CE1 4.44Å; K123-F217 HydrophobicContact CB-CE2 4.32Å; K123-F217 WeakPolarHBondContact O-CZ 3.37Å; H125-F217 HydrophobicContact CB-CD1 3.53Å; H125-F217 HydrophobicContact CB-CD2 4.08Å; H125-F217 HydrophobicContact CB-CE1 3.56Å; H125-F217 HydrophobicContact CB-CE2 4.1Å; H125-F217 HydrophobicContact CB-CG 3.79Å; H125-F217 HydrophobicContact CB-CZ 3.85Å; H125-F217 AromaticContact CD2-CD2 3.65Å; H125-F217 AromaticContact CD2-CG 3.5Å; H125-F217 AromaticContact CG-CD1 3.79Å; H125-F217 AromaticContact CG-CG 3.66Å; V128-F217 HydrophobicContact CG2-CD1 4Å; V128-F217 HydrophobicContact CG2-CE1 4.39Å; S213-F217 WeakPolarHBondContact O-CB 3.16Å; S213-F217 PolarHBondContact O-N 2.86Å; A214-F217 PolarHBondContact O-N 3.24Å; V215-F217 VanDerWaalsContact C-N 3.35Å; V215-F217 PolarHBondContact O-N 3.45Å; F217-E220 PolarHBondContact O-N 2.89Å; F217-N221 WeakPolarHBondContact CE2-ND2 3.34Å; F217-N221 PolarHBondContact O-N 3.44Å; F217-N221 VanDerWaalsContact O-N 3.12Å; F217-N221 PolarHBondContact O-ND2 2.7Å
218	L	96.6	Very high	96.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.4	-45.2	176.9	-70.9	177.2	0	0	0	111.7	L121 V128 A214 V215 N221 N222 I223 V246 F249	L121-L218 HydrophobicContact CD2-CD2 4.5Å; V128-L218 HydrophobicContact CG1-CD2 4.44Å; V128-L218 HydrophobicContact CG2-CD2 4.22Å; V128-L218 HydrophobicContact CG2-CG 4.27Å; A214-L218 WeakPolarHBondContact O-CG 3.48Å; A214-L218 PolarHBondContact O-N 3.16Å; V215-L218 PolarHBondContact O-N 2.86Å; L218-N221 CarbonylContact O-C 3.51Å; L218-N221 PolarHBondContact O-N 3.35Å; L218-N221 VanDerWaalsContact O-N 3.15Å; L218-N222 PolarHBondContact O-N 3.01Å; L218-I223 CarbonylContact C-O 3.52Å; L218-I223 HydrophobicContact CB-CB 4.36Å; L218-I223 HydrophobicContact CD2-CB 4.4Å; L218-I223 HydrophobicContact CD2-CD1 4.22Å; L218-I223 HydrophobicContact CD2-CG2 4.38Å; L218-I223 PolarHBondContact O-N 3.49Å; L218-V246 HydrophobicContact CD1-CG1 4.2Å; L218-F249 HydrophobicContact CD1-CE1 3.81Å; L218-F249 HydrophobicContact CD1-CZ 4.07Å; L218-F249 HydrophobicContact CD2-CE1 3.64Å; L218-F249 HydrophobicContact CD2-CZ 4Å; L218-F249 HydrophobicContact CG-CE1 4.4Å
219	H	96	Very high	96.3	Very high	14 Å²	14	21 Å²	21	7%	0.065	11%	0.105	C	C	.	.	H	α-helix	trans	-67.6	-37	180	-71.6	-165.6	0	0	0	112.1	V215 A216 N221 N222 I223 V277 A303 D306 A390	V215-H219 WeakPolarHBondContact O-CB 3.43Å; V215-H219 PolarHBondContact O-CD2 3.36Å; V215-H219 PolarHBondContact O-N 3.35Å; A216-H219 PolarHBondContact O-N 2.71Å; H219-N221 VanDerWaalsContact C-N 3.27Å; H219-N221 PolarHBondContact O-N 2.7Å; H219-N222 PolarHBondContact O-N 3.13Å; H219-I223 PolarHBondContact CD2-O 3.31Å; H219-I223 VanDerWaalsContact CD2-O 3.3Å; H219-V277 HydrophobicContact CB-CG2 4.06Å; H219-A303 PolarHBondContact CE1-O 2.84Å; H219-D306 IonicContact CD2-OD2 2.89Å; H219-D306 IonicContact CE1-OD2 2.87Å; H219-D306 IonicContact NE2-OD2 2.72Å; H219-D306 PolarHBondContact NE2-OD2 3.05Å; H219-A390 HydrophobicContact CB-CB 4.16Å; H219-A390 WeakPolarHBondContact ND1-CB 3.4Å
220	E	94.5	Very high	96.3	Very high	145 Å²	145	19 Å²	19	68%	0.678	9%	0.094	S	C	*	.	H	α-helix	trans	-59.1	-38.1	170.9	-172.2	-172.2	-168.1	0	0	111.7	A216 F217 N222	A216-E220 WeakPolarHBondContact O-CB 3.25Å; A216-E220 PolarHBondContact O-N 3.44Å; F217-E220 PolarHBondContact O-N 2.89Å; E220-N222 PolarHBondContact O-N 3.44Å
221	N	92.3	Very high	96	Very high	38 Å²	38	19.7 Å²	19.7	20%	0.203	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	9.2	175.8	-73	-94	0	0	0	113.5	L121 F217 L218 H219 I223	L121-N221 HydrophobicContact CD2-CB 3.93Å; F217-N221 WeakPolarHBondContact CE2-ND2 3.34Å; F217-N221 PolarHBondContact O-N 3.44Å; F217-N221 VanDerWaalsContact O-N 3.12Å; F217-N221 PolarHBondContact O-ND2 2.7Å; L218-N221 CarbonylContact O-C 3.51Å; L218-N221 PolarHBondContact O-N 3.35Å; L218-N221 VanDerWaalsContact O-N 3.15Å; H219-N221 VanDerWaalsContact C-N 3.27Å; H219-N221 PolarHBondContact O-N 2.7Å; N221-I223 VanDerWaalsContact C-N 3.32Å; N221-I223 HydrophobicContact CB-CD1 4.32Å; N221-I223 HydrophobicContact CB-CG1 4.42Å; N221-I223 PolarHBondContact O-N 3.49Å
222	N	92.3	Very high	95.9	Very high	37 Å²	37	20.3 Å²	20.3	20%	0.198	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	31.8	-178.8	-46.8	-96	0	0	0	113.9	L218 H219 E220 C255 A256 V275 V277	L218-N222 PolarHBondContact O-N 3.01Å; H219-N222 PolarHBondContact O-N 3.13Å; E220-N222 PolarHBondContact O-N 3.44Å; N222-C255 HydrophobicContact CB-CB 4.41Å; N222-C255 PolarHBondContact O-N 2.91Å; N222-A256 HydrophobicContact CB-CB 4.41Å; N222-V275 PolarHBondContact OD1-O 2.85Å; N222-V277 HydrophobicContact CB-CG1 4.08Å
223	I	92.3	Very high	95.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.9	177.1	-55	173.4	0	0	0	108.8	A117 L121 L218 H219 N221 F249 K253 V254	A117-I223 HydrophobicContact CB-CG2 4.18Å; A117-I223 WeakPolarHBondContact O-CD1 3.38Å; L121-I223 HydrophobicContact CD2-CD1 3.52Å; L121-I223 HydrophobicContact CG-CD1 4.06Å; L218-I223 CarbonylContact C-O 3.52Å; L218-I223 HydrophobicContact CB-CB 4.36Å; L218-I223 HydrophobicContact CD2-CB 4.4Å; L218-I223 HydrophobicContact CD2-CD1 4.22Å; L218-I223 HydrophobicContact CD2-CG2 4.38Å; L218-I223 PolarHBondContact O-N 3.49Å; H219-I223 PolarHBondContact CD2-O 3.31Å; H219-I223 VanDerWaalsContact CD2-O 3.3Å; N221-I223 VanDerWaalsContact C-N 3.32Å; N221-I223 HydrophobicContact CB-CD1 4.32Å; N221-I223 HydrophobicContact CB-CG1 4.42Å; N221-I223 PolarHBondContact O-N 3.49Å; I223-F249 HydrophobicContact CG2-CD1 4.38Å; I223-F249 HydrophobicContact CG2-CE1 4.44Å; I223-K253 WeakPolarHBondContact CA-O 3.29Å; I223-V254 HydrophobicContact CG1-CG2 4.42Å
224	V	95.4	Very high	95.9	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.6	169.1	-170.2	0	0	0	0	108.4	R226 S252 K253 V277 L282 A303 D306	V224-R226 HydrophobicContact CB-CG 4.22Å; V224-R226 HydrophobicContact CG1-CG 3.8Å; V224-S252 CarbonylContact O-C 3.57Å; V224-S252 VanDerWaalsContact O-CA 3.22Å; V224-S252 WeakPolarHBondContact O-CA 3.37Å; V224-S252 WeakPolarHBondContact O-CB 3.21Å; V224-K253 PolarHBondContact N-O 3.25Å; V224-K253 PolarHBondContact O-N 2.89Å; V224-V277 HydrophobicContact CG2-CB 4.05Å; V224-V277 HydrophobicContact CG2-CG1 4.3Å; V224-L282 HydrophobicContact CB-CD1 4.33Å; V224-L282 HydrophobicContact CG1-CD1 4.02Å; V224-A303 HydrophobicContact CG1-CB 4.19Å; V224-A303 HydrophobicContact CG2-CB 3.75Å; V224-D306 VanDerWaalsContact CG1-OD2 3.31Å; V224-D306 WeakPolarHBondContact CG1-OD2 3.34Å
225	H	95.7	Very high	95.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.105	C	C	.	.			trans	-78.1	-42.1	-170.5	-167	-82.8	0	0	0	112.9	D227 L228 V246 A247 D248 F249 S252 D306	H225-D227 PolarHBondContact CE1-O 3.02Å; H225-D227 PolarHBondContact ND1-O 3.49Å; H225-D227 PolarHBondContact O-N 3.29Å; H225-L228 HydrophobicContact CB-CD1 4.41Å; H225-L228 HydrophobicContact CB-CD2 3.98Å; H225-L228 HydrophobicContact CB-CG 3.85Å; H225-L228 PolarHBondContact ND1-N 3.27Å; H225-V246 WeakPolarHBondContact NE2-CG1 3.17Å; H225-A247 PolarHBondContact CE1-O 2.97Å; H225-A247 PolarHBondContact NE2-O 3.48Å; H225-A247 VanDerWaalsContact NE2-O 3.13Å; H225-D248 PolarHBondContact CE1-O 3.32Å; H225-F249 AromaticContact CD2-CE1 3.77Å; H225-S252 WeakPolarHBondContact O-CA 3.18Å; H225-S252 PolarHBondContact O-OG 2.84Å; H225-D306 PolarHBondContact N-OD2 3.34Å
226	R	94.6	Very high	95.8	Very high	36 Å²	36	21.8 Å²	21.8	14%	0.136	11%	0.108	C	C	.	.	S	Bend	trans	67.6	-14.6	172.9	-55.1	170.5	61.8	-142.6	8	117	V224 L251 L282 S284 C286 G287 Y301 D306	V224-R226 HydrophobicContact CB-CG 4.22Å; V224-R226 HydrophobicContact CG1-CG 3.8Å; R226-L251 VanDerWaalsContact CD-O 3.32Å; R226-L251 WeakPolarHBondContact CD-O 3.31Å; R226-L251 PolarHBondContact NH1-O 3.14Å; R226-L282 HydrophobicContact CG-CD1 4.09Å; R226-S284 PolarHBondContact NH2-O 3.48Å; R226-S284 PolarHBondContact NH2-OG 2.88Å; R226-C286 PolarHBondContact NH2-SG 3.13Å; R226-G287 WeakPolarHBondContact O-CA 3.5Å; R226-Y301 HydrophobicContact CG-CE2 4.27Å; R226-Y301 PolarHBondContact NE-OH 2.87Å; R226-Y301 PolarHBondContact NH2-OH 3.37Å; R226-Y301 VanDerWaalsContact NH2-OH 3.15Å; R226-D306 PolarHBondContact N-OD1 3.08Å
227	D	94.7	Very high	95.6	Very high	14 Å²	14	24.3 Å²	24.3	8%	0.075	12%	0.118	C	C	.	.			trans	-135.7	55.5	170.3	-169.5	42.7	0	0	0	111.2	H225 K229 N232 L251 G287 S288	H225-D227 PolarHBondContact CE1-O 3.02Å; H225-D227 PolarHBondContact ND1-O 3.49Å; H225-D227 PolarHBondContact O-N 3.29Å; D227-K229 PolarHBondContact O-N 3.33Å; D227-K229 IonicContact OD1-NZ 2.75Å; D227-K229 PolarHBondContact OD1-NZ 3.01Å; D227-K229 VanDerWaalsContact OD2-CE 3.29Å; D227-K229 WeakPolarHBondContact OD2-CE 3.35Å; D227-K229 IonicContact OD2-NZ 3.35Å; D227-K229 PolarHBondContact OD2-NZ 3.46Å; D227-N232 PolarHBondContact O-ND2 3.13Å; D227-N232 PolarHBondContact OD2-ND2 3.31Å; D227-L251 HydrophobicContact CB-CB 4.17Å; D227-L251 HydrophobicContact CB-CD1 3.66Å; D227-L251 HydrophobicContact CB-CG 4.5Å; D227-G287 WeakPolarHBondContact OD1-CA 3.32Å; D227-S288 PolarHBondContact OD1-N 3.21Å; D227-S288 PolarHBondContact OD1-OG 2.72Å
228	L	97.5	Very high	95.1	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.016	14%	0.139	C	C	.	.			trans	-72.9	119.3	170.8	-72.6	174.6	0	0	0	109.7	V215 H225 V246 D306 A309 L310 I313	V215-L228 HydrophobicContact CG2-CD1 3.78Å; H225-L228 HydrophobicContact CB-CD1 4.41Å; H225-L228 HydrophobicContact CB-CD2 3.98Å; H225-L228 HydrophobicContact CB-CG 3.85Å; H225-L228 PolarHBondContact ND1-N 3.27Å; L228-V246 HydrophobicContact CD2-CG1 3.93Å; L228-D306 HydrophobicContact CD1-CB 3.7Å; L228-A309 HydrophobicContact CB-CB 3.93Å; L228-L310 HydrophobicContact CD1-CD2 4.19Å; L228-L310 HydrophobicContact CD1-CG 4.09Å; L228-I313 HydrophobicContact CB-CD1 4.14Å
229	K	96.1	Very high	94.6	Very high	39 Å²	39	32.9 Å²	32.9	17%	0.17	17%	0.165	C	C	.	.			trans	-154.1	160.3	175.1	62	-175.5	170.8	-144.5	0	110.1	D227 D231 N232 I233 S288 Y291	D227-K229 PolarHBondContact O-N 3.33Å; D227-K229 IonicContact OD1-NZ 2.75Å; D227-K229 PolarHBondContact OD1-NZ 3.01Å; D227-K229 VanDerWaalsContact OD2-CE 3.29Å; D227-K229 WeakPolarHBondContact OD2-CE 3.35Å; D227-K229 IonicContact OD2-NZ 3.35Å; D227-K229 PolarHBondContact OD2-NZ 3.46Å; K229-D231 VanDerWaalsContact C-N 3.25Å; K229-D231 HydrophobicContact CD-CB 4.36Å; K229-D231 HydrophobicContact CG-CB 4.27Å; K229-D231 PolarHBondContact O-N 3.12Å; K229-N232 WeakPolarHBondContact CE-ND2 3.37Å; K229-N232 VanDerWaalsContact CE-OD1 3.24Å; K229-N232 WeakPolarHBondContact CE-OD1 3.2Å; K229-N232 HydrophobicContact CG-CB 3.96Å; K229-N232 PolarHBondContact O-N 3.49Å; K229-I233 WeakPolarHBondContact O-CD1 3.35Å; K229-I233 WeakPolarHBondContact O-CG1 3.34Å; K229-S288 WeakPolarHBondContact CD-OG 3.3Å; K229-S288 PolarHBondContact NZ-OG 2.72Å; K229-Y291 HydrophobicContact CB-CD1 4.44Å; K229-Y291 HydrophobicContact CB-CD2 3.7Å; K229-Y291 HydrophobicContact CB-CE1 4.39Å; K229-Y291 HydrophobicContact CB-CE2 3.63Å; K229-Y291 HydrophobicContact CB-CG 4.11Å
230	P	97	Very high	94.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-53.9	-35.5	179.5	-30.4	40.6	0	0	0	114.7	L190 N191 N232 I233 Y291 I313 L333	L190-P230 HydrophobicContact CB-CB 4.34Å; L190-P230 WeakPolarHBondContact CB-O 3.45Å; L190-P230 HydrophobicContact CD2-CB 4.49Å; L190-P230 PolarHBondContact N-O 3.48Å; N191-P230 HydrophobicContact CB-CB 3.79Å; P230-N232 VanDerWaalsContact C-N 3.29Å; P230-N232 PolarHBondContact O-N 3.44Å; P230-I233 PolarHBondContact O-N 3.38Å; P230-Y291 VanDerWaalsContact CD-CZ 3.44Å; P230-Y291 WeakPolarHBondContact CD-OH 3.37Å; P230-Y291 HydrophobicContact CG-CE1 3.99Å; P230-I313 HydrophobicContact CG-CG1 4.29Å; P230-I313 HydrophobicContact CG-CG2 4.5Å; P230-L333 HydrophobicContact CG-CB 3.99Å
231	D	93.8	Very high	94	Very high	33 Å²	33	32.8 Å²	32.8	18%	0.176	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-65.5	-27.9	175.8	-59.5	-102.5	0	0	0	113.8	K229 I233 R330	K229-D231 VanDerWaalsContact C-N 3.25Å; K229-D231 HydrophobicContact CD-CB 4.36Å; K229-D231 HydrophobicContact CG-CB 4.27Å; K229-D231 PolarHBondContact O-N 3.12Å; D231-I233 VanDerWaalsContact C-N 3.28Å; D231-R330 IonicContact OD1-CZ 3.52Å; D231-R330 IonicContact OD1-NH1 2.69Å; D231-R330 PolarHBondContact OD1-NH1 2.8Å; D231-R330 IonicContact OD1-NH2 3.98Å; D231-R330 PolarHBondContact OD1-NH2 2.76Å
232	N	96.3	Very high	94.2	Very high	13 Å²	13	32.2 Å²	32.2	7%	0.07	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-91.8	11.4	179.1	-71.4	3.5	0	0	0	112.1	D227 K229 P230 A247 D248	D227-N232 PolarHBondContact O-ND2 3.13Å; D227-N232 PolarHBondContact OD2-ND2 3.31Å; K229-N232 WeakPolarHBondContact CE-ND2 3.37Å; K229-N232 VanDerWaalsContact CE-OD1 3.24Å; K229-N232 WeakPolarHBondContact CE-OD1 3.2Å; K229-N232 HydrophobicContact CG-CB 3.96Å; K229-N232 PolarHBondContact O-N 3.49Å; P230-N232 VanDerWaalsContact C-N 3.29Å; P230-N232 PolarHBondContact O-N 3.44Å; N232-A247 PolarHBondContact O-N 3.34Å; N232-A247 VanDerWaalsContact O-O 3.12Å; N232-D248 HydrophobicContact CB-CB 4.46Å
233	I	98.3	Very high	94.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	108.3	-179.1	-65.4	161.7	0	0	0	107.3	D189 L190 L211 K229 P230 D231 L244 I313	D189-I233 CarbonylContact C-O 3.53Å; D189-I233 WeakPolarHBondContact CA-O 3.47Å; L190-I233 HydrophobicContact CB-CB 3.92Å; L190-I233 HydrophobicContact CB-CG2 3.84Å; L190-I233 HydrophobicContact CD2-CB 4.35Å; L190-I233 HydrophobicContact CD2-CD1 4.02Å; L190-I233 HydrophobicContact CD2-CG2 4.06Å; L190-I233 HydrophobicContact CG-CG2 4.45Å; L190-I233 PolarHBondContact N-O 3.36Å; L211-I233 HydrophobicContact CD2-CD1 3.63Å; L211-I233 HydrophobicContact CD2-CG1 4.11Å; L211-I233 HydrophobicContact CD2-CG2 4.21Å; K229-I233 WeakPolarHBondContact O-CD1 3.35Å; K229-I233 WeakPolarHBondContact O-CG1 3.34Å; P230-I233 PolarHBondContact O-N 3.38Å; D231-I233 VanDerWaalsContact C-N 3.28Å; I233-L244 HydrophobicContact CG2-CD1 3.49Å; I233-L244 VanDerWaalsContact CG2-CD1 3.49Å; I233-L244 HydrophobicContact CG2-CD2 3.74Å; I233-L244 HydrophobicContact CG2-CG 3.38Å; I233-I313 HydrophobicContact CD1-CD1 3.94Å; I233-I313 HydrophobicContact CD1-CG2 4.19Å
234	L	98.1	Very high	94.7	Very high	47 Å²	47	31.3 Å²	31.3	25%	0.246	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	153.4	-174.4	-55.6	-179.3	0	0	0	111.8	C185 G188 D189 L244 K245 A247	C185-L234 HydrophobicContact CB-CB 3.74Å; C185-L234 HydrophobicContact CB-CD1 4.28Å; G188-L234 CarbonylContact O-C 3.58Å; G188-L234 WeakPolarHBondContact O-CA 3.31Å; D189-L234 HydrophobicContact CB-CD2 4.36Å; L234-L244 CarbonylContact O-C 3.44Å; L234-L244 WeakPolarHBondContact O-CA 3.29Å; L234-K245 PolarHBondContact N-O 2.94Å; L234-K245 PolarHBondContact O-N 2.96Å; L234-A247 HydrophobicContact CD1-CB 3.7Å; L234-A247 HydrophobicContact CG-CB 3.84Å
235	I	98	Very high	94.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.8	178	-49.3	-59.1	0	0	0	110.9	C185 E186 G187 G188 L190 F193 F207 E237 P242 L244	C185-I235 CarbonylContact C-O 3.57Å; C185-I235 WeakPolarHBondContact CB-O 3.27Å; E186-I235 PolarHBondContact N-O 2.7Å; G187-I235 VanDerWaalsContact CA-O 3.29Å; G187-I235 WeakPolarHBondContact CA-O 3.32Å; G187-I235 PolarHBondContact N-O 2.96Å; G188-I235 PolarHBondContact O-N 3.33Å; L190-I235 HydrophobicContact CD1-CD1 4.27Å; F193-I235 HydrophobicContact CB-CG1 3.92Å; F193-I235 HydrophobicContact CD1-CG1 4.46Å; F193-I235 HydrophobicContact CD2-CB 3.93Å; F193-I235 HydrophobicContact CD2-CG1 3.81Å; F193-I235 HydrophobicContact CD2-CG2 3.75Å; F193-I235 HydrophobicContact CE2-CB 4.31Å; F193-I235 HydrophobicContact CE2-CG1 4.44Å; F193-I235 HydrophobicContact CE2-CG2 3.61Å; F193-I235 HydrophobicContact CG-CB 4.45Å; F193-I235 HydrophobicContact CG-CG1 3.82Å; F193-I235 HydrophobicContact CG-CG2 4.49Å; F193-I235 HydrophobicContact CZ-CG2 4.28Å; F207-I235 HydrophobicContact CE1-CD1 4.21Å; F207-I235 HydrophobicContact CE2-CD1 3.9Å; F207-I235 HydrophobicContact CZ-CD1 3.61Å; F207-I235 HydrophobicContact CZ-CG1 4.4Å; F207-I235 HydrophobicContact CZ-CG2 4.37Å; I235-E237 HydrophobicContact CG2-CG 4.24Å; I235-P242 HydrophobicContact CG2-CB 3.88Å; I235-L244 HydrophobicContact CD1-CB 3.99Å; I235-L244 HydrophobicContact CD1-CD1 4.27Å; I235-L244 HydrophobicContact CD1-CG 4.16Å
236	S	96.7	Very high	95	Very high	8 Å²	8	32.1 Å²	32.1	6%	0.056	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.6	167.8	172	0	0	0	0	109.3	V243	S236-V243 PolarHBondContact N-O 2.89Å; S236-V243 PolarHBondContact O-N 2.77Å
237	E	93.7	Very high	95.1	Very high	66 Å²	66	30.8 Å²	30.8	31%	0.308	18%	0.184	S	C	.	.			trans	-113.8	13.4	176.1	-63.7	-169.7	107.7	0	0	112.4	F193 R197 I235 S239 G240	F193-E237 HydrophobicContact CE2-CG 4.48Å; R197-E237 IonicContact CZ-OE1 3.59Å; R197-E237 VanDerWaalsContact CZ-OE1 3.26Å; R197-E237 IonicContact CZ-OE2 2.75Å; R197-E237 IonicContact NH1-OE1 2.69Å; R197-E237 PolarHBondContact NH1-OE1 3.4Å; R197-E237 IonicContact NH2-OE1 2.73Å; R197-E237 PolarHBondContact NH2-OE1 2.88Å; R197-E237 IonicContact NH2-OE2 3.23Å; R197-E237 PolarHBondContact NH2-OE2 3.25Å; I235-E237 HydrophobicContact CG2-CG 4.24Å; E237-S239 VanDerWaalsContact C-N 3.27Å; E237-S239 PolarHBondContact O-N 3.08Å; E237-G240 PolarHBondContact O-N 3.03Å
238	K	88.1	Confident	94.9	Very high	117 Å²	117	32.3 Å²	32.3	51%	0.509	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.9	-173.6	-65.7	175.2	-172.3	163.3	0	115	F184 E186	F184-K238 WeakPolarHBondContact O-CE 3.41Å; F184-K238 PolarHBondContact O-NZ 2.79Å; E186-K238 VanDerWaalsContact CD-CE 3.4Å; E186-K238 WeakPolarHBondContact OE1-CE 3.24Å; E186-K238 IonicContact OE1-NZ 3.7Å; E186-K238 WeakPolarHBondContact OE2-CE 3.46Å; E186-K238 WeakPolarHBondContact OE2-CG 3.41Å
239	S	85.7	Confident	94.6	Very high	79 Å²	79	32.1 Å²	32.1	55%	0.552	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-0.3	179	46.7	0	0	0	0	113.7	E237 T241	E237-S239 VanDerWaalsContact C-N 3.27Å; E237-S239 PolarHBondContact O-N 3.08Å; S239-T241 PolarHBondContact O-N 3.35Å; S239-T241 PolarHBondContact OG-O 2.82Å; S239-T241 VanDerWaalsContact OG-O 3.04Å; S239-T241 PolarHBondContact OG-OG1 2.94Å
240	G	86.4	Confident	93.9	Very high	70 Å²	70	30.5 Å²	30.5	72%	0.722	19%	0.185	S	C	*	.	S	Bend	trans	77.2	-16.5	-169.3	0	0	0	0	0	114	E237	E237-G240 PolarHBondContact O-N 3.03Å
241	T	91.8	Very high	93.3	Very high	87 Å²	87	31.8 Å²	31.8	53%	0.534	19%	0.192	S	C	.	.	S	Bend	trans	-99.3	137.8	165.3	48.4	0	0	0	0	110.1	S239 V243	S239-T241 PolarHBondContact O-N 3.35Å; S239-T241 PolarHBondContact OG-O 2.82Å; S239-T241 VanDerWaalsContact OG-O 3.04Å; S239-T241 PolarHBondContact OG-OG1 2.94Å; T241-V243 PolarHBondContact O-N 3.47Å
242	P	96.3	Very high	92.9	Very high	27 Å²	27	30.4 Å²	30.4	18%	0.175	19%	0.185	C	C	.	.			trans	-66.6	121	174.4	-22.3	34.5	0	0	0	112.1	F193 F207 I235	F193-P242 HydrophobicContact CE2-CB 4.15Å; F193-P242 HydrophobicContact CE2-CG 4.27Å; F193-P242 HydrophobicContact CZ-CB 3.71Å; F193-P242 HydrophobicContact CZ-CG 3.67Å; F207-P242 HydrophobicContact CE1-CB 3.88Å; F207-P242 HydrophobicContact CZ-CB 3.79Å; I235-P242 HydrophobicContact CG2-CB 3.88Å
243	V	97.8	Very high	92.4	Very high	18 Å²	18	33.7 Å²	33.7	11%	0.109	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119	174.5	-180	0	0	0	0	109.4	E126 S236 T241	E126-V243 HydrophobicContact CG-CG1 3.77Å; S236-V243 PolarHBondContact N-O 2.89Å; S236-V243 PolarHBondContact O-N 2.77Å; T241-V243 PolarHBondContact O-N 3.47Å
244	L	97.6	Very high	91.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	139.7	-179.4	178.8	151.8	0	0	0	110.9	N127 L190 F207 Q210 L211 I233 L234 I235	N127-L244 WeakPolarHBondContact CA-O 3.44Å; N127-L244 WeakPolarHBondContact CB-O 3.25Å; N127-L244 PolarHBondContact ND2-O 2.85Å; L190-L244 HydrophobicContact CD1-CD1 4.35Å; F207-L244 HydrophobicContact CB-CD1 3.96Å; F207-L244 HydrophobicContact CD1-CB 3.99Å; F207-L244 HydrophobicContact CD1-CD1 4.1Å; F207-L244 HydrophobicContact CD2-CD1 4.23Å; F207-L244 HydrophobicContact CE1-CB 4.12Å; F207-L244 HydrophobicContact CG-CD1 3.86Å; Q210-L244 HydrophobicContact CB-CB 4.15Å; Q210-L244 HydrophobicContact CB-CD2 4.33Å; L211-L244 HydrophobicContact CD1-CD1 4.12Å; L211-L244 HydrophobicContact CD2-CD1 4.05Å; L211-L244 HydrophobicContact CD2-CD2 3.66Å; L211-L244 HydrophobicContact CD2-CG 4.47Å; L211-L244 HydrophobicContact CG-CD1 3.73Å; L211-L244 HydrophobicContact CG-CD2 3.82Å; L211-L244 HydrophobicContact CG-CG 4.47Å; I233-L244 HydrophobicContact CG2-CD1 3.49Å; I233-L244 VanDerWaalsContact CG2-CD1 3.49Å; I233-L244 HydrophobicContact CG2-CD2 3.74Å; I233-L244 HydrophobicContact CG2-CG 3.38Å; L234-L244 CarbonylContact O-C 3.44Å; L234-L244 WeakPolarHBondContact O-CA 3.29Å; I235-L244 HydrophobicContact CD1-CB 3.99Å; I235-L244 HydrophobicContact CD1-CD1 4.27Å; I235-L244 HydrophobicContact CD1-CG 4.16Å
245	K	98.1	Very high	90.7	Very high	17 Å²	17	33.1 Å²	33.1	7%	0.074	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	119.2	-178.6	-74.3	171.2	175.3	-70.7	0	111.6	E126 N127 E183 L234	E126-K245 PolarHBondContact O-NZ 3.41Å; N127-K245 WeakPolarHBondContact O-CA 3.38Å; E183-K245 VanDerWaalsContact CD-CE 3.41Å; E183-K245 VanDerWaalsContact CD-NZ 3.26Å; E183-K245 HydrophobicContact CG-CD 4.48Å; E183-K245 WeakPolarHBondContact OE1-CD 3.3Å; E183-K245 WeakPolarHBondContact OE1-CE 3.49Å; E183-K245 IonicContact OE1-NZ 3.42Å; E183-K245 PolarHBondContact OE1-NZ 2.87Å; E183-K245 WeakPolarHBondContact OE2-CE 3.32Å; E183-K245 IonicContact OE2-NZ 2.9Å; E183-K245 PolarHBondContact OE2-NZ 2.92Å; E183-K245 VanDerWaalsContact OE2-NZ 3.12Å; L234-K245 PolarHBondContact N-O 2.94Å; L234-K245 PolarHBondContact O-N 2.96Å
246	V	98.3	Very high	89	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	133.1	171.4	178.2	0	0	0	0	109.9	N127 V129 A214 L218 H225 L228 F249	N127-V246 PolarHBondContact O-N 3.37Å; V129-V246 PolarHBondContact N-O 3.5Å; A214-V246 HydrophobicContact CB-CB 4.44Å; A214-V246 HydrophobicContact CB-CG2 3.6Å; L218-V246 HydrophobicContact CD1-CG1 4.2Å; H225-V246 WeakPolarHBondContact NE2-CG1 3.17Å; L228-V246 HydrophobicContact CD2-CG1 3.93Å; V246-F249 HydrophobicContact CG1-CZ 4.23Å
247	A	96	Very high	86.8	Confident	8 Å²	8	38.6 Å²	38.6	7%	0.066	25%	0.249	C	C	.	.			trans	-143.6	175.6	-173.4	0	0	0	0	0	112.3	V129 H225 N232 L234	V129-A247 HydrophobicContact CB-CB 4.1Å; V129-A247 HydrophobicContact CG1-CB 3.88Å; H225-A247 PolarHBondContact CE1-O 2.97Å; H225-A247 PolarHBondContact NE2-O 3.48Å; H225-A247 VanDerWaalsContact NE2-O 3.13Å; N232-A247 PolarHBondContact O-N 3.34Å; N232-A247 VanDerWaalsContact O-O 3.12Å; L234-A247 HydrophobicContact CD1-CB 3.7Å; L234-A247 HydrophobicContact CG-CB 3.84Å
248	D	92.4	Very high	84.5	Confident	46 Å²	46	39.9 Å²	39.9	25%	0.246	26%	0.257	C	S	.	.			trans	58.4	79.8	-174.2	-154.3	-22.2	0	0	0	115.1	K98 H225 N232 G250	K98-D248 IonicContact NZ-OD1 3.26Å; K98-D248 PolarHBondContact NZ-OD1 3.43Å; K98-D248 IonicContact NZ-OD2 3.97Å; K98-D248 PolarHBondContact NZ-OD2 3.4Å; H225-D248 PolarHBondContact CE1-O 3.32Å; N232-D248 HydrophobicContact CB-CB 4.46Å; D248-G250 PolarHBondContact O-N 3.15Å; D248-G250 PolarHBondContact OD1-N 2.94Å; D248-G250 VanDerWaalsContact OD1-N 3.16Å
249	F	90.4	Very high	82.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-86.2	14	179.3	-68.6	-97.6	0	0	0	113.2	E114 A117 L118 V128 V129 L218 I223 H225 V246 L251 S252	E114-F249 WeakPolarHBondContact CA-O 3.27Å; E114-F249 HydrophobicContact CB-CB 4.46Å; E114-F249 HydrophobicContact CG-CB 4.26Å; E114-F249 PolarHBondContact N-O 3.45Å; A117-F249 HydrophobicContact CB-CB 3.77Å; A117-F249 HydrophobicContact CB-CD1 3.72Å; A117-F249 HydrophobicContact CB-CG 4.05Å; L118-F249 HydrophobicContact CD1-CD2 4.37Å; L118-F249 HydrophobicContact CD2-CD2 3.54Å; L118-F249 HydrophobicContact CD2-CE2 3.7Å; L118-F249 HydrophobicContact CD2-CG 4.18Å; L118-F249 HydrophobicContact CD2-CZ 4.43Å; L118-F249 HydrophobicContact CG-CB 4.38Å; L118-F249 HydrophobicContact CG-CD2 3.88Å; L118-F249 HydrophobicContact CG-CG 4.17Å; V128-F249 HydrophobicContact CG1-CE2 4.17Å; V128-F249 HydrophobicContact CG1-CZ 3.77Å; V129-F249 HydrophobicContact CG1-CE2 4.11Å; L218-F249 HydrophobicContact CD1-CE1 3.81Å; L218-F249 HydrophobicContact CD1-CZ 4.07Å; L218-F249 HydrophobicContact CD2-CE1 3.64Å; L218-F249 HydrophobicContact CD2-CZ 4Å; L218-F249 HydrophobicContact CG-CE1 4.4Å; I223-F249 HydrophobicContact CG2-CD1 4.38Å; I223-F249 HydrophobicContact CG2-CE1 4.44Å; H225-F249 AromaticContact CD2-CE1 3.77Å; V246-F249 HydrophobicContact CG1-CZ 4.23Å; F249-L251 PolarHBondContact O-N 2.91Å; F249-S252 WeakPolarHBondContact CA-OG 3.4Å; F249-S252 VanDerWaalsContact CD1-OG 3.27Å; F249-S252 WeakPolarHBondContact CD1-OG 3.31Å; F249-S252 VanDerWaalsContact O-CB 3.32Å; F249-S252 WeakPolarHBondContact O-CB 3.47Å; F249-S252 PolarHBondContact O-N 2.98Å; F249-S252 PolarHBondContact O-OG 3.45Å
250	G	80.9	Confident	79.7	Confident	4 Å²	4	36.1 Å²	36.1	4%	0.041	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-58.9	-30.1	-176	0	0	0	0	0	114.5	L110 A113 D248	L110-G250 WeakPolarHBondContact CA-O 3.46Å; L110-G250 WeakPolarHBondContact CD2-O 3.33Å; A113-G250 WeakPolarHBondContact CB-O 3.33Å; D248-G250 PolarHBondContact O-N 3.15Å; D248-G250 PolarHBondContact OD1-N 2.94Å; D248-G250 VanDerWaalsContact OD1-N 3.16Å
251	L	83.8	Confident	77.3	Confident	27 Å²	27	38.2 Å²	38.2	14%	0.141	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-100.7	-1.3	176.4	-69.7	171.3	0	0	0	113.5	L110 R226 D227 F249 C286	L110-L251 HydrophobicContact CD2-CD2 3.54Å; L110-L251 HydrophobicContact CD2-CG 4.31Å; R226-L251 VanDerWaalsContact CD-O 3.32Å; R226-L251 WeakPolarHBondContact CD-O 3.31Å; R226-L251 PolarHBondContact NH1-O 3.14Å; D227-L251 HydrophobicContact CB-CB 4.17Å; D227-L251 HydrophobicContact CB-CD1 3.66Å; D227-L251 HydrophobicContact CB-CG 4.5Å; F249-L251 PolarHBondContact O-N 2.91Å; L251-C286 HydrophobicContact CD1-CB 4.4Å; L251-C286 HydrophobicContact CD2-CB 4.04Å
252	S	85.6	Confident	74.8	Confident	4 Å²	4	37 Å²	37	3%	0.028	28%	0.28	C	S	.	.			trans	-65.9	153.8	-175.5	-65.5	0	0	0	0	113.2	V224 H225 F249	V224-S252 CarbonylContact O-C 3.57Å; V224-S252 VanDerWaalsContact O-CA 3.22Å; V224-S252 WeakPolarHBondContact O-CA 3.37Å; V224-S252 WeakPolarHBondContact O-CB 3.21Å; H225-S252 WeakPolarHBondContact O-CA 3.18Å; H225-S252 PolarHBondContact O-OG 2.84Å; F249-S252 WeakPolarHBondContact CA-OG 3.4Å; F249-S252 VanDerWaalsContact CD1-OG 3.27Å; F249-S252 WeakPolarHBondContact CD1-OG 3.31Å; F249-S252 VanDerWaalsContact O-CB 3.32Å; F249-S252 WeakPolarHBondContact O-CB 3.47Å; F249-S252 PolarHBondContact O-N 2.98Å; F249-S252 PolarHBondContact O-OG 3.45Å
253	K	85.8	Confident	72	Confident	83 Å²	83	44.9 Å²	44.9	36%	0.361	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.2	173.5	-170.1	70.9	174.9	-175.8	0	110.5	I223 V224 L282	I223-K253 WeakPolarHBondContact CA-O 3.29Å; V224-K253 PolarHBondContact N-O 3.25Å; V224-K253 PolarHBondContact O-N 2.89Å; K253-L282 HydrophobicContact CB-CD2 3.83Å; K253-L282 HydrophobicContact CG-CD2 3.66Å
254	V	81.2	Confident	69.3	Low	35 Å²	35	50.5 Å²	50.5	21%	0.212	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	118.8	163	-173.4	0	0	0	0	108	W116 A117 I223 A256	W116-V254 HydrophobicContact CB-CG2 4.04Å; A117-V254 HydrophobicContact CB-CG2 4.25Å; I223-V254 HydrophobicContact CG1-CG2 4.42Å; V254-A256 HydrophobicContact CG1-CB 4.16Å
255	C	79.4	Confident	66.4	Low	0 Å²	0	58.7 Å²	58.7	0%	0	39%	0.385	C	S	.	.			trans	-96.4	-8.1	-176.3	-61.7	0	0	0	0	113.2	N222 G257 V275 V277 F280	N222-C255 HydrophobicContact CB-CB 4.41Å; N222-C255 PolarHBondContact O-N 2.91Å; C255-G257 PolarHBondContact O-N 3.35Å; C255-V275 HydrophobicContact CB-CG1 3.9Å; C255-V275 WeakPolarHBondContact O-CG2 3.37Å; C255-V277 HydrophobicContact CB-CG1 3.93Å; C255-F280 HydrophobicContact CB-CD1 4.25Å; C255-F280 HydrophobicContact CB-CE1 4.47Å; C255-F280 HydrophobicContact CB-CG 4.33Å; C255-F280 VanDerWaalsContact SG-CD1 3.56Å
256	A	62.2	Low	63.6	Low	56 Å²	56	67.9 Å²	67.9	46%	0.463	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	133.4	180	0	0	0	0	0	112.6	N222 V254 L258	N222-A256 HydrophobicContact CB-CB 4.41Å; V254-A256 HydrophobicContact CG1-CB 4.16Å; A256-L258 PolarHBondContact O-N 3.4Å
257	G	51.3	Low	60.6	Low	66 Å²	66	71.1 Å²	71.1	68%	0.68	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	-4	173.2	0	0	0	0	0	116.5	C255 G259	C255-G257 PolarHBondContact O-N 3.35Å; G257-G259 PolarHBondContact O-N 3.36Å
258	L	46.4	Very low	57.8	Low	93 Å²	93	80.1 Å²	80.1	49%	0.487	50%	0.502	S	S	.	.			trans	-85.7	33.8	177.4	-69.4	170.7	0	0	0	113.6	A256 G260 F280	A256-L258 PolarHBondContact O-N 3.4Å; L258-G260 PolarHBondContact O-N 3.33Å; L258-G260 VanDerWaalsContact O-N 3.13Å; L258-F280 HydrophobicContact CB-CE2 4Å; L258-F280 HydrophobicContact CB-CZ 4.23Å; L258-F280 HydrophobicContact CD1-CE2 4.47Å; L258-F280 HydrophobicContact CD1-CZ 3.88Å
259	G	37.8	Very low	55.1	Low	48 Å²	48	84.4 Å²	84.4	50%	0.495	53%	0.525	S	S	.	.			trans	-72.2	102.2	176	0	0	0	0	0	111.5	G257	G257-G259 PolarHBondContact O-N 3.36Å
260	G	35.2	Very low	52.7	Low	70 Å²	70	94.7 Å²	94.7	72%	0.722	57%	0.57	S	S	*	*			trans	92.2	71.6	164.5	0	0	0	0	0	116.6	L258	L258-G260 PolarHBondContact O-N 3.33Å; L258-G260 VanDerWaalsContact O-N 3.13Å
261	A	36.1	Very low	50.7	Low	113 Å²	113	100.3 Å²	100.3	93%	0.934	60%	0.599	S	S	*	*			trans	-100	12.3	148.5	0	0	0	0	0	112
262	G	37.4	Very low	48.8	Very low	63 Å²	63	107.7 Å²	107.7	65%	0.649	63%	0.63	S	S	*	*	S	Bend	trans	-85.9	136.9	164.6	0	0	0	0	0	109.5
263	K	39.4	Very low	46.7	Very low	191 Å²	191	113 Å²	113	83%	0.83	66%	0.658	S	S	*	*			trans	-57.4	141.8	-178.9	-75	-179.9	175.8	-179.4	0	112.9
264	D	40.3	Very low	45.2	Very low	136 Å²	136	115 Å²	115	73%	0.727	68%	0.677	S	S	*	*			trans	46.7	97.5	143.2	-43.2	-28.1	0	0	0	117.4
265	N	35.9	Very low	44.2	Very low	172 Å²	172	114.3 Å²	114.3	92%	0.92	67%	0.673	S	S	*	*			trans	-157.7	120.9	132.8	-90.9	-47	0	0	0	109.1
266	E	40.5	Very low	43.9	Very low	210 Å²	210	117.7 Å²	117.7	98%	0.981	69%	0.691	S	S	*	*			trans	-77.6	121.8	175.9	-64	-179.4	133	0	0	109.7
267	G	34.9	Very low	44.6	Very low	69 Å²	69	115.4 Å²	115.4	71%	0.711	67%	0.671	S	S	*	*			trans	172.4	102.9	179.9	0	0	0	0	0	112.9
268	E	37.5	Very low	45.5	Very low	196 Å²	196	113 Å²	113	92%	0.916	64%	0.643	S	S	*	*			trans	16.1	107.8	150.4	-57.7	177.9	151.4	0	0	118.1
269	D	35.4	Very low	46.5	Very low	136 Å²	136	116 Å²	116	73%	0.727	65%	0.652	S	S	*	*				-170.6	145.1	96.5	-141.1	-20.4	0	0	0	112	N271	D269-N271 VanDerWaalsContact C-N 3.27Å; D269-N271 PolarHBondContact O-N 2.72Å
270	K	39.6	Very low	48	Very low	217 Å²	217	115.8 Å²	115.8	94%	0.943	64%	0.637	S	S	*	*			trans	-93.5	28.9	176.3	-76.6	-175	-178.7	172.3	0	112.9
271	N	38.4	Very low	49.7	Very low	122 Å²	122	120.3 Å²	120.3	65%	0.652	63%	0.633	S	S	*	*	S	Bend	trans	-81.1	155.7	173.3	-145.4	-14.8	0	0	0	110.2	D269 N273	D269-N271 VanDerWaalsContact C-N 3.27Å; D269-N271 PolarHBondContact O-N 2.72Å; N271-N273 PolarHBondContact O-N 2.95Å; N271-N273 VanDerWaalsContact O-N 3.14Å
272	K	44.3	Very low	51.5	Low	182 Å²	182	115.2 Å²	115.2	79%	0.791	59%	0.59	S	S	*	*			trans	-51.9	122.9	-173.1	-67.7	174.2	179.8	175.3	0	110.9	V274	K272-V274 HydrophobicContact CB-CG2 4.46Å; K272-V274 PolarHBondContact O-N 3.49Å
273	N	42.6	Very low	52.8	Low	115 Å²	115	117.3 Å²	117.3	62%	0.615	59%	0.594	S	S	*	*			trans	-64.8	82.8	171	-87	-11	0	0	0	110.2	N271 V275	N271-N273 PolarHBondContact O-N 2.95Å; N271-N273 VanDerWaalsContact O-N 3.14Å; N273-V275 PolarHBondContact O-N 2.89Å
274	V	53.1	Low	54.4	Low	125 Å²	125	111.1 Å²	111.1	76%	0.758	58%	0.575	S	S	*	*			trans	-73.5	104.1	172.1	179.2	0	0	0	0	107.5	K272 N276	K272-V274 HydrophobicContact CB-CG2 4.46Å; K272-V274 PolarHBondContact O-N 3.49Å; V274-N276 PolarHBondContact O-N 3.3Å
275	V	61.5	Low	55.8	Low	20 Å²	20	107.3 Å²	107.3	12%	0.121	56%	0.563	C	S	.	*			trans	-81	106.8	-179.5	178.3	0	0	0	0	108.5	N222 C255 N273 V277 F280	N222-V275 PolarHBondContact OD1-O 2.85Å; C255-V275 HydrophobicContact CB-CG1 3.9Å; C255-V275 WeakPolarHBondContact O-CG2 3.37Å; N273-V275 PolarHBondContact O-N 2.89Å; V275-V277 PolarHBondContact O-N 3.01Å; V275-F280 HydrophobicContact CG1-CB 4.2Å; V275-F280 HydrophobicContact CG1-CD2 3.77Å; V275-F280 HydrophobicContact CG1-CG 4.2Å
276	N	72.9	Confident	57.8	Low	72 Å²	72	100.2 Å²	100.2	39%	0.385	53%	0.526	S	S	.	.			trans	-71.1	103.1	175.4	-174.6	-40.8	0	0	0	109.8	V274 N278 K279 F280	V274-N276 PolarHBondContact O-N 3.3Å; N276-N278 PolarHBondContact O-N 3.4Å; N276-N278 WeakPolarHBondContact OD1-CA 3.34Å; N276-N278 VanDerWaalsContact OD1-CB 3.32Å; N276-N278 WeakPolarHBondContact OD1-CB 3.22Å; N276-N278 PolarHBondContact OD1-N 3.41Å; N276-K279 HydrophobicContact CB-CB 4.37Å; N276-K279 HydrophobicContact CB-CG 4.47Å; N276-K279 CarbonylContact O-C 3.52Å; N276-K279 WeakPolarHBondContact O-CA 3.35Å; N276-K279 PolarHBondContact O-N 3.22Å; N276-K279 PolarHBondContact OD1-N 3.05Å; N276-F280 PolarHBondContact O-N 3.34Å
277	V	76.4	Confident	59.9	Low	7 Å²	7	91.3 Å²	91.3	4%	0.042	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.1	-178.4	-63.8	0	0	0	0	114.2	H219 N222 V224 C255 V275 K279 A303	H219-V277 HydrophobicContact CB-CG2 4.06Å; N222-V277 HydrophobicContact CB-CG1 4.08Å; V224-V277 HydrophobicContact CG2-CB 4.05Å; V224-V277 HydrophobicContact CG2-CG1 4.3Å; C255-V277 HydrophobicContact CB-CG1 3.93Å; V275-V277 PolarHBondContact O-N 3.01Å; V277-K279 PolarHBondContact O-N 2.89Å; V277-A303 HydrophobicContact CB-CB 3.86Å; V277-A303 HydrophobicContact CG2-CB 3.7Å; V277-A303 WeakPolarHBondContact O-CB 3.44Å; V277-A303 PolarHBondContact O-N 2.82Å; V277-A303 VanDerWaalsContact O-N 3.11Å
278	N	70.8	Confident	62.5	Low	17 Å²	17	89.4 Å²	89.4	9%	0.091	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.8	172.4	-60.3	-49.8	0	0	0	112.6	N276 T302 K304 D389	N276-N278 PolarHBondContact O-N 3.4Å; N276-N278 WeakPolarHBondContact OD1-CA 3.34Å; N276-N278 VanDerWaalsContact OD1-CB 3.32Å; N276-N278 WeakPolarHBondContact OD1-CB 3.22Å; N276-N278 PolarHBondContact OD1-N 3.41Å; N278-T302 WeakPolarHBondContact O-CB 3.44Å; N278-T302 WeakPolarHBondContact O-CG2 3.41Å; N278-T302 PolarHBondContact O-OG1 3.08Å; N278-K304 WeakPolarHBondContact OD1-CE 3.41Å; N278-D389 PolarHBondContact ND2-OD1 3.08Å; N278-D389 PolarHBondContact ND2-OD2 2.92Å
279	K	67	Low	65.1	Low	154 Å²	154	84.2 Å²	84.2	67%	0.67	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-1.7	175.8	-59.7	-175.4	-179.9	-176.4	0	113.6	N276 V277	N276-K279 HydrophobicContact CB-CB 4.37Å; N276-K279 HydrophobicContact CB-CG 4.47Å; N276-K279 CarbonylContact O-C 3.52Å; N276-K279 WeakPolarHBondContact O-CA 3.35Å; N276-K279 PolarHBondContact O-N 3.22Å; N276-K279 PolarHBondContact OD1-N 3.05Å; V277-K279 PolarHBondContact O-N 2.89Å
280	F	68.4	Low	67.9	Low	44 Å²	44	79.6 Å²	79.6	19%	0.193	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-88.4	123	179.6	-174.7	-91.4	0	0	0	110.5	C255 L258 V275 N276 L282	C255-F280 HydrophobicContact CB-CD1 4.25Å; C255-F280 HydrophobicContact CB-CE1 4.47Å; C255-F280 HydrophobicContact CB-CG 4.33Å; C255-F280 VanDerWaalsContact SG-CD1 3.56Å; L258-F280 HydrophobicContact CB-CE2 4Å; L258-F280 HydrophobicContact CB-CZ 4.23Å; L258-F280 HydrophobicContact CD1-CE2 4.47Å; L258-F280 HydrophobicContact CD1-CZ 3.88Å; V275-F280 HydrophobicContact CG1-CB 4.2Å; V275-F280 HydrophobicContact CG1-CD2 3.77Å; V275-F280 HydrophobicContact CG1-CG 4.2Å; N276-F280 PolarHBondContact O-N 3.34Å; F280-L282 HydrophobicContact CD1-CD2 4.06Å; F280-L282 HydrophobicContact CE1-CD2 4.02Å
281	W	70.8	Confident	70.6	Confident	165 Å²	165	69.8 Å²	69.8	63%	0.625	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-80.8	126.3	-179.7	-64.8	109.7	0	0	0	112.2	H300 T302	W281-H300 HydrophobicContact CE3-CB 4.19Å; W281-H300 HydrophobicContact CZ3-CB 4.42Å; W281-T302 HydrophobicContact CE3-CG2 4.16Å; W281-T302 HydrophobicContact CZ3-CG2 4.26Å
282	L	74.3	Confident	73.3	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.037	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-97.6	125.7	171.1	-60.4	170.2	0	0	0	108.4	V224 R226 K253 F280 H300 Y301	V224-L282 HydrophobicContact CB-CD1 4.33Å; V224-L282 HydrophobicContact CG1-CD1 4.02Å; R226-L282 HydrophobicContact CG-CD1 4.09Å; K253-L282 HydrophobicContact CB-CD2 3.83Å; K253-L282 HydrophobicContact CG-CD2 3.66Å; F280-L282 HydrophobicContact CD1-CD2 4.06Å; F280-L282 HydrophobicContact CE1-CD2 4.02Å; L282-H300 WeakPolarHBondContact O-CA 3.45Å; L282-Y301 HydrophobicContact CB-CD1 4.26Å; L282-Y301 HydrophobicContact CB-CD2 4.17Å; L282-Y301 HydrophobicContact CB-CE1 4.03Å; L282-Y301 HydrophobicContact CB-CE2 3.96Å; L282-Y301 HydrophobicContact CB-CG 4.32Å; L282-Y301 WeakPolarHBondContact CB-O 3.44Å; L282-Y301 HydrophobicContact CD1-CD2 3.7Å; L282-Y301 HydrophobicContact CD1-CE2 3.37Å; L282-Y301 HydrophobicContact CG-CE2 4.3Å; L282-Y301 PolarHBondContact N-O 2.88Å; L282-Y301 PolarHBondContact O-N 3.34Å
283	S	65.3	Low	75.8	Confident	106 Å²	106	56.1 Å²	56.1	74%	0.741	31%	0.311	S	S	*	.			trans	-104.8	23.8	-170.2	63.2	0	0	0	0	114.4	G299	S283-G299 CarbonylContact C-O 3.56Å; S283-G299 VanDerWaalsContact CA-O 3.3Å; S283-G299 WeakPolarHBondContact CA-O 3.36Å
284	S	71.8	Confident	78.3	Confident	62 Å²	62	50.9 Å²	50.9	43%	0.434	28%	0.283	S	S	.	.	S	Bend	trans	-144.5	109.8	-176	157.3	0	0	0	0	109.3	R226 C286 Y301	R226-S284 PolarHBondContact NH2-O 3.48Å; R226-S284 PolarHBondContact NH2-OG 2.88Å; S284-C286 PolarHBondContact O-N 3.17Å; S284-Y301 VanDerWaalsContact O-CE1 3.22Å; S284-Y301 WeakPolarHBondContact O-CE1 3.43Å; S284-Y301 PolarHBondContact O-OH 3.01Å
285	A	70.6	Confident	80.2	Confident	56 Å²	56	45.4 Å²	45.4	46%	0.463	25%	0.25	S	C	.	.			trans	-62.1	123	170.4	0	0	0	0	0	109.5	V296	A285-V296 VanDerWaalsContact CB-O 3.22Å; A285-V296 WeakPolarHBondContact CB-O 3.44Å
286	C	78.4	Confident	81.6	Confident	23 Å²	23	44.6 Å²	44.6	16%	0.155	25%	0.245	C	C	.	.			trans	-160.1	166.1	172.4	72.8	0	0	0	0	109.1	R226 L251 S284	R226-C286 PolarHBondContact NH2-SG 3.13Å; L251-C286 HydrophobicContact CD1-CB 4.4Å; L251-C286 HydrophobicContact CD2-CB 4.04Å; S284-C286 PolarHBondContact O-N 3.17Å
287	G	83.3	Confident	82.2	Confident	23 Å²	23	46.1 Å²	46.1	24%	0.237	25%	0.245	C	C	.	.	S	Bend	trans	130.9	-170.8	-172.9	0	0	0	0	0	109.6	R226 D227	R226-G287 WeakPolarHBondContact O-CA 3.5Å; D227-G287 WeakPolarHBondContact OD1-CA 3.32Å
288	S	89.9	Confident	82.6	Confident	29 Å²	29	52 Å²	52	20%	0.203	27%	0.272	C	S	.	.			trans	-116.8	120.8	177.6	-55.2	0	0	0	0	108.9	D227 K229 F290 Y291 M292	D227-S288 PolarHBondContact OD1-N 3.21Å; D227-S288 PolarHBondContact OD1-OG 2.72Å; K229-S288 WeakPolarHBondContact CD-OG 3.3Å; K229-S288 PolarHBondContact NZ-OG 2.72Å; S288-F290 VanDerWaalsContact C-N 3.3Å; S288-F290 PolarHBondContact O-N 3.28Å; S288-Y291 WeakPolarHBondContact O-CD2 3.41Å; S288-Y291 PolarHBondContact O-N 3.2Å; S288-M292 PolarHBondContact O-N 3.11Å
289	D	91.9	Very high	82.8	Confident	86 Å²	86	51.9 Å²	51.9	46%	0.46	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-43.3	-46.7	-160.7	-55.1	-5	0	0	0	115.2	Y291 M292 W297 P345	D289-Y291 PolarHBondContact O-N 2.89Å; D289-Y291 VanDerWaalsContact O-N 3.09Å; D289-M292 PolarHBondContact O-N 2.87Å; D289-W297 HydrophobicContact CB-CH2 4.44Å; D289-W297 HydrophobicContact CB-CZ2 4.17Å; D289-P345 HydrophobicContact CB-CG 4.18Å
290	F	94.8	Very high	83.3	Confident	39 Å²	39	50.1 Å²	50.1	17%	0.171	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-63.4	-14	-178.3	-77.8	-87.1	0	0	0	115.2	S288 I312 F323 I343 P345	S288-F290 VanDerWaalsContact C-N 3.3Å; S288-F290 PolarHBondContact O-N 3.28Å; F290-I312 WeakPolarHBondContact O-CG2 3.42Å; F290-F323 HydrophobicContact CB-CE1 4Å; F290-F323 HydrophobicContact CB-CZ 3.87Å; F290-F323 HydrophobicContact CD1-CD1 4.19Å; F290-F323 HydrophobicContact CD1-CD2 4.48Å; F290-F323 AromaticContact CD1-CE1 4Å; F290-F323 HydrophobicContact CD1-CE1 4Å; F290-F323 HydrophobicContact CD1-CE2 4.3Å; F290-F323 HydrophobicContact CD1-CG 4.43Å; F290-F323 HydrophobicContact CD1-CZ 4.05Å; F290-F323 HydrophobicContact CD2-CD2 4.31Å; F290-F323 HydrophobicContact CD2-CE1 4.25Å; F290-F323 AromaticContact CD2-CE2 3.52Å; F290-F323 HydrophobicContact CD2-CE2 3.52Å; F290-F323 AromaticContact CD2-CZ 3.48Å; F290-F323 HydrophobicContact CD2-CZ 3.48Å; F290-F323 VanDerWaalsContact CD2-CZ 3.48Å; F290-F323 HydrophobicContact CE1-CD1 4.47Å; F290-F323 HydrophobicContact CE1-CD2 4.2Å; F290-F323 HydrophobicContact CE1-CE2 4.33Å; F290-F323 HydrophobicContact CE1-CG 4.28Å; F290-F323 HydrophobicContact CE2-CD2 4.01Å; F290-F323 AromaticContact CE2-CE2 3.56Å; F290-F323 HydrophobicContact CE2-CE2 3.56Å; F290-F323 HydrophobicContact CE2-CZ 4.02Å; F290-F323 HydrophobicContact CG-CD1 4.43Å; F290-F323 AromaticContact CG-CE1 3.8Å; F290-F323 HydrophobicContact CG-CE1 3.8Å; F290-F323 AromaticContact CG-CE2 3.91Å; F290-F323 HydrophobicContact CG-CE2 3.91Å; F290-F323 AromaticContact CG-CZ 3.5Å; F290-F323 HydrophobicContact CG-CZ 3.5Å; F290-F323 VanDerWaalsContact CG-CZ 3.5Å; F290-F323 AromaticContact CZ-CD2 3.96Å; F290-F323 HydrophobicContact CZ-CD2 3.96Å; F290-F323 AromaticContact CZ-CE2 3.98Å; F290-F323 HydrophobicContact CZ-CE2 3.98Å; F290-F323 HydrophobicContact CZ-CG 4.48Å; F290-I343 HydrophobicContact CE1-CD1 3.88Å; F290-I343 HydrophobicContact CE1-CG1 4.2Å; F290-I343 HydrophobicContact CZ-CD1 3.85Å; F290-I343 HydrophobicContact CZ-CG1 4.09Å; F290-P345 HydrophobicContact CD1-CB 4.48Å; F290-P345 HydrophobicContact CD1-CG 4.09Å; F290-P345 HydrophobicContact CD2-CG 4.36Å; F290-P345 HydrophobicContact CE1-CG 4.12Å; F290-P345 HydrophobicContact CE2-CG 4.39Å; F290-P345 HydrophobicContact CG-CG 4.21Å; F290-P345 HydrophobicContact CZ-CG 4.27Å
291	Y	96.4	Very high	84	Confident	11 Å²	11	48.1 Å²	48.1	4%	0.043	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-116.9	-7.1	179.6	-42.5	-86.6	0	0	0	113	K229 P230 S288 D289 A309 I312 I313 L333	K229-Y291 HydrophobicContact CB-CD1 4.44Å; K229-Y291 HydrophobicContact CB-CD2 3.7Å; K229-Y291 HydrophobicContact CB-CE1 4.39Å; K229-Y291 HydrophobicContact CB-CE2 3.63Å; K229-Y291 HydrophobicContact CB-CG 4.11Å; P230-Y291 VanDerWaalsContact CD-CZ 3.44Å; P230-Y291 WeakPolarHBondContact CD-OH 3.37Å; P230-Y291 HydrophobicContact CG-CE1 3.99Å; S288-Y291 WeakPolarHBondContact O-CD2 3.41Å; S288-Y291 PolarHBondContact O-N 3.2Å; D289-Y291 PolarHBondContact O-N 2.89Å; D289-Y291 VanDerWaalsContact O-N 3.09Å; Y291-A309 WeakPolarHBondContact O-CA 3.42Å; Y291-A309 WeakPolarHBondContact O-CB 3.35Å; Y291-I312 HydrophobicContact CD1-CB 4.33Å; Y291-I312 HydrophobicContact CD1-CG2 3.67Å; Y291-I312 HydrophobicContact CE1-CG2 4.26Å; Y291-I313 HydrophobicContact CD1-CG1 4.05Å; Y291-I313 HydrophobicContact CE1-CG1 4.4Å; Y291-L333 VanDerWaalsContact CE1-O 3.27Å; Y291-L333 WeakPolarHBondContact CE1-O 3.26Å; Y291-L333 PolarHBondContact OH-O 2.87Å
292	M	95.2	Very high	84.9	Confident	17 Å²	17	40.5 Å²	40.5	8%	0.084	23%	0.232	C	C	.	.			trans	-71.1	139.7	-177.3	-73.4	169.3	68.5	0	0	111.7	S288 D289 V296 F308 G347	S288-M292 PolarHBondContact O-N 3.11Å; D289-M292 PolarHBondContact O-N 2.87Å; M292-V296 HydrophobicContact CE-CB 4.03Å; M292-V296 HydrophobicContact CE-CG1 3.48Å; M292-V296 VanDerWaalsContact CE-CG1 3.48Å; M292-F308 VanDerWaalsContact O-CE1 3.27Å; M292-F308 WeakPolarHBondContact O-CE1 3.47Å; M292-G347 WeakPolarHBondContact O-CA 3.36Å
293	A	96.1	Very high	85.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.008	23%	0.23	C	C	.	.			trans	-75.6	154.8	173.4	0	0	0	0	0	111.4	E295 V296 A305 F308	A293-E295 VanDerWaalsContact C-N 3.31Å; A293-E295 WeakPolarHBondContact CB-OE1 3.22Å; A293-E295 VanDerWaalsContact CB-OE2 3.26Å; A293-E295 WeakPolarHBondContact CB-OE2 3.44Å; A293-E295 PolarHBondContact O-N 2.87Å; A293-V296 HydrophobicContact CB-CG2 3.99Å; A293-V296 WeakPolarHBondContact O-CB 3.25Å; A293-V296 WeakPolarHBondContact O-CG2 3.3Å; A293-V296 PolarHBondContact O-N 2.6Å; A293-V296 VanDerWaalsContact O-N 3.08Å; A293-A305 HydrophobicContact CB-CB 4.27Å; A293-F308 VanDerWaalsContact CA-CD1 3.47Å; A293-F308 HydrophobicContact CB-CB 3.63Å; A293-F308 HydrophobicContact CB-CD1 3.75Å; A293-F308 HydrophobicContact CB-CD2 4.2Å; A293-F308 HydrophobicContact CB-CE1 4.45Å; A293-F308 HydrophobicContact CB-CG 3.6Å
294	P	94.8	Very high	87.3	Confident	4 Å²	4	35.4 Å²	35.4	3%	0.026	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-52.3	-45.7	-177.1	-26	33.7	0	0	0	113.4	V296 W297 F308 L350 L351 V382	P294-V296 PolarHBondContact O-N 2.88Å; P294-W297 PolarHBondContact O-N 3.32Å; P294-F308 HydrophobicContact CG-CE2 4.4Å; P294-L350 HydrophobicContact CG-CB 3.79Å; P294-L350 HydrophobicContact CG-CD1 4.25Å; P294-L351 HydrophobicContact CB-CB 4.18Å; P294-L351 HydrophobicContact CB-CD1 4.39Å; P294-V382 HydrophobicContact CG-CG1 4.46Å
295	E	93.5	Very high	88.5	Confident	11 Å²	11	32.9 Å²	32.9	5%	0.051	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-68.6	-15	-176.5	73	-83.5	-165.9	0	0	114.1	A293 W297 E298 P384 R387	A293-E295 VanDerWaalsContact C-N 3.31Å; A293-E295 WeakPolarHBondContact CB-OE1 3.22Å; A293-E295 VanDerWaalsContact CB-OE2 3.26Å; A293-E295 WeakPolarHBondContact CB-OE2 3.44Å; A293-E295 PolarHBondContact O-N 2.87Å; E295-W297 VanDerWaalsContact C-N 3.29Å; E295-W297 PolarHBondContact O-N 2.85Å; E295-E298 PolarHBondContact O-N 2.81Å; E295-P384 HydrophobicContact CB-CG 4.25Å; E295-P384 VanDerWaalsContact CD-CG 3.42Å; E295-P384 HydrophobicContact CG-CG 3.81Å; E295-P384 WeakPolarHBondContact OE1-CG 3.29Å; E295-R387 IonicContact OE1-CZ 2.71Å; E295-R387 IonicContact OE1-NH1 2.7Å; E295-R387 PolarHBondContact OE1-NH1 3.5Å; E295-R387 IonicContact OE1-NH2 2.7Å; E295-R387 IonicContact OE2-CZ 2.94Å; E295-R387 IonicContact OE2-NH1 2.87Å; E295-R387 PolarHBondContact OE2-NH1 2.84Å; E295-R387 IonicContact OE2-NH2 3.24Å; E295-R387 PolarHBondContact OE2-NH2 2.75Å
296	V	91.2	Very high	89.8	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.018	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-69.3	-32.7	179.4	-173.2	0	0	0	0	110.5	A285 M292 A293 P294 E298 G299 Y301 A305	A285-V296 VanDerWaalsContact CB-O 3.22Å; A285-V296 WeakPolarHBondContact CB-O 3.44Å; M292-V296 HydrophobicContact CE-CB 4.03Å; M292-V296 HydrophobicContact CE-CG1 3.48Å; M292-V296 VanDerWaalsContact CE-CG1 3.48Å; A293-V296 HydrophobicContact CB-CG2 3.99Å; A293-V296 WeakPolarHBondContact O-CB 3.25Å; A293-V296 WeakPolarHBondContact O-CG2 3.3Å; A293-V296 PolarHBondContact O-N 2.6Å; A293-V296 VanDerWaalsContact O-N 3.08Å; P294-V296 PolarHBondContact O-N 2.88Å; V296-E298 VanDerWaalsContact C-N 3.27Å; V296-E298 PolarHBondContact O-N 2.79Å; V296-G299 PolarHBondContact O-N 2.91Å; V296-Y301 HydrophobicContact CB-CD1 4.27Å; V296-Y301 HydrophobicContact CB-CE1 4.48Å; V296-Y301 HydrophobicContact CB-CG 4.47Å; V296-Y301 HydrophobicContact CG1-CD1 4.03Å; V296-Y301 HydrophobicContact CG1-CE1 3.75Å; V296-Y301 HydrophobicContact CG1-CE2 4.46Å; V296-Y301 HydrophobicContact CG2-CD1 4.25Å; V296-Y301 HydrophobicContact CG2-CD2 4.06Å; V296-Y301 HydrophobicContact CG2-CE2 4.4Å; V296-Y301 HydrophobicContact CG2-CG 3.97Å; V296-A305 HydrophobicContact CG2-CB 3.76Å
297	W	85.7	Confident	90.7	Very high	104 Å²	104	29.3 Å²	29.3	39%	0.394	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.6	175.4	-64.1	88.9	0	0	0	112.8	D289 P294 E295 G299 L351	D289-W297 HydrophobicContact CB-CH2 4.44Å; D289-W297 HydrophobicContact CB-CZ2 4.17Å; P294-W297 PolarHBondContact O-N 3.32Å; E295-W297 VanDerWaalsContact C-N 3.29Å; E295-W297 PolarHBondContact O-N 2.85Å; W297-G299 PolarHBondContact O-N 2.76Å; W297-L351 HydrophobicContact CB-CD2 3.72Å; W297-L351 HydrophobicContact CG-CD2 4.15Å
298	E	84.3	Confident	91.4	Very high	129 Å²	129	28.2 Å²	28.2	60%	0.603	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-3.5	173.3	-53.6	-174.5	140	0	0	112.4	E295 V296 H300 L351	E295-E298 PolarHBondContact O-N 2.81Å; V296-E298 VanDerWaalsContact C-N 3.27Å; V296-E298 PolarHBondContact O-N 2.79Å; E298-H300 PolarHBondContact O-N 2.99Å; E298-H300 PolarHBondContact O-ND1 3.36Å; E298-H300 VanDerWaalsContact O-ND1 3.11Å; E298-L351 HydrophobicContact CG-CD1 4.2Å
299	G	75.3	Confident	91.8	Very high	15 Å²	15	27.1 Å²	27.1	16%	0.155	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	1.8	174.5	0	0	0	0	0	115.5	S283 V296 W297	S283-G299 CarbonylContact C-O 3.56Å; S283-G299 VanDerWaalsContact CA-O 3.3Å; S283-G299 WeakPolarHBondContact CA-O 3.36Å; V296-G299 PolarHBondContact O-N 2.91Å; W297-G299 PolarHBondContact O-N 2.76Å
300	H	76.8	Confident	92.1	Very high	117 Å²	117	23 Å²	23	54%	0.542	11%	0.11	S	C	.	.			trans	-130.6	97.4	-177.1	-65.8	83.8	0	0	0	110.7	W281 L282 E298	W281-H300 HydrophobicContact CE3-CB 4.19Å; W281-H300 HydrophobicContact CZ3-CB 4.42Å; L282-H300 WeakPolarHBondContact O-CA 3.45Å; E298-H300 PolarHBondContact O-N 2.99Å; E298-H300 PolarHBondContact O-ND1 3.36Å; E298-H300 VanDerWaalsContact O-ND1 3.11Å
301	Y	83.9	Confident	92.3	Very high	3 Å²	3	21.2 Å²	21.2	1%	0.012	10%	0.102	C	C	.	.	B	Isolated β-bridge	trans	-141.4	172.2	-173.6	62.2	-81.9	0	0	0	112.4	R226 L282 S284 V296 A305	R226-Y301 HydrophobicContact CG-CE2 4.27Å; R226-Y301 PolarHBondContact NE-OH 2.87Å; R226-Y301 PolarHBondContact NH2-OH 3.37Å; R226-Y301 VanDerWaalsContact NH2-OH 3.15Å; L282-Y301 HydrophobicContact CB-CD1 4.26Å; L282-Y301 HydrophobicContact CB-CD2 4.17Å; L282-Y301 HydrophobicContact CB-CE1 4.03Å; L282-Y301 HydrophobicContact CB-CE2 3.96Å; L282-Y301 HydrophobicContact CB-CG 4.32Å; L282-Y301 WeakPolarHBondContact CB-O 3.44Å; L282-Y301 HydrophobicContact CD1-CD2 3.7Å; L282-Y301 HydrophobicContact CD1-CE2 3.37Å; L282-Y301 HydrophobicContact CG-CE2 4.3Å; L282-Y301 PolarHBondContact N-O 2.88Å; L282-Y301 PolarHBondContact O-N 3.34Å; S284-Y301 VanDerWaalsContact O-CE1 3.22Å; S284-Y301 WeakPolarHBondContact O-CE1 3.43Å; S284-Y301 PolarHBondContact O-OH 3.01Å; V296-Y301 HydrophobicContact CB-CD1 4.27Å; V296-Y301 HydrophobicContact CB-CE1 4.48Å; V296-Y301 HydrophobicContact CB-CG 4.47Å; V296-Y301 HydrophobicContact CG1-CD1 4.03Å; V296-Y301 HydrophobicContact CG1-CE1 3.75Å; V296-Y301 HydrophobicContact CG1-CE2 4.46Å; V296-Y301 HydrophobicContact CG2-CD1 4.25Å; V296-Y301 HydrophobicContact CG2-CD2 4.06Å; V296-Y301 HydrophobicContact CG2-CE2 4.4Å; V296-Y301 HydrophobicContact CG2-CG 3.97Å; Y301-A305 HydrophobicContact CD2-CB 3.66Å; Y301-A305 HydrophobicContact CE2-CB 4.22Å
302	T	89.4	Confident	92.4	Very high	5 Å²	5	20.7 Å²	20.7	3%	0.031	10%	0.1	C	C	.	.			trans	-124.2	-174.2	-178.6	75.6	0	0	0	0	110.6	N278 W281 K304 A305	N278-T302 WeakPolarHBondContact O-CB 3.44Å; N278-T302 WeakPolarHBondContact O-CG2 3.41Å; N278-T302 PolarHBondContact O-OG1 3.08Å; W281-T302 HydrophobicContact CE3-CG2 4.16Å; W281-T302 HydrophobicContact CZ3-CG2 4.26Å; T302-K304 PolarHBondContact O-N 2.89Å; T302-K304 PolarHBondContact OG1-N 3Å; T302-A305 PolarHBondContact O-N 2.91Å; T302-A305 VanDerWaalsContact O-N 3.1Å
303	A	93.1	Very high	92.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-14.4	174.5	0	0	0	0	0	114.7	H219 V224 V277 A305 D306	H219-A303 PolarHBondContact CE1-O 2.84Å; V224-A303 HydrophobicContact CG1-CB 4.19Å; V224-A303 HydrophobicContact CG2-CB 3.75Å; V277-A303 HydrophobicContact CB-CB 3.86Å; V277-A303 HydrophobicContact CG2-CB 3.7Å; V277-A303 WeakPolarHBondContact O-CB 3.44Å; V277-A303 PolarHBondContact O-N 2.82Å; V277-A303 VanDerWaalsContact O-N 3.11Å; A303-A305 PolarHBondContact O-N 2.96Å; A303-D306 WeakPolarHBondContact O-CB 3.4Å; A303-D306 PolarHBondContact O-N 2.97Å; A303-D306 VanDerWaalsContact O-N 3.1Å
304	K	96.8	Very high	92.5	Very high	6 Å²	6	19.9 Å²	19.9	3%	0.026	10%	0.096	C	C	.	.	H	α-helix	trans	-64.3	-13.8	172.8	-63.2	-62.6	177.5	82.6	0	114.6	N278 T302 I307 F308 P384 R387 P388 D389	N278-K304 WeakPolarHBondContact OD1-CE 3.41Å; T302-K304 PolarHBondContact O-N 2.89Å; T302-K304 PolarHBondContact OG1-N 3Å; K304-I307 HydrophobicContact CD-CG1 4.11Å; K304-I307 PolarHBondContact O-N 3.09Å; K304-F308 PolarHBondContact O-N 2.91Å; K304-P384 HydrophobicContact CB-CB 3.78Å; K304-P384 HydrophobicContact CG-CB 4.33Å; K304-P384 WeakPolarHBondContact CG-O 3.25Å; K304-R387 HydrophobicContact CD-CB 4.2Å; K304-R387 PolarHBondContact NZ-O 3.46Å; K304-R387 PolarHBondContact O-NH1 3.41Å; K304-P388 WeakPolarHBondContact CE-O 3.38Å; K304-D389 WeakPolarHBondContact CE-OD1 3.43Å; K304-D389 IonicContact NZ-OD1 2.68Å; K304-D389 PolarHBondContact NZ-OD1 2.98Å
305	A	96.4	Very high	92.6	Very high	9 Å²	9	20.5 Å²	20.5	7%	0.074	10%	0.098	C	C	.	.	H	α-helix	trans	-66.6	-38.6	168.9	0	0	0	0	0	112.2	A293 V296 Y301 T302 A303 I307 F308 A309	A293-A305 HydrophobicContact CB-CB 4.27Å; V296-A305 HydrophobicContact CG2-CB 3.76Å; Y301-A305 HydrophobicContact CD2-CB 3.66Å; Y301-A305 HydrophobicContact CE2-CB 4.22Å; T302-A305 PolarHBondContact O-N 2.91Å; T302-A305 VanDerWaalsContact O-N 3.1Å; A303-A305 PolarHBondContact O-N 2.96Å; A305-I307 VanDerWaalsContact C-N 3.28Å; A305-I307 PolarHBondContact O-N 3.2Å; A305-F308 PolarHBondContact O-N 2.69Å; A305-A309 PolarHBondContact O-N 2.87Å
306	D	98	Very high	92.6	Very high	3 Å²	3	20 Å²	20	2%	0.016	10%	0.095	C	C	.	.	H	α-helix	trans	-63.3	-36.1	175.9	-71.7	-14.4	0	0	0	111	V215 H219 V224 H225 R226 L228 A303 A309 L310	V215-D306 HydrophobicContact CG1-CB 4.25Å; H219-D306 IonicContact CD2-OD2 2.89Å; H219-D306 IonicContact CE1-OD2 2.87Å; H219-D306 IonicContact NE2-OD2 2.72Å; H219-D306 PolarHBondContact NE2-OD2 3.05Å; V224-D306 VanDerWaalsContact CG1-OD2 3.31Å; V224-D306 WeakPolarHBondContact CG1-OD2 3.34Å; H225-D306 PolarHBondContact N-OD2 3.34Å; R226-D306 PolarHBondContact N-OD1 3.08Å; L228-D306 HydrophobicContact CD1-CB 3.7Å; A303-D306 WeakPolarHBondContact O-CB 3.4Å; A303-D306 PolarHBondContact O-N 2.97Å; A303-D306 VanDerWaalsContact O-N 3.1Å; D306-A309 PolarHBondContact O-N 3.07Å; D306-L310 WeakPolarHBondContact O-CG 3.18Å; D306-L310 PolarHBondContact O-N 3.26Å
307	I	98.5	Very high	92.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64	-41.8	177.4	-55.4	-60.8	0	0	0	111.5	K304 A305 G311 M379 R387 P388 A390 L393	K304-I307 HydrophobicContact CD-CG1 4.11Å; K304-I307 PolarHBondContact O-N 3.09Å; A305-I307 VanDerWaalsContact C-N 3.28Å; A305-I307 PolarHBondContact O-N 3.2Å; I307-G311 PolarHBondContact O-N 2.89Å; I307-G311 VanDerWaalsContact O-N 3.12Å; I307-M379 HydrophobicContact CG2-CB 4.26Å; I307-M379 HydrophobicContact CG2-CG 4.12Å; I307-M379 WeakPolarHBondContact O-CE 3.46Å; I307-R387 HydrophobicContact CG2-CB 4.14Å; I307-P388 HydrophobicContact CG2-CG 4.28Å; I307-A390 HydrophobicContact CD1-CB 3.86Å; I307-L393 HydrophobicContact CD1-CD2 3.82Å; I307-L393 HydrophobicContact CG2-CD2 4.31Å
308	F	98.3	Very high	93.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65.9	-46.5	175.6	-175.4	-83.4	0	0	0	111.2	M292 A293 P294 K304 A305 L310 G311 I312 V346 L350 L380	M292-F308 VanDerWaalsContact O-CE1 3.27Å; M292-F308 WeakPolarHBondContact O-CE1 3.47Å; A293-F308 VanDerWaalsContact CA-CD1 3.47Å; A293-F308 HydrophobicContact CB-CB 3.63Å; A293-F308 HydrophobicContact CB-CD1 3.75Å; A293-F308 HydrophobicContact CB-CD2 4.2Å; A293-F308 HydrophobicContact CB-CE1 4.45Å; A293-F308 HydrophobicContact CB-CG 3.6Å; P294-F308 HydrophobicContact CG-CE2 4.4Å; K304-F308 PolarHBondContact O-N 2.91Å; A305-F308 PolarHBondContact O-N 2.69Å; F308-L310 VanDerWaalsContact C-N 3.33Å; F308-L310 PolarHBondContact O-N 3Å; F308-G311 WeakPolarHBondContact O-CA 3.43Å; F308-G311 PolarHBondContact O-N 3.06Å; F308-I312 HydrophobicContact CD1-CD1 4.45Å; F308-I312 HydrophobicContact CD1-CG1 4.01Å; F308-I312 HydrophobicContact CE1-CD1 3.79Å; F308-I312 HydrophobicContact CE1-CG1 3.78Å; F308-I312 HydrophobicContact CZ-CD1 4.17Å; F308-I312 PolarHBondContact O-N 3.04Å; F308-V346 HydrophobicContact CZ-CG1 4.06Å; F308-L350 HydrophobicContact CE2-CD1 3.79Å; F308-L350 HydrophobicContact CZ-CD1 4.03Å; F308-L380 HydrophobicContact CD1-CD2 4.33Å; F308-L380 HydrophobicContact CD2-CD2 3.86Å; F308-L380 HydrophobicContact CE1-CD2 4.28Å; F308-L380 HydrophobicContact CE2-CB 4.32Å; F308-L380 HydrophobicContact CE2-CD2 3.79Å; F308-L380 HydrophobicContact CG-CD2 4.14Å; F308-L380 HydrophobicContact CZ-CD2 4.01Å
309	A	98.3	Very high	93.5	Very high	7 Å²	7	9.7 Å²	9.7	6%	0.058	5%	0.052	C	C	.	.	H	α-helix	trans	-58.5	-42.8	177.3	0	0	0	0	0	112	L228 Y291 A305 D306 G311 I312 I313	L228-A309 HydrophobicContact CB-CB 3.93Å; Y291-A309 WeakPolarHBondContact O-CA 3.42Å; Y291-A309 WeakPolarHBondContact O-CB 3.35Å; A305-A309 PolarHBondContact O-N 2.87Å; D306-A309 PolarHBondContact O-N 3.07Å; A309-G311 VanDerWaalsContact C-N 3.28Å; A309-G311 PolarHBondContact O-N 3.35Å; A309-I312 WeakPolarHBondContact O-CB 3.39Å; A309-I312 PolarHBondContact O-N 2.67Å; A309-I313 WeakPolarHBondContact O-CD1 3.31Å; A309-I313 VanDerWaalsContact O-CG1 3.24Å; A309-I313 WeakPolarHBondContact O-CG1 3.45Å; A309-I313 PolarHBondContact O-N 3.38Å
310	L	98.2	Very high	94.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-57.3	-39.6	170.2	-76.8	-176.2	0	0	0	112.5	L211 V215 L228 D306 F308 I313 I314 M379 L393	L211-L310 HydrophobicContact CB-CD2 4.06Å; L211-L310 HydrophobicContact CD2-CD2 4.12Å; V215-L310 HydrophobicContact CB-CD1 3.95Å; V215-L310 HydrophobicContact CG1-CD1 4.17Å; V215-L310 HydrophobicContact CG2-CD1 3.82Å; V215-L310 HydrophobicContact CG2-CD2 4.15Å; V215-L310 HydrophobicContact CG2-CG 4.21Å; L228-L310 HydrophobicContact CD1-CD2 4.19Å; L228-L310 HydrophobicContact CD1-CG 4.09Å; D306-L310 WeakPolarHBondContact O-CG 3.18Å; D306-L310 PolarHBondContact O-N 3.26Å; F308-L310 VanDerWaalsContact C-N 3.33Å; F308-L310 PolarHBondContact O-N 3Å; L310-I313 PolarHBondContact O-N 2.82Å; L310-I314 WeakPolarHBondContact O-CB 3.47Å; L310-I314 VanDerWaalsContact O-CG1 3.28Å; L310-I314 WeakPolarHBondContact O-CG1 3.45Å; L310-I314 PolarHBondContact O-N 3.48Å; L310-M379 HydrophobicContact CB-CE 3.57Å; L310-L393 HydrophobicContact CD1-CD2 3.81Å
311	G	97.9	Very high	95.1	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-62.5	-42.4	178.2	0	0	0	0	0	112.2	I307 F308 A309 W315 L376 M379	I307-G311 PolarHBondContact O-N 2.89Å; I307-G311 VanDerWaalsContact O-N 3.12Å; F308-G311 WeakPolarHBondContact O-CA 3.43Å; F308-G311 PolarHBondContact O-N 3.06Å; A309-G311 VanDerWaalsContact C-N 3.28Å; A309-G311 PolarHBondContact O-N 3.35Å; G311-W315 VanDerWaalsContact O-CB 3.26Å; G311-W315 WeakPolarHBondContact O-CB 3.35Å; G311-W315 PolarHBondContact O-N 2.83Å; G311-L376 WeakPolarHBondContact O-CD2 3.22Å; G311-M379 VanDerWaalsContact N-CE 3.32Å
312	I	97.9	Very high	95.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60.9	-50.2	173	-57.8	-63.3	0	0	0	110.6	F290 Y291 F308 A309 W315 A316 T335 V346 L380	F290-I312 WeakPolarHBondContact O-CG2 3.42Å; Y291-I312 HydrophobicContact CD1-CB 4.33Å; Y291-I312 HydrophobicContact CD1-CG2 3.67Å; Y291-I312 HydrophobicContact CE1-CG2 4.26Å; F308-I312 HydrophobicContact CD1-CD1 4.45Å; F308-I312 HydrophobicContact CD1-CG1 4.01Å; F308-I312 HydrophobicContact CE1-CD1 3.79Å; F308-I312 HydrophobicContact CE1-CG1 3.78Å; F308-I312 HydrophobicContact CZ-CD1 4.17Å; F308-I312 PolarHBondContact O-N 3.04Å; A309-I312 WeakPolarHBondContact O-CB 3.39Å; A309-I312 PolarHBondContact O-N 2.67Å; I312-W315 PolarHBondContact O-N 3.34Å; I312-A316 VanDerWaalsContact O-CB 3.23Å; I312-A316 WeakPolarHBondContact O-CB 3.41Å; I312-A316 PolarHBondContact O-N 2.89Å; I312-T335 VanDerWaalsContact CD1-OG1 3.23Å; I312-T335 WeakPolarHBondContact CD1-OG1 3.2Å; I312-T335 HydrophobicContact CG2-CG2 4.5Å; I312-V346 HydrophobicContact CD1-CB 3.8Å; I312-V346 HydrophobicContact CD1-CG1 4.14Å; I312-V346 HydrophobicContact CD1-CG2 4.22Å; I312-L380 HydrophobicContact CD1-CD2 3.66Å; I312-L380 HydrophobicContact CG1-CD2 4.03Å
313	I	97.8	Very high	95.9	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-61.7	-48.7	-177.1	-66.7	161.4	0	0	0	111.2	L190 L211 L228 P230 I233 Y291 A309 L310 A316 M317	L190-I313 HydrophobicContact CD2-CG2 3.91Å; L211-I313 HydrophobicContact CD1-CG2 4.18Å; L228-I313 HydrophobicContact CB-CD1 4.14Å; P230-I313 HydrophobicContact CG-CG1 4.29Å; P230-I313 HydrophobicContact CG-CG2 4.5Å; I233-I313 HydrophobicContact CD1-CD1 3.94Å; I233-I313 HydrophobicContact CD1-CG2 4.19Å; Y291-I313 HydrophobicContact CD1-CG1 4.05Å; Y291-I313 HydrophobicContact CE1-CG1 4.4Å; A309-I313 WeakPolarHBondContact O-CD1 3.31Å; A309-I313 VanDerWaalsContact O-CG1 3.24Å; A309-I313 WeakPolarHBondContact O-CG1 3.45Å; A309-I313 PolarHBondContact O-N 3.38Å; L310-I313 PolarHBondContact O-N 2.82Å; I313-A316 PolarHBondContact O-N 3.01Å; I313-M317 VanDerWaalsContact O-CB 3.26Å; I313-M317 WeakPolarHBondContact O-CB 3.19Å; I313-M317 PolarHBondContact O-N 2.83Å
314	I	96.7	Very high	95.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-65	-45.3	-178.6	-68.9	173.5	0	0	0	110.6	M208 L211 L310 M317 L318 L376 M379 M397	M208-I314 HydrophobicContact CG-CD1 4.27Å; M208-I314 HydrophobicContact CG-CG1 4.2Å; M208-I314 HydrophobicContact CG-CG2 3.79Å; M208-I314 HydrophobicContact SD-CG2 3.46Å; M208-I314 WeakPolarHBondContact SD-CG2 3.36Å; L211-I314 HydrophobicContact CD1-CG1 4.5Å; L310-I314 WeakPolarHBondContact O-CB 3.47Å; L310-I314 VanDerWaalsContact O-CG1 3.28Å; L310-I314 WeakPolarHBondContact O-CG1 3.45Å; L310-I314 PolarHBondContact O-N 3.48Å; I314-M317 PolarHBondContact O-N 2.85Å; I314-L318 HydrophobicContact CG2-CD1 3.78Å; I314-L318 HydrophobicContact CG2-CG 4.29Å; I314-L318 WeakPolarHBondContact O-CB 3.42Å; I314-L318 WeakPolarHBondContact O-CG 3.4Å; I314-L318 PolarHBondContact O-N 3.45Å; I314-L376 HydrophobicContact CB-CD2 4.08Å; I314-L376 HydrophobicContact CG2-CD2 3.94Å; I314-M379 HydrophobicContact CD1-CE 4.28Å; I314-M397 HydrophobicContact CD1-CE 4Å
315	W	95.6	Very high	95.6	Very high	17 Å²	17	16 Å²	16	6%	0.064	8%	0.081	C	C	.	.	H	α-helix	trans	-63.4	-45.3	177.7	-178.3	15.1	0	0	0	111.5	G311 I312 M317 L318 E319 I321 T335 I360 L376 L380	G311-W315 VanDerWaalsContact O-CB 3.26Å; G311-W315 WeakPolarHBondContact O-CB 3.35Å; G311-W315 PolarHBondContact O-N 2.83Å; I312-W315 PolarHBondContact O-N 3.34Å; W315-M317 PolarHBondContact O-N 3.27Å; W315-L318 PolarHBondContact O-N 2.98Å; W315-E319 PolarHBondContact O-N 3.4Å; W315-E319 VanDerWaalsContact O-N 3.07Å; W315-I321 HydrophobicContact CD2-CD1 4.36Å; W315-I321 HydrophobicContact CG-CD1 4.37Å; W315-I321 HydrophobicContact CZ2-CD1 4.19Å; W315-T335 HydrophobicContact CB-CG2 4.1Å; W315-T335 HydrophobicContact CD2-CG2 3.71Å; W315-T335 HydrophobicContact CE3-CG2 3.72Å; W315-T335 HydrophobicContact CG-CG2 3.91Å; W315-T335 HydrophobicContact CZ3-CG2 4.33Å; W315-I360 HydrophobicContact CD2-CG1 4.38Å; W315-I360 HydrophobicContact CD2-CG2 4.36Å; W315-I360 HydrophobicContact CE3-CG1 4.46Å; W315-I360 HydrophobicContact CG-CG2 4.47Å; W315-I360 HydrophobicContact CH2-CG1 4.27Å; W315-I360 HydrophobicContact CZ2-CB 4.35Å; W315-I360 HydrophobicContact CZ2-CG1 4.18Å; W315-I360 HydrophobicContact CZ2-CG2 4.41Å; W315-I360 HydrophobicContact CZ3-CG1 4.41Å; W315-L376 HydrophobicContact CB-CD1 4.03Å; W315-L376 HydrophobicContact CB-CD2 4.17Å; W315-L376 HydrophobicContact CG-CD1 4.43Å; W315-L380 HydrophobicContact CE3-CD1 3.65Å; W315-L380 HydrophobicContact CZ3-CD1 4.05Å
316	A	95.4	Very high	95.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.1	-42.9	175.7	0	0	0	0	0	112.2	I312 I313 R320 I321 L333 T335	I312-A316 VanDerWaalsContact O-CB 3.23Å; I312-A316 WeakPolarHBondContact O-CB 3.41Å; I312-A316 PolarHBondContact O-N 2.89Å; I313-A316 PolarHBondContact O-N 3.01Å; A316-R320 CarbonylContact O-C 3.41Å; A316-R320 WeakPolarHBondContact O-CA 3.34Å; A316-R320 PolarHBondContact O-N 3.39Å; A316-I321 PolarHBondContact O-N 2.74Å; A316-L333 HydrophobicContact CB-CB 4.15Å; A316-L333 HydrophobicContact CB-CD2 4.49Å; A316-T335 HydrophobicContact CB-CG2 3.91Å
317	M	95.1	Very high	94.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.9	-48.1	178.6	179.5	-179.8	71	0	0	112.6	L190 I194 N204 F207 M208 I313 I314 W315	L190-M317 HydrophobicContact CD1-SD 4.34Å; I194-M317 HydrophobicContact CD1-CG 3.93Å; I194-M317 HydrophobicContact CD1-SD 4.17Å; I194-M317 HydrophobicContact CG1-CG 4.2Å; N204-M317 HydrophobicContact CB-CE 4.22Å; N204-M317 WeakPolarHBondContact O-CE 3.31Å; F207-M317 HydrophobicContact CB-CE 4.14Å; F207-M317 HydrophobicContact CB-SD 4.02Å; F207-M317 HydrophobicContact CD2-SD 4.09Å; M208-M317 HydrophobicContact CG-CE 3.83Å; I313-M317 VanDerWaalsContact O-CB 3.26Å; I313-M317 WeakPolarHBondContact O-CB 3.19Å; I313-M317 PolarHBondContact O-N 2.83Å; I314-M317 PolarHBondContact O-N 2.85Å; W315-M317 PolarHBondContact O-N 3.27Å
318	L	92.7	Very high	93.9	Very high	14 Å²	14	30.5 Å²	30.5	7%	0.073	17%	0.167	C	C	.	.	H	α-helix	trans	-66.3	-46.9	-177.4	-73	173.9	0	0	0	112.2	N204 M208 I314 W315 M368 V372	N204-L318 HydrophobicContact CB-CD2 4.1Å; M208-L318 HydrophobicContact CE-CD2 4.2Å; M208-L318 HydrophobicContact SD-CD1 3.82Å; M208-L318 HydrophobicContact SD-CD2 4.26Å; M208-L318 HydrophobicContact SD-CG 4.31Å; I314-L318 HydrophobicContact CG2-CD1 3.78Å; I314-L318 HydrophobicContact CG2-CG 4.29Å; I314-L318 WeakPolarHBondContact O-CB 3.42Å; I314-L318 WeakPolarHBondContact O-CG 3.4Å; I314-L318 PolarHBondContact O-N 3.45Å; W315-L318 PolarHBondContact O-N 2.98Å; L318-M368 HydrophobicContact CB-CE 4.08Å; L318-M368 HydrophobicContact CD1-CB 4.4Å; L318-M368 HydrophobicContact CD1-CE 3.87Å; L318-M368 HydrophobicContact CD1-CG 4.25Å; L318-V372 HydrophobicContact CD1-CG1 3.76Å
319	E	91.8	Very high	93.6	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-89.3	-5.8	-178.3	-72.1	-62.9	154.5	0	0	113	W315 I321 K363 S366 M368	W315-E319 PolarHBondContact O-N 3.4Å; W315-E319 VanDerWaalsContact O-N 3.07Å; E319-I321 HydrophobicContact CB-CD1 3.89Å; E319-I321 HydrophobicContact CB-CG1 3.71Å; E319-K363 WeakPolarHBondContact O-CE 3.32Å; E319-K363 PolarHBondContact O-NZ 3.01Å; E319-K363 PolarHBondContact OE1-N 2.79Å; E319-K363 WeakPolarHBondContact OE2-CB 3.33Å; E319-K363 WeakPolarHBondContact OE2-CD 3.05Å; E319-K363 WeakPolarHBondContact OE2-CE 3.49Å; E319-K363 WeakPolarHBondContact OE2-CG 3.18Å; E319-K363 PolarHBondContact OE2-N 2.97Å; E319-S366 WeakPolarHBondContact OE1-CB 3.33Å; E319-S366 PolarHBondContact OE1-OG 2.84Å; E319-M368 HydrophobicContact CG-CE 3.98Å
320	R	92.4	Very high	93.3	Very high	62 Å²	62	42 Å²	42	23%	0.234	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	62	-169.5	-66.5	-173	168.9	-137.1	-7.3	111.6	I194 R197 R198 A316	I194-R320 VanDerWaalsContact O-CZ 3.27Å; I194-R320 PolarHBondContact O-NH1 3.31Å; I194-R320 PolarHBondContact O-NH2 3.32Å; R197-R320 VanDerWaalsContact O-CZ 3.29Å; R197-R320 PolarHBondContact O-NH1 2.9Å; R197-R320 PolarHBondContact O-NH2 2.77Å; R198-R320 PolarHBondContact O-NH2 2.92Å; R198-R320 VanDerWaalsContact O-NH2 3.12Å; A316-R320 CarbonylContact O-C 3.41Å; A316-R320 WeakPolarHBondContact O-CA 3.34Å; A316-R320 PolarHBondContact O-N 3.39Å
321	I	93.6	Very high	93.1	Very high	31 Å²	31	46.3 Å²	46.3	16%	0.159	23%	0.233	C	C	.	.			trans	-93.7	121.9	174.3	-51.1	174.8	0	0	0	107.2	W315 A316 E319 L333 G334 T335 Y336	W315-I321 HydrophobicContact CD2-CD1 4.36Å; W315-I321 HydrophobicContact CG-CD1 4.37Å; W315-I321 HydrophobicContact CZ2-CD1 4.19Å; A316-I321 PolarHBondContact O-N 2.74Å; E319-I321 HydrophobicContact CB-CD1 3.89Å; E319-I321 HydrophobicContact CB-CG1 3.71Å; I321-L333 WeakPolarHBondContact O-CA 3.31Å; I321-G334 CarbonylContact C-O 3.55Å; I321-G334 VanDerWaalsContact CG2-O 3.24Å; I321-G334 WeakPolarHBondContact CG2-O 3.12Å; I321-G334 PolarHBondContact O-N 3.44Å; I321-T335 HydrophobicContact CB-CG2 4.34Å; I321-T335 HydrophobicContact CD1-CG2 3.88Å; I321-Y336 HydrophobicContact CG2-CD1 4.48Å; I321-Y336 HydrophobicContact CG2-CE1 3.94Å
322	T	95.3	Very high	93	Very high	32 Å²	32	47.1 Å²	47.1	20%	0.196	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	155.6	-177.6	57	0	0	0	0	112	L195 E331 L332 L333 Y336	L195-T322 HydrophobicContact CD1-CG2 4.32Å; L195-T322 HydrophobicContact CD2-CG2 3.59Å; T322-E331 VanDerWaalsContact CB-OE1 3.23Å; T322-E331 WeakPolarHBondContact CB-OE1 3.43Å; T322-E331 HydrophobicContact CG2-CG 3.94Å; T322-E331 WeakPolarHBondContact CG2-OE1 3.03Å; T322-E331 PolarHBondContact OG1-OE1 3.4Å; T322-L332 CarbonylContact C-O 3.6Å; T322-L332 WeakPolarHBondContact CA-O 3.1Å; T322-L332 WeakPolarHBondContact CB-O 3.47Å; T322-L333 HydrophobicContact CG2-CD2 4.01Å; T322-Y336 VanDerWaalsContact O-CE1 3.26Å; T322-Y336 WeakPolarHBondContact O-CE1 3.48Å; T322-Y336 PolarHBondContact O-OH 3.45Å
323	F	94.6	Very high	92.9	Very high	11 Å²	11	47.1 Å²	47.1	5%	0.048	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	162.2	167.7	67.3	-79	0	0	0	109.9	F290 D325 E331 L332 Y336 I343	F290-F323 HydrophobicContact CB-CE1 4Å; F290-F323 HydrophobicContact CB-CZ 3.87Å; F290-F323 HydrophobicContact CD1-CD1 4.19Å; F290-F323 HydrophobicContact CD1-CD2 4.48Å; F290-F323 AromaticContact CD1-CE1 4Å; F290-F323 HydrophobicContact CD1-CE1 4Å; F290-F323 HydrophobicContact CD1-CE2 4.3Å; F290-F323 HydrophobicContact CD1-CG 4.43Å; F290-F323 HydrophobicContact CD1-CZ 4.05Å; F290-F323 HydrophobicContact CD2-CD2 4.31Å; F290-F323 HydrophobicContact CD2-CE1 4.25Å; F290-F323 AromaticContact CD2-CE2 3.52Å; F290-F323 HydrophobicContact CD2-CE2 3.52Å; F290-F323 AromaticContact CD2-CZ 3.48Å; F290-F323 HydrophobicContact CD2-CZ 3.48Å; F290-F323 VanDerWaalsContact CD2-CZ 3.48Å; F290-F323 HydrophobicContact CE1-CD1 4.47Å; F290-F323 HydrophobicContact CE1-CD2 4.2Å; F290-F323 HydrophobicContact CE1-CE2 4.33Å; F290-F323 HydrophobicContact CE1-CG 4.28Å; F290-F323 HydrophobicContact CE2-CD2 4.01Å; F290-F323 AromaticContact CE2-CE2 3.56Å; F290-F323 HydrophobicContact CE2-CE2 3.56Å; F290-F323 HydrophobicContact CE2-CZ 4.02Å; F290-F323 HydrophobicContact CG-CD1 4.43Å; F290-F323 AromaticContact CG-CE1 3.8Å; F290-F323 HydrophobicContact CG-CE1 3.8Å; F290-F323 AromaticContact CG-CE2 3.91Å; F290-F323 HydrophobicContact CG-CE2 3.91Å; F290-F323 AromaticContact CG-CZ 3.5Å; F290-F323 HydrophobicContact CG-CZ 3.5Å; F290-F323 VanDerWaalsContact CG-CZ 3.5Å; F290-F323 AromaticContact CZ-CD2 3.96Å; F290-F323 HydrophobicContact CZ-CD2 3.96Å; F290-F323 AromaticContact CZ-CE2 3.98Å; F290-F323 HydrophobicContact CZ-CE2 3.98Å; F290-F323 HydrophobicContact CZ-CG 4.48Å; F323-D325 HydrophobicContact CE2-CB 4.24Å; F323-E331 WeakPolarHBondContact O-CA 3.04Å; F323-L332 HydrophobicContact CD1-CB 4.3Å; F323-L332 WeakPolarHBondContact CD1-O 2.96Å; F323-L332 HydrophobicContact CE1-CB 3.74Å; F323-L332 HydrophobicContact CE2-CB 4.31Å; F323-L332 HydrophobicContact CE2-CD1 4.17Å; F323-L332 HydrophobicContact CZ-CB 3.76Å; F323-L332 HydrophobicContact CZ-CD1 3.85Å; F323-L332 HydrophobicContact CZ-CG 4.37Å; F323-L332 PolarHBondContact N-O 2.86Å; F323-L332 PolarHBondContact O-N 3.43Å; F323-Y336 HydrophobicContact CB-CD1 4.22Å; F323-Y336 HydrophobicContact CB-CE1 3.89Å; F323-I343 HydrophobicContact CB-CD1 3.53Å; F323-I343 HydrophobicContact CD2-CD1 4.28Å; F323-I343 HydrophobicContact CG-CD1 4.19Å
324	I	93.6	Very high	92.7	Very high	107 Å²	107	47.1 Å²	47.1	55%	0.549	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.6	169.7	-55.7	-55.7	0	0	0	107.4	R330 E331	I324-R330 WeakPolarHBondContact CA-O 3.17Å; I324-E331 HydrophobicContact CD1-CB 3.72Å; I324-E331 HydrophobicContact CD1-CG 4.02Å
325	D	89.4	Confident	92.6	Very high	37 Å²	37	47.1 Å²	47.1	20%	0.198	24%	0.237	C	C	.	.			trans	-64.4	136.6	176.8	170.9	40.9	0	0	0	111.4	F323 E327 S328 K329 R330 L332	F323-D325 HydrophobicContact CE2-CB 4.24Å; D325-E327 PolarHBondContact OD1-N 3.5Å; D325-S328 WeakPolarHBondContact OD2-CA 3.44Å; D325-S328 WeakPolarHBondContact OD2-CB 3.47Å; D325-S328 PolarHBondContact OD2-N 3.27Å; D325-S328 PolarHBondContact OD2-OG 2.88Å; D325-K329 VanDerWaalsContact O-CA 3.27Å; D325-K329 WeakPolarHBondContact O-CA 3.36Å; D325-K329 PolarHBondContact O-N 3.15Å; D325-K329 VanDerWaalsContact O-N 3.16Å; D325-R330 PolarHBondContact N-O 2.94Å; D325-L332 HydrophobicContact CB-CD1 3.78Å; D325-L332 HydrophobicContact CB-CG 4.2Å
326	A	86.1	Confident	92.5	Very high	78 Å²	78	48.6 Å²	48.6	65%	0.645	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-30.1	-175.6	0	0	0	0	0	112.4	K329	A326-K329 WeakPolarHBondContact O-CE 3.49Å; A326-K329 PolarHBondContact O-NZ 3.12Å
327	E	85	Confident	92.4	Very high	181 Å²	181	50.4 Å²	50.4	85%	0.846	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-63.5	-179.1	-175.3	169.8	-164.5	0	0	111.6	D325 K329	D325-E327 PolarHBondContact OD1-N 3.5Å; E327-K329 VanDerWaalsContact C-N 3.33Å; E327-K329 PolarHBondContact O-N 3.42Å
328	S	85.7	Confident	92.1	Very high	57 Å²	57	59.1 Å²	59.1	40%	0.399	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.7	-174.3	70.5	0	0	0	0	114.6	D325 R330	D325-S328 WeakPolarHBondContact OD2-CA 3.44Å; D325-S328 WeakPolarHBondContact OD2-CB 3.47Å; D325-S328 PolarHBondContact OD2-N 3.27Å; D325-S328 PolarHBondContact OD2-OG 2.88Å; S328-R330 PolarHBondContact O-N 3.3Å; S328-R330 VanDerWaalsContact O-N 3.15Å; S328-R330 PolarHBondContact OG-N 3.47Å
329	K	92.1	Very high	91.9	Very high	147 Å²	147	62.9 Å²	62.9	64%	0.639	30%	0.304	S	S	*	.			trans	58.9	14.5	-172	-49.3	-52.6	-174.1	-170.3	0	114.6	D325 A326 E327	D325-K329 VanDerWaalsContact O-CA 3.27Å; D325-K329 WeakPolarHBondContact O-CA 3.36Å; D325-K329 PolarHBondContact O-N 3.15Å; D325-K329 VanDerWaalsContact O-N 3.16Å; A326-K329 WeakPolarHBondContact O-CE 3.49Å; A326-K329 PolarHBondContact O-NZ 3.12Å; E327-K329 VanDerWaalsContact C-N 3.33Å; E327-K329 PolarHBondContact O-N 3.42Å
330	R	91.6	Very high	91.8	Very high	100 Å²	100	66.4 Å²	66.4	38%	0.377	34%	0.342	S	S	.	.			trans	-77.8	148.9	174.3	-66.9	170.4	70.4	-142.2	4.1	110.1	D189 D231 I324 D325 S328 L332	D189-R330 IonicContact OD2-NH2 2.64Å; D189-R330 PolarHBondContact OD2-NH2 3.47Å; D231-R330 IonicContact OD1-CZ 3.52Å; D231-R330 IonicContact OD1-NH1 2.69Å; D231-R330 PolarHBondContact OD1-NH1 2.8Å; D231-R330 IonicContact OD1-NH2 3.98Å; D231-R330 PolarHBondContact OD1-NH2 2.76Å; I324-R330 WeakPolarHBondContact CA-O 3.17Å; D325-R330 PolarHBondContact N-O 2.94Å; S328-R330 PolarHBondContact O-N 3.3Å; S328-R330 VanDerWaalsContact O-N 3.15Å; S328-R330 PolarHBondContact OG-N 3.47Å; R330-L332 HydrophobicContact CB-CD2 4.06Å
331	E	95.3	Very high	91.5	Very high	92 Å²	92	68.2 Å²	68.2	43%	0.43	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	124.4	163.8	-174.2	173.8	-165.4	0	0	108.6	N191 L195 T322 F323 I324	N191-E331 PolarHBondContact ND2-O 3.14Å; L195-E331 HydrophobicContact CD1-CB 4.24Å; L195-E331 HydrophobicContact CD1-CG 3.96Å; L195-E331 WeakPolarHBondContact CD1-O 3.28Å; T322-E331 VanDerWaalsContact CB-OE1 3.23Å; T322-E331 WeakPolarHBondContact CB-OE1 3.43Å; T322-E331 HydrophobicContact CG2-CG 3.94Å; T322-E331 WeakPolarHBondContact CG2-OE1 3.03Å; T322-E331 PolarHBondContact OG1-OE1 3.4Å; F323-E331 WeakPolarHBondContact O-CA 3.04Å; I324-E331 HydrophobicContact CD1-CB 3.72Å; I324-E331 HydrophobicContact CD1-CG 4.02Å
332	L	95.3	Very high	91.4	Very high	16 Å²	16	72.3 Å²	72.3	8%	0.084	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	139.5	-178.5	-58.6	-175	0	0	0	110.6	N191 T322 F323 D325 R330 G334	N191-L332 WeakPolarHBondContact ND2-CD2 3.16Å; N191-L332 WeakPolarHBondContact OD1-CA 3.49Å; T322-L332 CarbonylContact C-O 3.6Å; T322-L332 WeakPolarHBondContact CA-O 3.1Å; T322-L332 WeakPolarHBondContact CB-O 3.47Å; F323-L332 HydrophobicContact CD1-CB 4.3Å; F323-L332 WeakPolarHBondContact CD1-O 2.96Å; F323-L332 HydrophobicContact CE1-CB 3.74Å; F323-L332 HydrophobicContact CE2-CB 4.31Å; F323-L332 HydrophobicContact CE2-CD1 4.17Å; F323-L332 HydrophobicContact CZ-CB 3.76Å; F323-L332 HydrophobicContact CZ-CD1 3.85Å; F323-L332 HydrophobicContact CZ-CG 4.37Å; F323-L332 PolarHBondContact N-O 2.86Å; F323-L332 PolarHBondContact O-N 3.43Å; D325-L332 HydrophobicContact CB-CD1 3.78Å; D325-L332 HydrophobicContact CB-CG 4.2Å; R330-L332 HydrophobicContact CB-CD2 4.06Å; L332-G334 PolarHBondContact O-N 2.87Å
333	L	95.9	Very high	91.3	Very high	1 Å²	1	73.6 Å²	73.6	1%	0.005	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	120.4	167.2	-77	174.8	0	0	0	110.2	N191 I194 L195 P230 Y291 A316 I321 T322	N191-L333 PolarHBondContact OD1-N 3.34Å; I194-L333 HydrophobicContact CB-CD1 3.92Å; I194-L333 HydrophobicContact CG1-CD1 4.2Å; I194-L333 HydrophobicContact CG2-CD1 3.97Å; I194-L333 HydrophobicContact CG2-CD2 4.38Å; L195-L333 HydrophobicContact CD2-CD2 4.06Å; L195-L333 HydrophobicContact CD2-CG 4.32Å; L195-L333 HydrophobicContact CG-CG 4.48Å; P230-L333 HydrophobicContact CG-CB 3.99Å; Y291-L333 VanDerWaalsContact CE1-O 3.27Å; Y291-L333 WeakPolarHBondContact CE1-O 3.26Å; Y291-L333 PolarHBondContact OH-O 2.87Å; A316-L333 HydrophobicContact CB-CB 4.15Å; A316-L333 HydrophobicContact CB-CD2 4.49Å; I321-L333 WeakPolarHBondContact O-CA 3.31Å; T322-L333 HydrophobicContact CG2-CD2 4.01Å
334	G	94.1	Very high	91.3	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	40%	0.4	C	S	.	.			trans	-173.6	160.7	174.1	0	0	0	0	0	111.2	I321 L332	I321-G334 CarbonylContact C-O 3.55Å; I321-G334 VanDerWaalsContact CG2-O 3.24Å; I321-G334 WeakPolarHBondContact CG2-O 3.12Å; I321-G334 PolarHBondContact O-N 3.44Å; L332-G334 PolarHBondContact O-N 2.87Å
335	T	93.6	Very high	91.4	Very high	1 Å²	1	69.1 Å²	69.1	1%	0.006	38%	0.376	C	S	.	.			trans	-110.2	148.8	179.2	71	0	0	0	0	110.5	I312 W315 A316 I321 V346	I312-T335 VanDerWaalsContact CD1-OG1 3.23Å; I312-T335 WeakPolarHBondContact CD1-OG1 3.2Å; I312-T335 HydrophobicContact CG2-CG2 4.5Å; W315-T335 HydrophobicContact CB-CG2 4.1Å; W315-T335 HydrophobicContact CD2-CG2 3.71Å; W315-T335 HydrophobicContact CE3-CG2 3.72Å; W315-T335 HydrophobicContact CG-CG2 3.91Å; W315-T335 HydrophobicContact CZ3-CG2 4.33Å; A316-T335 HydrophobicContact CB-CG2 3.91Å; I321-T335 HydrophobicContact CB-CG2 4.34Å; I321-T335 HydrophobicContact CD1-CG2 3.88Å; T335-V346 WeakPolarHBondContact OG1-CG2 3.49Å
336	Y	94.1	Very high	91.7	Very high	48 Å²	48	67.4 Å²	67.4	19%	0.188	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	157.8	-171.8	52.2	-92.6	0	0	0	110.5	I321 T322 F323 R338 I343 V344	I321-Y336 HydrophobicContact CG2-CD1 4.48Å; I321-Y336 HydrophobicContact CG2-CE1 3.94Å; T322-Y336 VanDerWaalsContact O-CE1 3.26Å; T322-Y336 WeakPolarHBondContact O-CE1 3.48Å; T322-Y336 PolarHBondContact O-OH 3.45Å; F323-Y336 HydrophobicContact CB-CD1 4.22Å; F323-Y336 HydrophobicContact CB-CE1 3.89Å; Y336-R338 HydrophobicContact CD2-CG 4.18Å; Y336-R338 HydrophobicContact CE2-CG 3.96Å; Y336-I343 HydrophobicContact CD2-CB 3.64Å; Y336-I343 HydrophobicContact CD2-CG2 3.45Å; Y336-I343 VanDerWaalsContact CD2-CG2 3.45Å; Y336-I343 HydrophobicContact CE2-CB 4.17Å; Y336-I343 HydrophobicContact CE2-CG2 3.47Å; Y336-I343 VanDerWaalsContact CE2-CG2 3.47Å; Y336-I343 HydrophobicContact CG-CB 3.99Å; Y336-I343 HydrophobicContact CG-CD1 4.48Å; Y336-I343 HydrophobicContact CG-CG2 4.23Å; Y336-V344 CarbonylContact C-O 3.2Å; Y336-V344 VanDerWaalsContact CA-O 3.3Å; Y336-V344 WeakPolarHBondContact CA-O 3.35Å; Y336-V344 VanDerWaalsContact CB-O 3.32Å; Y336-V344 WeakPolarHBondContact CB-O 3.38Å
337	V	92.6	Very high	92.1	Very high	37 Å²	37	63.7 Å²	63.7	22%	0.224	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	139.9	167.5	-178	0	0	0	0	108.3	I343 V344 A349 M356	V337-I343 WeakPolarHBondContact O-CA 3.32Å; V337-V344 PolarHBondContact N-O 2.89Å; V337-V344 PolarHBondContact O-N 2.8Å; V337-A349 HydrophobicContact CB-CB 3.99Å; V337-A349 HydrophobicContact CG2-CB 3.65Å; V337-M356 HydrophobicContact CG2-CE 3.97Å; V337-M356 HydrophobicContact CG2-SD 3.99Å
338	R	90.3	Very high	92.6	Very high	183 Å²	183	58.4 Å²	58.4	69%	0.691	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.3	172.5	-72.8	-175.7	174.5	-127.5	-6.8	109.8	Y336 D342 I343	Y336-R338 HydrophobicContact CD2-CG 4.18Å; Y336-R338 HydrophobicContact CE2-CG 3.96Å; R338-D342 WeakPolarHBondContact CA-O 3.43Å; R338-I343 HydrophobicContact CG-CG2 4.35Å
339	Q	88.1	Confident	93	Very high	93 Å²	93	55.9 Å²	55.9	44%	0.435	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	91.1	172.2	-63.6	-157.6	29.4	0	0	108.6	A341 D342 V344 E352	Q339-A341 PolarHBondContact O-N 3.36Å; Q339-A341 VanDerWaalsContact O-N 3.16Å; Q339-D342 PolarHBondContact N-O 3.2Å; Q339-D342 PolarHBondContact O-N 3.02Å; Q339-D342 VanDerWaalsContact O-N 3.07Å; Q339-V344 HydrophobicContact CB-CG2 4.18Å; Q339-V344 HydrophobicContact CG-CB 4.47Å; Q339-V344 HydrophobicContact CG-CG2 3.76Å; Q339-E352 PolarHBondContact NE2-OE2 3.04Å; Q339-E352 VanDerWaalsContact NE2-OE2 3.11Å
340	G	88.4	Confident	93.1	Very high	80 Å²	80	49 Å²	49	83%	0.825	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	-112	-175.7	0	0	0	0	0	112.6
341	A	87.8	Confident	93.2	Very high	101 Å²	101	47.2 Å²	47.2	84%	0.835	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-19.2	175.7	0	0	0	0	0	112.9	Q339	Q339-A341 PolarHBondContact O-N 3.36Å; Q339-A341 VanDerWaalsContact O-N 3.16Å
342	D	90.8	Very high	93	Very high	116 Å²	116	48.8 Å²	48.8	62%	0.62	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	160.7	-172	-58.1	-59.8	0	0	0	111.6	R338 Q339	R338-D342 WeakPolarHBondContact CA-O 3.43Å; Q339-D342 PolarHBondContact N-O 3.2Å; Q339-D342 PolarHBondContact O-N 3.02Å; Q339-D342 VanDerWaalsContact O-N 3.07Å
343	I	93.8	Very high	92.9	Very high	59 Å²	59	51.9 Å²	51.9	30%	0.303	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136.6	173.6	63.5	174.5	0	0	0	108.8	F290 F323 Y336 V337 R338	F290-I343 HydrophobicContact CE1-CD1 3.88Å; F290-I343 HydrophobicContact CE1-CG1 4.2Å; F290-I343 HydrophobicContact CZ-CD1 3.85Å; F290-I343 HydrophobicContact CZ-CG1 4.09Å; F323-I343 HydrophobicContact CB-CD1 3.53Å; F323-I343 HydrophobicContact CD2-CD1 4.28Å; F323-I343 HydrophobicContact CG-CD1 4.19Å; Y336-I343 HydrophobicContact CD2-CB 3.64Å; Y336-I343 HydrophobicContact CD2-CG2 3.45Å; Y336-I343 VanDerWaalsContact CD2-CG2 3.45Å; Y336-I343 HydrophobicContact CE2-CB 4.17Å; Y336-I343 HydrophobicContact CE2-CG2 3.47Å; Y336-I343 VanDerWaalsContact CE2-CG2 3.47Å; Y336-I343 HydrophobicContact CG-CB 3.99Å; Y336-I343 HydrophobicContact CG-CD1 4.48Å; Y336-I343 HydrophobicContact CG-CG2 4.23Å; V337-I343 WeakPolarHBondContact O-CA 3.32Å; R338-I343 HydrophobicContact CG-CG2 4.35Å
344	V	94.1	Very high	92.6	Very high	17 Å²	17	55.8 Å²	55.8	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.8	-179.2	-178.9	0	0	0	0	108.2	Y336 V337 Q339 E348 A349	Y336-V344 CarbonylContact C-O 3.2Å; Y336-V344 VanDerWaalsContact CA-O 3.3Å; Y336-V344 WeakPolarHBondContact CA-O 3.35Å; Y336-V344 VanDerWaalsContact CB-O 3.32Å; Y336-V344 WeakPolarHBondContact CB-O 3.38Å; V337-V344 PolarHBondContact N-O 2.89Å; V337-V344 PolarHBondContact O-N 2.8Å; Q339-V344 HydrophobicContact CB-CG2 4.18Å; Q339-V344 HydrophobicContact CG-CB 4.47Å; Q339-V344 HydrophobicContact CG-CG2 3.76Å; V344-E348 HydrophobicContact CG1-CB 3.94Å; V344-E348 HydrophobicContact CG1-CG 3.86Å; V344-A349 HydrophobicContact CG1-CB 4.05Å
345	P	95.4	Very high	92.4	Very high	7 Å²	7	64.8 Å²	64.8	5%	0.045	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-43.6	141.2	170.1	-32.3	36.4	0	0	0	113.2	D289 F290 G347 E348 A349	D289-P345 HydrophobicContact CB-CG 4.18Å; F290-P345 HydrophobicContact CD1-CB 4.48Å; F290-P345 HydrophobicContact CD1-CG 4.09Å; F290-P345 HydrophobicContact CD2-CG 4.36Å; F290-P345 HydrophobicContact CE1-CG 4.12Å; F290-P345 HydrophobicContact CE2-CG 4.39Å; F290-P345 HydrophobicContact CG-CG 4.21Å; F290-P345 HydrophobicContact CZ-CG 4.27Å; P345-G347 VanDerWaalsContact C-N 3.27Å; P345-G347 PolarHBondContact O-N 2.81Å; P345-E348 HydrophobicContact CB-CB 4.13Å; P345-E348 WeakPolarHBondContact CD-OE2 3.22Å; P345-E348 PolarHBondContact O-N 3.21Å; P345-A349 PolarHBondContact O-N 2.73Å
346	V	95.6	Very high	92.1	Very high	1 Å²	1	67 Å²	67	1%	0.006	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-37.5	-179.5	173.7	0	0	0	0	111.8	F308 I312 T335 L350 L358	F308-V346 HydrophobicContact CZ-CG1 4.06Å; I312-V346 HydrophobicContact CD1-CB 3.8Å; I312-V346 HydrophobicContact CD1-CG1 4.14Å; I312-V346 HydrophobicContact CD1-CG2 4.22Å; T335-V346 WeakPolarHBondContact OG1-CG2 3.49Å; V346-L350 HydrophobicContact CG1-CD1 3.91Å; V346-L350 HydrophobicContact CG1-CG 4.27Å; V346-L350 WeakPolarHBondContact O-CB 3.42Å; V346-L350 VanDerWaalsContact O-CG 3.25Å; V346-L350 WeakPolarHBondContact O-CG 3.47Å; V346-L350 PolarHBondContact O-N 3.32Å; V346-L358 HydrophobicContact CG1-CD1 3.64Å; V346-L358 HydrophobicContact CG1-CD2 3.88Å; V346-L358 HydrophobicContact CG1-CG 4.41Å
347	G	95.1	Very high	91.6	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.01	39%	0.39	C	S	.	.	H	α-helix	trans	-61.6	-44.7	176.3	0	0	0	0	0	113.2	M292 P345 L350 L351	M292-G347 WeakPolarHBondContact O-CA 3.36Å; P345-G347 VanDerWaalsContact C-N 3.27Å; P345-G347 PolarHBondContact O-N 2.81Å; G347-L350 PolarHBondContact O-N 2.99Å; G347-L351 WeakPolarHBondContact O-CB 3.35Å; G347-L351 PolarHBondContact O-N 3.46Å
348	E	94.6	Very high	91.2	Very high	69 Å²	69	70.4 Å²	70.4	32%	0.322	39%	0.386	S	S	.	.	H	α-helix	trans	-64.9	-48.8	177	-176.5	179.1	-177.1	0	0	111.3	V344 P345 L350 L351 E352	V344-E348 HydrophobicContact CG1-CB 3.94Å; V344-E348 HydrophobicContact CG1-CG 3.86Å; P345-E348 HydrophobicContact CB-CB 4.13Å; P345-E348 WeakPolarHBondContact CD-OE2 3.22Å; P345-E348 PolarHBondContact O-N 3.21Å; E348-L350 VanDerWaalsContact C-N 3.26Å; E348-L350 PolarHBondContact O-N 3.21Å; E348-L351 WeakPolarHBondContact O-CA 3.49Å; E348-L351 WeakPolarHBondContact O-CB 3.28Å; E348-L351 PolarHBondContact O-N 2.84Å; E348-E352 PolarHBondContact O-N 2.83Å
349	A	94.5	Very high	90.8	Very high	4 Å²	4	67.8 Å²	67.8	3%	0.033	39%	0.386	C	S	.	.	H	α-helix	trans	-63.4	-30.2	179	0	0	0	0	0	113.3	V337 V344 P345 N353 M356	V337-A349 HydrophobicContact CB-CB 3.99Å; V337-A349 HydrophobicContact CG2-CB 3.65Å; V344-A349 HydrophobicContact CG1-CB 4.05Å; P345-A349 PolarHBondContact O-N 2.73Å; A349-N353 PolarHBondContact O-N 2.83Å; A349-N353 VanDerWaalsContact O-N 3.08Å; A349-M356 HydrophobicContact CB-CE 3.7Å; A349-M356 HydrophobicContact CB-SD 4.46Å
350	L	94.3	Very high	90.4	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-76.2	-29.7	172.1	-75	176.2	0	0	0	113.1	P294 F308 V346 G347 E348 N353 P354 M356 L358 V382	P294-L350 HydrophobicContact CG-CB 3.79Å; P294-L350 HydrophobicContact CG-CD1 4.25Å; F308-L350 HydrophobicContact CE2-CD1 3.79Å; F308-L350 HydrophobicContact CZ-CD1 4.03Å; V346-L350 HydrophobicContact CG1-CD1 3.91Å; V346-L350 HydrophobicContact CG1-CG 4.27Å; V346-L350 WeakPolarHBondContact O-CB 3.42Å; V346-L350 VanDerWaalsContact O-CG 3.25Å; V346-L350 WeakPolarHBondContact O-CG 3.47Å; V346-L350 PolarHBondContact O-N 3.32Å; G347-L350 PolarHBondContact O-N 2.99Å; E348-L350 VanDerWaalsContact C-N 3.26Å; E348-L350 PolarHBondContact O-N 3.21Å; L350-N353 CarbonylContact O-C 3.46Å; L350-P354 VanDerWaalsContact O-CA 3.26Å; L350-P354 WeakPolarHBondContact O-CA 3.3Å; L350-P354 VanDerWaalsContact O-N 3.09Å; L350-M356 HydrophobicContact CD2-CB 4.32Å; L350-M356 HydrophobicContact CD2-CE 3.52Å; L350-M356 HydrophobicContact CG-CE 3.83Å; L350-L358 HydrophobicContact CD1-CD1 4.07Å; L350-L358 HydrophobicContact CD2-CD1 4.46Å; L350-L358 HydrophobicContact CD2-CD2 4.23Å; L350-L358 HydrophobicContact CD2-CG 4.12Å; L350-V382 HydrophobicContact CB-CG2 4.12Å; L350-V382 HydrophobicContact CD1-CG2 4.19Å; L350-V382 HydrophobicContact CD2-CG2 3.73Å; L350-V382 HydrophobicContact CG-CG2 4.23Å
351	L	92.9	Very high	89.7	Confident	63 Å²	63	62.8 Å²	62.8	33%	0.33	35%	0.347	S	S	.	.	H	α-helix	trans	-69.3	-44.4	172.6	-174	67.2	0	0	0	110.8	P294 W297 E298 G347 E348 N353	P294-L351 HydrophobicContact CB-CB 4.18Å; P294-L351 HydrophobicContact CB-CD1 4.39Å; W297-L351 HydrophobicContact CB-CD2 3.72Å; W297-L351 HydrophobicContact CG-CD2 4.15Å; E298-L351 HydrophobicContact CG-CD1 4.2Å; G347-L351 WeakPolarHBondContact O-CB 3.35Å; G347-L351 PolarHBondContact O-N 3.46Å; E348-L351 WeakPolarHBondContact O-CA 3.49Å; E348-L351 WeakPolarHBondContact O-CB 3.28Å; E348-L351 PolarHBondContact O-N 2.84Å; L351-N353 VanDerWaalsContact C-N 3.35Å
352	E	92.9	Very high	88.9	Confident	126 Å²	126	62.3 Å²	62.3	59%	0.589	33%	0.327	S	S	*	.	H	α-helix	trans	-63.2	-38.9	174.3	-67.9	-168.9	133.8	0	0	112.4	Q339 E348	Q339-E352 PolarHBondContact NE2-OE2 3.04Å; Q339-E352 VanDerWaalsContact NE2-OE2 3.11Å; E348-E352 PolarHBondContact O-N 2.83Å
353	N	92.6	Very high	88	Confident	80 Å²	80	62.2 Å²	62.2	43%	0.428	32%	0.321	S	S	.	.			trans	-135.3	84.5	-179.8	-175.2	3.4	0	0	0	112.3	A349 L350 L351 K355 M356	A349-N353 PolarHBondContact O-N 2.83Å; A349-N353 VanDerWaalsContact O-N 3.08Å; L350-N353 CarbonylContact O-C 3.46Å; L351-N353 VanDerWaalsContact C-N 3.35Å; N353-K355 PolarHBondContact O-N 3.04Å; N353-K355 PolarHBondContact OD1-N 2.89Å; N353-M356 HydrophobicContact CB-CB 4.16Å; N353-M356 WeakPolarHBondContact O-CB 3.3Å; N353-M356 PolarHBondContact O-N 3.08Å; N353-M356 PolarHBondContact OD1-N 3.01Å
354	P	90.1	Very high	86.6	Confident	83 Å²	83	71.8 Å²	71.8	54%	0.539	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-10.5	178.7	-28.3	37.5	0	0	0	115.5	L350 V382	L350-P354 VanDerWaalsContact O-CA 3.26Å; L350-P354 WeakPolarHBondContact O-CA 3.3Å; L350-P354 VanDerWaalsContact O-N 3.09Å; P354-V382 HydrophobicContact CB-CG1 4.21Å
355	K	87.9	Confident	85.3	Confident	190 Å²	190	80.8 Å²	80.8	83%	0.826	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	2.2	175.8	-63.1	-177.7	-178.2	177.3	0	112.9	N353 V357	N353-K355 PolarHBondContact O-N 3.04Å; N353-K355 PolarHBondContact OD1-N 2.89Å; K355-V357 PolarHBondContact O-N 2.9Å
356	M	88.4	Confident	84.1	Confident	46 Å²	46	81.9 Å²	81.9	23%	0.227	40%	0.399	C	S	.	.			trans	-65.1	120.8	176	-179.9	176.2	58.3	0	0	110.2	V337 A349 L350 N353 L358	V337-M356 HydrophobicContact CG2-CE 3.97Å; V337-M356 HydrophobicContact CG2-SD 3.99Å; A349-M356 HydrophobicContact CB-CE 3.7Å; A349-M356 HydrophobicContact CB-SD 4.46Å; L350-M356 HydrophobicContact CD2-CB 4.32Å; L350-M356 HydrophobicContact CD2-CE 3.52Å; L350-M356 HydrophobicContact CG-CE 3.83Å; N353-M356 HydrophobicContact CB-CB 4.16Å; N353-M356 WeakPolarHBondContact O-CB 3.3Å; N353-M356 PolarHBondContact O-N 3.08Å; N353-M356 PolarHBondContact OD1-N 3.01Å; M356-L358 HydrophobicContact CE-CD2 3.81Å; M356-L358 PolarHBondContact O-N 2.83Å
357	V	84.2	Confident	83.1	Confident	130 Å²	130	83.8 Å²	83.8	79%	0.788	41%	0.413	S	S	*	.			trans	-82.6	112.3	172.1	-179.4	0	0	0	0	108.7	K355 N359	K355-V357 PolarHBondContact O-N 2.9Å; V357-N359 PolarHBondContact O-N 2.88Å
358	L	83.5	Confident	82.6	Confident	27 Å²	27	84 Å²	84	14%	0.141	41%	0.413	C	S	.	.			trans	-66.4	104.9	171.6	-66.6	-178.2	0	0	0	110.4	V346 L350 M356 I360 L380	V346-L358 HydrophobicContact CG1-CD1 3.64Å; V346-L358 HydrophobicContact CG1-CD2 3.88Å; V346-L358 HydrophobicContact CG1-CG 4.41Å; L350-L358 HydrophobicContact CD1-CD1 4.07Å; L350-L358 HydrophobicContact CD2-CD1 4.46Å; L350-L358 HydrophobicContact CD2-CD2 4.23Å; L350-L358 HydrophobicContact CD2-CG 4.12Å; M356-L358 HydrophobicContact CE-CD2 3.81Å; M356-L358 PolarHBondContact O-N 2.83Å; L358-I360 PolarHBondContact O-N 2.85Å; L358-L380 HydrophobicContact CD1-CB 3.9Å; L358-L380 HydrophobicContact CD1-CD1 4.15Å
359	N	81.1	Confident	82.3	Confident	129 Å²	129	83 Å²	83	69%	0.69	41%	0.414	S	S	*	.			trans	-76.9	102.7	167.1	-174.4	9	0	0	0	108.9	V357 P361	V357-N359 PolarHBondContact O-N 2.88Å; N359-P361 WeakPolarHBondContact O-CD 3.49Å
360	I	81.4	Confident	82.1	Confident	1 Å²	1	88.3 Å²	88.3	1%	0.005	44%	0.442	C	S	.	.			trans	-79.1	103.3	171.4	-60.1	-178.6	0	0	0	107.6	W315 L358 M368 K373 L376 Q377	W315-I360 HydrophobicContact CD2-CG1 4.38Å; W315-I360 HydrophobicContact CD2-CG2 4.36Å; W315-I360 HydrophobicContact CE3-CG1 4.46Å; W315-I360 HydrophobicContact CG-CG2 4.47Å; W315-I360 HydrophobicContact CH2-CG1 4.27Å; W315-I360 HydrophobicContact CZ2-CB 4.35Å; W315-I360 HydrophobicContact CZ2-CG1 4.18Å; W315-I360 HydrophobicContact CZ2-CG2 4.41Å; W315-I360 HydrophobicContact CZ3-CG1 4.41Å; L358-I360 PolarHBondContact O-N 2.85Å; I360-M368 HydrophobicContact CG2-CE 4.12Å; I360-M368 HydrophobicContact CG2-SD 3.87Å; I360-K373 HydrophobicContact CB-CG 4.39Å; I360-K373 HydrophobicContact CG2-CG 4.28Å; I360-K373 WeakPolarHBondContact O-CE 3.23Å; I360-L376 HydrophobicContact CD1-CB 3.65Å; I360-Q377 HydrophobicContact CD1-CG 3.96Å
361	P	73.8	Confident	82	Confident	67 Å²	67	89.6 Å²	89.6	44%	0.435	46%	0.455	S	S	.	.			trans	-82.9	123.9	-174.2	33.9	-28.8	0	0	0	109.1	N359	N359-P361 WeakPolarHBondContact O-CD 3.49Å
362	Q	69.3	Low	82	Confident	90 Å²	90	86.9 Å²	86.9	42%	0.421	44%	0.442	S	S	.	.			trans	-89.2	114.1	174.8	-168.7	-177.8	13.3	0	0	108.2	M368	Q362-M368 PolarHBondContact NE2-O 2.73Å
363	K	72.7	Confident	82	Confident	115 Å²	115	83.3 Å²	83.3	50%	0.5	42%	0.424	S	S	.	.			trans	-63.3	151.5	174.4	-73.8	171.1	-165.8	178.3	0	110	E319 K365 S366	E319-K363 WeakPolarHBondContact O-CE 3.32Å; E319-K363 PolarHBondContact O-NZ 3.01Å; E319-K363 PolarHBondContact OE1-N 2.79Å; E319-K363 WeakPolarHBondContact OE2-CB 3.33Å; E319-K363 WeakPolarHBondContact OE2-CD 3.05Å; E319-K363 WeakPolarHBondContact OE2-CE 3.49Å; E319-K363 WeakPolarHBondContact OE2-CG 3.18Å; E319-K363 PolarHBondContact OE2-N 2.97Å; K363-K365 PolarHBondContact O-N 3.38Å; K363-S366 WeakPolarHBondContact O-CB 3.49Å; K363-S366 PolarHBondContact O-N 3.29Å
364	R	64.6	Low	82.1	Confident	260 Å²	260	84.5 Å²	84.5	98%	0.981	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-9.8	178.9	-74	-172.8	177	-174.4	-0.9	115.6
365	K	65.7	Low	82.4	Confident	206 Å²	206	80.7 Å²	80.7	90%	0.896	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	23.8	174.5	-62.7	-171.5	176.9	-173.2	0	111.8	K363	K363-K365 PolarHBondContact O-N 3.38Å
366	S	72.1	Confident	82.8	Confident	29 Å²	29	71.8 Å²	71.8	20%	0.203	36%	0.362	C	S	.	.			trans	-67.2	143.5	176.8	-175.8	0	0	0	0	110.5	E319 K363 M368	E319-S366 WeakPolarHBondContact OE1-CB 3.33Å; E319-S366 PolarHBondContact OE1-OG 2.84Å; K363-S366 WeakPolarHBondContact O-CB 3.49Å; K363-S366 PolarHBondContact O-N 3.29Å; S366-M368 VanDerWaalsContact C-N 3.31Å; S366-M368 VanDerWaalsContact OG-CB 3.29Å; S366-M368 WeakPolarHBondContact OG-CB 3.47Å; S366-M368 PolarHBondContact OG-N 3.12Å
367	S	73	Confident	83.1	Confident	42 Å²	42	73.4 Å²	73.4	29%	0.294	37%	0.369	S	S	.	.			trans	-87.3	-0.5	168.7	59.7	0	0	0	0	113.1	S369	S367-S369 PolarHBondContact O-N 2.82Å
368	M	85.9	Confident	83.7	Confident	5 Å²	5	68.3 Å²	68.3	3%	0.025	34%	0.337	C	S	.	.			trans	-72.5	122.2	178.8	-170.5	-174.3	-62.4	0	0	110.3	L318 E319 I360 Q362 S366 V372 K373 L376	L318-M368 HydrophobicContact CB-CE 4.08Å; L318-M368 HydrophobicContact CD1-CB 4.4Å; L318-M368 HydrophobicContact CD1-CE 3.87Å; L318-M368 HydrophobicContact CD1-CG 4.25Å; E319-M368 HydrophobicContact CG-CE 3.98Å; I360-M368 HydrophobicContact CG2-CE 4.12Å; I360-M368 HydrophobicContact CG2-SD 3.87Å; Q362-M368 PolarHBondContact NE2-O 2.73Å; S366-M368 VanDerWaalsContact C-N 3.31Å; S366-M368 VanDerWaalsContact OG-CB 3.29Å; S366-M368 WeakPolarHBondContact OG-CB 3.47Å; S366-M368 PolarHBondContact OG-N 3.12Å; M368-V372 HydrophobicContact CG-CB 4.09Å; M368-V372 HydrophobicContact CG-CG1 3.9Å; M368-K373 HydrophobicContact CG-CB 4.32Å; M368-K373 HydrophobicContact SD-CB 3.86Å; M368-K373 HydrophobicContact SD-CG 4.3Å; M368-L376 HydrophobicContact CE-CD1 3.54Å; M368-L376 HydrophobicContact SD-CD1 3.86Å
369	S	88.5	Confident	84.4	Confident	47 Å²	47	67 Å²	67	33%	0.329	33%	0.331	S	S	.	.			trans	-81.2	161.1	170.7	70.2	0	0	0	0	111.5	S367 G371 V372 K373	S367-S369 PolarHBondContact O-N 2.82Å; S369-G371 PolarHBondContact O-N 3.44Å; S369-V372 PolarHBondContact O-N 3.46Å; S369-V372 VanDerWaalsContact O-N 3.15Å; S369-V372 WeakPolarHBondContact OG-CG2 3.34Å; S369-V372 PolarHBondContact OG-N 3.35Å; S369-K373 PolarHBondContact O-N 3.34Å
370	D	89.4	Confident	85.2	Confident	116 Å²	116	61.2 Å²	61.2	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-59.6	-32.1	175.9	-72.7	-48.2	0	0	0	112.6	K373 K374	D370-K373 PolarHBondContact O-N 2.95Å; D370-K374 WeakPolarHBondContact O-CB 3.41Å; D370-K374 PolarHBondContact O-N 2.92Å
371	G	92.5	Very high	85.8	Confident	29 Å²	29	62.4 Å²	62.4	30%	0.299	31%	0.308	S	S	.	.	H	α-helix	trans	-66.5	-43.8	174.5	0	0	0	0	0	112.8	S369 K373 K374 L375	S369-G371 PolarHBondContact O-N 3.44Å; G371-K373 VanDerWaalsContact C-N 3.34Å; G371-K374 PolarHBondContact O-N 3.4Å; G371-L375 WeakPolarHBondContact O-CB 3.33Å; G371-L375 PolarHBondContact O-N 3.13Å
372	V	93.2	Very high	86.8	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-40	173.7	174.1	0	0	0	0	110.6	M208 L318 M368 S369 K374 L375 L376 L400	M208-V372 HydrophobicContact CE-CG2 4.44Å; M208-V372 HydrophobicContact SD-CG1 4.13Å; L318-V372 HydrophobicContact CD1-CG1 3.76Å; M368-V372 HydrophobicContact CG-CB 4.09Å; M368-V372 HydrophobicContact CG-CG1 3.9Å; S369-V372 PolarHBondContact O-N 3.46Å; S369-V372 VanDerWaalsContact O-N 3.15Å; S369-V372 WeakPolarHBondContact OG-CG2 3.34Å; S369-V372 PolarHBondContact OG-N 3.35Å; V372-K374 PolarHBondContact O-N 3.21Å; V372-L375 PolarHBondContact O-N 3.23Å; V372-L376 HydrophobicContact CG1-CD1 4.28Å; V372-L376 HydrophobicContact CG1-CG 4.49Å; V372-L376 WeakPolarHBondContact O-CG 3.35Å; V372-L376 PolarHBondContact O-N 2.65Å; V372-L400 HydrophobicContact CG2-CB 4.37Å; V372-L400 HydrophobicContact CG2-CD1 4.13Å
373	K	93.3	Very high	87.9	Confident	50 Å²	50	60.4 Å²	60.4	22%	0.217	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-43.4	174.8	-176.9	178.4	-179.9	177.1	0	112.1	I360 M368 S369 D370 G371 L376 Q377	I360-K373 HydrophobicContact CB-CG 4.39Å; I360-K373 HydrophobicContact CG2-CG 4.28Å; I360-K373 WeakPolarHBondContact O-CE 3.23Å; M368-K373 HydrophobicContact CG-CB 4.32Å; M368-K373 HydrophobicContact SD-CB 3.86Å; M368-K373 HydrophobicContact SD-CG 4.3Å; S369-K373 PolarHBondContact O-N 3.34Å; D370-K373 PolarHBondContact O-N 2.95Å; G371-K373 VanDerWaalsContact C-N 3.34Å; K373-L376 PolarHBondContact O-N 2.76Å; K373-Q377 WeakPolarHBondContact O-CG 2.84Å; K373-Q377 PolarHBondContact O-N 3.19Å; K373-Q377 VanDerWaalsContact O-N 3.1Å
374	K	94.2	Very high	89	Confident	106 Å²	106	56.2 Å²	56.2	46%	0.461	28%	0.283	S	S	.	.	H	α-helix	trans	-66.8	-40.4	175.9	179.1	53.1	-178.5	145.4	0	111.7	D370 G371 V372 L376 Q377 D378	D370-K374 WeakPolarHBondContact O-CB 3.41Å; D370-K374 PolarHBondContact O-N 2.92Å; G371-K374 PolarHBondContact O-N 3.4Å; V372-K374 PolarHBondContact O-N 3.21Å; K374-L376 PolarHBondContact O-N 3.19Å; K374-Q377 WeakPolarHBondContact O-CB 3.4Å; K374-Q377 PolarHBondContact O-N 3.06Å; K374-D378 WeakPolarHBondContact CE-OD1 3.48Å; K374-D378 IonicContact NZ-OD1 3.52Å; K374-D378 PolarHBondContact NZ-OD1 3.08Å; K374-D378 IonicContact NZ-OD2 3.39Å; K374-D378 PolarHBondContact O-N 2.87Å; K374-D378 VanDerWaalsContact O-N 3.12Å
375	L	96.1	Very high	90.3	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-42.4	174.7	-175.5	57.6	0	0	0	111.8	G371 V372 Q377 D378 M379 L393 R396 M397 L400	G371-L375 WeakPolarHBondContact O-CB 3.33Å; G371-L375 PolarHBondContact O-N 3.13Å; V372-L375 PolarHBondContact O-N 3.23Å; L375-Q377 VanDerWaalsContact C-N 3.33Å; L375-Q377 PolarHBondContact O-N 3.06Å; L375-D378 PolarHBondContact O-N 2.9Å; L375-M379 HydrophobicContact CG-SD 4.15Å; L375-M379 VanDerWaalsContact O-CG 3.24Å; L375-M379 WeakPolarHBondContact O-CG 3.4Å; L375-M379 PolarHBondContact O-N 2.97Å; L375-L393 HydrophobicContact CD1-CD1 3.86Å; L375-L393 HydrophobicContact CD2-CD1 3.99Å; L375-L393 HydrophobicContact CG-CD1 4.02Å; L375-R396 HydrophobicContact CD1-CB 4.2Å; L375-R396 HydrophobicContact CD2-CB 4.39Å; L375-M397 HydrophobicContact CD2-CB 4.39Å; L375-M397 HydrophobicContact CD2-CE 3.69Å; L375-M397 HydrophobicContact CD2-SD 4.27Å; L375-L400 HydrophobicContact CB-CD1 4.21Å; L375-L400 HydrophobicContact CD2-CD1 3.83Å
376	L	96.1	Very high	91.8	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-37.3	174.2	-75.3	172.2	0	0	0	113.1	G311 I314 W315 I360 M368 V372 K373 K374 M379 L380	G311-L376 WeakPolarHBondContact O-CD2 3.22Å; I314-L376 HydrophobicContact CB-CD2 4.08Å; I314-L376 HydrophobicContact CG2-CD2 3.94Å; W315-L376 HydrophobicContact CB-CD1 4.03Å; W315-L376 HydrophobicContact CB-CD2 4.17Å; W315-L376 HydrophobicContact CG-CD1 4.43Å; I360-L376 HydrophobicContact CD1-CB 3.65Å; M368-L376 HydrophobicContact CE-CD1 3.54Å; M368-L376 HydrophobicContact SD-CD1 3.86Å; V372-L376 HydrophobicContact CG1-CD1 4.28Å; V372-L376 HydrophobicContact CG1-CG 4.49Å; V372-L376 WeakPolarHBondContact O-CG 3.35Å; V372-L376 PolarHBondContact O-N 2.65Å; K373-L376 PolarHBondContact O-N 2.76Å; K374-L376 PolarHBondContact O-N 3.19Å; L376-M379 HydrophobicContact CD2-SD 4.32Å; L376-L380 WeakPolarHBondContact O-CB 3.46Å; L376-L380 VanDerWaalsContact O-CG 3.28Å; L376-L380 WeakPolarHBondContact O-CG 3.45Å; L376-L380 PolarHBondContact O-N 3.33Å
377	Q	95.4	Very high	93	Very high	80 Å²	80	43.2 Å²	43.2	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-61.8	-44	173.2	-71.3	174.7	-28.1	0	0	111.5	I360 K373 K374 L375 L380 S381	I360-Q377 HydrophobicContact CD1-CG 3.96Å; K373-Q377 WeakPolarHBondContact O-CG 2.84Å; K373-Q377 PolarHBondContact O-N 3.19Å; K373-Q377 VanDerWaalsContact O-N 3.1Å; K374-Q377 WeakPolarHBondContact O-CB 3.4Å; K374-Q377 PolarHBondContact O-N 3.06Å; L375-Q377 VanDerWaalsContact C-N 3.33Å; L375-Q377 PolarHBondContact O-N 3.06Å; Q377-L380 PolarHBondContact O-N 2.92Å; Q377-S381 PolarHBondContact O-N 2.83Å; Q377-S381 PolarHBondContact O-OG 3.2Å
378	D	96.8	Very high	94.1	Very high	24 Å²	24	41.3 Å²	41.3	13%	0.128	22%	0.223	C	C	.	.	H	α-helix	trans	-66.3	-43.1	179.7	-60.9	-13	0	0	0	110.9	K374 L375 L380 S381 R387 R396	K374-D378 WeakPolarHBondContact CE-OD1 3.48Å; K374-D378 IonicContact NZ-OD1 3.52Å; K374-D378 PolarHBondContact NZ-OD1 3.08Å; K374-D378 IonicContact NZ-OD2 3.39Å; K374-D378 PolarHBondContact O-N 2.87Å; K374-D378 VanDerWaalsContact O-N 3.12Å; L375-D378 PolarHBondContact O-N 2.9Å; D378-L380 VanDerWaalsContact C-N 3.3Å; D378-L380 PolarHBondContact O-N 2.92Å; D378-S381 WeakPolarHBondContact O-CB 3.41Å; D378-S381 PolarHBondContact O-N 3.18Å; D378-S381 PolarHBondContact O-OG 2.99Å; D378-R387 WeakPolarHBondContact O-CA 3.23Å; D378-R387 WeakPolarHBondContact O-CG 3.49Å; D378-R396 IonicContact OD2-CZ 2.72Å; D378-R396 IonicContact OD2-NH1 3.13Å; D378-R396 PolarHBondContact OD2-NH1 3.12Å; D378-R396 IonicContact OD2-NH2 2.75Å; D378-R396 PolarHBondContact OD2-NH2 3.37Å
379	M	97.9	Very high	94.7	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-34.3	175.7	-67.3	171.1	76.6	0	0	113.5	I307 L310 G311 I314 L375 L376 R387 P388 L393	I307-M379 HydrophobicContact CG2-CB 4.26Å; I307-M379 HydrophobicContact CG2-CG 4.12Å; I307-M379 WeakPolarHBondContact O-CE 3.46Å; L310-M379 HydrophobicContact CB-CE 3.57Å; G311-M379 VanDerWaalsContact N-CE 3.32Å; I314-M379 HydrophobicContact CD1-CE 4.28Å; L375-M379 HydrophobicContact CG-SD 4.15Å; L375-M379 VanDerWaalsContact O-CG 3.24Å; L375-M379 WeakPolarHBondContact O-CG 3.4Å; L375-M379 PolarHBondContact O-N 2.97Å; L376-M379 HydrophobicContact CD2-SD 4.32Å; M379-R387 VanDerWaalsContact O-CD 3.25Å; M379-R387 WeakPolarHBondContact O-CD 3.4Å; M379-P388 HydrophobicContact CG-CG 4.34Å; M379-L393 HydrophobicContact CE-CD1 3.88Å; M379-L393 HydrophobicContact CE-CD2 3.76Å; M379-L393 HydrophobicContact CE-CG 4.48Å; M379-L393 HydrophobicContact CG-CD1 3.92Å; M379-L393 HydrophobicContact SD-CD1 3.51Å; M379-L393 VanDerWaalsContact SD-CD1 3.51Å; M379-L393 HydrophobicContact SD-CD2 4.48Å
380	L	96.8	Very high	95.1	Very high	6 Å²	6	41.9 Å²	41.9	3%	0.031	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	15.1	-178.3	-62.8	173	0	0	0	113.3	F308 I312 W315 L358 L376 Q377 D378	F308-L380 HydrophobicContact CD1-CD2 4.33Å; F308-L380 HydrophobicContact CD2-CD2 3.86Å; F308-L380 HydrophobicContact CE1-CD2 4.28Å; F308-L380 HydrophobicContact CE2-CB 4.32Å; F308-L380 HydrophobicContact CE2-CD2 3.79Å; F308-L380 HydrophobicContact CG-CD2 4.14Å; F308-L380 HydrophobicContact CZ-CD2 4.01Å; I312-L380 HydrophobicContact CD1-CD2 3.66Å; I312-L380 HydrophobicContact CG1-CD2 4.03Å; W315-L380 HydrophobicContact CE3-CD1 3.65Å; W315-L380 HydrophobicContact CZ3-CD1 4.05Å; L358-L380 HydrophobicContact CD1-CB 3.9Å; L358-L380 HydrophobicContact CD1-CD1 4.15Å; L376-L380 WeakPolarHBondContact O-CB 3.46Å; L376-L380 VanDerWaalsContact O-CG 3.28Å; L376-L380 WeakPolarHBondContact O-CG 3.45Å; L376-L380 PolarHBondContact O-N 3.33Å; Q377-L380 PolarHBondContact O-N 2.92Å; D378-L380 VanDerWaalsContact C-N 3.3Å; D378-L380 PolarHBondContact O-N 2.92Å
381	S	95.4	Very high	95.5	Very high	27 Å²	27	41.6 Å²	41.6	19%	0.189	22%	0.22	C	C	.	.			trans	-58.2	135.9	174.9	-59.6	0	0	0	0	111.5	Q377 D378 R387	Q377-S381 PolarHBondContact O-N 2.83Å; Q377-S381 PolarHBondContact O-OG 3.2Å; D378-S381 WeakPolarHBondContact O-CB 3.41Å; D378-S381 PolarHBondContact O-N 3.18Å; D378-S381 PolarHBondContact O-OG 2.99Å; S381-R387 PolarHBondContact O-NE 2.82Å; S381-R387 PolarHBondContact O-NH2 3.43Å
382	V	93.8	Very high	95.7	Very high	44 Å²	44	44.2 Å²	44.2	27%	0.267	23%	0.225	S	C	.	.	S	Bend	trans	-61	-51.3	178.9	-174	0	0	0	0	110.5	P294 L350 P354 P384 R387	P294-V382 HydrophobicContact CG-CG1 4.46Å; L350-V382 HydrophobicContact CB-CG2 4.12Å; L350-V382 HydrophobicContact CD1-CG2 4.19Å; L350-V382 HydrophobicContact CD2-CG2 3.73Å; L350-V382 HydrophobicContact CG-CG2 4.23Å; P354-V382 HydrophobicContact CB-CG1 4.21Å; V382-P384 WeakPolarHBondContact O-CD 3.24Å; V382-R387 PolarHBondContact O-NH2 2.81Å; V382-R387 VanDerWaalsContact O-NH2 3.08Å
383	N	93.5	Very high	96	Very high	71 Å²	71	44 Å²	44	38%	0.38	22%	0.223	S	C	.	.	S	Bend	trans	-69.6	120	173.9	171.5	19.4	0	0	0	110.3	Q385 D386	N383-Q385 PolarHBondContact O-N 2.84Å; N383-Q385 PolarHBondContact OD1-N 3.28Å; N383-Q385 VanDerWaalsContact OD1-N 3.09Å; N383-D386 VanDerWaalsContact CB-OD2 3.29Å; N383-D386 WeakPolarHBondContact CB-OD2 2.85Å; N383-D386 PolarHBondContact ND2-OD1 3.29Å; N383-D386 PolarHBondContact ND2-OD2 3.4Å; N383-D386 PolarHBondContact O-N 3.38Å; N383-D386 VanDerWaalsContact O-N 3.16Å
384	P	94.2	Very high	96.2	Very high	27 Å²	27	43.5 Å²	43.5	18%	0.175	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.2	-21.1	-178.3	-21.9	34.4	0	0	0	114.2	E295 K304 V382 D386 R387	E295-P384 HydrophobicContact CB-CG 4.25Å; E295-P384 VanDerWaalsContact CD-CG 3.42Å; E295-P384 HydrophobicContact CG-CG 3.81Å; E295-P384 WeakPolarHBondContact OE1-CG 3.29Å; K304-P384 HydrophobicContact CB-CB 3.78Å; K304-P384 HydrophobicContact CG-CB 4.33Å; K304-P384 WeakPolarHBondContact CG-O 3.25Å; V382-P384 WeakPolarHBondContact O-CD 3.24Å; P384-D386 VanDerWaalsContact C-N 3.31Å; P384-R387 PolarHBondContact O-N 2.71Å
385	Q	93.4	Very high	96.3	Very high	115 Å²	115	42.2 Å²	42.2	54%	0.537	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-73.4	-23.4	177.8	-58.6	-57.9	-42.4	0	0	112.9	N383 R387	N383-Q385 PolarHBondContact O-N 2.84Å; N383-Q385 PolarHBondContact OD1-N 3.28Å; N383-Q385 VanDerWaalsContact OD1-N 3.09Å; Q385-R387 VanDerWaalsContact C-N 3.32Å
386	D	95.3	Very high	96.4	Very high	103 Å²	103	45.2 Å²	45.2	55%	0.551	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-84.3	-9	178	-59.1	-31.5	0	0	0	112.4	N383 P384	N383-D386 VanDerWaalsContact CB-OD2 3.29Å; N383-D386 WeakPolarHBondContact CB-OD2 2.85Å; N383-D386 PolarHBondContact ND2-OD1 3.29Å; N383-D386 PolarHBondContact ND2-OD2 3.4Å; N383-D386 PolarHBondContact O-N 3.38Å; N383-D386 VanDerWaalsContact O-N 3.16Å; P384-D386 VanDerWaalsContact C-N 3.31Å
387	R	97.4	Very high	96.4	Very high	3 Å²	3	45.2 Å²	45.2	1%	0.011	23%	0.231	C	C	.	.	S	Bend	trans	-80.8	142.1	173.5	-56	179.8	-162.9	144.4	15	110.2	E295 K304 I307 D378 M379 S381 V382 P384 Q385	E295-R387 IonicContact OE1-CZ 2.71Å; E295-R387 IonicContact OE1-NH1 2.7Å; E295-R387 PolarHBondContact OE1-NH1 3.5Å; E295-R387 IonicContact OE1-NH2 2.7Å; E295-R387 IonicContact OE2-CZ 2.94Å; E295-R387 IonicContact OE2-NH1 2.87Å; E295-R387 PolarHBondContact OE2-NH1 2.84Å; E295-R387 IonicContact OE2-NH2 3.24Å; E295-R387 PolarHBondContact OE2-NH2 2.75Å; K304-R387 HydrophobicContact CD-CB 4.2Å; K304-R387 PolarHBondContact NZ-O 3.46Å; K304-R387 PolarHBondContact O-NH1 3.41Å; I307-R387 HydrophobicContact CG2-CB 4.14Å; D378-R387 WeakPolarHBondContact O-CA 3.23Å; D378-R387 WeakPolarHBondContact O-CG 3.49Å; M379-R387 VanDerWaalsContact O-CD 3.25Å; M379-R387 WeakPolarHBondContact O-CD 3.4Å; S381-R387 PolarHBondContact O-NE 2.82Å; S381-R387 PolarHBondContact O-NH2 3.43Å; V382-R387 PolarHBondContact O-NH2 2.81Å; V382-R387 VanDerWaalsContact O-NH2 3.08Å; P384-R387 PolarHBondContact O-N 2.71Å; Q385-R387 VanDerWaalsContact C-N 3.32Å
388	P	97.8	Very high	96.3	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.019	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-62.1	153	175.6	27.2	-35.7	0	0	0	112.2	K304 I307 M379 E392 L393	K304-P388 WeakPolarHBondContact CE-O 3.38Å; I307-P388 HydrophobicContact CG2-CG 4.28Å; M379-P388 HydrophobicContact CG-CG 4.34Å; P388-E392 WeakPolarHBondContact CA-OE2 3.25Å; P388-E392 HydrophobicContact CB-CB 4.22Å; P388-E392 HydrophobicContact CB-CG 4.3Å; P388-L393 HydrophobicContact CB-CB 4.28Å; P388-L393 HydrophobicContact CG-CB 4.1Å; P388-L393 HydrophobicContact CG-CD1 4.49Å
389	D	97.1	Very high	96.2	Very high	61 Å²	61	49.9 Å²	49.9	33%	0.326	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-70.9	153.2	165.7	-77	21.1	0	0	0	109.8	N278 K304 L391 E392 L393	N278-D389 PolarHBondContact ND2-OD1 3.08Å; N278-D389 PolarHBondContact ND2-OD2 2.92Å; K304-D389 WeakPolarHBondContact CE-OD1 3.43Å; K304-D389 IonicContact NZ-OD1 2.68Å; K304-D389 PolarHBondContact NZ-OD1 2.98Å; D389-L391 VanDerWaalsContact C-N 3.28Å; D389-L391 PolarHBondContact O-N 3.44Å; D389-L391 VanDerWaalsContact O-N 3.16Å; D389-E392 WeakPolarHBondContact O-CA 3.49Å; D389-E392 WeakPolarHBondContact O-CB 3.3Å; D389-E392 PolarHBondContact O-N 3.37Å; D389-L393 PolarHBondContact O-N 3.36Å
390	A	97.6	Very high	95.8	Very high	2 Å²	2	51.9 Å²	51.9	2%	0.017	27%	0.265	C	S	.	.	H	α-helix	trans	-56.8	-36.8	-172.6	0	0	0	0	0	114.7	V215 A216 H219 I307 H394	V215-A390 HydrophobicContact CG1-CB 4.11Å; A216-A390 HydrophobicContact CB-CB 4.29Å; H219-A390 HydrophobicContact CB-CB 4.16Å; H219-A390 WeakPolarHBondContact ND1-CB 3.4Å; I307-A390 HydrophobicContact CD1-CB 3.86Å; A390-H394 WeakPolarHBondContact O-CB 3.43Å; A390-H394 PolarHBondContact O-N 2.91Å
391	L	97.3	Very high	95.1	Very high	110 Å²	110	52.6 Å²	52.6	58%	0.576	27%	0.269	S	S	*	.	H	α-helix	trans	-69.5	-38.4	175.1	-178.2	61.6	0	0	0	112.3	D389 H394 N395	D389-L391 VanDerWaalsContact C-N 3.28Å; D389-L391 PolarHBondContact O-N 3.44Å; D389-L391 VanDerWaalsContact O-N 3.16Å; L391-H394 PolarHBondContact O-N 3.41Å; L391-N395 PolarHBondContact O-N 2.93Å; L391-N395 PolarHBondContact O-ND2 3Å
392	E	97.7	Very high	94.2	Very high	85 Å²	85	56 Å²	56	40%	0.397	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-45.2	174.4	-170.3	-150.8	139.2	0	0	110.5	P388 D389 H394 N395 R396	P388-E392 WeakPolarHBondContact CA-OE2 3.25Å; P388-E392 HydrophobicContact CB-CB 4.22Å; P388-E392 HydrophobicContact CB-CG 4.3Å; D389-E392 WeakPolarHBondContact O-CA 3.49Å; D389-E392 WeakPolarHBondContact O-CB 3.3Å; D389-E392 PolarHBondContact O-N 3.37Å; E392-H394 PolarHBondContact O-N 3.07Å; E392-N395 PolarHBondContact O-N 2.87Å; E392-R396 HydrophobicContact CG-CG 4.45Å; E392-R396 WeakPolarHBondContact O-CB 3.13Å; E392-R396 VanDerWaalsContact O-CG 3.26Å; E392-R396 WeakPolarHBondContact O-CG 3.49Å; E392-R396 PolarHBondContact O-N 3.21Å; E392-R396 WeakPolarHBondContact OE1-CD 3.38Å; E392-R396 IonicContact OE1-CZ 2.76Å; E392-R396 IonicContact OE1-NE 3.21Å; E392-R396 IonicContact OE1-NH1 3.37Å; E392-R396 PolarHBondContact OE1-NH1 3.09Å
393	L	98.1	Very high	92.6	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-55.6	-47.9	174.7	169.2	62.1	0	0	0	111.6	T212 I307 L310 L375 M379 P388 D389 R396 M397	T212-L393 HydrophobicContact CG2-CD1 4.13Å; T212-L393 HydrophobicContact CG2-CD2 3.93Å; T212-L393 HydrophobicContact CG2-CG 3.7Å; I307-L393 HydrophobicContact CD1-CD2 3.82Å; I307-L393 HydrophobicContact CG2-CD2 4.31Å; L310-L393 HydrophobicContact CD1-CD2 3.81Å; L375-L393 HydrophobicContact CD1-CD1 3.86Å; L375-L393 HydrophobicContact CD2-CD1 3.99Å; L375-L393 HydrophobicContact CG-CD1 4.02Å; M379-L393 HydrophobicContact CE-CD1 3.88Å; M379-L393 HydrophobicContact CE-CD2 3.76Å; M379-L393 HydrophobicContact CE-CG 4.48Å; M379-L393 HydrophobicContact CG-CD1 3.92Å; M379-L393 HydrophobicContact SD-CD1 3.51Å; M379-L393 VanDerWaalsContact SD-CD1 3.51Å; M379-L393 HydrophobicContact SD-CD2 4.48Å; P388-L393 HydrophobicContact CB-CB 4.28Å; P388-L393 HydrophobicContact CG-CB 4.1Å; P388-L393 HydrophobicContact CG-CD1 4.49Å; D389-L393 PolarHBondContact O-N 3.36Å; L393-R396 PolarHBondContact O-N 2.92Å; L393-M397 WeakPolarHBondContact O-CB 3.35Å; L393-M397 PolarHBondContact O-N 3.37Å
394	H	98.1	Very high	90.8	Very high	41 Å²	41	60.5 Å²	60.5	19%	0.19	34%	0.344	C	S	.	.	H	α-helix	trans	-61.8	-48.9	178.4	-179.2	51.7	0	0	0	111.9	T212 S213 A216 A390 L391 E392 R396 M397 D398	T212-H394 PolarHBondContact OG1-ND1 2.76Å; T212-H394 VanDerWaalsContact OG1-ND1 3.15Å; S213-H394 PolarHBondContact N-ND1 3.41Å; A216-H394 HydrophobicContact CB-CB 4.19Å; A390-H394 WeakPolarHBondContact O-CB 3.43Å; A390-H394 PolarHBondContact O-N 2.91Å; L391-H394 PolarHBondContact O-N 3.41Å; E392-H394 PolarHBondContact O-N 3.07Å; H394-R396 VanDerWaalsContact C-N 3.31Å; H394-R396 PolarHBondContact O-N 3.49Å; H394-M397 PolarHBondContact O-N 3.19Å; H394-M397 VanDerWaalsContact O-N 3.14Å; H394-D398 PolarHBondContact O-N 2.74Å
395	N	97.6	Very high	90.7	Very high	78 Å²	78	62.2 Å²	62.2	42%	0.417	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-38.7	178	-66.7	-21.2	0	0	0	112.4	L391 E392 Q399	L391-N395 PolarHBondContact O-N 2.93Å; L391-N395 PolarHBondContact O-ND2 3Å; E392-N395 PolarHBondContact O-N 2.87Å; N395-Q399 VanDerWaalsContact O-CG 3.3Å; N395-Q399 WeakPolarHBondContact O-CG 2.93Å; N395-Q399 PolarHBondContact O-N 2.86Å
396	R	97.3	Very high	90.5	Very high	66 Å²	66	59.4 Å²	59.4	25%	0.249	34%	0.342	C	S	.	.	H	α-helix	trans	-70	-35.9	176	-72.4	175.4	62.9	-177.4	-4.9	112.1	L375 D378 E392 L393 H394 L400	L375-R396 HydrophobicContact CD1-CB 4.2Å; L375-R396 HydrophobicContact CD2-CB 4.39Å; D378-R396 IonicContact OD2-CZ 2.72Å; D378-R396 IonicContact OD2-NH1 3.13Å; D378-R396 PolarHBondContact OD2-NH1 3.12Å; D378-R396 IonicContact OD2-NH2 2.75Å; D378-R396 PolarHBondContact OD2-NH2 3.37Å; E392-R396 HydrophobicContact CG-CG 4.45Å; E392-R396 WeakPolarHBondContact O-CB 3.13Å; E392-R396 VanDerWaalsContact O-CG 3.26Å; E392-R396 WeakPolarHBondContact O-CG 3.49Å; E392-R396 PolarHBondContact O-N 3.21Å; E392-R396 WeakPolarHBondContact OE1-CD 3.38Å; E392-R396 IonicContact OE1-CZ 2.76Å; E392-R396 IonicContact OE1-NE 3.21Å; E392-R396 IonicContact OE1-NH1 3.37Å; E392-R396 PolarHBondContact OE1-NH1 3.09Å; L393-R396 PolarHBondContact O-N 2.92Å; H394-R396 VanDerWaalsContact C-N 3.31Å; H394-R396 PolarHBondContact O-N 3.49Å; R396-L400 VanDerWaalsContact O-CG 3.26Å; R396-L400 WeakPolarHBondContact O-CG 3.47Å; R396-L400 PolarHBondContact O-N 3.18Å
397	M	96	Very high	90.3	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-46	174.9	-170.9	63.1	73.8	0	0	111.3	M208 L209 T212 I314 L375 L393 H394 Q399 L400 T401	M208-M397 HydrophobicContact CB-CE 4Å; M208-M397 HydrophobicContact CB-CG 4.11Å; M208-M397 HydrophobicContact CB-SD 3.8Å; M208-M397 HydrophobicContact CE-SD 4.26Å; M208-M397 HydrophobicContact CG-CE 4.36Å; M208-M397 HydrophobicContact CG-SD 4.43Å; M208-M397 HydrophobicContact SD-CE 3.97Å; M208-M397 HydrophobicContact SD-SD 3.91Å; L209-M397 HydrophobicContact CD2-CB 4.33Å; L209-M397 HydrophobicContact CD2-CG 3.91Å; T212-M397 HydrophobicContact CG2-CB 4.26Å; T212-M397 HydrophobicContact CG2-CE 4.31Å; T212-M397 HydrophobicContact CG2-CG 4.39Å; I314-M397 HydrophobicContact CD1-CE 4Å; L375-M397 HydrophobicContact CD2-CB 4.39Å; L375-M397 HydrophobicContact CD2-CE 3.69Å; L375-M397 HydrophobicContact CD2-SD 4.27Å; L393-M397 WeakPolarHBondContact O-CB 3.35Å; L393-M397 PolarHBondContact O-N 3.37Å; H394-M397 PolarHBondContact O-N 3.19Å; H394-M397 VanDerWaalsContact O-N 3.14Å; M397-Q399 PolarHBondContact O-N 3.46Å; M397-L400 WeakPolarHBondContact O-CB 3.25Å; M397-L400 PolarHBondContact O-N 2.72Å; M397-T401 PolarHBondContact O-N 3.08Å; M397-T401 PolarHBondContact O-OG1 3Å; M397-T401 VanDerWaalsContact O-OG1 3.08Å
398	D	94.3	Very high	89.8	Confident	72 Å²	72	60.1 Å²	60.1	39%	0.385	35%	0.35	S	S	.	.	H	α-helix	trans	-56.7	-45.8	179.1	-174.6	57.4	0	0	0	112.6	L209 H394 L400 T401 C402	L209-D398 HydrophobicContact CD2-CB 4.06Å; H394-D398 PolarHBondContact O-N 2.74Å; D398-L400 VanDerWaalsContact C-N 3.31Å; D398-L400 PolarHBondContact O-N 3.49Å; D398-T401 PolarHBondContact O-N 2.87Å; D398-T401 PolarHBondContact O-OG1 2.95Å; D398-T401 VanDerWaalsContact O-OG1 3.06Å; D398-C402 WeakPolarHBondContact O-CB 3.13Å; D398-C402 PolarHBondContact O-N 2.77Å; D398-C402 PolarHBondContact O-SG 2.93Å
399	Q	93.5	Very high	89.3	Confident	131 Å²	131	63.7 Å²	63.7	61%	0.612	37%	0.37	S	S	*	.	H	α-helix	trans	-59	-39.3	173.7	-70.9	169.9	14	0	0	112.9	N395 M397 A403	N395-Q399 VanDerWaalsContact O-CG 3.3Å; N395-Q399 WeakPolarHBondContact O-CG 2.93Å; N395-Q399 PolarHBondContact O-N 2.86Å; M397-Q399 PolarHBondContact O-N 3.46Å; Q399-A403 WeakPolarHBondContact O-CB 3.49Å; Q399-A403 PolarHBondContact O-N 3.46Å
400	L	90.8	Very high	88.8	Confident	42 Å²	42	63.9 Å²	63.9	22%	0.22	37%	0.373	C	S	.	.	H	α-helix	trans	-73.5	-34.7	-179.5	-70.9	171.5	0	0	0	112.8	V372 L375 R396 M397 D398	V372-L400 HydrophobicContact CG2-CB 4.37Å; V372-L400 HydrophobicContact CG2-CD1 4.13Å; L375-L400 HydrophobicContact CB-CD1 4.21Å; L375-L400 HydrophobicContact CD2-CD1 3.83Å; R396-L400 VanDerWaalsContact O-CG 3.26Å; R396-L400 WeakPolarHBondContact O-CG 3.47Å; R396-L400 PolarHBondContact O-N 3.18Å; M397-L400 WeakPolarHBondContact O-CB 3.25Å; M397-L400 PolarHBondContact O-N 2.72Å; D398-L400 VanDerWaalsContact C-N 3.31Å; D398-L400 PolarHBondContact O-N 3.49Å
401	T	81.9	Confident	88.2	Confident	20 Å²	20	68.3 Å²	68.3	12%	0.123	40%	0.399	C	S	.	.	H	α-helix	trans	-82.4	-26.4	177.7	48.1	0	0	0	0	113.5	N205 L209 M397 D398 A403	N205-T401 HydrophobicContact CB-CG2 4.32Å; L209-T401 HydrophobicContact CD1-CG2 4.23Å; L209-T401 WeakPolarHBondContact CD1-OG1 3.2Å; L209-T401 HydrophobicContact CD2-CG2 4.32Å; L209-T401 VanDerWaalsContact CD2-OG1 3.31Å; L209-T401 WeakPolarHBondContact CD2-OG1 3.26Å; L209-T401 HydrophobicContact CG-CG2 4.07Å; M397-T401 PolarHBondContact O-N 3.08Å; M397-T401 PolarHBondContact O-OG1 3Å; M397-T401 VanDerWaalsContact O-OG1 3.08Å; D398-T401 PolarHBondContact O-N 2.87Å; D398-T401 PolarHBondContact O-OG1 2.95Å; D398-T401 VanDerWaalsContact O-OG1 3.06Å; T401-A403 VanDerWaalsContact C-N 3.29Å
402	C	76.4	Confident	87.5	Confident	98 Å²	98	65.1 Å²	65.1	66%	0.662	39%	0.385	S	S	*	.	H	α-helix	trans	-76.1	-17.7	172.4	-70.8	0	0	0	0	113.1	D398	D398-C402 WeakPolarHBondContact O-CB 3.13Å; D398-C402 PolarHBondContact O-N 2.77Å; D398-C402 PolarHBondContact O-SG 2.93Å
403	A	60.4	Low	86.7	Confident	89 Å²	89	63.4 Å²	63.4	74%	0.736	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	2.1	179.6	0	0	0	0	0	114.3	Q399 T401	Q399-A403 WeakPolarHBondContact O-CB 3.49Å; Q399-A403 PolarHBondContact O-N 3.46Å; T401-A403 VanDerWaalsContact C-N 3.29Å
404	A	55.7	Low	85.6	Confident	121 Å²	121	69.1 Å²	69.1	100%	1	42%	0.418	S	S	*	.			trans	-115.8	0	-174.1	0	0	0	0	0	112.5

Retrieved 404 of 404 residues in 246.9 ms (Link to these results)

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