A0A077Z4X1_TRITR Loading...

SH3 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z4X1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 174 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	38.7	Very low	36.6	Very low	239 Å²	239	156.4 Å²	156.4	100%	1.177	83%	0.826	S	S	*	*				0	110.4	0	-73.5	167.7	178.5	0	0	107.4	M3	M1-M3 PolarHBondContact O-N 2.8Å
2	A	33.3	Very low	36.6	Very low	109 Å²	109	152.8 Å²	152.8	90%	0.901	82%	0.82	S	S	*	*			trans	-82.6	113.4	-178.5	0	0	0	0	0	109.6	K4	A2-K4 PolarHBondContact O-N 3.32Å
3	M	35.3	Very low	36.5	Very low	178 Å²	178	152.1 Å²	152.1	88%	0.877	82%	0.817	S	S	*	*			trans	-78.7	115.8	173.3	-67.8	-166.9	172.6	0	0	109.1	M1 M5	M1-M3 PolarHBondContact O-N 2.8Å; M3-M5 PolarHBondContact O-N 3.43Å
4	K	31.2	Very low	36.4	Very low	206 Å²	206	148.3 Å²	148.3	90%	0.896	81%	0.808	S	S	*	*			trans	-86	103.8	178.4	-167.3	159	175.3	166.5	0	108.3	A2	A2-K4 PolarHBondContact O-N 3.32Å
5	M	33.5	Very low	36.7	Very low	171 Å²	171	145.7 Å²	145.7	84%	0.842	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-81.5	130.5	178.1	-69.1	172.3	157.2	0	0	110.1	M3	M3-M5 PolarHBondContact O-N 3.43Å
6	K	33.5	Very low	36.6	Very low	191 Å²	191	143.9 Å²	143.9	83%	0.83	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-98.6	121.8	170.6	-76.1	176.6	175.2	178.1	0	108.1
7	S	38.9	Very low	36.7	Very low	115 Å²	115	147.1 Å²	147.1	80%	0.804	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-76.7	135.7	168.1	55.6	0	0	0	0	109.4
8	F	45.2	Very low	36.7	Very low	139 Å²	139	148.4 Å²	148.4	61%	0.61	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-79.5	120.5	168.6	-56.7	-87.7	0	0	0	107.8
9	S	35.7	Very low	36.8	Very low	102 Å²	102	147.6 Å²	147.6	71%	0.713	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-82.2	117.4	173.9	-155.4	0	0	0	0	107.7
10	L	41.4	Very low	36.7	Very low	113 Å²	113	144.5 Å²	144.5	59%	0.592	80%	0.801	S	S	*	*			trans	-99.1	104.5	171.8	-71.5	169.9	0	0	0	107.6	C12 T75	L10-C12 PolarHBondContact O-N 3.49Å; L10-T75 HydrophobicContact CD2-CG2 4.03Å
11	D	35.7	Very low	37	Very low	157 Å²	157	146.7 Å²	146.7	84%	0.84	81%	0.808	S	S	*	*			trans	-68.2	112.9	173.9	-63.7	-59.3	0	0	0	109.3
12	C	37	Very low	36.9	Very low	113 Å²	113	144.7 Å²	144.7	76%	0.764	80%	0.796	S	S	*	*			trans	-107.5	98.3	178	-154.7	0	0	0	0	108.6	L10 S14	L10-C12 PolarHBondContact O-N 3.49Å; C12-S14 PolarHBondContact O-N 2.93Å; C12-S14 PolarHBondContact O-OG 2.56Å
13	D	35.4	Very low	37.6	Very low	144 Å²	144	145.1 Å²	145.1	77%	0.77	79%	0.792	S	S	*	*			trans	-72.5	120.3	175.4	-163.1	-83.1	0	0	0	110	S15	D13-S15 PolarHBondContact OD1-OG 2.84Å
14	S	34.6	Very low	37.6	Very low	99 Å²	99	146 Å²	146	69%	0.692	79%	0.794	S	S	*	*			trans	-102.5	86.3	-173.8	-55.2	0	0	0	0	109.6	C12 T16	C12-S14 PolarHBondContact O-N 2.93Å; C12-S14 PolarHBondContact O-OG 2.56Å; S14-T16 PolarHBondContact O-N 3.11Å
15	S	41.3	Very low	37.8	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	79%	0.785	S	S	*	*			trans	-93.7	97.8	170.9	-73	0	0	0	0	110.5	D13	D13-S15 PolarHBondContact OD1-OG 2.84Å
16	T	35.7	Very low	38	Very low	116 Å²	116	139 Å²	139	71%	0.712	79%	0.786	S	S	*	*			trans	-86.3	130.9	168.4	-55.9	0	0	0	0	107.9	S14	S14-T16 PolarHBondContact O-N 3.11Å
17	E	37.9	Very low	38.3	Very low	198 Å²	198	140.1 Å²	140.1	93%	0.925	79%	0.791	S	S	*	*			trans	-155	137.2	150.3	-114	177.4	139.4	0	0	113
18	Q	35.7	Very low	38.2	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.804	79%	0.794	S	S	*	*			trans	-78.2	160.3	-170.6	-66.8	158	18.3	0	0	111.6
19	T	38.5	Very low	37.7	Very low	132 Å²	132	144.9 Å²	144.9	81%	0.81	81%	0.813	S	S	*	*				169.8	124.5	112.7	-64.4	0	0	0	0	110.3
20	A	35.1	Very low	37.5	Very low	85 Å²	85	142.9 Å²	142.9	70%	0.702	81%	0.808	S	S	*	*			trans	-74.4	149.5	173.2	0	0	0	0	0	111.5
21	M	43.7	Very low	37	Very low	192 Å²	192	146.7 Å²	146.7	95%	0.946	82%	0.821	S	S	*	*			trans	-156.6	138.6	143.3	-79.6	-133.4	156.4	0	0	112.5
22	H	35.6	Very low	36.9	Very low	196 Å²	196	143.9 Å²	143.9	91%	0.907	81%	0.813	S	S	*	*			trans	-53.6	146.2	176.5	-93.1	70.6	0	0	0	114.2
23	S	48.6	Very low	36.7	Very low	119 Å²	119	144.7 Å²	144.7	83%	0.832	82%	0.815	S	S	*	*				-173.3	134	129.9	-177	0	0	0	0	112.2
24	Q	36.4	Very low	36.8	Very low	197 Å²	197	143.5 Å²	143.5	92%	0.921	81%	0.808	S	S	*	*			trans	-65	137.1	174.3	-129.1	164.4	-58.5	0	0	111
25	G	35.1	Very low	36.8	Very low	68 Å²	68	149.1 Å²	149.1	70%	0.701	82%	0.82	S	S	*	*			trans	176.9	97.2	173.1	0	0	0	0	0	115.3
26	D	37.8	Very low	36.9	Very low	160 Å²	160	148.4 Å²	148.4	86%	0.856	83%	0.83	S	S	*	*			trans	45.3	114.6	148.7	-64.7	-51.3	0	0	0	122.1	R28	D26-R28 PolarHBondContact O-N 3.01Å
27	K	40.1	Very low	37.2	Very low	215 Å²	215	144.7 Å²	144.7	94%	0.935	81%	0.814	S	S	*	*			trans	-73	84.9	167.2	-60.6	177.4	-177.5	174.5	0	110.3
28	R	36	Very low	38.1	Very low	232 Å²	232	143.1 Å²	143.1	88%	0.875	80%	0.8	S	S	*	*	S	Bend	trans	-132.9	137.2	156.4	-92.7	-178.7	169.9	-165.5	-2.7	107.9	D26 G30	D26-R28 PolarHBondContact O-N 3.01Å; R28-G30 VanDerWaalsContact C-N 3.32Å; R28-G30 PolarHBondContact O-N 2.96Å
29	A	33.9	Very low	38.9	Very low	123 Å²	123	138.1 Å²	138.1	100%	1.017	78%	0.783	S	S	*	*	S	Bend	trans	-55.2	96.2	175.2	0	0	0	0	0	109.3
30	G	31.6	Very low	40.2	Very low	59 Å²	59	133.8 Å²	133.8	61%	0.608	75%	0.753	S	S	*	*			trans	-155.5	130.2	-166	0	0	0	0	0	108.8	R28 S32	R28-G30 VanDerWaalsContact C-N 3.32Å; R28-G30 PolarHBondContact O-N 2.96Å; G30-S32 PolarHBondContact O-N 2.77Å
31	F	30.7	Very low	41.9	Very low	194 Å²	194	136.4 Å²	136.4	85%	0.851	75%	0.749	S	S	*	*			trans	-57.1	127.8	-177.5	-76.5	-104.2	0	0	0	111.2
32	S	33.4	Very low	43.2	Very low	98 Å²	98	127.7 Å²	127.7	69%	0.685	71%	0.706	S	S	*	*			trans	-108.7	107.9	162.4	42	0	0	0	0	109.2	G30 L34	G30-S32 PolarHBondContact O-N 2.77Å; S32-L34 PolarHBondContact O-N 3.08Å
33	V	34.8	Very low	45.1	Very low	130 Å²	130	123 Å²	123	79%	0.788	68%	0.681	S	S	*	*			trans	-75	109.6	166.2	170.6	0	0	0	0	107
34	L	36.4	Very low	46.2	Very low	119 Å²	119	120.9 Å²	120.9	62%	0.623	66%	0.664	S	S	*	*			trans	-75.7	123.7	167.5	-72.6	168.7	0	0	0	108.3	S32 G36 G37	S32-L34 PolarHBondContact O-N 3.08Å; L34-G36 PolarHBondContact O-N 2.9Å; L34-G36 VanDerWaalsContact O-N 3.08Å; L34-G37 PolarHBondContact O-N 3.02Å
35	K	34.4	Very low	47.8	Very low	217 Å²	217	114 Å²	114	94%	0.943	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.5	117.4	172.6	-96.6	178.3	170.8	172.7	0	109.6
36	G	42.7	Very low	49	Very low	95 Å²	95	116.2 Å²	116.2	98%	0.979	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	97.2	-0.1	170.5	0	0	0	0	0	117.3	L34	L34-G36 PolarHBondContact O-N 2.9Å; L34-G36 VanDerWaalsContact O-N 3.08Å
37	G	43.4	Very low	49.6	Very low	38 Å²	38	116.4 Å²	116.4	39%	0.392	62%	0.622	S	S	.	*			trans	-137.4	126.4	175.4	0	0	0	0	0	111.9	L34 C39	L34-G37 PolarHBondContact O-N 3.02Å; G37-C39 PolarHBondContact O-N 3.26Å
38	R	55.8	Low	49.5	Very low	165 Å²	165	114.9 Å²	114.9	62%	0.623	62%	0.618	S	S	*	*			trans	-70.3	121.7	173	-66	-177.3	-164.8	-175.3	6.1	108.5	F40	R38-F40 HydrophobicContact CB-CD2 4.42Å; R38-F40 HydrophobicContact CB-CE1 4.31Å; R38-F40 HydrophobicContact CB-CE2 3.5Å; R38-F40 HydrophobicContact CB-CZ 3.44Å; R38-F40 VanDerWaalsContact CB-CZ 3.44Å; R38-F40 HydrophobicContact CG-CZ 4.27Å; R38-F40 WeakPolarHBondContact O-CE2 3.46Å
39	C	52.1	Low	49.7	Very low	67 Å²	67	109.8 Å²	109.8	45%	0.453	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.3	131.2	170.4	-170.6	0	0	0	0	108	G37 N126	G37-C39 PolarHBondContact O-N 3.26Å; C39-N126 WeakPolarHBondContact CA-O 3.35Å
40	F	66.1	Low	49.9	Very low	40 Å²	40	108.8 Å²	108.8	18%	0.175	59%	0.593	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	122.7	177.3	-57.4	-86.1	0	0	0	108.8	R38 V42 L125 N126 L127 W128 Y169	R38-F40 HydrophobicContact CB-CD2 4.42Å; R38-F40 HydrophobicContact CB-CE1 4.31Å; R38-F40 HydrophobicContact CB-CE2 3.5Å; R38-F40 HydrophobicContact CB-CZ 3.44Å; R38-F40 VanDerWaalsContact CB-CZ 3.44Å; R38-F40 HydrophobicContact CG-CZ 4.27Å; R38-F40 WeakPolarHBondContact O-CE2 3.46Å; F40-V42 HydrophobicContact CB-CG1 4.33Å; F40-L125 HydrophobicContact CD2-CD2 4.23Å; F40-L125 HydrophobicContact CE2-CD2 3.66Å; F40-N126 PolarHBondContact N-O 3.28Å; F40-L127 HydrophobicContact CB-CD2 4.07Å; F40-L127 HydrophobicContact CD2-CD2 4.27Å; F40-W128 PolarHBondContact O-N 2.87Å; F40-Y169 HydrophobicContact CD1-CE2 4.16Å; F40-Y169 HydrophobicContact CD2-CE2 4.27Å; F40-Y169 AromaticContact CE1-CE2 3.62Å; F40-Y169 HydrophobicContact CE1-CE2 3.62Å; F40-Y169 AromaticContact CE1-CZ 3.71Å; F40-Y169 WeakPolarHBondContact CE1-OH 3.31Å; F40-Y169 HydrophobicContact CE2-CD2 4.4Å; F40-Y169 AromaticContact CE2-CE2 3.76Å; F40-Y169 HydrophobicContact CE2-CE2 3.76Å; F40-Y169 HydrophobicContact CG-CE2 4.46Å; F40-Y169 HydrophobicContact CZ-CD2 4.41Å; F40-Y169 HydrophobicContact CZ-CE1 4.27Å; F40-Y169 AromaticContact CZ-CE2 3.39Å; F40-Y169 HydrophobicContact CZ-CE2 3.39Å; F40-Y169 AromaticContact CZ-CZ 3.31Å; F40-Y169 WeakPolarHBondContact CZ-OH 3.32Å
41	K	72.2	Confident	50.6	Low	141 Å²	141	112.9 Å²	112.9	61%	0.613	60%	0.599	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.5	118	162.3	-173.5	179.1	175.6	72.6	0	106.9	W128	K41-W128 CarbonylContact C-O 3.54Å; K41-W128 VanDerWaalsContact CA-O 3.3Å; K41-W128 WeakPolarHBondContact CA-O 3.43Å
42	V	70.8	Confident	51.3	Low	9 Å²	9	110.8 Å²	110.8	6%	0.055	60%	0.597	C	S	.	*			trans	-105.4	159.7	177	-61.1	0	0	0	0	109.6	F40 L127 W128 D129 I163 N164	F40-V42 HydrophobicContact CB-CG1 4.33Å; V42-L127 HydrophobicContact CG1-CD2 4.18Å; V42-W128 PolarHBondContact N-O 3.3Å; V42-D129 HydrophobicContact CG2-CB 3.63Å; V42-D129 WeakPolarHBondContact O-CA 3.49Å; V42-I163 HydrophobicContact CG2-CD1 4.19Å; V42-I163 HydrophobicContact CG2-CG1 3.81Å; V42-N164 HydrophobicContact CB-CB 4.07Å; V42-N164 WeakPolarHBondContact CG1-O 3.23Å; V42-N164 HydrophobicContact CG2-CB 4.11Å; V42-N164 WeakPolarHBondContact CG2-O 3.45Å
43	R	75.1	Confident	51.9	Low	98 Å²	98	110.3 Å²	110.3	37%	0.37	60%	0.598	S	S	.	*			trans	-64.5	140.8	174.4	73.1	-168.1	-179.9	79.7	13.4	109.5	D148 L152 N164	R43-D148 IonicContact CZ-OD2 3.97Å; R43-D148 IonicContact NE-OD2 3.43Å; R43-D148 PolarHBondContact NE-OD2 3.28Å; R43-D148 VanDerWaalsContact NE-OD2 3.11Å; R43-D148 IonicContact NH2-OD2 3.15Å; R43-D148 PolarHBondContact NH2-OD2 2.97Å; R43-L152 HydrophobicContact CB-CD1 4.45Å; R43-L152 HydrophobicContact CG-CD1 3.61Å; R43-L152 VanDerWaalsContact NE-CD1 3.3Å; R43-N164 WeakPolarHBondContact CG-ND2 3.45Å; R43-N164 PolarHBondContact O-ND2 3.48Å
44	P	70.9	Confident	52.5	Low	73 Å²	73	112.1 Å²	112.1	47%	0.474	60%	0.604	S	S	.	*			trans	-56.2	150.7	173.3	-16.7	24.4	0	0	0	112	T46 D129	P44-T46 PolarHBondContact O-N 3.11Å; P44-D129 WeakPolarHBondContact CG-O 3.22Å
45	L	71.3	Confident	53.3	Low	52 Å²	52	115 Å²	115	27%	0.272	61%	0.614	S	S	.	*			trans	-69.2	97.9	167.2	-65.5	176.2	0	0	0	109.5	R47 E154 R162 N164	L45-R47 PolarHBondContact O-N 3.04Å; L45-R47 VanDerWaalsContact O-N 3.11Å; L45-E154 HydrophobicContact CD1-CG 4.49Å; L45-E154 HydrophobicContact CD2-CB 4.33Å; L45-E154 HydrophobicContact CD2-CG 3.88Å; L45-E154 VanDerWaalsContact CD2-OE2 3.29Å; L45-E154 WeakPolarHBondContact CD2-OE2 3.48Å; L45-R162 HydrophobicContact CD1-CB 3.94Å; L45-N164 VanDerWaalsContact CD2-OD1 3.29Å; L45-N164 WeakPolarHBondContact CD2-OD1 3.24Å
46	T	59.5	Low	54.3	Low	115 Å²	115	113.8 Å²	113.8	71%	0.706	61%	0.612	S	S	*	*			trans	-80.7	85.5	171.2	-47.4	0	0	0	0	109.2	P44 Q48	P44-T46 PolarHBondContact O-N 3.11Å; T46-Q48 PolarHBondContact O-N 3.43Å
47	R	51.2	Low	54.4	Low	165 Å²	165	116.8 Å²	116.8	62%	0.623	61%	0.605	S	S	*	*			trans	-74.1	107.1	160.4	-79.9	-174.9	176.4	-176.1	-2.9	107.5	L45 I49	L45-R47 PolarHBondContact O-N 3.04Å; L45-R47 VanDerWaalsContact O-N 3.11Å; R47-I49 HydrophobicContact CB-CG1 4.11Å; R47-I49 PolarHBondContact O-N 3.33Å
48	Q	38	Very low	54.8	Low	182 Å²	182	120.5 Å²	120.5	85%	0.85	63%	0.625	S	S	*	*			trans	-64.6	92.3	158	-79.6	-175.3	-21.7	0	0	107	T46 S50	T46-Q48 PolarHBondContact O-N 3.43Å; Q48-S50 VanDerWaalsContact C-N 3.33Å; Q48-S50 PolarHBondContact O-N 2.84Å
49	I	39.6	Very low	54.4	Low	125 Å²	125	116.5 Å²	116.5	64%	0.641	63%	0.628	S	S	*	*			trans	-81.9	90.8	163.6	-54	173.5	0	0	0	104.6	R47 I51	R47-I49 HydrophobicContact CB-CG1 4.11Å; R47-I49 PolarHBondContact O-N 3.33Å; I49-I51 VanDerWaalsContact C-N 3.3Å; I49-I51 HydrophobicContact CG2-CG1 3.72Å; I49-I51 PolarHBondContact O-N 3.1Å
50	S	38.8	Very low	54.4	Low	103 Å²	103	121.1 Å²	121.1	72%	0.72	65%	0.647	S	S	*	*			trans	-67	98.1	158.2	36.8	0	0	0	0	106.8	Q48 D52	Q48-S50 VanDerWaalsContact C-N 3.33Å; Q48-S50 PolarHBondContact O-N 2.84Å; S50-D52 VanDerWaalsContact C-N 3.33Å; S50-D52 PolarHBondContact O-N 2.79Å; S50-D52 VanDerWaalsContact O-N 3.16Å
51	I	44.8	Very low	53.4	Low	145 Å²	145	128.3 Å²	128.3	74%	0.744	68%	0.681	S	S	*	*			trans	-73.9	93.6	166.7	-62.4	164.6	0	0	0	105.5	I49	I49-I51 VanDerWaalsContact C-N 3.3Å; I49-I51 HydrophobicContact CG2-CG1 3.72Å; I49-I51 PolarHBondContact O-N 3.1Å
52	D	45.4	Very low	52.1	Low	150 Å²	150	126 Å²	126	80%	0.802	68%	0.683	S	S	*	*			trans	-102.2	112.1	153.3	-88.6	-70.5	0	0	0	106.4	S50 N54	S50-D52 VanDerWaalsContact C-N 3.33Å; S50-D52 PolarHBondContact O-N 2.79Å; S50-D52 VanDerWaalsContact O-N 3.16Å; D52-N54 PolarHBondContact O-N 2.95Å
53	A	46.4	Very low	50.5	Low	87 Å²	87	132.8 Å²	132.8	72%	0.719	72%	0.719	S	S	*	*			trans	-69.6	115.6	173.8	0	0	0	0	0	108.9
54	N	47	Very low	48.9	Very low	168 Å²	168	133.8 Å²	133.8	90%	0.898	74%	0.735	S	S	*	*			trans	-137.9	111.4	150.4	-100.7	-22.6	0	0	0	107.3	D52	D52-N54 PolarHBondContact O-N 2.95Å
55	E	54.8	Low	47.4	Very low	180 Å²	180	135.9 Å²	135.9	84%	0.841	75%	0.752	S	S	*	*			trans	-70.3	156.1	167.4	-66.9	176.3	98	0	0	109.4
56	E	54	Low	46	Very low	191 Å²	191	138.2 Å²	138.2	89%	0.893	77%	0.769	S	S	*	*			trans	82	81.4	162.7	-37.7	-162.3	122.2	0	0	117.5
57	D	46.1	Very low	45.8	Very low	159 Å²	159	136.4 Å²	136.4	85%	0.85	76%	0.76	S	S	*	*			trans	-151.2	130.5	133	-164.3	46	0	0	0	111.4	A59	D57-A59 PolarHBondContact O-N 2.83Å
58	S	50.4	Low	46.6	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	74%	0.739	S	S	*	*			trans	-83.7	99.9	-178.1	-66.6	0	0	0	0	109.6
59	A	47.2	Very low	48.7	Very low	82 Å²	82	124.9 Å²	124.9	68%	0.678	72%	0.716	S	S	*	*			trans	-100.3	101.1	167.5	0	0	0	0	0	109.8	D57 E61	D57-A59 PolarHBondContact O-N 2.83Å; A59-E61 PolarHBondContact O-N 3.31Å
60	L	52.5	Low	51	Low	163 Å²	163	119.7 Å²	119.7	85%	0.853	69%	0.689	S	S	*	*			trans	-50.6	104.2	152.4	-109.2	87.7	0	0	0	107.6	S62	L60-S62 PolarHBondContact O-N 3.23Å
61	E	46	Very low	53.4	Low	191 Å²	191	114.8 Å²	114.8	89%	0.893	65%	0.654	S	S	*	*			trans	-74.3	81.9	161	-69.1	-161.7	105.1	0	0	107.2	A59 D63	A59-E61 PolarHBondContact O-N 3.31Å; E61-D63 PolarHBondContact O-N 2.8Å
62	S	44.7	Very low	55.1	Low	94 Å²	94	109.2 Å²	109.2	66%	0.657	63%	0.626	S	S	*	*			trans	-58.6	127.3	163.8	53.7	0	0	0	0	108.5	L60 V64	L60-S62 PolarHBondContact O-N 3.23Å; S62-V64 VanDerWaalsContact C-N 3.27Å; S62-V64 PolarHBondContact O-N 3.01Å
63	D	36	Very low	56.6	Low	150 Å²	150	103 Å²	103	80%	0.802	59%	0.594	S	S	*	*			trans	-48.5	83.8	171.4	-67.7	-82.5	0	0	0	112.2	E61 S65	E61-D63 PolarHBondContact O-N 2.8Å; D63-S65 PolarHBondContact O-N 3.43Å
64	V	42.4	Very low	57.7	Low	119 Å²	119	101.9 Å²	101.9	72%	0.721	58%	0.581	S	S	*	*			trans	-79.1	110.2	154.4	66.4	0	0	0	0	105.6	S62 T66	S62-V64 VanDerWaalsContact C-N 3.27Å; S62-V64 PolarHBondContact O-N 3.01Å; V64-T66 PolarHBondContact O-N 2.98Å
65	S	38.5	Very low	58.4	Low	117 Å²	117	95.3 Å²	95.3	82%	0.818	55%	0.547	S	S	*	.			trans	-59	62.7	174.3	-175.6	0	0	0	0	111.5	D63 S67	D63-S65 PolarHBondContact O-N 3.43Å; S65-S67 PolarHBondContact O-N 3.37Å; S65-S67 VanDerWaalsContact O-N 3.12Å
66	T	43.5	Very low	58.8	Low	102 Å²	102	89.4 Å²	89.4	63%	0.626	53%	0.529	S	S	*	.			trans	-66.9	105.9	157.8	-54.8	0	0	0	0	103.4	V64 S68	V64-T66 PolarHBondContact O-N 2.98Å; T66-S68 PolarHBondContact O-N 2.85Å; T66-S68 PolarHBondContact O-OG 2.86Å
67	S	53.8	Low	59.6	Low	76 Å²	76	87.1 Å²	87.1	53%	0.531	52%	0.516	S	S	.	.			trans	-48.7	96.4	177.4	59.7	0	0	0	0	107.8	S65 E69	S65-S67 PolarHBondContact O-N 3.37Å; S65-S67 VanDerWaalsContact O-N 3.12Å; S67-E69 PolarHBondContact O-N 3.47Å
68	S	67.8	Low	60.9	Low	25 Å²	25	80.6 Å²	80.6	18%	0.175	48%	0.482	C	S	.	.			trans	-72.1	112.6	-178.5	-73.4	0	0	0	0	104.2	T66 Y70 R111	T66-S68 PolarHBondContact O-N 2.85Å; T66-S68 PolarHBondContact O-OG 2.86Å; S68-Y70 WeakPolarHBondContact O-CD2 3.35Å; S68-Y70 WeakPolarHBondContact O-CE2 3.29Å; S68-Y70 PolarHBondContact O-N 2.97Å; S68-R111 PolarHBondContact OG-NE 3.05Å; S68-R111 PolarHBondContact OG-NH2 3.12Å
69	E	82.3	Confident	62.4	Low	80 Å²	80	77.9 Å²	77.9	37%	0.374	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	132.1	176.9	-65.8	-171.8	93.9	0	0	108.4	S67 R80 I112	S67-E69 PolarHBondContact O-N 3.47Å; E69-R80 WeakPolarHBondContact OE1-CD 3.41Å; E69-R80 IonicContact OE1-CZ 3.11Å; E69-R80 IonicContact OE1-NH1 3.68Å; E69-R80 PolarHBondContact OE1-NH1 3.15Å; E69-R80 IonicContact OE2-NH1 2.86Å; E69-R80 PolarHBondContact OE2-NH1 3.06Å; E69-R80 VanDerWaalsContact OE2-NH1 3.15Å; E69-I112 HydrophobicContact CB-CD1 4.14Å; E69-I112 PolarHBondContact O-N 3.16Å
70	Y	89.5	Confident	64.3	Low	16 Å²	16	80.1 Å²	80.1	6%	0.063	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144.7	172.3	-71.7	-103.4	0	0	0	108.9	S68 R80 V81 V83 W92 V109 A110 R111	S68-Y70 WeakPolarHBondContact O-CD2 3.35Å; S68-Y70 WeakPolarHBondContact O-CE2 3.29Å; S68-Y70 PolarHBondContact O-N 2.97Å; Y70-R80 CarbonylContact O-C 3.57Å; Y70-R80 WeakPolarHBondContact O-CA 3.36Å; Y70-V81 PolarHBondContact N-O 2.94Å; Y70-V81 PolarHBondContact O-N 2.9Å; Y70-V83 HydrophobicContact CD1-CG2 4.14Å; Y70-V83 HydrophobicContact CD2-CB 3.73Å; Y70-V83 HydrophobicContact CD2-CG2 3.26Å; Y70-V83 HydrophobicContact CE1-CG2 4.48Å; Y70-V83 HydrophobicContact CE2-CB 3.73Å; Y70-V83 HydrophobicContact CE2-CG2 3.68Å; Y70-V83 HydrophobicContact CG-CB 4.47Å; Y70-V83 HydrophobicContact CG-CG2 3.54Å; Y70-W92 HydrophobicContact CD1-CZ3 4.06Å; Y70-W92 HydrophobicContact CE1-CE3 4.42Å; Y70-W92 HydrophobicContact CE1-CH2 4.18Å; Y70-W92 AromaticContact CE1-CZ3 3.51Å; Y70-W92 HydrophobicContact CE1-CZ3 3.51Å; Y70-V109 HydrophobicContact CD1-CB 4.22Å; Y70-V109 HydrophobicContact CD1-CG2 4.05Å; Y70-A110 WeakPolarHBondContact CA-O 3.41Å; Y70-R111 HydrophobicContact CD1-CB 4.07Å; Y70-R111 HydrophobicContact CE1-CB 3.78Å; Y70-R111 HydrophobicContact CE1-CG 4.42Å
71	C	87.7	Confident	66	Low	0 Å²	0	72.8 Å²	72.8	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	137.5	167.9	-171.9	0	0	0	0	108.8	S73 E79 V109 A110 I112 T118 F143	C71-S73 PolarHBondContact O-N 2.81Å; C71-E79 CarbonylContact C-O 3.57Å; C71-E79 WeakPolarHBondContact CA-O 3.43Å; C71-V109 CarbonylContact O-C 3.44Å; C71-V109 VanDerWaalsContact O-CA 3.26Å; C71-V109 WeakPolarHBondContact O-CA 3.29Å; C71-A110 PolarHBondContact N-O 3.46Å; C71-A110 PolarHBondContact O-N 3.27Å; C71-I112 HydrophobicContact CB-CD1 4.12Å; C71-I112 HydrophobicContact CB-CG1 4.13Å; C71-T118 HydrophobicContact CB-CG2 3.83Å; C71-F143 HydrophobicContact CB-CE1 3.8Å; C71-F143 HydrophobicContact CB-CZ 4.04Å
72	I	81.4	Confident	68.1	Low	29 Å²	29	65.5 Å²	65.5	15%	0.149	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	114.5	163.8	-62	169.1	0	0	0	106.9	S74 T75 E79 V81 C108 V109	I72-S74 WeakPolarHBondContact CG2-OG 3.43Å; I72-T75 HydrophobicContact CG2-CG2 3.98Å; I72-T75 WeakPolarHBondContact CG2-OG1 3.27Å; I72-E79 HydrophobicContact CB-CB 4.34Å; I72-E79 HydrophobicContact CD1-CB 3.9Å; I72-E79 HydrophobicContact CG1-CB 4.42Å; I72-E79 PolarHBondContact N-O 2.77Å; I72-V81 HydrophobicContact CD1-CG2 3.47Å; I72-V81 VanDerWaalsContact CD1-CG2 3.47Å; I72-V81 HydrophobicContact CG1-CG2 3.61Å; I72-C108 CarbonylContact C-O 3.59Å; I72-C108 WeakPolarHBondContact CA-O 3.42Å; I72-V109 HydrophobicContact CG1-CG1 4.16Å
73	S	75.9	Confident	70.3	Confident	18 Å²	18	61.9 Å²	61.9	13%	0.126	35%	0.352	C	S	.	.			trans	-92	-16.3	-179.7	63	0	0	0	0	112.8	C71 T75 C108 E158	C71-S73 PolarHBondContact O-N 2.81Å; S73-T75 VanDerWaalsContact C-N 3.29Å; S73-T75 PolarHBondContact O-N 2.84Å; S73-C108 PolarHBondContact N-O 2.65Å; S73-E158 WeakPolarHBondContact CB-OE2 3.25Å; S73-E158 PolarHBondContact OG-OE2 2.66Å
74	S	69.9	Low	72.9	Confident	65 Å²	65	59.8 Å²	59.8	46%	0.455	34%	0.336	S	S	.	.	S	Bend	trans	-77	-13.1	-178.3	57.9	0	0	0	0	114	I72	I72-S74 WeakPolarHBondContact CG2-OG 3.43Å
75	T	62.5	Low	75.2	Confident	29 Å²	29	56.7 Å²	56.7	18%	0.178	32%	0.315	C	S	.	.	S	Bend	trans	-103.3	142.9	179.6	48.6	0	0	0	0	110.8	L10 I72 S73 K77	L10-T75 HydrophobicContact CD2-CG2 4.03Å; I72-T75 HydrophobicContact CG2-CG2 3.98Å; I72-T75 WeakPolarHBondContact CG2-OG1 3.27Å; S73-T75 VanDerWaalsContact C-N 3.29Å; S73-T75 PolarHBondContact O-N 2.84Å; T75-K77 PolarHBondContact O-N 2.78Å; T75-K77 PolarHBondContact OG1-O 3.29Å
76	A	63.4	Low	77.7	Confident	56 Å²	56	57.5 Å²	57.5	46%	0.463	30%	0.3	S	S	.	.	S	Bend	trans	-61.8	-12.9	172.5	0	0	0	0	0	113	Q120 D139 R173	A76-Q120 PolarHBondContact O-OE1 3.21Å; A76-Q120 VanDerWaalsContact O-OE1 3.1Å; A76-D139 HydrophobicContact CB-CB 4.49Å; A76-R173 PolarHBondContact O-NH1 3.45Å
77	K	69.6	Low	80	Confident	143 Å²	143	56.9 Å²	56.9	62%	0.622	31%	0.306	S	S	*	.	S	Bend	trans	-103.3	135.6	171.9	-65.2	-177.1	-179.6	179.8	0	109.1	T75 E79	T75-K77 PolarHBondContact O-N 2.78Å; T75-K77 PolarHBondContact OG1-O 3.29Å; K77-E79 PolarHBondContact O-N 2.87Å
78	T	73.4	Confident	81.8	Confident	22 Å²	22	55.7 Å²	55.7	14%	0.135	29%	0.293	C	S	.	.			trans	-73.8	101.2	172.5	47.3	0	0	0	0	108.6	V141 R173	T78-V141 HydrophobicContact CG2-CB 4.4Å; T78-V141 HydrophobicContact CG2-CG1 3.78Å; T78-V141 HydrophobicContact CG2-CG2 3.69Å; T78-R173 WeakPolarHBondContact OG1-CB 3.2Å
79	E	82.6	Confident	82.9	Confident	58 Å²	58	59 Å²	59	27%	0.271	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.8	174.7	-67.4	-167	143	0	0	110	C71 I72 K77 K96	C71-E79 CarbonylContact C-O 3.57Å; C71-E79 WeakPolarHBondContact CA-O 3.43Å; I72-E79 HydrophobicContact CB-CB 4.34Å; I72-E79 HydrophobicContact CD1-CB 3.9Å; I72-E79 HydrophobicContact CG1-CB 4.42Å; I72-E79 PolarHBondContact N-O 2.77Å; K77-E79 PolarHBondContact O-N 2.87Å; E79-K96 HydrophobicContact CB-CD 4.41Å; E79-K96 IonicContact OE1-NZ 2.84Å; E79-K96 PolarHBondContact OE1-NZ 2.86Å; E79-K96 IonicContact OE2-NZ 3.64Å
80	R	86.9	Confident	83.3	Confident	129 Å²	129	60.3 Å²	60.3	49%	0.487	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	137.4	177.7	-61.8	-171.5	-175.9	-164.5	2.9	111	E69 Y70 I112	E69-R80 WeakPolarHBondContact OE1-CD 3.41Å; E69-R80 IonicContact OE1-CZ 3.11Å; E69-R80 IonicContact OE1-NH1 3.68Å; E69-R80 PolarHBondContact OE1-NH1 3.15Å; E69-R80 IonicContact OE2-NH1 2.86Å; E69-R80 PolarHBondContact OE2-NH1 3.06Å; E69-R80 VanDerWaalsContact OE2-NH1 3.15Å; Y70-R80 CarbonylContact O-C 3.57Å; Y70-R80 WeakPolarHBondContact O-CA 3.36Å; R80-I112 HydrophobicContact CG-CD1 4.44Å
81	V	88.4	Confident	83.4	Confident	9 Å²	9	65.5 Å²	65.5	6%	0.055	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.5	177.4	172.5	0	0	0	0	109.1	Y70 I72 V83 Y95 F104	Y70-V81 PolarHBondContact N-O 2.94Å; Y70-V81 PolarHBondContact O-N 2.9Å; I72-V81 HydrophobicContact CD1-CG2 3.47Å; I72-V81 VanDerWaalsContact CD1-CG2 3.47Å; I72-V81 HydrophobicContact CG1-CG2 3.61Å; V81-V83 HydrophobicContact CG1-CG2 4.47Å; V81-Y95 WeakPolarHBondContact CA-O 3.4Å; V81-F104 HydrophobicContact CG1-CE1 3.78Å; V81-F104 HydrophobicContact CG1-CZ 3.67Å
82	V	90.2	Very high	83.6	Confident	38 Å²	38	67.7 Å²	67.7	23%	0.23	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114	168	-179.9	0	0	0	0	107.7	G94 Y95	V82-G94 CarbonylContact O-C 3.59Å; V82-G94 WeakPolarHBondContact O-CA 3.3Å; V82-Y95 HydrophobicContact CB-CD1 4.19Å; V82-Y95 HydrophobicContact CB-CE1 3.7Å; V82-Y95 HydrophobicContact CB-CE2 4.12Å; V82-Y95 HydrophobicContact CG1-CE1 3.73Å; V82-Y95 HydrophobicContact CG2-CE1 4.44Å; V82-Y95 HydrophobicContact CG2-CE2 4.08Å; V82-Y95 PolarHBondContact N-O 2.79Å; V82-Y95 PolarHBondContact O-N 2.64Å
83	V	91.1	Very high	84	Confident	18 Å²	18	69.2 Å²	69.2	11%	0.109	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.8	174.3	-179.8	0	0	0	0	108.6	Y70 V81 R86 W92 F104	Y70-V83 HydrophobicContact CD1-CG2 4.14Å; Y70-V83 HydrophobicContact CD2-CB 3.73Å; Y70-V83 HydrophobicContact CD2-CG2 3.26Å; Y70-V83 HydrophobicContact CE1-CG2 4.48Å; Y70-V83 HydrophobicContact CE2-CB 3.73Å; Y70-V83 HydrophobicContact CE2-CG2 3.68Å; Y70-V83 HydrophobicContact CG-CB 4.47Å; Y70-V83 HydrophobicContact CG-CG2 3.54Å; V81-V83 HydrophobicContact CG1-CG2 4.47Å; V83-R86 HydrophobicContact CG1-CG 3.52Å; V83-W92 HydrophobicContact CG1-CB 4.24Å; V83-W92 HydrophobicContact CG1-CD2 4.41Å; V83-W92 HydrophobicContact CG1-CE3 4.07Å; V83-W92 HydrophobicContact CG2-CE3 4.2Å; V83-F104 HydrophobicContact CG2-CE2 4.16Å; V83-F104 HydrophobicContact CG2-CZ 3.92Å
84	F	91	Very high	84.7	Confident	106 Å²	106	68.5 Å²	68.5	47%	0.465	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	-15.9	178.9	62.9	-101.8	0	0	0	113.9	Q93 G94 Y95 A101	F84-Q93 HydrophobicContact CD2-CB 4.42Å; F84-Q93 HydrophobicContact CE1-CB 4.37Å; F84-Q93 HydrophobicContact CE2-CB 3.68Å; F84-Q93 HydrophobicContact CZ-CB 3.65Å; F84-Q93 PolarHBondContact N-O 3.39Å; F84-G94 VanDerWaalsContact CE1-CA 3.43Å; F84-Y95 AromaticContact CD1-CD1 3.84Å; F84-Y95 HydrophobicContact CD1-CD1 3.84Å; F84-Y95 HydrophobicContact CD1-CE1 4.26Å; F84-Y95 AromaticContact CE1-CD1 3.99Å; F84-Y95 HydrophobicContact CE1-CD1 3.99Å; F84-A101 HydrophobicContact CE1-CB 3.77Å; F84-A101 HydrophobicContact CZ-CB 3.81Å
85	D	89.3	Confident	85.5	Confident	55 Å²	55	70.2 Å²	70.2	29%	0.294	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	126.3	174.4	179.8	9.2	0	0	0	110.4	A87 W92 Q93	D85-A87 VanDerWaalsContact OD1-CB 3.24Å; D85-A87 WeakPolarHBondContact OD1-CB 3.49Å; D85-A87 PolarHBondContact OD1-N 2.9Å; D85-W92 CarbonylContact O-C 3.56Å; D85-W92 WeakPolarHBondContact O-CA 3.44Å; D85-W92 WeakPolarHBondContact O-CB 3.09Å; D85-Q93 HydrophobicContact CB-CB 3.84Å; D85-Q93 HydrophobicContact CB-CG 3.79Å; D85-Q93 PolarHBondContact N-O 2.75Å; D85-Q93 PolarHBondContact O-N 2.94Å
86	R	92.2	Very high	86.6	Confident	133 Å²	133	71.5 Å²	71.5	50%	0.502	35%	0.354	S	S	.	.			trans	-128.8	17.6	-177.9	-57.8	173.4	-65.3	-172.5	4	111.5	V83 D88 W92	V83-R86 HydrophobicContact CG1-CG 3.52Å; R86-D88 VanDerWaalsContact C-N 3.26Å; R86-D88 PolarHBondContact O-N 3.05Å; R86-W92 HydrophobicContact CB-CG 4.48Å; R86-W92 HydrophobicContact CG-CD2 4.1Å; R86-W92 HydrophobicContact CG-CG 4.24Å
87	A	92.2	Very high	87.5	Confident	90 Å²	90	77.7 Å²	77.7	74%	0.744	37%	0.373	S	S	*	.	S	Bend	trans	-64.1	-32.5	-174.6	0	0	0	0	0	112.7	D85	D85-A87 VanDerWaalsContact OD1-CB 3.24Å; D85-A87 WeakPolarHBondContact OD1-CB 3.49Å; D85-A87 PolarHBondContact OD1-N 2.9Å
88	D	90.6	Very high	88.2	Confident	50 Å²	50	75 Å²	75	27%	0.267	39%	0.386	S	S	.	.	S	Bend	trans	-95.2	123.1	174	179.4	-29.6	0	0	0	109.3	R86 D90 W91 W92 R103	R86-D88 VanDerWaalsContact C-N 3.26Å; R86-D88 PolarHBondContact O-N 3.05Å; D88-D90 VanDerWaalsContact C-N 3.28Å; D88-D90 PolarHBondContact O-N 3.41Å; D88-D90 PolarHBondContact OD1-N 2.86Å; D88-W91 HydrophobicContact CB-CB 4.5Å; D88-W91 WeakPolarHBondContact CB-O 3.19Å; D88-W91 PolarHBondContact OD1-N 2.85Å; D88-W91 VanDerWaalsContact OD1-N 3.08Å; D88-W92 PolarHBondContact O-NE1 2.89Å; D88-R103 IonicContact OD2-CZ 3.65Å; D88-R103 IonicContact OD2-NH2 2.66Å; D88-R103 PolarHBondContact OD2-NH2 2.92Å
89	P	91.5	Very high	88.9	Confident	96 Å²	96	77.8 Å²	77.8	62%	0.623	40%	0.397	S	S	*	.	S	Bend	trans	-66.8	-27.9	-174.6	26.7	-34.8	0	0	0	113.6	S106	P89-S106 VanDerWaalsContact O-CB 3.31Å; P89-S106 WeakPolarHBondContact O-CB 3.35Å; P89-S106 PolarHBondContact O-OG 2.86Å
90	D	91.1	Very high	89	Confident	107 Å²	107	79.6 Å²	79.6	57%	0.572	42%	0.417	S	S	*	.	S	Bend	trans	-94	-28	-177.5	-67.9	-39.3	0	0	0	111.7	D88 P105 S106	D88-D90 VanDerWaalsContact C-N 3.28Å; D88-D90 PolarHBondContact O-N 3.41Å; D88-D90 PolarHBondContact OD1-N 2.86Å; D90-P105 CarbonylContact O-C 3.49Å; D90-P105 WeakPolarHBondContact O-CA 3.45Å; D90-S106 PolarHBondContact O-N 3.35Å
91	W	90.7	Very high	89.1	Confident	124 Å²	124	76.4 Å²	76.4	47%	0.47	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	100.7	-172.1	-69.9	88.4	0	0	0	113.6	D88 R103 F104 P105	D88-W91 HydrophobicContact CB-CB 4.5Å; D88-W91 WeakPolarHBondContact CB-O 3.19Å; D88-W91 PolarHBondContact OD1-N 2.85Å; D88-W91 VanDerWaalsContact OD1-N 3.08Å; W91-R103 HydrophobicContact CE3-CB 4.27Å; W91-R103 PolarHBondContact O-NH2 3.3Å; W91-F104 CarbonylContact C-O 3.55Å; W91-F104 WeakPolarHBondContact CA-O 3.3Å; W91-P105 HydrophobicContact CH2-CG 4.2Å; W91-P105 HydrophobicContact CZ3-CG 4.17Å
92	W	92.1	Very high	89	Confident	47 Å²	47	77.2 Å²	77.2	18%	0.178	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	162.7	177.3	-64.8	-6.7	0	0	0	112.3	Y70 V83 D85 R86 D88 R103 F104 V109	Y70-W92 HydrophobicContact CD1-CZ3 4.06Å; Y70-W92 HydrophobicContact CE1-CE3 4.42Å; Y70-W92 HydrophobicContact CE1-CH2 4.18Å; Y70-W92 AromaticContact CE1-CZ3 3.51Å; Y70-W92 HydrophobicContact CE1-CZ3 3.51Å; V83-W92 HydrophobicContact CG1-CB 4.24Å; V83-W92 HydrophobicContact CG1-CD2 4.41Å; V83-W92 HydrophobicContact CG1-CE3 4.07Å; V83-W92 HydrophobicContact CG2-CE3 4.2Å; D85-W92 CarbonylContact O-C 3.56Å; D85-W92 WeakPolarHBondContact O-CA 3.44Å; D85-W92 WeakPolarHBondContact O-CB 3.09Å; R86-W92 HydrophobicContact CB-CG 4.48Å; R86-W92 HydrophobicContact CG-CD2 4.1Å; R86-W92 HydrophobicContact CG-CG 4.24Å; D88-W92 PolarHBondContact O-NE1 2.89Å; W92-R103 CarbonylContact O-C 3.53Å; W92-R103 VanDerWaalsContact O-CA 3.23Å; W92-R103 WeakPolarHBondContact O-CA 3.25Å; W92-F104 HydrophobicContact CB-CD2 4.29Å; W92-F104 HydrophobicContact CB-CE2 3.77Å; W92-F104 HydrophobicContact CB-CZ 4.27Å; W92-F104 PolarHBondContact N-O 3.08Å; W92-F104 PolarHBondContact O-N 2.86Å; W92-V109 HydrophobicContact CE3-CG2 3.61Å; W92-V109 HydrophobicContact CZ3-CG2 3.61Å
93	Q	89.1	Confident	89	Confident	61 Å²	61	81.1 Å²	81.1	29%	0.285	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	142.1	169.2	-37.7	-169.3	-20.5	0	0	111.4	F84 D85 G102 R103	F84-Q93 HydrophobicContact CD2-CB 4.42Å; F84-Q93 HydrophobicContact CE1-CB 4.37Å; F84-Q93 HydrophobicContact CE2-CB 3.68Å; F84-Q93 HydrophobicContact CZ-CB 3.65Å; F84-Q93 PolarHBondContact N-O 3.39Å; D85-Q93 HydrophobicContact CB-CB 3.84Å; D85-Q93 HydrophobicContact CB-CG 3.79Å; D85-Q93 PolarHBondContact N-O 2.75Å; D85-Q93 PolarHBondContact O-N 2.94Å; Q93-G102 WeakPolarHBondContact CA-O 3.49Å; Q93-R103 HydrophobicContact CG-CG 4.1Å
94	G	90.1	Very high	88.8	Confident	2 Å²	2	81.9 Å²	81.9	2%	0.021	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	-179.4	-179.9	0	0	0	0	0	111.5	V82 F84 A101 G102 F104	V82-G94 CarbonylContact O-C 3.59Å; V82-G94 WeakPolarHBondContact O-CA 3.3Å; F84-G94 VanDerWaalsContact CE1-CA 3.43Å; G94-A101 CarbonylContact O-C 3.56Å; G94-A101 VanDerWaalsContact O-CA 3.29Å; G94-A101 WeakPolarHBondContact O-CA 3.43Å; G94-G102 PolarHBondContact N-O 3.33Å; G94-G102 VanDerWaalsContact N-O 3.1Å; G94-G102 PolarHBondContact O-N 3.38Å; G94-F104 VanDerWaalsContact N-CE1 3.34Å
95	Y	87.8	Confident	88.7	Confident	102 Å²	102	78.8 Å²	78.8	40%	0.4	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.8	174	65.2	-87.7	0	0	0	110.1	V81 V82 F84	V81-Y95 WeakPolarHBondContact CA-O 3.4Å; V82-Y95 HydrophobicContact CB-CD1 4.19Å; V82-Y95 HydrophobicContact CB-CE1 3.7Å; V82-Y95 HydrophobicContact CB-CE2 4.12Å; V82-Y95 HydrophobicContact CG1-CE1 3.73Å; V82-Y95 HydrophobicContact CG2-CE1 4.44Å; V82-Y95 HydrophobicContact CG2-CE2 4.08Å; V82-Y95 PolarHBondContact N-O 2.79Å; V82-Y95 PolarHBondContact O-N 2.64Å; F84-Y95 AromaticContact CD1-CD1 3.84Å; F84-Y95 HydrophobicContact CD1-CD1 3.84Å; F84-Y95 HydrophobicContact CD1-CE1 4.26Å; F84-Y95 AromaticContact CE1-CD1 3.99Å; F84-Y95 HydrophobicContact CE1-CD1 3.99Å
96	K	85	Confident	88.7	Confident	55 Å²	55	77.1 Å²	77.1	24%	0.239	42%	0.424	C	S	.	.			trans	-94	148.2	164.6	176.7	170.5	158.8	-148	0	108.5	E79 G98 E99	E79-K96 HydrophobicContact CB-CD 4.41Å; E79-K96 IonicContact OE1-NZ 2.84Å; E79-K96 PolarHBondContact OE1-NZ 2.86Å; E79-K96 IonicContact OE2-NZ 3.64Å; K96-G98 PolarHBondContact O-N 2.91Å; K96-E99 HydrophobicContact CB-CB 4.26Å; K96-E99 HydrophobicContact CB-CG 4.36Å; K96-E99 VanDerWaalsContact CD-OE1 3.32Å; K96-E99 WeakPolarHBondContact CD-OE1 3.44Å; K96-E99 WeakPolarHBondContact CE-OE1 3.47Å; K96-E99 IonicContact NZ-OE1 2.83Å; K96-E99 PolarHBondContact NZ-OE1 3.29Å; K96-E99 PolarHBondContact O-N 2.8Å
97	Q	82.3	Confident	88.4	Confident	186 Å²	186	76 Å²	76	87%	0.869	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	126	178.7	-169.7	-179	27.6	0	0	110.4	E99	Q97-E99 VanDerWaalsContact C-N 3.32Å
98	G	85.3	Confident	88.1	Confident	86 Å²	86	72.9 Å²	72.9	89%	0.887	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-2.5	-178.1	0	0	0	0	0	115.4	K96	K96-G98 PolarHBondContact O-N 2.91Å
99	E	86.3	Confident	88.1	Confident	81 Å²	81	71.2 Å²	71.2	38%	0.379	40%	0.396	S	S	.	.	S	Bend	trans	-113.1	155.5	178.3	-61.8	-173.7	-149.6	0	0	111.5	K96 Q97	K96-E99 HydrophobicContact CB-CB 4.26Å; K96-E99 HydrophobicContact CB-CG 4.36Å; K96-E99 VanDerWaalsContact CD-OE1 3.32Å; K96-E99 WeakPolarHBondContact CD-OE1 3.44Å; K96-E99 WeakPolarHBondContact CE-OE1 3.47Å; K96-E99 IonicContact NZ-OE1 2.83Å; K96-E99 PolarHBondContact NZ-OE1 3.29Å; K96-E99 PolarHBondContact O-N 2.8Å; Q97-E99 VanDerWaalsContact C-N 3.32Å
100	S	85.5	Confident	88	Confident	97 Å²	97	67 Å²	67	68%	0.678	37%	0.37	S	S	*	.			trans	-69.3	148.1	174	54.8	0	0	0	0	111.1
101	A	88.3	Confident	88	Confident	61 Å²	61	67.5 Å²	67.5	50%	0.504	36%	0.363	S	S	.	.			trans	-57.4	144.1	173.2	0	0	0	0	0	112.4	F84 G94	F84-A101 HydrophobicContact CE1-CB 3.77Å; F84-A101 HydrophobicContact CZ-CB 3.81Å; G94-A101 CarbonylContact O-C 3.56Å; G94-A101 VanDerWaalsContact O-CA 3.29Å; G94-A101 WeakPolarHBondContact O-CA 3.43Å
102	G	88.2	Confident	88.1	Confident	27 Å²	27	62.5 Å²	62.5	28%	0.278	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	173.3	-179.9	0	0	0	0	0	112.2	Q93 G94	Q93-G102 WeakPolarHBondContact CA-O 3.49Å; G94-G102 PolarHBondContact N-O 3.33Å; G94-G102 VanDerWaalsContact N-O 3.1Å; G94-G102 PolarHBondContact O-N 3.38Å
103	R	88.4	Confident	88.1	Confident	119 Å²	119	62.7 Å²	62.7	45%	0.449	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	146.1	172.1	-55.1	-166.3	72.3	-167.1	3.6	110.4	D88 W91 W92 Q93	D88-R103 IonicContact OD2-CZ 3.65Å; D88-R103 IonicContact OD2-NH2 2.66Å; D88-R103 PolarHBondContact OD2-NH2 2.92Å; W91-R103 HydrophobicContact CE3-CB 4.27Å; W91-R103 PolarHBondContact O-NH2 3.3Å; W92-R103 CarbonylContact O-C 3.53Å; W92-R103 VanDerWaalsContact O-CA 3.23Å; W92-R103 WeakPolarHBondContact O-CA 3.25Å; Q93-R103 HydrophobicContact CG-CG 4.1Å
104	F	87.1	Confident	88.2	Confident	34 Å²	34	64.7 Å²	64.7	15%	0.149	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154.8	174.4	43.8	-92.8	0	0	0	110.4	V81 V83 W91 W92 G94 S106 V109	V81-F104 HydrophobicContact CG1-CE1 3.78Å; V81-F104 HydrophobicContact CG1-CZ 3.67Å; V83-F104 HydrophobicContact CG2-CE2 4.16Å; V83-F104 HydrophobicContact CG2-CZ 3.92Å; W91-F104 CarbonylContact C-O 3.55Å; W91-F104 WeakPolarHBondContact CA-O 3.3Å; W92-F104 HydrophobicContact CB-CD2 4.29Å; W92-F104 HydrophobicContact CB-CE2 3.77Å; W92-F104 HydrophobicContact CB-CZ 4.27Å; W92-F104 PolarHBondContact N-O 3.08Å; W92-F104 PolarHBondContact O-N 2.86Å; G94-F104 VanDerWaalsContact N-CE1 3.34Å; F104-S106 PolarHBondContact O-N 2.77Å; F104-V109 HydrophobicContact CD2-CG1 3.9Å; F104-V109 HydrophobicContact CD2-CG2 4.27Å; F104-V109 HydrophobicContact CE2-CB 4.49Å; F104-V109 HydrophobicContact CE2-CG1 3.75Å; F104-V109 HydrophobicContact CE2-CG2 3.89Å
105	P	90.2	Very high	88.2	Confident	41 Å²	41	71 Å²	71	27%	0.266	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	135.1	171.5	-22.7	33.5	0	0	0	110.7	D90 W91 T107 C108	D90-P105 CarbonylContact O-C 3.49Å; D90-P105 WeakPolarHBondContact O-CA 3.45Å; W91-P105 HydrophobicContact CH2-CG 4.2Å; W91-P105 HydrophobicContact CZ3-CG 4.17Å; P105-T107 PolarHBondContact O-N 3.1Å; P105-T107 VanDerWaalsContact O-N 3.12Å; P105-C108 WeakPolarHBondContact O-CB 3.3Å; P105-C108 PolarHBondContact O-N 2.69Å
106	S	87.8	Confident	88.5	Confident	21 Å²	21	67 Å²	67	15%	0.147	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-57.9	-26.4	176.2	60.6	0	0	0	0	112.3	P89 D90 F104 C108 V109	P89-S106 VanDerWaalsContact O-CB 3.31Å; P89-S106 WeakPolarHBondContact O-CB 3.35Å; P89-S106 PolarHBondContact O-OG 2.86Å; D90-S106 PolarHBondContact O-N 3.35Å; F104-S106 PolarHBondContact O-N 2.77Å; S106-C108 VanDerWaalsContact C-N 3.31Å; S106-C108 PolarHBondContact O-N 3.37Å; S106-V109 WeakPolarHBondContact O-CG2 3.16Å; S106-V109 PolarHBondContact O-N 2.72Å
107	T	87.1	Confident	88.8	Confident	109 Å²	109	71.3 Å²	71.3	67%	0.669	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-73.1	-15.4	177.3	56.6	0	0	0	0	114.7	P105 V109	P105-T107 PolarHBondContact O-N 3.1Å; P105-T107 VanDerWaalsContact O-N 3.12Å; T107-V109 VanDerWaalsContact C-N 3.29Å
108	C	86.1	Confident	89.3	Confident	25 Å²	25	62.8 Å²	62.8	17%	0.169	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-81.8	-10	178	-69	0	0	0	0	113	I72 S73 P105 S106	I72-C108 CarbonylContact C-O 3.59Å; I72-C108 WeakPolarHBondContact CA-O 3.42Å; S73-C108 PolarHBondContact N-O 2.65Å; P105-C108 WeakPolarHBondContact O-CB 3.3Å; P105-C108 PolarHBondContact O-N 2.69Å; S106-C108 VanDerWaalsContact C-N 3.31Å; S106-C108 PolarHBondContact O-N 3.37Å
109	V	89	Confident	89.7	Confident	14 Å²	14	59.9 Å²	59.9	9%	0.085	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	150	-175.6	-65.8	0	0	0	0	111.8	Y70 C71 I72 W92 F104 S106 T107	Y70-V109 HydrophobicContact CD1-CB 4.22Å; Y70-V109 HydrophobicContact CD1-CG2 4.05Å; C71-V109 CarbonylContact O-C 3.44Å; C71-V109 VanDerWaalsContact O-CA 3.26Å; C71-V109 WeakPolarHBondContact O-CA 3.29Å; I72-V109 HydrophobicContact CG1-CG1 4.16Å; W92-V109 HydrophobicContact CE3-CG2 3.61Å; W92-V109 HydrophobicContact CZ3-CG2 3.61Å; F104-V109 HydrophobicContact CD2-CG1 3.9Å; F104-V109 HydrophobicContact CD2-CG2 4.27Å; F104-V109 HydrophobicContact CE2-CB 4.49Å; F104-V109 HydrophobicContact CE2-CG1 3.75Å; F104-V109 HydrophobicContact CE2-CG2 3.89Å; S106-V109 WeakPolarHBondContact O-CG2 3.16Å; S106-V109 PolarHBondContact O-N 2.72Å; T107-V109 VanDerWaalsContact C-N 3.29Å
110	A	90.7	Very high	90	Very high	8 Å²	8	56.4 Å²	56.4	7%	0.066	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137.3	170.4	0	0	0	0	0	110.3	Y70 C71 I112 F143 E158	Y70-A110 WeakPolarHBondContact CA-O 3.41Å; C71-A110 PolarHBondContact N-O 3.46Å; C71-A110 PolarHBondContact O-N 3.27Å; A110-I112 PolarHBondContact O-N 2.66Å; A110-F143 HydrophobicContact CB-CE2 3.55Å; A110-F143 HydrophobicContact CB-CZ 3.47Å; A110-F143 VanDerWaalsContact CB-CZ 3.47Å; A110-E158 HydrophobicContact CB-CB 4.07Å
111	R	91.6	Very high	90.5	Very high	117 Å²	117	51.8 Å²	51.8	44%	0.442	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	135.4	179.4	-172.1	177.2	-176.1	-170.7	3.7	109.6	S68 Y70 L113 R156	S68-R111 PolarHBondContact OG-NE 3.05Å; S68-R111 PolarHBondContact OG-NH2 3.12Å; Y70-R111 HydrophobicContact CD1-CB 4.07Å; Y70-R111 HydrophobicContact CE1-CB 3.78Å; Y70-R111 HydrophobicContact CE1-CG 4.42Å; R111-L113 HydrophobicContact CG-CD2 4.24Å; R111-R156 PolarHBondContact O-NH2 2.78Å
112	I	91.7	Very high	90.7	Very high	20 Å²	20	52.1 Å²	52.1	10%	0.103	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-86.6	118.6	166.7	-58	165.5	0	0	0	106.5	E69 C71 R80 A110 E116 T118 F143	E69-I112 HydrophobicContact CB-CD1 4.14Å; E69-I112 PolarHBondContact O-N 3.16Å; C71-I112 HydrophobicContact CB-CD1 4.12Å; C71-I112 HydrophobicContact CB-CG1 4.13Å; R80-I112 HydrophobicContact CG-CD1 4.44Å; A110-I112 PolarHBondContact O-N 2.66Å; I112-E116 HydrophobicContact CG2-CB 4.38Å; I112-T118 HydrophobicContact CD1-CG2 3.92Å; I112-T118 HydrophobicContact CG1-CG2 4.04Å; I112-F143 HydrophobicContact CG1-CD1 4.06Å; I112-F143 HydrophobicContact CG1-CE1 3.69Å
113	L	92.8	Very high	91	Very high	50 Å²	50	53.2 Å²	53.2	26%	0.262	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-81.1	158.9	177.3	-55.6	178	0	0	0	110.3	R111 N115 E116	R111-L113 HydrophobicContact CG-CD2 4.24Å; L113-N115 PolarHBondContact O-N 3.39Å; L113-E116 HydrophobicContact CB-CG 4.16Å; L113-E116 VanDerWaalsContact CB-OE2 3.25Å; L113-E116 WeakPolarHBondContact CB-OE2 3.36Å; L113-E116 WeakPolarHBondContact CG-OE2 3.43Å; L113-E116 PolarHBondContact N-OE2 3.33Å; L113-E116 WeakPolarHBondContact O-CB 3.45Å; L113-E116 PolarHBondContact O-N 3.02Å; L113-E116 VanDerWaalsContact O-N 3.1Å
114	P	90.7	Very high	91.4	Very high	104 Å²	104	51.4 Å²	51.4	68%	0.675	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	140.6	170.2	-25.7	34.9	0	0	0	111.1	E116	P114-E116 PolarHBondContact O-N 3.05Å
115	N	91.4	Very high	91.8	Very high	135 Å²	135	49.9 Å²	49.9	72%	0.722	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	6	-177.4	-50.1	-42.9	0	0	0	116	L113 P146	L113-N115 PolarHBondContact O-N 3.39Å; N115-P146 WeakPolarHBondContact O-CD 3.09Å
116	E	93	Very high	92	Very high	17 Å²	17	49.7 Å²	49.7	8%	0.079	26%	0.26	C	S	.	.			trans	-95.3	149	171.8	-66.8	176.3	160.7	0	0	111.9	I112 L113 P114 F143 A144 Q145 R156	I112-E116 HydrophobicContact CG2-CB 4.38Å; L113-E116 HydrophobicContact CB-CG 4.16Å; L113-E116 VanDerWaalsContact CB-OE2 3.25Å; L113-E116 WeakPolarHBondContact CB-OE2 3.36Å; L113-E116 WeakPolarHBondContact CG-OE2 3.43Å; L113-E116 PolarHBondContact N-OE2 3.33Å; L113-E116 WeakPolarHBondContact O-CB 3.45Å; L113-E116 PolarHBondContact O-N 3.02Å; L113-E116 VanDerWaalsContact O-N 3.1Å; P114-E116 PolarHBondContact O-N 3.05Å; E116-F143 HydrophobicContact CB-CB 4.19Å; E116-F143 HydrophobicContact CG-CB 4.35Å; E116-F143 WeakPolarHBondContact OE2-CB 3.26Å; E116-A144 CarbonylContact C-O 3.48Å; E116-A144 VanDerWaalsContact CA-O 3.27Å; E116-A144 WeakPolarHBondContact CA-O 3.33Å; E116-Q145 HydrophobicContact CG-CG 4.39Å; E116-R156 IonicContact OE1-CZ 2.64Å; E116-R156 IonicContact OE1-NE 3.82Å; E116-R156 PolarHBondContact OE1-NE 3.04Å; E116-R156 IonicContact OE1-NH2 3.39Å; E116-R156 IonicContact OE2-CZ 3.76Å; E116-R156 IonicContact OE2-NE 3.9Å; E116-R156 PolarHBondContact OE2-NE 3.06Å; E116-R156 IonicContact OE2-NH2 2.72Å; E116-R156 PolarHBondContact OE2-NH2 2.91Å
117	R	91.6	Very high	92.3	Very high	145 Å²	145	48.7 Å²	48.7	55%	0.547	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.1	170	-60.7	-177.8	-176.5	-137.9	-2.9	109.5	M119 F143 A144	R117-M119 HydrophobicContact CB-SD 4.48Å; R117-M119 PolarHBondContact O-N 3.49Å; R117-F143 CarbonylContact O-C 3.46Å; R117-F143 WeakPolarHBondContact O-CA 3.42Å; R117-A144 PolarHBondContact N-O 2.7Å; R117-A144 PolarHBondContact O-N 2.72Å
118	T	92.6	Very high	92.6	Very high	7 Å²	7	48 Å²	48	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.6	171.9	47.6	0	0	0	0	109.4	C71 I112 F143	C71-T118 HydrophobicContact CB-CG2 3.83Å; I112-T118 HydrophobicContact CD1-CG2 3.92Å; I112-T118 HydrophobicContact CG1-CG2 4.04Å; T118-F143 HydrophobicContact CG2-CD1 3.96Å; T118-F143 HydrophobicContact CG2-CE1 3.78Å
119	M	93.7	Very high	92.7	Very high	25 Å²	25	47 Å²	47	12%	0.123	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	150.2	179.5	-56.5	-70.9	-75.8	0	0	110.1	R117 V141 V142 A144 L170 L171 Q172	R117-M119 HydrophobicContact CB-SD 4.48Å; R117-M119 PolarHBondContact O-N 3.49Å; M119-V141 WeakPolarHBondContact O-CA 3.42Å; M119-V142 HydrophobicContact CB-CG2 4.1Å; M119-V142 PolarHBondContact N-O 2.86Å; M119-V142 PolarHBondContact O-N 3.49Å; M119-A144 HydrophobicContact CB-CB 4.28Å; M119-A144 HydrophobicContact CG-CB 3.36Å; M119-L170 HydrophobicContact CB-CB 4.1Å; M119-L170 HydrophobicContact CE-CB 3.68Å; M119-L170 HydrophobicContact CG-CB 4.49Å; M119-L171 WeakPolarHBondContact CA-O 3.37Å; M119-Q172 HydrophobicContact CE-CB 3.98Å; M119-Q172 VanDerWaalsContact CE-N 3.32Å; M119-Q172 WeakPolarHBondContact SD-CA 3.43Å; M119-Q172 HydrophobicContact SD-CB 3.56Å; M119-Q172 VanDerWaalsContact SD-CB 3.56Å; M119-Q172 HydrophobicContact SD-CG 3.94Å
120	Q	93.5	Very high	92.7	Very high	9 Å²	9	48.5 Å²	48.5	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.4	174.9	-177.5	170	-30.9	0	0	111.3	A76 V122 D139 L170 L171	A76-Q120 PolarHBondContact O-OE1 3.21Å; A76-Q120 VanDerWaalsContact O-OE1 3.1Å; Q120-V122 PolarHBondContact O-N 3.49Å; Q120-D139 PolarHBondContact NE2-OD1 2.81Å; Q120-L170 WeakPolarHBondContact O-CA 3.31Å; Q120-L171 PolarHBondContact N-O 3.08Å; Q120-L171 PolarHBondContact O-N 2.83Å
121	V	94.1	Very high	92.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123.8	176.2	174.7	0	0	0	0	110.3	Q123 L125 L136 Y137 D139 Q140 V142 L170	V121-Q123 WeakPolarHBondContact CG1-O 2.97Å; V121-L125 HydrophobicContact CG1-CD1 4.47Å; V121-L125 HydrophobicContact CG1-CG 4.48Å; V121-L136 HydrophobicContact CG1-CB 4.11Å; V121-L136 HydrophobicContact CG2-CB 4.12Å; V121-L136 HydrophobicContact CG2-CD1 3.9Å; V121-L136 HydrophobicContact CG2-CG 4.49Å; V121-Y137 VanDerWaalsContact CB-O 3.3Å; V121-Y137 WeakPolarHBondContact CB-O 3.24Å; V121-Y137 VanDerWaalsContact CG1-O 3.24Å; V121-Y137 WeakPolarHBondContact CG1-O 3.3Å; V121-D139 PolarHBondContact O-N 2.74Å; V121-Q140 HydrophobicContact CB-CB 4.39Å; V121-Q140 HydrophobicContact CG2-CB 4.29Å; V121-Q140 WeakPolarHBondContact CG2-O 3.35Å; V121-Q140 PolarHBondContact N-O 3.16Å; V121-V142 HydrophobicContact CG2-CG1 3.99Å; V121-V142 HydrophobicContact CG2-CG2 4.35Å; V121-L170 HydrophobicContact CG2-CD2 4.15Å
122	V	94.5	Very high	92.6	Very high	68 Å²	68	48.9 Å²	48.9	41%	0.412	27%	0.267	S	S	.	.	S	Bend	trans	-77.5	-28.1	-173.8	178.4	0	0	0	0	112.8	Q120 R138 Y169 L171	Q120-V122 PolarHBondContact O-N 3.49Å; V122-R138 PolarHBondContact O-NE 2.92Å; V122-Y169 PolarHBondContact N-O 3.04Å; V122-L171 HydrophobicContact CG2-CB 3.98Å
123	Q	94.3	Very high	92.6	Very high	50 Å²	50	51.5 Å²	51.5	23%	0.234	28%	0.281	C	S	.	.	S	Bend	trans	-154	163.9	179.8	64.2	176.6	-3.6	0	0	111.2	V121 L125 Y169	V121-Q123 WeakPolarHBondContact CG1-O 2.97Å; Q123-L125 HydrophobicContact CG-CD2 3.76Å; Q123-L125 WeakPolarHBondContact O-CG 3.08Å; Q123-L125 PolarHBondContact O-N 3.28Å; Q123-Y169 HydrophobicContact CG-CD1 4.22Å
124	N	95.8	Very high	92.8	Very high	80 Å²	80	49.7 Å²	49.7	43%	0.428	27%	0.272	S	S	.	.			trans	-60.2	128	174.3	-60.9	-13.5	0	0	0	110.6	L136 Y137 R138	N124-L136 CarbonylContact C-O 3.6Å; N124-L136 WeakPolarHBondContact CA-O 3.34Å; N124-Y137 WeakPolarHBondContact OD1-CA 3.44Å; N124-R138 PolarHBondContact OD1-N 3.18Å
125	L	95.5	Very high	93	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.6	178.6	-53.7	176.5	0	0	0	110.2	F40 V121 Q123 L127 R135 L136 Y169	F40-L125 HydrophobicContact CD2-CD2 4.23Å; F40-L125 HydrophobicContact CE2-CD2 3.66Å; V121-L125 HydrophobicContact CG1-CD1 4.47Å; V121-L125 HydrophobicContact CG1-CG 4.48Å; Q123-L125 HydrophobicContact CG-CD2 3.76Å; Q123-L125 WeakPolarHBondContact O-CG 3.08Å; Q123-L125 PolarHBondContact O-N 3.28Å; L125-L127 HydrophobicContact CB-CD2 4.25Å; L125-L127 HydrophobicContact CB-CG 4.22Å; L125-L127 HydrophobicContact CD1-CD2 4.37Å; L125-R135 WeakPolarHBondContact O-CA 3.45Å; L125-L136 HydrophobicContact CB-CB 4.35Å; L125-L136 HydrophobicContact CD1-CD1 4.27Å; L125-L136 PolarHBondContact N-O 3.08Å; L125-L136 PolarHBondContact O-N 3.41Å; L125-Y169 HydrophobicContact CD1-CD2 4.15Å; L125-Y169 HydrophobicContact CD1-CG 4.04Å; L125-Y169 HydrophobicContact CD2-CD1 4.13Å; L125-Y169 HydrophobicContact CD2-CD2 3.95Å; L125-Y169 HydrophobicContact CD2-CE2 4.45Å; L125-Y169 HydrophobicContact CD2-CG 3.78Å
126	N	95.1	Very high	93.2	Very high	37 Å²	37	45.2 Å²	45.2	20%	0.198	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	107.8	161.9	-171.2	18.5	0	0	0	108.2	C39 F40 N133	C39-N126 WeakPolarHBondContact CA-O 3.35Å; F40-N126 PolarHBondContact N-O 3.28Å; N126-N133 PolarHBondContact OD1-ND2 2.89Å; N126-N133 PolarHBondContact OD1-OD1 3.28Å
127	L	94.6	Very high	93.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136	-176.5	-58.5	177.2	0	0	0	109.4	F40 V42 L125 N133 L134 L136 I155 I163 C165	F40-L127 HydrophobicContact CB-CD2 4.07Å; F40-L127 HydrophobicContact CD2-CD2 4.27Å; V42-L127 HydrophobicContact CG1-CD2 4.18Å; L125-L127 HydrophobicContact CB-CD2 4.25Å; L125-L127 HydrophobicContact CB-CG 4.22Å; L125-L127 HydrophobicContact CD1-CD2 4.37Å; L127-N133 WeakPolarHBondContact O-CA 3.45Å; L127-L134 PolarHBondContact N-O 2.89Å; L127-L134 PolarHBondContact O-N 3.14Å; L127-L136 HydrophobicContact CD1-CD1 3.87Å; L127-I155 HydrophobicContact CD1-CD1 4.21Å; L127-I163 HydrophobicContact CB-CD1 3.6Å; L127-I163 HydrophobicContact CB-CG1 4.18Å; L127-I163 HydrophobicContact CB-CG2 4.2Å; L127-I163 HydrophobicContact CD1-CG2 3.57Å; L127-C165 HydrophobicContact CD1-CB 3.94Å
128	W	92.4	Very high	93.2	Very high	94 Å²	94	50.3 Å²	50.3	36%	0.356	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	124.4	176.1	171.5	-109.6	0	0	0	110.6	F40 K41 V42 G130 T132 N133	F40-W128 PolarHBondContact O-N 2.87Å; K41-W128 CarbonylContact C-O 3.54Å; K41-W128 VanDerWaalsContact CA-O 3.3Å; K41-W128 WeakPolarHBondContact CA-O 3.43Å; V42-W128 PolarHBondContact N-O 3.3Å; W128-G130 VanDerWaalsContact CE2-N 3.34Å; W128-G130 VanDerWaalsContact CH2-C 3.43Å; W128-G130 WeakPolarHBondContact CH2-O 3.17Å; W128-G130 WeakPolarHBondContact CZ2-O 3.41Å; W128-T132 WeakPolarHBondContact CA-O 3.37Å; W128-T132 VanDerWaalsContact CZ3-C 3.48Å; W128-N133 HydrophobicContact CE3-CB 3.71Å; W128-N133 HydrophobicContact CZ3-CB 4.06Å
129	D	88.7	Confident	93.2	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.027	27%	0.268	C	S	.	.			trans	-105.2	1.1	-178.7	83	-17	0	0	0	114.1	V42 P44 S131 T132 I163	V42-D129 HydrophobicContact CG2-CB 3.63Å; V42-D129 WeakPolarHBondContact O-CA 3.49Å; P44-D129 WeakPolarHBondContact CG-O 3.22Å; D129-S131 WeakPolarHBondContact OD1-CA 3.4Å; D129-S131 PolarHBondContact OD1-N 3.02Å; D129-S131 PolarHBondContact OD1-OG 2.81Å; D129-S131 PolarHBondContact OD2-OG 2.86Å; D129-T132 PolarHBondContact N-O 2.94Å; D129-T132 PolarHBondContact OD1-N 2.89Å; D129-I163 HydrophobicContact CB-CD1 4.23Å; D129-I163 HydrophobicContact CB-CG1 4.21Å
130	G	89.4	Confident	93.1	Very high	44 Å²	44	54.9 Å²	54.9	45%	0.454	27%	0.274	S	S	.	.	S	Bend	trans	103.5	-19.5	-172	0	0	0	0	0	114	W128	W128-G130 VanDerWaalsContact CE2-N 3.34Å; W128-G130 VanDerWaalsContact CH2-C 3.43Å; W128-G130 WeakPolarHBondContact CH2-O 3.17Å; W128-G130 WeakPolarHBondContact CZ2-O 3.41Å
131	S	90.1	Very high	93	Very high	88 Å²	88	54.9 Å²	54.9	62%	0.615	27%	0.274	S	S	*	.	S	Bend	trans	-125.2	-37	179.3	71.6	0	0	0	0	112.6	D129	D129-S131 WeakPolarHBondContact OD1-CA 3.4Å; D129-S131 PolarHBondContact OD1-N 3.02Å; D129-S131 PolarHBondContact OD1-OG 2.81Å; D129-S131 PolarHBondContact OD2-OG 2.86Å
132	T	89.2	Confident	93	Very high	45 Å²	45	54.9 Å²	54.9	28%	0.276	27%	0.274	S	S	.	.			trans	-121.7	126.4	-170.6	-61.2	0	0	0	0	109.7	W128 D129 I163	W128-T132 WeakPolarHBondContact CA-O 3.37Å; W128-T132 VanDerWaalsContact CZ3-C 3.48Å; D129-T132 PolarHBondContact N-O 2.94Å; D129-T132 PolarHBondContact OD1-N 2.89Å; T132-I163 HydrophobicContact CG2-CD1 4.41Å; T132-I163 WeakPolarHBondContact O-CD1 3.07Å
133	N	92.5	Very high	93.1	Very high	75 Å²	75	51.7 Å²	51.7	40%	0.401	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.6	167.6	-174.4	-93.2	0	0	0	109	N126 L127 W128	N126-N133 PolarHBondContact OD1-ND2 2.89Å; N126-N133 PolarHBondContact OD1-OD1 3.28Å; L127-N133 WeakPolarHBondContact O-CA 3.45Å; W128-N133 HydrophobicContact CE3-CB 3.71Å; W128-N133 HydrophobicContact CZ3-CB 4.06Å
134	L	95.4	Very high	93.1	Very high	12 Å²	12	49.5 Å²	49.5	6%	0.063	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	117.3	178.4	-172.5	68.5	0	0	0	110.4	L127 L136 I155 T157 R161 I163	L127-L134 PolarHBondContact N-O 2.89Å; L127-L134 PolarHBondContact O-N 3.14Å; L134-L136 HydrophobicContact CD2-CD2 3.87Å; L134-L136 HydrophobicContact CD2-CG 4.4Å; L134-L136 HydrophobicContact CG-CD2 4.08Å; L134-L136 HydrophobicContact CG-CG 4.47Å; L134-I155 HydrophobicContact CD2-CD1 4.22Å; L134-T157 HydrophobicContact CD1-CG2 4.19Å; L134-T157 HydrophobicContact CD2-CG2 3.85Å; L134-R161 HydrophobicContact CD1-CB 3.99Å; L134-I163 HydrophobicContact CB-CD1 4.2Å; L134-I163 HydrophobicContact CB-CG2 4.09Å; L134-I163 HydrophobicContact CD2-CB 4.33Å; L134-I163 HydrophobicContact CD2-CG2 3.42Å; L134-I163 VanDerWaalsContact CD2-CG2 3.42Å; L134-I163 HydrophobicContact CG-CG2 4.37Å
135	R	95.8	Very high	93.1	Very high	146 Å²	146	49 Å²	49	55%	0.551	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.7	169.9	-171.1	172.6	-176.8	172.7	0.4	109.5	L125 Y137	L125-R135 WeakPolarHBondContact O-CA 3.45Å; R135-Y137 HydrophobicContact CG-CE2 4.28Å
136	L	94.7	Very high	93.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	147.4	171.2	-58.4	175.3	0	0	0	109.5	V121 N124 L125 L127 L134 V142 I155 T157	V121-L136 HydrophobicContact CG1-CB 4.11Å; V121-L136 HydrophobicContact CG2-CB 4.12Å; V121-L136 HydrophobicContact CG2-CD1 3.9Å; V121-L136 HydrophobicContact CG2-CG 4.49Å; N124-L136 CarbonylContact C-O 3.6Å; N124-L136 WeakPolarHBondContact CA-O 3.34Å; L125-L136 HydrophobicContact CB-CB 4.35Å; L125-L136 HydrophobicContact CD1-CD1 4.27Å; L125-L136 PolarHBondContact N-O 3.08Å; L125-L136 PolarHBondContact O-N 3.41Å; L127-L136 HydrophobicContact CD1-CD1 3.87Å; L134-L136 HydrophobicContact CD2-CD2 3.87Å; L134-L136 HydrophobicContact CD2-CG 4.4Å; L134-L136 HydrophobicContact CG-CD2 4.08Å; L134-L136 HydrophobicContact CG-CG 4.47Å; L136-V142 HydrophobicContact CD2-CG1 4.09Å; L136-I155 HydrophobicContact CD1-CD1 3.38Å; L136-I155 HydrophobicContact CD2-CD1 4.25Å; L136-I155 HydrophobicContact CG-CD1 4.34Å; L136-T157 HydrophobicContact CD2-CG2 4.08Å
137	Y	93.8	Very high	93.1	Very high	120 Å²	120	57.4 Å²	57.4	47%	0.471	29%	0.287	S	S	.	.			trans	-107.3	150.9	177.1	-63.5	-86.3	0	0	0	110.2	V121 N124 R135 D139 Q140	V121-Y137 VanDerWaalsContact CB-O 3.3Å; V121-Y137 WeakPolarHBondContact CB-O 3.24Å; V121-Y137 VanDerWaalsContact CG1-O 3.24Å; V121-Y137 WeakPolarHBondContact CG1-O 3.3Å; N124-Y137 WeakPolarHBondContact OD1-CA 3.44Å; R135-Y137 HydrophobicContact CG-CE2 4.28Å; Y137-D139 PolarHBondContact O-N 2.95Å; Y137-Q140 WeakPolarHBondContact O-CB 3.47Å; Y137-Q140 PolarHBondContact O-N 3.18Å; Y137-Q140 VanDerWaalsContact O-N 3.16Å
138	R	92.9	Very high	93	Very high	149 Å²	149	59.5 Å²	59.5	56%	0.562	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	141.7	169.4	178	179.1	-76.8	162.9	-0.5	109.2	V122 N124 Q140	V122-R138 PolarHBondContact O-NE 2.92Å; N124-R138 PolarHBondContact OD1-N 3.18Å; R138-Q140 PolarHBondContact O-N 3.18Å
139	D	91.1	Very high	93	Very high	76 Å²	76	64.7 Å²	64.7	41%	0.406	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	2.8	-179.9	-51.6	-36.9	0	0	0	115.2	A76 Q120 V121 Y137	A76-D139 HydrophobicContact CB-CB 4.49Å; Q120-D139 PolarHBondContact NE2-OD1 2.81Å; V121-D139 PolarHBondContact O-N 2.74Å; Y137-D139 PolarHBondContact O-N 2.95Å
140	Q	91.8	Very high	93.2	Very high	52 Å²	52	70.2 Å²	70.2	24%	0.243	36%	0.355	C	S	.	.			trans	-68.2	135.3	171.3	-173.2	174	5	0	0	110.7	V121 Y137 R138	V121-Q140 HydrophobicContact CB-CB 4.39Å; V121-Q140 HydrophobicContact CG2-CB 4.29Å; V121-Q140 WeakPolarHBondContact CG2-O 3.35Å; V121-Q140 PolarHBondContact N-O 3.16Å; Y137-Q140 WeakPolarHBondContact O-CB 3.47Å; Y137-Q140 PolarHBondContact O-N 3.18Å; Y137-Q140 VanDerWaalsContact O-N 3.16Å; R138-Q140 PolarHBondContact O-N 3.18Å
141	V	92.3	Very high	93.4	Very high	8 Å²	8	69.2 Å²	69.2	5%	0.048	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	134.1	171.9	178.7	0	0	0	0	110.1	T78 M119	T78-V141 HydrophobicContact CG2-CB 4.4Å; T78-V141 HydrophobicContact CG2-CG1 3.78Å; T78-V141 HydrophobicContact CG2-CG2 3.69Å; M119-V141 WeakPolarHBondContact O-CA 3.42Å
142	V	94.4	Very high	93.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	158.9	172.8	-61.6	0	0	0	0	110.3	M119 V121 L136 I155 L170	M119-V142 HydrophobicContact CB-CG2 4.1Å; M119-V142 PolarHBondContact N-O 2.86Å; M119-V142 PolarHBondContact O-N 3.49Å; V121-V142 HydrophobicContact CG2-CG1 3.99Å; V121-V142 HydrophobicContact CG2-CG2 4.35Å; L136-V142 HydrophobicContact CD2-CG1 4.09Å; V142-I155 HydrophobicContact CB-CB 4.34Å; V142-I155 HydrophobicContact CG1-CD1 4.27Å; V142-I155 HydrophobicContact CG2-CB 4.33Å; V142-I155 HydrophobicContact CG2-CG2 4.07Å; V142-L170 HydrophobicContact CG2-CD2 3.75Å
143	F	95.1	Very high	93.9	Very high	1 Å²	1	64.5 Å²	64.5	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	115.7	176	-54.2	-85	0	0	0	108.7	C71 A110 I112 E116 R117 T118 I155 R156	C71-F143 HydrophobicContact CB-CE1 3.8Å; C71-F143 HydrophobicContact CB-CZ 4.04Å; A110-F143 HydrophobicContact CB-CE2 3.55Å; A110-F143 HydrophobicContact CB-CZ 3.47Å; A110-F143 VanDerWaalsContact CB-CZ 3.47Å; I112-F143 HydrophobicContact CG1-CD1 4.06Å; I112-F143 HydrophobicContact CG1-CE1 3.69Å; E116-F143 HydrophobicContact CB-CB 4.19Å; E116-F143 HydrophobicContact CG-CB 4.35Å; E116-F143 WeakPolarHBondContact OE2-CB 3.26Å; R117-F143 CarbonylContact O-C 3.46Å; R117-F143 WeakPolarHBondContact O-CA 3.42Å; T118-F143 HydrophobicContact CG2-CD1 3.96Å; T118-F143 HydrophobicContact CG2-CE1 3.78Å; F143-I155 CarbonylContact O-C 3.59Å; F143-I155 VanDerWaalsContact O-CA 3.3Å; F143-I155 WeakPolarHBondContact O-CA 3.29Å; F143-R156 HydrophobicContact CB-CB 4.32Å; F143-R156 WeakPolarHBondContact CD2-O 3.35Å; F143-R156 PolarHBondContact N-O 3.25Å; F143-R156 PolarHBondContact O-N 2.86Å
144	A	95.4	Very high	94	Very high	4 Å²	4	62.2 Å²	62.2	3%	0.033	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.2	-171.2	0	0	0	0	0	111.1	E116 R117 M119 V153 I155	E116-A144 CarbonylContact C-O 3.48Å; E116-A144 VanDerWaalsContact CA-O 3.27Å; E116-A144 WeakPolarHBondContact CA-O 3.33Å; R117-A144 PolarHBondContact N-O 2.7Å; R117-A144 PolarHBondContact O-N 2.72Å; M119-A144 HydrophobicContact CB-CB 4.28Å; M119-A144 HydrophobicContact CG-CB 3.36Å; A144-V153 HydrophobicContact CB-CG1 3.54Å; A144-I155 HydrophobicContact CB-CG2 4.43Å
145	Q	95.4	Very high	94.1	Very high	71 Å²	71	61.7 Å²	61.7	33%	0.332	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-74.2	173.3	165.5	-68.6	-168.2	-8.1	0	0	111.3	E116 V153 E154	E116-Q145 HydrophobicContact CG-CG 4.39Å; Q145-V153 VanDerWaalsContact O-CG1 3.25Å; Q145-V153 WeakPolarHBondContact O-CG1 3.41Å; Q145-E154 HydrophobicContact CB-CB 4.35Å; Q145-E154 HydrophobicContact CG-CB 4.41Å; Q145-E154 PolarHBondContact N-O 3.45Å; Q145-E154 PolarHBondContact NE2-OE1 3.03Å
146	P	95.2	Very high	94.1	Very high	93 Å²	93	55 Å²	55	60%	0.604	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-57.1	145.5	171.3	-24.8	36.5	0	0	0	112	N115	N115-P146 WeakPolarHBondContact O-CD 3.09Å
147	E	94.9	Very high	94	Very high	122 Å²	122	55.3 Å²	55.3	57%	0.57	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-64	138.5	174.7	-171.4	178.2	146.4	0	0	110.9	G151 V153 A167	E147-G151 VanDerWaalsContact OE1-CA 3.32Å; E147-G151 WeakPolarHBondContact OE1-CA 3.37Å; E147-V153 HydrophobicContact CB-CG2 3.91Å; E147-V153 HydrophobicContact CG-CG2 4.13Å; E147-A167 HydrophobicContact CG-CB 4.1Å; E147-A167 WeakPolarHBondContact OE2-CB 3.44Å
148	D	92.6	Very high	93.9	Very high	45 Å²	45	53.5 Å²	53.5	24%	0.241	27%	0.269	C	S	.	.			trans	-84.5	-175.5	174.7	71.3	14.2	0	0	0	112.5	R43 D150 G151 L152	R43-D148 IonicContact CZ-OD2 3.97Å; R43-D148 IonicContact NE-OD2 3.43Å; R43-D148 PolarHBondContact NE-OD2 3.28Å; R43-D148 VanDerWaalsContact NE-OD2 3.11Å; R43-D148 IonicContact NH2-OD2 3.15Å; R43-D148 PolarHBondContact NH2-OD2 2.97Å; D148-D150 PolarHBondContact O-N 2.99Å; D148-D150 VanDerWaalsContact OD1-CA 3.31Å; D148-D150 WeakPolarHBondContact OD1-CA 3.32Å; D148-D150 WeakPolarHBondContact OD1-CB 2.93Å; D148-D150 PolarHBondContact OD1-N 3.5Å; D148-G151 PolarHBondContact O-N 2.92Å; D148-G151 PolarHBondContact OD1-N 3.37Å; D148-L152 PolarHBondContact N-O 2.99Å; D148-L152 PolarHBondContact OD1-N 3.37Å; D148-L152 WeakPolarHBondContact OD2-CB 3.37Å
149	Q	92.3	Very high	93.7	Very high	202 Å²	202	54.1 Å²	54.1	94%	0.944	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-16.2	179.2	-61.8	-179	-0.6	0	0	113.8
150	D	92.3	Very high	93.8	Very high	121 Å²	121	55.5 Å²	55.5	65%	0.647	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	4.1	-178.1	-64.8	-44	0	0	0	112.4	D148 L152	D148-D150 PolarHBondContact O-N 2.99Å; D148-D150 VanDerWaalsContact OD1-CA 3.31Å; D148-D150 WeakPolarHBondContact OD1-CA 3.32Å; D148-D150 WeakPolarHBondContact OD1-CB 2.93Å; D148-D150 PolarHBondContact OD1-N 3.5Å; D150-L152 VanDerWaalsContact C-N 3.29Å; D150-L152 HydrophobicContact CB-CD1 4.35Å; D150-L152 HydrophobicContact CB-CG 4.47Å; D150-L152 PolarHBondContact O-N 2.79Å
151	G	93.6	Very high	93.9	Very high	24 Å²	24	59.9 Å²	59.9	25%	0.247	30%	0.297	C	S	.	.	S	Bend	trans	73.2	20.2	-176.2	0	0	0	0	0	114.2	E147 D148 A167	E147-G151 VanDerWaalsContact OE1-CA 3.32Å; E147-G151 WeakPolarHBondContact OE1-CA 3.37Å; D148-G151 PolarHBondContact O-N 2.92Å; D148-G151 PolarHBondContact OD1-N 3.37Å; G151-A167 PolarHBondContact O-N 2.91Å
152	L	94.6	Very high	94	Very high	24 Å²	24	62.2 Å²	62.2	13%	0.126	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	149.1	176.7	-63.6	169.6	0	0	0	110.7	R43 D148 D150 P166	R43-L152 HydrophobicContact CB-CD1 4.45Å; R43-L152 HydrophobicContact CG-CD1 3.61Å; R43-L152 VanDerWaalsContact NE-CD1 3.3Å; D148-L152 PolarHBondContact N-O 2.99Å; D148-L152 PolarHBondContact OD1-N 3.37Å; D148-L152 WeakPolarHBondContact OD2-CB 3.37Å; D150-L152 VanDerWaalsContact C-N 3.29Å; D150-L152 HydrophobicContact CB-CD1 4.35Å; D150-L152 HydrophobicContact CB-CG 4.47Å; D150-L152 PolarHBondContact O-N 2.79Å; L152-P166 HydrophobicContact CD2-CB 4.32Å; L152-P166 HydrophobicContact CD2-CG 3.92Å
153	V	95.3	Very high	94.1	Very high	9 Å²	9	62.2 Å²	62.2	6%	0.055	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127.4	-178.1	173.7	0	0	0	0	108.2	A144 Q145 E147 I155 N164 C165 A167 L170	A144-V153 HydrophobicContact CB-CG1 3.54Å; Q145-V153 VanDerWaalsContact O-CG1 3.25Å; Q145-V153 WeakPolarHBondContact O-CG1 3.41Å; E147-V153 HydrophobicContact CB-CG2 3.91Å; E147-V153 HydrophobicContact CG-CG2 4.13Å; V153-I155 HydrophobicContact CG1-CG2 4.08Å; V153-I155 PolarHBondContact O-N 2.91Å; V153-N164 CarbonylContact O-C 3.55Å; V153-N164 WeakPolarHBondContact O-CA 3.43Å; V153-C165 PolarHBondContact N-O 3.44Å; V153-C165 PolarHBondContact O-N 3.37Å; V153-A167 HydrophobicContact CG2-CB 3.81Å; V153-L170 HydrophobicContact CB-CD1 4.2Å; V153-L170 HydrophobicContact CG1-CD1 4.15Å
154	E	96.2	Very high	94.2	Very high	27 Å²	27	62.3 Å²	62.3	13%	0.126	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	115.1	166.8	-175.3	-179.2	105.9	0	0	108.1	L45 Q145 R162	L45-E154 HydrophobicContact CD1-CG 4.49Å; L45-E154 HydrophobicContact CD2-CB 4.33Å; L45-E154 HydrophobicContact CD2-CG 3.88Å; L45-E154 VanDerWaalsContact CD2-OE2 3.29Å; L45-E154 WeakPolarHBondContact CD2-OE2 3.48Å; Q145-E154 HydrophobicContact CB-CB 4.35Å; Q145-E154 HydrophobicContact CG-CB 4.41Å; Q145-E154 PolarHBondContact N-O 3.45Å; Q145-E154 PolarHBondContact NE2-OE1 3.03Å; E154-R162 WeakPolarHBondContact OE1-CD 3.38Å; E154-R162 IonicContact OE1-CZ 3.11Å; E154-R162 IonicContact OE1-NE 2.85Å; E154-R162 IonicContact OE1-NH1 2.56Å; E154-R162 PolarHBondContact OE1-NH1 3.12Å
155	I	96.2	Very high	94.2	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	152.9	174.4	61	158.7	0	0	0	110.7	L127 L134 L136 V142 F143 A144 V153 R162 I163 C165 L170	L127-I155 HydrophobicContact CD1-CD1 4.21Å; L134-I155 HydrophobicContact CD2-CD1 4.22Å; L136-I155 HydrophobicContact CD1-CD1 3.38Å; L136-I155 HydrophobicContact CD2-CD1 4.25Å; L136-I155 HydrophobicContact CG-CD1 4.34Å; V142-I155 HydrophobicContact CB-CB 4.34Å; V142-I155 HydrophobicContact CG1-CD1 4.27Å; V142-I155 HydrophobicContact CG2-CB 4.33Å; V142-I155 HydrophobicContact CG2-CG2 4.07Å; F143-I155 CarbonylContact O-C 3.59Å; F143-I155 VanDerWaalsContact O-CA 3.3Å; F143-I155 WeakPolarHBondContact O-CA 3.29Å; A144-I155 HydrophobicContact CB-CG2 4.43Å; V153-I155 HydrophobicContact CG1-CG2 4.08Å; V153-I155 PolarHBondContact O-N 2.91Å; I155-R162 WeakPolarHBondContact O-CA 3.46Å; I155-I163 HydrophobicContact CD1-CG2 3.87Å; I155-I163 HydrophobicContact CG1-CG2 3.77Å; I155-I163 WeakPolarHBondContact CG1-O 3.36Å; I155-I163 PolarHBondContact N-O 3.31Å; I155-I163 PolarHBondContact O-N 3.24Å; I155-C165 HydrophobicContact CD1-CB 4.04Å; I155-C165 HydrophobicContact CG1-CB 4.01Å; I155-C165 HydrophobicContact CG2-CB 3.81Å; I155-L170 HydrophobicContact CG2-CD1 3.58Å; I155-L170 HydrophobicContact CG2-CD2 4.48Å
156	R	95.8	Very high	94.2	Very high	5 Å²	5	59.9 Å²	59.9	2%	0.019	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.9	170.6	-177.9	178.4	62.6	76.8	6.7	109.7	R111 E116 F143 N160 R161 R162	R111-R156 PolarHBondContact O-NH2 2.78Å; E116-R156 IonicContact OE1-CZ 2.64Å; E116-R156 IonicContact OE1-NE 3.82Å; E116-R156 PolarHBondContact OE1-NE 3.04Å; E116-R156 IonicContact OE1-NH2 3.39Å; E116-R156 IonicContact OE2-CZ 3.76Å; E116-R156 IonicContact OE2-NE 3.9Å; E116-R156 PolarHBondContact OE2-NE 3.06Å; E116-R156 IonicContact OE2-NH2 2.72Å; E116-R156 PolarHBondContact OE2-NH2 2.91Å; F143-R156 HydrophobicContact CB-CB 4.32Å; F143-R156 WeakPolarHBondContact CD2-O 3.35Å; F143-R156 PolarHBondContact N-O 3.25Å; F143-R156 PolarHBondContact O-N 2.86Å; R156-N160 PolarHBondContact NH1-OD1 2.99Å; R156-R161 CarbonylContact C-O 3.55Å; R156-R161 VanDerWaalsContact CA-O 3.3Å; R156-R161 WeakPolarHBondContact CA-O 3.39Å; R156-R162 HydrophobicContact CB-CG 4.07Å; R156-R162 HydrophobicContact CG-CG 4.13Å
157	T	93.7	Very high	94.2	Very high	8 Å²	8	56.2 Å²	56.2	5%	0.049	27%	0.274	C	S	.	.			trans	-87.1	169.5	172.1	67.3	0	0	0	0	111.6	L134 L136 K159 N160 R161	L134-T157 HydrophobicContact CD1-CG2 4.19Å; L134-T157 HydrophobicContact CD2-CG2 3.85Å; L136-T157 HydrophobicContact CD2-CG2 4.08Å; T157-K159 PolarHBondContact O-N 3.35Å; T157-K159 VanDerWaalsContact O-N 3.14Å; T157-K159 PolarHBondContact OG1-N 2.94Å; T157-N160 WeakPolarHBondContact O-CA 3.37Å; T157-N160 PolarHBondContact O-N 3.1Å; T157-R161 PolarHBondContact N-O 3.02Å; T157-R161 PolarHBondContact OG1-N 3.44Å
158	E	89.7	Confident	94.2	Very high	82 Å²	82	55.9 Å²	55.9	38%	0.383	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.6	171.4	75.1	-170.3	-178.7	0	0	112.6	S73 A110 N160	S73-E158 WeakPolarHBondContact CB-OE2 3.25Å; S73-E158 PolarHBondContact OG-OE2 2.66Å; A110-E158 HydrophobicContact CB-CB 4.07Å; E158-N160 PolarHBondContact O-N 3.41Å
159	K	89.9	Confident	94.3	Very high	161 Å²	161	55.5 Å²	55.5	70%	0.7	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	15.3	177.6	-58	-174.3	-178.6	177.3	0	113	T157 R161	T157-K159 PolarHBondContact O-N 3.35Å; T157-K159 VanDerWaalsContact O-N 3.14Å; T157-K159 PolarHBondContact OG1-N 2.94Å; K159-R161 PolarHBondContact O-N 2.86Å; K159-R161 VanDerWaalsContact O-N 3.08Å
160	N	92.2	Very high	94.5	Very high	106 Å²	106	46.6 Å²	46.6	57%	0.567	23%	0.234	S	C	*	.			trans	57.8	19.5	-179.8	-61.2	-53.7	0	0	0	115.4	R156 T157 E158	R156-N160 PolarHBondContact NH1-OD1 2.99Å; T157-N160 WeakPolarHBondContact O-CA 3.37Å; T157-N160 PolarHBondContact O-N 3.1Å; E158-N160 PolarHBondContact O-N 3.41Å
161	R	94.4	Very high	94.5	Very high	143 Å²	143	45.3 Å²	45.3	54%	0.54	23%	0.226	S	C	.	.			trans	-73.8	135.7	169.4	-69.7	-167.1	165.7	-152.1	-3.3	109.4	L134 R156 T157 K159	L134-R161 HydrophobicContact CD1-CB 3.99Å; R156-R161 CarbonylContact C-O 3.55Å; R156-R161 VanDerWaalsContact CA-O 3.3Å; R156-R161 WeakPolarHBondContact CA-O 3.39Å; T157-R161 PolarHBondContact N-O 3.02Å; T157-R161 PolarHBondContact OG1-N 3.44Å; K159-R161 PolarHBondContact O-N 2.86Å; K159-R161 VanDerWaalsContact O-N 3.08Å
162	R	95.7	Very high	94.3	Very high	58 Å²	58	47.8 Å²	47.8	22%	0.219	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.2	-179.7	-63.2	-175.8	-179.7	-140.2	-3.1	112	L45 E154 I155 R156	L45-R162 HydrophobicContact CD1-CB 3.94Å; E154-R162 WeakPolarHBondContact OE1-CD 3.38Å; E154-R162 IonicContact OE1-CZ 3.11Å; E154-R162 IonicContact OE1-NE 2.85Å; E154-R162 IonicContact OE1-NH1 2.56Å; E154-R162 PolarHBondContact OE1-NH1 3.12Å; I155-R162 WeakPolarHBondContact O-CA 3.46Å; R156-R162 HydrophobicContact CB-CG 4.07Å; R156-R162 HydrophobicContact CG-CG 4.13Å
163	I	96.2	Very high	93.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	156.2	173.2	-165.5	153.6	0	0	0	109.5	V42 L127 D129 T132 L134 I155	V42-I163 HydrophobicContact CG2-CD1 4.19Å; V42-I163 HydrophobicContact CG2-CG1 3.81Å; L127-I163 HydrophobicContact CB-CD1 3.6Å; L127-I163 HydrophobicContact CB-CG1 4.18Å; L127-I163 HydrophobicContact CB-CG2 4.2Å; L127-I163 HydrophobicContact CD1-CG2 3.57Å; D129-I163 HydrophobicContact CB-CD1 4.23Å; D129-I163 HydrophobicContact CB-CG1 4.21Å; T132-I163 HydrophobicContact CG2-CD1 4.41Å; T132-I163 WeakPolarHBondContact O-CD1 3.07Å; L134-I163 HydrophobicContact CB-CD1 4.2Å; L134-I163 HydrophobicContact CB-CG2 4.09Å; L134-I163 HydrophobicContact CD2-CB 4.33Å; L134-I163 HydrophobicContact CD2-CG2 3.42Å; L134-I163 VanDerWaalsContact CD2-CG2 3.42Å; L134-I163 HydrophobicContact CG-CG2 4.37Å; I155-I163 HydrophobicContact CD1-CG2 3.87Å; I155-I163 HydrophobicContact CG1-CG2 3.77Å; I155-I163 WeakPolarHBondContact CG1-O 3.36Å; I155-I163 PolarHBondContact N-O 3.31Å; I155-I163 PolarHBondContact O-N 3.24Å
164	N	96.1	Very high	91.5	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.011	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	138.8	167.7	-75.6	-36.3	0	0	0	110.7	V42 R43 L45 V153	V42-N164 HydrophobicContact CB-CB 4.07Å; V42-N164 WeakPolarHBondContact CG1-O 3.23Å; V42-N164 HydrophobicContact CG2-CB 4.11Å; V42-N164 WeakPolarHBondContact CG2-O 3.45Å; R43-N164 WeakPolarHBondContact CG-ND2 3.45Å; R43-N164 PolarHBondContact O-ND2 3.48Å; L45-N164 VanDerWaalsContact CD2-OD1 3.29Å; L45-N164 WeakPolarHBondContact CD2-OD1 3.24Å; V153-N164 CarbonylContact O-C 3.55Å; V153-N164 WeakPolarHBondContact O-CA 3.43Å
165	C	96	Very high	91.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	133.9	177.2	-173.9	0	0	0	0	109.2	L127 V153 I155 A167 L170	L127-C165 HydrophobicContact CD1-CB 3.94Å; V153-C165 PolarHBondContact N-O 3.44Å; V153-C165 PolarHBondContact O-N 3.37Å; I155-C165 HydrophobicContact CD1-CB 4.04Å; I155-C165 HydrophobicContact CG1-CB 4.01Å; I155-C165 HydrophobicContact CG2-CB 3.81Å; C165-A167 PolarHBondContact O-N 2.88Å; C165-L170 HydrophobicContact CB-CD1 4.31Å
166	P	95.5	Very high	91	Very high	24 Å²	24	64.4 Å²	64.4	16%	0.156	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	126.8	170	-22.7	33.6	0	0	0	111.4	L152 V168 Y169	L152-P166 HydrophobicContact CD2-CB 4.32Å; L152-P166 HydrophobicContact CD2-CG 3.92Å; P166-V168 HydrophobicContact CB-CG2 3.9Å; P166-V168 PolarHBondContact O-N 2.75Å; P166-V168 VanDerWaalsContact O-N 3.08Å; P166-Y169 HydrophobicContact CB-CD2 3.78Å; P166-Y169 HydrophobicContact CB-CE2 3.97Å; P166-Y169 HydrophobicContact CG-CD2 3.96Å; P166-Y169 HydrophobicContact CG-CE2 3.98Å; P166-Y169 PolarHBondContact O-N 3.35Å
167	A	95.1	Very high	90.7	Very high	17 Å²	17	67.7 Å²	67.7	14%	0.14	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-55.5	-31.6	-176.3	0	0	0	0	0	112.6	E147 G151 V153 C165 Y169 L170	E147-A167 HydrophobicContact CG-CB 4.1Å; E147-A167 WeakPolarHBondContact OE2-CB 3.44Å; G151-A167 PolarHBondContact O-N 2.91Å; V153-A167 HydrophobicContact CG2-CB 3.81Å; C165-A167 PolarHBondContact O-N 2.88Å; A167-Y169 PolarHBondContact O-N 3.37Å; A167-L170 WeakPolarHBondContact O-CB 3.44Å; A167-L170 PolarHBondContact O-N 2.99Å; A167-L170 VanDerWaalsContact O-O 3.09Å
168	V	94.7	Very high	90.5	Very high	115 Å²	115	71.2 Å²	71.2	70%	0.697	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-58.2	-17.1	177.4	-59.2	0	0	0	0	114.8	P166	P166-V168 HydrophobicContact CB-CG2 3.9Å; P166-V168 PolarHBondContact O-N 2.75Å; P166-V168 VanDerWaalsContact O-N 3.08Å
169	Y	95.5	Very high	90.6	Very high	37 Å²	37	70.6 Å²	70.6	15%	0.145	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-99.7	6.6	176.4	-58.3	-53.3	0	0	0	113.8	F40 V122 Q123 L125 P166 A167	F40-Y169 HydrophobicContact CD1-CE2 4.16Å; F40-Y169 HydrophobicContact CD2-CE2 4.27Å; F40-Y169 AromaticContact CE1-CE2 3.62Å; F40-Y169 HydrophobicContact CE1-CE2 3.62Å; F40-Y169 AromaticContact CE1-CZ 3.71Å; F40-Y169 WeakPolarHBondContact CE1-OH 3.31Å; F40-Y169 HydrophobicContact CE2-CD2 4.4Å; F40-Y169 AromaticContact CE2-CE2 3.76Å; F40-Y169 HydrophobicContact CE2-CE2 3.76Å; F40-Y169 HydrophobicContact CG-CE2 4.46Å; F40-Y169 HydrophobicContact CZ-CD2 4.41Å; F40-Y169 HydrophobicContact CZ-CE1 4.27Å; F40-Y169 AromaticContact CZ-CE2 3.39Å; F40-Y169 HydrophobicContact CZ-CE2 3.39Å; F40-Y169 AromaticContact CZ-CZ 3.31Å; F40-Y169 WeakPolarHBondContact CZ-OH 3.32Å; V122-Y169 PolarHBondContact N-O 3.04Å; Q123-Y169 HydrophobicContact CG-CD1 4.22Å; L125-Y169 HydrophobicContact CD1-CD2 4.15Å; L125-Y169 HydrophobicContact CD1-CG 4.04Å; L125-Y169 HydrophobicContact CD2-CD1 4.13Å; L125-Y169 HydrophobicContact CD2-CD2 3.95Å; L125-Y169 HydrophobicContact CD2-CE2 4.45Å; L125-Y169 HydrophobicContact CD2-CG 3.78Å; P166-Y169 HydrophobicContact CB-CD2 3.78Å; P166-Y169 HydrophobicContact CB-CE2 3.97Å; P166-Y169 HydrophobicContact CG-CD2 3.96Å; P166-Y169 HydrophobicContact CG-CE2 3.98Å; P166-Y169 PolarHBondContact O-N 3.35Å; A167-Y169 PolarHBondContact O-N 3.37Å
170	L	95.2	Very high	90.6	Very high	15 Å²	15	64.5 Å²	64.5	8%	0.079	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.2	-179.8	-57.8	178.1	0	0	0	109.2	M119 Q120 V121 V142 V153 I155 C165 A167	M119-L170 HydrophobicContact CB-CB 4.1Å; M119-L170 HydrophobicContact CE-CB 3.68Å; M119-L170 HydrophobicContact CG-CB 4.49Å; Q120-L170 WeakPolarHBondContact O-CA 3.31Å; V121-L170 HydrophobicContact CG2-CD2 4.15Å; V142-L170 HydrophobicContact CG2-CD2 3.75Å; V153-L170 HydrophobicContact CB-CD1 4.2Å; V153-L170 HydrophobicContact CG1-CD1 4.15Å; I155-L170 HydrophobicContact CG2-CD1 3.58Å; I155-L170 HydrophobicContact CG2-CD2 4.48Å; C165-L170 HydrophobicContact CB-CD1 4.31Å; A167-L170 WeakPolarHBondContact O-CB 3.44Å; A167-L170 PolarHBondContact O-N 2.99Å; A167-L170 VanDerWaalsContact O-O 3.09Å
171	L	94	Very high	90.5	Very high	94 Å²	94	61.6 Å²	61.6	49%	0.492	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.2	174.1	-177	66.8	0	0	0	109.1	M119 Q120 V122 R173	M119-L171 WeakPolarHBondContact CA-O 3.37Å; Q120-L171 PolarHBondContact N-O 3.08Å; Q120-L171 PolarHBondContact O-N 2.83Å; V122-L171 HydrophobicContact CG2-CB 3.98Å; L171-R173 PolarHBondContact O-N 3.43Å
172	Q	87.8	Confident	90.2	Very high	76 Å²	76	55.3 Å²	55.3	36%	0.355	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	124.1	170.1	-168.4	174	-55.9	0	0	108.2	M119 D174	M119-Q172 HydrophobicContact CE-CB 3.98Å; M119-Q172 VanDerWaalsContact CE-N 3.32Å; M119-Q172 WeakPolarHBondContact SD-CA 3.43Å; M119-Q172 HydrophobicContact SD-CB 3.56Å; M119-Q172 VanDerWaalsContact SD-CB 3.56Å; M119-Q172 HydrophobicContact SD-CG 3.94Å; Q172-D174 PolarHBondContact NE2-OD1 3.49Å
173	R	70.8	Confident	89.8	Confident	86 Å²	86	55.1 Å²	55.1	33%	0.325	29%	0.287	S	S	.	.			trans	-105.4	114.5	166.8	-77.6	-158.9	166.2	169.8	1.8	107.6	A76 T78 L171	A76-R173 PolarHBondContact O-NH1 3.45Å; T78-R173 WeakPolarHBondContact OG1-CB 3.2Å; L171-R173 PolarHBondContact O-N 3.43Å
174	D	60.3	Low	89.2	Confident	195 Å²	195	60.1 Å²	60.1	100%	1.043	31%	0.313	S	S	*	.			trans	-80.7	0	169.5	-59.9	-54.3	0	0	0	110.6	Q172	Q172-D174 PolarHBondContact NE2-OD1 3.49Å

Retrieved 174 of 174 residues in 121.3 ms (Link to these results)

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