A0A077ZKP2_TRITR Loading...

Peptidase A2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZKP2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 336 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	56.6	Low	61.9	Low	175 Å²	175	95.7 Å²	95.7	86%	0.862	50%	0.498	S	S	*	.				0	-44.2	0	-156.4	-146.8	-91.2	0	0	112.7	R3 K4 I5 F31	M1-R3 PolarHBondContact O-N 3.39Å; M1-K4 WeakPolarHBondContact O-CB 3.47Å; M1-K4 PolarHBondContact O-N 2.85Å; M1-I5 HydrophobicContact CG-CD1 4.41Å; M1-I5 PolarHBondContact O-N 3.09Å; M1-I5 HydrophobicContact SD-CD1 3.92Å; M1-F31 HydrophobicContact CB-CE2 4.37Å; M1-F31 HydrophobicContact CB-CZ 4Å; M1-F31 HydrophobicContact CG-CZ 4.31Å; M1-F31 HydrophobicContact SD-CZ 3.87Å
2	F	59.2	Low	61.1	Low	11 Å²	11	98.8 Å²	98.8	5%	0.048	51%	0.509	C	S	.	.	H	α-helix	trans	-48.3	-47.4	-178.2	-171.5	-113.7	0	0	0	115.2	K4 I5 L6 F26 C30 F31 L34	F2-K4 VanDerWaalsContact C-N 3.31Å; F2-K4 PolarHBondContact O-N 3.12Å; F2-I5 PolarHBondContact O-N 3.08Å; F2-I5 VanDerWaalsContact O-N 3.08Å; F2-L6 HydrophobicContact CD1-CD1 3.67Å; F2-L6 HydrophobicContact CD1-CG 4.25Å; F2-L6 HydrophobicContact CE1-CD1 3.44Å; F2-L6 VanDerWaalsContact CE1-CD1 3.44Å; F2-L6 HydrophobicContact CE1-CD2 4.39Å; F2-L6 HydrophobicContact CE1-CG 4.06Å; F2-L6 HydrophobicContact CG-CD1 4.5Å; F2-L6 HydrophobicContact CZ-CD1 4.09Å; F2-L6 HydrophobicContact CZ-CD2 4.2Å; F2-L6 HydrophobicContact CZ-CG 4.27Å; F2-L6 PolarHBondContact O-N 3.03Å; F2-F26 AromaticContact CD1-CD1 3.89Å; F2-F26 HydrophobicContact CD1-CD1 3.89Å; F2-F26 AromaticContact CD1-CE1 3.92Å; F2-F26 HydrophobicContact CD1-CE1 3.92Å; F2-F26 HydrophobicContact CD1-CG 4.23Å; F2-F26 HydrophobicContact CD1-CZ 4.29Å; F2-F26 AromaticContact CE1-CD1 3.78Å; F2-F26 HydrophobicContact CE1-CD1 3.78Å; F2-F26 AromaticContact CE1-CE1 3.82Å; F2-F26 HydrophobicContact CE1-CE1 3.82Å; F2-C30 HydrophobicContact CD1-CB 4.49Å; F2-C30 HydrophobicContact CD2-CB 4.11Å; F2-C30 HydrophobicContact CE1-CB 4.26Å; F2-C30 HydrophobicContact CE2-CB 3.88Å; F2-C30 VanDerWaalsContact CE2-O 3.31Å; F2-C30 WeakPolarHBondContact CE2-O 3.49Å; F2-C30 HydrophobicContact CG-CB 4.42Å; F2-C30 HydrophobicContact CZ-CB 3.97Å; F2-F31 VanDerWaalsContact CA-CZ 3.46Å; F2-F31 HydrophobicContact CB-CE1 4.45Å; F2-F31 HydrophobicContact CB-CE2 4.05Å; F2-F31 HydrophobicContact CB-CZ 3.89Å; F2-F31 HydrophobicContact CD2-CD1 4.1Å; F2-F31 HydrophobicContact CD2-CD2 4.48Å; F2-F31 AromaticContact CD2-CE1 3.97Å; F2-F31 HydrophobicContact CD2-CE1 3.97Å; F2-F31 HydrophobicContact CD2-CE2 4.42Å; F2-F31 HydrophobicContact CD2-CG 4.35Å; F2-F31 HydrophobicContact CD2-CZ 4.18Å; F2-L34 HydrophobicContact CD2-CD2 4.44Å; F2-L34 HydrophobicContact CE2-CB 3.89Å; F2-L34 HydrophobicContact CE2-CD2 3.82Å; F2-L34 HydrophobicContact CE2-CG 4.38Å; F2-L34 HydrophobicContact CZ-CB 4.48Å
3	R	59.1	Low	61	Low	162 Å²	162	94 Å²	94	61%	0.611	48%	0.482	S	S	*	.	H	α-helix	trans	-59.6	-34.3	177.9	-68.6	-174.9	178.1	171.7	2.1	114.2	M1 I5 A7 F26	M1-R3 PolarHBondContact O-N 3.39Å; R3-I5 VanDerWaalsContact C-N 3.34Å; R3-A7 WeakPolarHBondContact O-CB 3.37Å; R3-A7 PolarHBondContact O-N 2.68Å; R3-F26 HydrophobicContact CG-CE2 4.14Å; R3-F26 HydrophobicContact CG-CZ 4.22Å
4	K	62.3	Low	61.1	Low	169 Å²	169	92.9 Å²	92.9	74%	0.735	47%	0.472	S	S	*	.	H	α-helix	trans	-68	-36.4	176.5	-71	-173.9	176.1	-177.5	0	111.3	M1 F2 K8	M1-K4 WeakPolarHBondContact O-CB 3.47Å; M1-K4 PolarHBondContact O-N 2.85Å; F2-K4 VanDerWaalsContact C-N 3.31Å; F2-K4 PolarHBondContact O-N 3.12Å; K4-K8 WeakPolarHBondContact O-CG 3.25Å; K4-K8 PolarHBondContact O-N 3.11Å
5	I	60.6	Low	61.2	Low	71 Å²	71	100.6 Å²	100.6	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-72.4	-40.8	178.1	-72.4	165.9	0	0	0	110.3	M1 F2 R3 A7 K8 L9 F31 L34	M1-I5 HydrophobicContact CG-CD1 4.41Å; M1-I5 PolarHBondContact O-N 3.09Å; M1-I5 HydrophobicContact SD-CD1 3.92Å; F2-I5 PolarHBondContact O-N 3.08Å; F2-I5 VanDerWaalsContact O-N 3.08Å; R3-I5 VanDerWaalsContact C-N 3.34Å; I5-A7 VanDerWaalsContact C-N 3.33Å; I5-A7 PolarHBondContact O-N 2.66Å; I5-K8 PolarHBondContact O-N 3.4Å; I5-K8 VanDerWaalsContact O-N 3.16Å; I5-L9 PolarHBondContact O-N 3.26Å; I5-F31 HydrophobicContact CD1-CD1 4.46Å; I5-F31 HydrophobicContact CD1-CE1 3.38Å; I5-F31 HydrophobicContact CD1-CZ 3.9Å; I5-F31 HydrophobicContact CG1-CE1 4.49Å; I5-L34 HydrophobicContact CG2-CD2 4.04Å
6	L	61.3	Low	61.1	Low	9 Å²	9	97.1 Å²	97.1	5%	0.047	48%	0.476	C	S	.	.	H	α-helix	trans	-60.3	-40.2	172.5	-69.6	175.8	0	0	0	113.1	F2 K8 L9 V17 V21 L34	F2-L6 HydrophobicContact CD1-CD1 3.67Å; F2-L6 HydrophobicContact CD1-CG 4.25Å; F2-L6 HydrophobicContact CE1-CD1 3.44Å; F2-L6 VanDerWaalsContact CE1-CD1 3.44Å; F2-L6 HydrophobicContact CE1-CD2 4.39Å; F2-L6 HydrophobicContact CE1-CG 4.06Å; F2-L6 HydrophobicContact CG-CD1 4.5Å; F2-L6 HydrophobicContact CZ-CD1 4.09Å; F2-L6 HydrophobicContact CZ-CD2 4.2Å; F2-L6 HydrophobicContact CZ-CG 4.27Å; F2-L6 PolarHBondContact O-N 3.03Å; L6-K8 PolarHBondContact O-N 2.78Å; L6-L9 HydrophobicContact CD2-CD1 3.81Å; L6-L9 WeakPolarHBondContact O-CB 3.45Å; L6-L9 PolarHBondContact O-N 3.29Å; L6-V17 HydrophobicContact CD2-CG2 4.19Å; L6-V21 HydrophobicContact CD1-CB 4.24Å; L6-V21 HydrophobicContact CD1-CG1 3.91Å; L6-V21 HydrophobicContact CD1-CG2 3.64Å; L6-V21 HydrophobicContact CD2-CG2 3.65Å; L6-V21 HydrophobicContact CG-CG2 4.25Å; L6-L34 HydrophobicContact CD2-CD1 4.33Å
7	A	63.5	Low	61.2	Low	85 Å²	85	91.4 Å²	91.4	70%	0.702	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-16.9	178.4	0	0	0	0	0	113.7	R3 I5	R3-A7 WeakPolarHBondContact O-CB 3.37Å; R3-A7 PolarHBondContact O-N 2.68Å; I5-A7 VanDerWaalsContact C-N 3.33Å; I5-A7 PolarHBondContact O-N 2.66Å
8	K	68.6	Low	61.5	Low	186 Å²	186	93.1 Å²	93.1	81%	0.809	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-5.9	176.3	-67.2	-70	-175.9	178.5	0	112.9	K4 I5 L6	K4-K8 WeakPolarHBondContact O-CG 3.25Å; K4-K8 PolarHBondContact O-N 3.11Å; I5-K8 PolarHBondContact O-N 3.4Å; I5-K8 VanDerWaalsContact O-N 3.16Å; L6-K8 PolarHBondContact O-N 2.78Å
9	L	58.8	Low	62	Low	34 Å²	34	93.4 Å²	93.4	18%	0.178	45%	0.453	C	S	.	.	S	Bend	trans	-73	129.8	176.3	-76.5	167.5	0	0	0	110.4	I5 L6 H13 V17 L34 L38	I5-L9 PolarHBondContact O-N 3.26Å; L6-L9 HydrophobicContact CD2-CD1 3.81Å; L6-L9 WeakPolarHBondContact O-CB 3.45Å; L6-L9 PolarHBondContact O-N 3.29Å; L9-H13 HydrophobicContact CB-CB 4.46Å; L9-H13 HydrophobicContact CD2-CB 4.05Å; L9-V17 HydrophobicContact CD1-CG2 3.89Å; L9-L34 HydrophobicContact CD1-CD1 4.29Å; L9-L38 HydrophobicContact CD2-CD1 4.39Å
10	P	63.8	Low	62.2	Low	69 Å²	69	89.2 Å²	89.2	45%	0.448	43%	0.433	S	S	.	.			trans	-54.7	146.4	170.3	-24.5	33.2	0	0	0	111.3	Q12 H13 F14	P10-Q12 HydrophobicContact CB-CG 4.09Å; P10-Q12 PolarHBondContact O-N 2.69Å; P10-H13 PolarHBondContact O-N 3.47Å; P10-F14 PolarHBondContact O-N 3.48Å; P10-F14 VanDerWaalsContact O-N 3.08Å
11	A	66.8	Low	62.3	Low	82 Å²	82	86.4 Å²	86.4	68%	0.678	42%	0.421	S	S	*	.	H	α-helix	trans	-52.6	-33.6	-173.5	0	0	0	0	0	114	F14 R15	A11-F14 PolarHBondContact O-N 3.13Å; A11-R15 PolarHBondContact O-N 3.03Å
12	Q	52.8	Low	63	Low	133 Å²	133	84 Å²	84	62%	0.621	41%	0.411	S	S	*	.	H	α-helix	trans	-60.9	-44.1	174.6	61.6	-173.1	-8.7	0	0	113	P10	P10-Q12 HydrophobicContact CB-CG 4.09Å; P10-Q12 PolarHBondContact O-N 2.69Å
13	H	59.4	Low	63.4	Low	36 Å²	36	87.7 Å²	87.7	17%	0.167	43%	0.428	C	S	.	.	H	α-helix	trans	-75.3	-33	179.7	-60.1	107.8	0	0	0	111.4	L9 P10 R15 M16 V17	L9-H13 HydrophobicContact CB-CB 4.46Å; L9-H13 HydrophobicContact CD2-CB 4.05Å; P10-H13 PolarHBondContact O-N 3.47Å; H13-R15 VanDerWaalsContact C-N 3.31Å; H13-R15 PolarHBondContact O-N 2.89Å; H13-M16 WeakPolarHBondContact O-CB 3.34Å; H13-M16 PolarHBondContact O-N 3.45Å; H13-M16 VanDerWaalsContact O-N 3.08Å; H13-V17 PolarHBondContact O-N 3.04Å
14	F	62.1	Low	63.8	Low	78 Å²	78	87.5 Å²	87.5	34%	0.342	44%	0.435	S	S	.	.	H	α-helix	trans	-60.6	-39.3	176.4	-171.1	-92.6	0	0	0	112.4	P10 A11 M16 V17 K18 V21	P10-F14 PolarHBondContact O-N 3.48Å; P10-F14 VanDerWaalsContact O-N 3.08Å; A11-F14 PolarHBondContact O-N 3.13Å; F14-M16 PolarHBondContact O-N 3.48Å; F14-V17 PolarHBondContact O-N 3.49Å; F14-K18 PolarHBondContact O-N 2.81Å; F14-V21 HydrophobicContact CE2-CG1 4.18Å; F14-V21 HydrophobicContact CE2-CG2 3.97Å; F14-V21 HydrophobicContact CZ-CB 4.43Å; F14-V21 HydrophobicContact CZ-CG1 3.95Å; F14-V21 HydrophobicContact CZ-CG2 4.21Å
15	R	63.4	Low	64	Low	209 Å²	209	85.4 Å²	85.4	79%	0.789	44%	0.438	S	S	*	.	H	α-helix	trans	-58.2	-35.7	174.8	-73.3	-176.9	178.1	-176.6	0	112.2	A11 H13	A11-R15 PolarHBondContact O-N 3.03Å; H13-R15 VanDerWaalsContact C-N 3.31Å; H13-R15 PolarHBondContact O-N 2.89Å
16	M	58.8	Low	64.2	Low	45 Å²	45	84.9 Å²	84.9	22%	0.222	43%	0.433	C	S	.	.	H	α-helix	trans	-71.3	-32.1	-177.4	-59.4	160.1	66.1	0	0	112.1	H13 F14 R41 L42	H13-M16 WeakPolarHBondContact O-CB 3.34Å; H13-M16 PolarHBondContact O-N 3.45Å; H13-M16 VanDerWaalsContact O-N 3.08Å; F14-M16 PolarHBondContact O-N 3.48Å; M16-R41 HydrophobicContact CE-CB 3.2Å; M16-R41 HydrophobicContact CE-CG 4.04Å; M16-L42 HydrophobicContact CE-CD2 4.11Å; M16-L42 HydrophobicContact CE-CG 4.39Å
17	V	63.1	Low	64.5	Low	0 Å²	0	85.7 Å²	85.7	0%	0	44%	0.442	C	S	.	.	H	α-helix	trans	-105.7	4	-175.2	-57.8	0	0	0	0	113.3	L6 L9 H13 F14 H19 L20 V21 L34 C37 L38	L6-V17 HydrophobicContact CD2-CG2 4.19Å; L9-V17 HydrophobicContact CD1-CG2 3.89Å; H13-V17 PolarHBondContact O-N 3.04Å; F14-V17 PolarHBondContact O-N 3.49Å; V17-H19 PolarHBondContact O-N 3Å; V17-L20 HydrophobicContact CB-CD1 4.49Å; V17-L20 WeakPolarHBondContact O-CB 3.41Å; V17-L20 PolarHBondContact O-N 3.26Å; V17-V21 HydrophobicContact CG2-CG2 4.35Å; V17-V21 PolarHBondContact O-N 3.08Å; V17-L34 HydrophobicContact CB-CD1 3.83Å; V17-L34 HydrophobicContact CG1-CD1 3.55Å; V17-L34 HydrophobicContact CG2-CD1 4.02Å; V17-C37 HydrophobicContact CG1-CB 4.41Å; V17-L38 HydrophobicContact CG1-CD2 4.09Å; V17-L38 HydrophobicContact CG1-CG 4.43Å
18	K	66.5	Low	65	Low	121 Å²	121	89 Å²	89	53%	0.526	45%	0.453	S	S	.	.	H	α-helix	trans	-46.7	-37.9	-176.8	-175	-179	178	-175.8	0	113.2	F14 V21 L22	F14-K18 PolarHBondContact O-N 2.81Å; K18-V21 WeakPolarHBondContact O-CB 3.38Å; K18-V21 PolarHBondContact O-N 3.34Å; K18-V21 VanDerWaalsContact O-N 3.15Å; K18-L22 HydrophobicContact CG-CD1 4.07Å; K18-L22 HydrophobicContact CG-CG 4.4Å; K18-L22 WeakPolarHBondContact O-CG 3.44Å; K18-L22 PolarHBondContact O-N 3.03Å; K18-L22 VanDerWaalsContact O-N 3.11Å
19	H	70.5	Confident	65.2	Low	100 Å²	100	83.5 Å²	83.5	46%	0.463	43%	0.432	S	S	.	.	H	α-helix	trans	-65.5	-37.1	179.8	75.9	-80	0	0	0	113.3	V17 V21 L22	V17-H19 PolarHBondContact O-N 3Å; H19-V21 VanDerWaalsContact C-N 3.25Å; H19-V21 PolarHBondContact O-N 3.4Å; H19-L22 PolarHBondContact O-N 3.16Å
20	L	65.9	Low	65.5	Low	8 Å²	8	82.6 Å²	82.6	4%	0.042	43%	0.428	C	S	.	.	H	α-helix	trans	-69.9	-26.1	173.9	-60.1	175.5	0	0	0	111.8	V17 Q33 L34 C37	V17-L20 HydrophobicContact CB-CD1 4.49Å; V17-L20 WeakPolarHBondContact O-CB 3.41Å; V17-L20 PolarHBondContact O-N 3.26Å; L20-Q33 HydrophobicContact CD1-CB 4.15Å; L20-Q33 HydrophobicContact CD2-CB 3.82Å; L20-L34 HydrophobicContact CD1-CB 4.33Å; L20-C37 HydrophobicContact CD1-CB 4.01Å
21	V	65.2	Low	65.5	Low	32 Å²	32	83 Å²	83	19%	0.194	42%	0.423	C	S	.	.	H	α-helix	trans	-77.7	-29.5	178.5	-173.7	0	0	0	0	112.2	L6 F14 V17 K18 H19	L6-V21 HydrophobicContact CD1-CB 4.24Å; L6-V21 HydrophobicContact CD1-CG1 3.91Å; L6-V21 HydrophobicContact CD1-CG2 3.64Å; L6-V21 HydrophobicContact CD2-CG2 3.65Å; L6-V21 HydrophobicContact CG-CG2 4.25Å; F14-V21 HydrophobicContact CE2-CG1 4.18Å; F14-V21 HydrophobicContact CE2-CG2 3.97Å; F14-V21 HydrophobicContact CZ-CB 4.43Å; F14-V21 HydrophobicContact CZ-CG1 3.95Å; F14-V21 HydrophobicContact CZ-CG2 4.21Å; V17-V21 HydrophobicContact CG2-CG2 4.35Å; V17-V21 PolarHBondContact O-N 3.08Å; K18-V21 WeakPolarHBondContact O-CB 3.38Å; K18-V21 PolarHBondContact O-N 3.34Å; K18-V21 VanDerWaalsContact O-N 3.15Å; H19-V21 VanDerWaalsContact C-N 3.25Å; H19-V21 PolarHBondContact O-N 3.4Å
22	L	70.9	Confident	65.7	Low	123 Å²	123	84.1 Å²	84.1	64%	0.644	42%	0.418	S	S	*	.	H	α-helix	trans	-85.4	-10.4	-177.3	-68.4	174.8	0	0	0	113.9	K18 H19 Q24	K18-L22 HydrophobicContact CG-CD1 4.07Å; K18-L22 HydrophobicContact CG-CG 4.4Å; K18-L22 WeakPolarHBondContact O-CG 3.44Å; K18-L22 PolarHBondContact O-N 3.03Å; K18-L22 VanDerWaalsContact O-N 3.11Å; H19-L22 PolarHBondContact O-N 3.16Å; L22-Q24 PolarHBondContact O-N 2.85Å
23	Q	67.2	Low	66.5	Low	89 Å²	89	80.4 Å²	80.4	42%	0.416	40%	0.4	S	S	.	.			trans	-74.2	120.9	177.3	-73.7	-179.3	-15.5	0	0	111.1	F26	Q23-F26 WeakPolarHBondContact O-CD1 3.42Å
24	Q	69	Low	66.8	Low	159 Å²	159	79 Å²	79	74%	0.743	39%	0.394	S	S	*	.	S	Bend	trans	-126.7	126.6	170.7	-68.4	-166.7	5.8	0	0	109.9	L22	L22-Q24 PolarHBondContact O-N 2.85Å
25	P	65.3	Low	67	Low	124 Å²	124	81.6 Å²	81.6	81%	0.805	41%	0.405	S	S	*	.	S	Bend	cis	-66.7	157.5	-5.8	29.7	-33.5	0	0	0	111.9	A27	P25-A27 PolarHBondContact O-N 3.42Å
26	F	65.9	Low	67.2	Low	60 Å²	60	74.4 Å²	74.4	26%	0.263	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-63.7	138	172.9	-64.9	-64.9	0	0	0	109.5	F2 R3 Q23 C30	F2-F26 AromaticContact CD1-CD1 3.89Å; F2-F26 HydrophobicContact CD1-CD1 3.89Å; F2-F26 AromaticContact CD1-CE1 3.92Å; F2-F26 HydrophobicContact CD1-CE1 3.92Å; F2-F26 HydrophobicContact CD1-CG 4.23Å; F2-F26 HydrophobicContact CD1-CZ 4.29Å; F2-F26 AromaticContact CE1-CD1 3.78Å; F2-F26 HydrophobicContact CE1-CD1 3.78Å; F2-F26 AromaticContact CE1-CE1 3.82Å; F2-F26 HydrophobicContact CE1-CE1 3.82Å; R3-F26 HydrophobicContact CG-CE2 4.14Å; R3-F26 HydrophobicContact CG-CZ 4.22Å; Q23-F26 WeakPolarHBondContact O-CD1 3.42Å; F26-C30 HydrophobicContact CB-CB 4.33Å
27	A	67.6	Low	67.3	Low	27 Å²	27	72.9 Å²	72.9	22%	0.223	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-60.5	146.7	175.5	0	0	0	0	0	111	P25 D29 C30	P25-A27 PolarHBondContact O-N 3.42Å; A27-D29 WeakPolarHBondContact CB-OD1 3.25Å; A27-D29 PolarHBondContact O-N 3.49Å; A27-D29 VanDerWaalsContact O-N 3.12Å; A27-C30 WeakPolarHBondContact O-CB 3.42Å; A27-C30 PolarHBondContact O-N 3.33Å; A27-C30 PolarHBondContact O-SG 3.48Å
28	V	72.5	Confident	67.2	Low	155 Å²	155	74.6 Å²	74.6	94%	0.939	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-30.9	179.6	-178.9	0	0	0	0	111
29	D	74	Confident	67.1	Low	69 Å²	69	73.9 Å²	73.9	37%	0.369	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	17.9	179.1	66.9	-37.3	0	0	0	113.5	A27 F31 N32 Q33	A27-D29 WeakPolarHBondContact CB-OD1 3.25Å; A27-D29 PolarHBondContact O-N 3.49Å; A27-D29 VanDerWaalsContact O-N 3.12Å; D29-F31 PolarHBondContact O-N 3.43Å; D29-N32 HydrophobicContact CB-CB 4.38Å; D29-N32 WeakPolarHBondContact O-CA 3.01Å; D29-N32 WeakPolarHBondContact O-CB 3.28Å; D29-N32 PolarHBondContact O-N 3.23Å; D29-Q33 PolarHBondContact O-N 3.21Å; D29-Q33 PolarHBondContact OD1-NE2 3.3Å; D29-Q33 WeakPolarHBondContact OD2-CG 3.42Å; D29-Q33 PolarHBondContact OD2-NE2 3.34Å
30	C	65	Low	66.7	Low	15 Å²	15	75.5 Å²	75.5	10%	0.101	41%	0.407	C	S	.	.	H	α-helix	trans	-50.9	-32.3	-178.4	56.4	0	0	0	0	113.7	F2 F26 A27 L34	F2-C30 HydrophobicContact CD1-CB 4.49Å; F2-C30 HydrophobicContact CD2-CB 4.11Å; F2-C30 HydrophobicContact CE1-CB 4.26Å; F2-C30 HydrophobicContact CE2-CB 3.88Å; F2-C30 VanDerWaalsContact CE2-O 3.31Å; F2-C30 WeakPolarHBondContact CE2-O 3.49Å; F2-C30 HydrophobicContact CG-CB 4.42Å; F2-C30 HydrophobicContact CZ-CB 3.97Å; F26-C30 HydrophobicContact CB-CB 4.33Å; A27-C30 WeakPolarHBondContact O-CB 3.42Å; A27-C30 PolarHBondContact O-N 3.33Å; A27-C30 PolarHBondContact O-SG 3.48Å; C30-L34 VanDerWaalsContact O-CB 3.27Å; C30-L34 WeakPolarHBondContact O-CB 3.42Å; C30-L34 PolarHBondContact O-N 3.02Å
31	F	63.6	Low	66.2	Low	77 Å²	77	81.7 Å²	81.7	34%	0.338	43%	0.43	S	S	.	.	H	α-helix	trans	-67.1	-43.5	172.7	-82.7	-68.2	0	0	0	113.7	M1 F2 I5 D29 L34 K35	M1-F31 HydrophobicContact CB-CE2 4.37Å; M1-F31 HydrophobicContact CB-CZ 4Å; M1-F31 HydrophobicContact CG-CZ 4.31Å; M1-F31 HydrophobicContact SD-CZ 3.87Å; F2-F31 VanDerWaalsContact CA-CZ 3.46Å; F2-F31 HydrophobicContact CB-CE1 4.45Å; F2-F31 HydrophobicContact CB-CE2 4.05Å; F2-F31 HydrophobicContact CB-CZ 3.89Å; F2-F31 HydrophobicContact CD2-CD1 4.1Å; F2-F31 HydrophobicContact CD2-CD2 4.48Å; F2-F31 AromaticContact CD2-CE1 3.97Å; F2-F31 HydrophobicContact CD2-CE1 3.97Å; F2-F31 HydrophobicContact CD2-CE2 4.42Å; F2-F31 HydrophobicContact CD2-CG 4.35Å; F2-F31 HydrophobicContact CD2-CZ 4.18Å; I5-F31 HydrophobicContact CD1-CD1 4.46Å; I5-F31 HydrophobicContact CD1-CE1 3.38Å; I5-F31 HydrophobicContact CD1-CZ 3.9Å; I5-F31 HydrophobicContact CG1-CE1 4.49Å; D29-F31 PolarHBondContact O-N 3.43Å; F31-L34 PolarHBondContact O-N 2.97Å; F31-K35 VanDerWaalsContact O-CB 3.29Å; F31-K35 WeakPolarHBondContact O-CB 3.48Å; F31-K35 PolarHBondContact O-N 3.33Å
32	N	70.1	Confident	65.9	Low	107 Å²	107	84.6 Å²	84.6	57%	0.572	44%	0.444	S	S	*	.	H	α-helix	trans	-69	-37.9	176.9	-69.7	-34.7	0	0	0	110.8	D29 K35 A36	D29-N32 HydrophobicContact CB-CB 4.38Å; D29-N32 WeakPolarHBondContact O-CA 3.01Å; D29-N32 WeakPolarHBondContact O-CB 3.28Å; D29-N32 PolarHBondContact O-N 3.23Å; N32-K35 PolarHBondContact O-N 2.96Å; N32-A36 VanDerWaalsContact O-CB 3.24Å; N32-A36 WeakPolarHBondContact O-CB 3.17Å; N32-A36 PolarHBondContact O-N 3.36Å
33	Q	69.6	Low	65.3	Low	54 Å²	54	80.6 Å²	80.6	25%	0.252	43%	0.432	S	S	.	.	H	α-helix	trans	-64.7	-41.6	173.9	-65.3	179.7	4.5	0	0	111.7	L20 D29 C37	L20-Q33 HydrophobicContact CD1-CB 4.15Å; L20-Q33 HydrophobicContact CD2-CB 3.82Å; D29-Q33 PolarHBondContact O-N 3.21Å; D29-Q33 PolarHBondContact OD1-NE2 3.3Å; D29-Q33 WeakPolarHBondContact OD2-CG 3.42Å; D29-Q33 PolarHBondContact OD2-NE2 3.34Å; Q33-C37 WeakPolarHBondContact O-CB 3.34Å; Q33-C37 PolarHBondContact O-N 2.88Å
34	L	65.7	Low	64.7	Low	7 Å²	7	80.3 Å²	80.3	4%	0.037	43%	0.433	C	S	.	.	H	α-helix	trans	-63.5	-46.7	173.3	179.7	69.5	0	0	0	111.1	F2 I5 L6 L9 V17 L20 C30 F31 C37 L38	F2-L34 HydrophobicContact CD2-CD2 4.44Å; F2-L34 HydrophobicContact CE2-CB 3.89Å; F2-L34 HydrophobicContact CE2-CD2 3.82Å; F2-L34 HydrophobicContact CE2-CG 4.38Å; F2-L34 HydrophobicContact CZ-CB 4.48Å; I5-L34 HydrophobicContact CG2-CD2 4.04Å; L6-L34 HydrophobicContact CD2-CD1 4.33Å; L9-L34 HydrophobicContact CD1-CD1 4.29Å; V17-L34 HydrophobicContact CB-CD1 3.83Å; V17-L34 HydrophobicContact CG1-CD1 3.55Å; V17-L34 HydrophobicContact CG2-CD1 4.02Å; L20-L34 HydrophobicContact CD1-CB 4.33Å; C30-L34 VanDerWaalsContact O-CB 3.27Å; C30-L34 WeakPolarHBondContact O-CB 3.42Å; C30-L34 PolarHBondContact O-N 3.02Å; F31-L34 PolarHBondContact O-N 2.97Å; L34-C37 PolarHBondContact O-N 3.12Å; L34-L38 HydrophobicContact CD1-CD1 4.11Å; L34-L38 HydrophobicContact CD1-CG 4.28Å; L34-L38 HydrophobicContact CG-CD1 3.98Å; L34-L38 HydrophobicContact CG-CG 4.47Å; L34-L38 WeakPolarHBondContact O-CB 3.23Å; L34-L38 VanDerWaalsContact O-CG 3.28Å; L34-L38 WeakPolarHBondContact O-CG 3.29Å; L34-L38 PolarHBondContact O-N 3.24Å
35	K	66.5	Low	64	Low	132 Å²	132	77.3 Å²	77.3	57%	0.574	43%	0.425	S	S	*	.	H	α-helix	trans	-59	-48.5	177.1	-178.1	-177.7	176.7	-175.3	0	111	F31 N32 L38 L39	F31-K35 VanDerWaalsContact O-CB 3.29Å; F31-K35 WeakPolarHBondContact O-CB 3.48Å; F31-K35 PolarHBondContact O-N 3.33Å; N32-K35 PolarHBondContact O-N 2.96Å; K35-L38 PolarHBondContact O-N 2.9Å; K35-L39 HydrophobicContact CD-CD1 4.47Å; K35-L39 HydrophobicContact CG-CD1 3.83Å; K35-L39 HydrophobicContact CG-CG 4.34Å; K35-L39 VanDerWaalsContact O-CB 3.32Å; K35-L39 WeakPolarHBondContact O-CB 3.31Å; K35-L39 VanDerWaalsContact O-CG 3.25Å; K35-L39 WeakPolarHBondContact O-CG 3.14Å; K35-L39 PolarHBondContact O-N 2.85Å
36	A	67.4	Low	63.3	Low	58 Å²	58	75.4 Å²	75.4	48%	0.479	41%	0.408	S	S	.	.	H	α-helix	trans	-62.1	-44.1	177.4	0	0	0	0	0	111.3	N32 L38 L39 D40	N32-A36 VanDerWaalsContact O-CB 3.24Å; N32-A36 WeakPolarHBondContact O-CB 3.17Å; N32-A36 PolarHBondContact O-N 3.36Å; A36-L38 PolarHBondContact O-N 2.87Å; A36-L39 PolarHBondContact O-N 2.82Å; A36-D40 WeakPolarHBondContact O-CB 3.41Å; A36-D40 PolarHBondContact O-N 3.46Å
37	C	62.6	Low	62.3	Low	14 Å²	14	75.8 Å²	75.8	10%	0.095	42%	0.418	C	S	.	.	H	α-helix	trans	-65.3	-37.8	178.3	-169.5	0	0	0	0	112.5	V17 L20 Q33 L34 R41	V17-C37 HydrophobicContact CG1-CB 4.41Å; L20-C37 HydrophobicContact CD1-CB 4.01Å; Q33-C37 WeakPolarHBondContact O-CB 3.34Å; Q33-C37 PolarHBondContact O-N 2.88Å; L34-C37 PolarHBondContact O-N 3.12Å; C37-R41 VanDerWaalsContact O-CB 3.32Å; C37-R41 WeakPolarHBondContact O-CB 3.3Å; C37-R41 VanDerWaalsContact O-CG 3.25Å; C37-R41 WeakPolarHBondContact O-CG 3.22Å; C37-R41 PolarHBondContact O-N 3.19Å
38	L	61.4	Low	61.7	Low	35 Å²	35	79.2 Å²	79.2	18%	0.183	43%	0.429	C	S	.	.	H	α-helix	trans	-72.9	-41	174.9	-69.2	175	0	0	0	111.5	L9 V17 L34 K35 A36 R41 L42	L9-L38 HydrophobicContact CD2-CD1 4.39Å; V17-L38 HydrophobicContact CG1-CD2 4.09Å; V17-L38 HydrophobicContact CG1-CG 4.43Å; L34-L38 HydrophobicContact CD1-CD1 4.11Å; L34-L38 HydrophobicContact CD1-CG 4.28Å; L34-L38 HydrophobicContact CG-CD1 3.98Å; L34-L38 HydrophobicContact CG-CG 4.47Å; L34-L38 WeakPolarHBondContact O-CB 3.23Å; L34-L38 VanDerWaalsContact O-CG 3.28Å; L34-L38 WeakPolarHBondContact O-CG 3.29Å; L34-L38 PolarHBondContact O-N 3.24Å; K35-L38 PolarHBondContact O-N 2.9Å; A36-L38 PolarHBondContact O-N 2.87Å; L38-R41 PolarHBondContact O-N 3.43Å; L38-L42 HydrophobicContact CB-CD1 4.22Å; L38-L42 HydrophobicContact CD2-CD1 3.78Å; L38-L42 VanDerWaalsContact O-CA 3.32Å; L38-L42 WeakPolarHBondContact O-CA 3.37Å; L38-L42 WeakPolarHBondContact O-CB 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.39Å; L38-L42 PolarHBondContact O-N 3.06Å
39	L	64.5	Low	60.8	Low	106 Å²	106	75.7 Å²	75.7	56%	0.555	40%	0.399	S	S	*	.	H	α-helix	trans	-66.9	-39.1	176.2	-74.4	174.3	0	0	0	112.4	K35 A36 R41 G43	K35-L39 HydrophobicContact CD-CD1 4.47Å; K35-L39 HydrophobicContact CG-CD1 3.83Å; K35-L39 HydrophobicContact CG-CG 4.34Å; K35-L39 VanDerWaalsContact O-CB 3.32Å; K35-L39 WeakPolarHBondContact O-CB 3.31Å; K35-L39 VanDerWaalsContact O-CG 3.25Å; K35-L39 WeakPolarHBondContact O-CG 3.14Å; K35-L39 PolarHBondContact O-N 2.85Å; A36-L39 PolarHBondContact O-N 2.82Å; L39-R41 VanDerWaalsContact C-N 3.28Å; L39-R41 PolarHBondContact O-N 3.41Å; L39-G43 WeakPolarHBondContact O-CA 3.32Å; L39-G43 PolarHBondContact O-N 2.78Å
40	D	60.9	Low	59.7	Low	134 Å²	134	76.6 Å²	76.6	72%	0.717	40%	0.403	S	S	*	.	H	α-helix	trans	-63.4	-37.1	175.8	178.8	66.5	0	0	0	111.4	A36	A36-D40 WeakPolarHBondContact O-CB 3.41Å; A36-D40 PolarHBondContact O-N 3.46Å
41	R	56.3	Low	59.2	Low	138 Å²	138	84.5 Å²	84.5	52%	0.521	43%	0.431	S	S	.	.	H	α-helix	trans	-102.3	-15.6	-174	-60.4	179.5	176.7	-116.8	2.6	115.7	M16 C37 L38 L39	M16-R41 HydrophobicContact CE-CB 3.2Å; M16-R41 HydrophobicContact CE-CG 4.04Å; C37-R41 VanDerWaalsContact O-CB 3.32Å; C37-R41 WeakPolarHBondContact O-CB 3.3Å; C37-R41 VanDerWaalsContact O-CG 3.25Å; C37-R41 WeakPolarHBondContact O-CG 3.22Å; C37-R41 PolarHBondContact O-N 3.19Å; L38-R41 PolarHBondContact O-N 3.43Å; L39-R41 VanDerWaalsContact C-N 3.28Å; L39-R41 PolarHBondContact O-N 3.41Å
42	L	58.7	Low	58.8	Low	94 Å²	94	86.9 Å²	86.9	49%	0.492	44%	0.441	S	S	.	.	H	α-helix	trans	-121.7	-1.4	178.8	-54.5	172.8	0	0	0	112.6	M16 L38 L44	M16-L42 HydrophobicContact CE-CD2 4.11Å; M16-L42 HydrophobicContact CE-CG 4.39Å; L38-L42 HydrophobicContact CB-CD1 4.22Å; L38-L42 HydrophobicContact CD2-CD1 3.78Å; L38-L42 VanDerWaalsContact O-CA 3.32Å; L38-L42 WeakPolarHBondContact O-CA 3.37Å; L38-L42 WeakPolarHBondContact O-CB 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.39Å; L38-L42 PolarHBondContact O-N 3.06Å; L42-L44 PolarHBondContact O-N 3.21Å
43	G	57.2	Low	57.8	Low	38 Å²	38	84.1 Å²	84.1	39%	0.392	43%	0.426	S	S	.	.	S	Bend	trans	-60.3	133.9	175.9	0	0	0	0	0	111.4	L39 V45	L39-G43 WeakPolarHBondContact O-CA 3.32Å; L39-G43 PolarHBondContact O-N 2.78Å; G43-V45 PolarHBondContact O-N 3.21Å
44	L	56.1	Low	57.1	Low	84 Å²	84	88.7 Å²	88.7	44%	0.44	45%	0.448	S	S	.	.			trans	-32	121.9	-171.1	-65.7	162.4	0	0	0	114.1	L42 E48 R49	L42-L44 PolarHBondContact O-N 3.21Å; L44-E48 HydrophobicContact CB-CB 4.48Å; L44-E48 HydrophobicContact CD2-CB 4.16Å; L44-E48 WeakPolarHBondContact CD2-OE2 3.2Å; L44-R49 HydrophobicContact CB-CG 4.38Å; L44-R49 PolarHBondContact O-NE 3.09Å
45	V	54.3	Low	56.7	Low	95 Å²	95	95.4 Å²	95.4	58%	0.576	48%	0.483	S	S	*	.			trans	-57.4	143.3	173.8	-175.3	0	0	0	0	108.8	G43 S47 E48 R49	G43-V45 PolarHBondContact O-N 3.21Å; V45-S47 VanDerWaalsContact CG1-OG 3.31Å; V45-S47 WeakPolarHBondContact CG1-OG 3.46Å; V45-S47 PolarHBondContact O-N 2.81Å; V45-E48 PolarHBondContact O-N 3.28Å; V45-R49 PolarHBondContact O-N 3.45Å
46	L	50.3	Low	56.1	Low	85 Å²	85	91.2 Å²	91.2	45%	0.445	47%	0.466	S	S	.	.	H	α-helix	trans	-46.7	-33.1	-176.8	-139	115.2	0	0	0	113.8	R49 L50 F284	L46-R49 PolarHBondContact O-N 3.11Å; L46-L50 HydrophobicContact CD2-CD1 4.21Å; L46-L50 WeakPolarHBondContact O-CB 3.47Å; L46-L50 WeakPolarHBondContact O-CG 3.13Å; L46-L50 PolarHBondContact O-N 3.39Å; L46-F284 HydrophobicContact CD1-CE2 3.83Å; L46-F284 HydrophobicContact CD1-CZ 3.81Å; L46-F284 HydrophobicContact CD2-CZ 4.43Å
47	S	43.7	Very low	55.2	Low	68 Å²	68	92.9 Å²	92.9	48%	0.476	47%	0.472	S	S	.	.	H	α-helix	trans	-63	-34.9	176.3	40.3	0	0	0	0	114.4	V45 R51	V45-S47 VanDerWaalsContact CG1-OG 3.31Å; V45-S47 WeakPolarHBondContact CG1-OG 3.46Å; V45-S47 PolarHBondContact O-N 2.81Å; S47-R51 PolarHBondContact O-N 3.3Å
48	E	55.7	Low	54.4	Low	99 Å²	99	100.9 Å²	100.9	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-78.8	-30.7	176	-68.4	-178.7	136.5	0	0	111.8	L44 V45 K52	L44-E48 HydrophobicContact CB-CB 4.48Å; L44-E48 HydrophobicContact CD2-CB 4.16Å; L44-E48 WeakPolarHBondContact CD2-OE2 3.2Å; V45-E48 PolarHBondContact O-N 3.28Å; E48-K52 PolarHBondContact O-N 3.45Å
49	R	53.9	Low	53.7	Low	81 Å²	81	102.8 Å²	102.8	31%	0.306	53%	0.53	S	S	.	.	H	α-helix	trans	-66.1	-40.3	169.4	-61.1	-176.6	-176.1	-143.9	-2.1	111	L44 V45 L46 K52 L53 I84	L44-R49 HydrophobicContact CB-CG 4.38Å; L44-R49 PolarHBondContact O-NE 3.09Å; V45-R49 PolarHBondContact O-N 3.45Å; L46-R49 PolarHBondContact O-N 3.11Å; R49-K52 PolarHBondContact O-N 3.41Å; R49-L53 PolarHBondContact O-N 3.08Å; R49-L53 VanDerWaalsContact O-N 3.09Å; R49-I84 VanDerWaalsContact NH1-CD1 3.3Å
50	L	50	Low	53	Low	87 Å²	87	102 Å²	102	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-42.7	174.8	-77.4	169.7	0	0	0	112.6	L46 K52 L53 E54	L46-L50 HydrophobicContact CD2-CD1 4.21Å; L46-L50 WeakPolarHBondContact O-CB 3.47Å; L46-L50 WeakPolarHBondContact O-CG 3.13Å; L46-L50 PolarHBondContact O-N 3.39Å; L50-K52 VanDerWaalsContact C-N 3.25Å; L50-K52 PolarHBondContact O-N 3.15Å; L50-L53 HydrophobicContact CD2-CD1 4.36Å; L50-L53 CarbonylContact O-C 3.54Å; L50-L53 WeakPolarHBondContact O-CA 3.47Å; L50-L53 WeakPolarHBondContact O-CB 3.43Å; L50-L53 PolarHBondContact O-N 2.95Å; L50-E54 WeakPolarHBondContact O-CG 3.35Å; L50-E54 PolarHBondContact O-N 2.71Å
51	R	54.6	Low	52.1	Low	181 Å²	181	99.1 Å²	99.1	68%	0.683	53%	0.527	S	S	*	.	H	α-helix	trans	-60.2	-34.1	173.6	-88.2	-174.8	170.3	174.8	-2.8	113.3	S47 L55	S47-R51 PolarHBondContact O-N 3.3Å; R51-L55 WeakPolarHBondContact O-CG 3.46Å
52	K	56.2	Low	52	Low	128 Å²	128	100.2 Å²	100.2	56%	0.557	54%	0.543	S	S	*	.	H	α-helix	trans	-72	-30.4	173.7	-75.8	-174.2	175.1	-175.4	0	112.8	E48 R49 L50	E48-K52 PolarHBondContact O-N 3.45Å; R49-K52 PolarHBondContact O-N 3.41Å; L50-K52 VanDerWaalsContact C-N 3.25Å; L50-K52 PolarHBondContact O-N 3.15Å
53	L	49.1	Very low	51.8	Low	48 Å²	48	98.5 Å²	98.5	25%	0.251	53%	0.534	S	S	.	.	H	α-helix	trans	-71.3	-36.6	171.8	-82.7	155.5	0	0	0	112.2	R49 L50 L55 L56 M88	R49-L53 PolarHBondContact O-N 3.08Å; R49-L53 VanDerWaalsContact O-N 3.09Å; L50-L53 HydrophobicContact CD2-CD1 4.36Å; L50-L53 CarbonylContact O-C 3.54Å; L50-L53 WeakPolarHBondContact O-CA 3.47Å; L50-L53 WeakPolarHBondContact O-CB 3.43Å; L50-L53 PolarHBondContact O-N 2.95Å; L53-L55 PolarHBondContact O-N 2.85Å; L53-L56 HydrophobicContact CD2-CD1 3.79Å; L53-L56 WeakPolarHBondContact O-CB 3.5Å; L53-L56 PolarHBondContact O-N 3.06Å; L53-L56 VanDerWaalsContact O-N 3.11Å; L53-M88 HydrophobicContact CD1-SD 4.2Å
54	E	53.4	Low	51.6	Low	151 Å²	151	103.8 Å²	103.8	71%	0.706	55%	0.546	S	S	*	.	H	α-helix	trans	-63.5	-20.3	175	-74.9	173.8	171.6	0	0	113.3	L50 L56	L50-E54 WeakPolarHBondContact O-CG 3.35Å; L50-E54 PolarHBondContact O-N 2.71Å; E54-L56 VanDerWaalsContact C-N 3.34Å
55	L	57.9	Low	51.4	Low	148 Å²	148	105.1 Å²	105.1	78%	0.775	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-1.9	176.2	-69.3	167.9	0	0	0	113.5	R51 L53	R51-L55 WeakPolarHBondContact O-CG 3.46Å; L53-L55 PolarHBondContact O-N 2.85Å
56	L	54.4	Low	51.4	Low	43 Å²	43	104.7 Å²	104.7	23%	0.225	56%	0.56	C	S	.	*	S	Bend	trans	-69.2	144.6	174.6	-69.4	174.3	0	0	0	110.7	L53 E54 L58 L60 L75	L53-L56 HydrophobicContact CD2-CD1 3.79Å; L53-L56 WeakPolarHBondContact O-CB 3.5Å; L53-L56 PolarHBondContact O-N 3.06Å; L53-L56 VanDerWaalsContact O-N 3.11Å; E54-L56 VanDerWaalsContact C-N 3.34Å; L56-L58 PolarHBondContact O-N 3.23Å; L56-L60 HydrophobicContact CB-CD1 3.98Å; L56-L60 HydrophobicContact CD1-CD1 4.27Å; L56-L75 HydrophobicContact CD2-CD1 3.62Å
57	P	48.6	Very low	51.7	Low	93 Å²	93	108.9 Å²	108.9	60%	0.604	57%	0.57	S	S	*	*			trans	-52.6	138.4	-179.1	-23.4	31.4	0	0	0	112.4	S59	P57-S59 PolarHBondContact O-N 3.4Å
58	L	45	Very low	52.3	Low	182 Å²	182	107.3 Å²	107.3	95%	0.953	56%	0.557	S	S	*	*	S	Bend	trans	-56.4	-1.4	-175.5	-103.8	76.2	0	0	0	116.1	L56 L60	L56-L58 PolarHBondContact O-N 3.23Å; L58-L60 PolarHBondContact O-N 2.78Å
59	S	47.6	Very low	52.3	Low	76 Å²	76	107.1 Å²	107.1	53%	0.531	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-85.3	21.2	-179.3	56.8	0	0	0	0	114.1	P57 G61	P57-S59 PolarHBondContact O-N 3.4Å; S59-G61 PolarHBondContact O-N 2.79Å
60	L	49	Very low	52.7	Low	89 Å²	89	104.6 Å²	104.6	47%	0.466	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-68.4	-20.7	-178.8	-122.1	96.7	0	0	0	113.5	L56 L58 L68	L56-L60 HydrophobicContact CB-CD1 3.98Å; L56-L60 HydrophobicContact CD1-CD1 4.27Å; L58-L60 PolarHBondContact O-N 2.78Å; L60-L68 HydrophobicContact CD2-CD1 3.63Å; L60-L68 HydrophobicContact CG-CD1 3.83Å
61	G	42.4	Very low	53.2	Low	73 Å²	73	104.2 Å²	104.2	75%	0.753	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-72.8	-26.9	-171	0	0	0	0	0	115.8	S59	S59-G61 PolarHBondContact O-N 2.79Å
62	D	54.5	Low	53.2	Low	161 Å²	161	96.2 Å²	96.2	86%	0.861	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-103.4	-3.1	-174.2	-59	-35	0	0	0	113.1	K64	D62-K64 PolarHBondContact O-N 3.14Å
63	M	53.4	Low	53.4	Low	59 Å²	59	94.8 Å²	94.8	29%	0.291	51%	0.514	S	S	.	.			trans	-76.7	127.7	-175.7	-65.3	-171.8	74.7	0	0	110.8	W67 Q71	M63-W67 HydrophobicContact CB-CB 4.49Å; M63-W67 HydrophobicContact CE-CB 3.81Å; M63-W67 HydrophobicContact CE-CE3 4Å; M63-Q71 HydrophobicContact CE-CG 3.63Å
64	K	53.7	Low	54	Low	149 Å²	149	99 Å²	99	65%	0.648	53%	0.532	S	S	*	.			trans	-52.3	139.9	165.3	-88.3	175.7	175.2	159	0	109.1	D62 S66 W67 L68	D62-K64 PolarHBondContact O-N 3.14Å; K64-S66 PolarHBondContact O-N 3.31Å; K64-W67 HydrophobicContact CB-CB 4.48Å; K64-W67 WeakPolarHBondContact O-CA 3.37Å; K64-W67 WeakPolarHBondContact O-CB 3.11Å; K64-W67 PolarHBondContact O-N 3.45Å; K64-L68 PolarHBondContact O-N 2.75Å; K64-L68 VanDerWaalsContact O-N 3.13Å
65	P	51.1	Low	54.1	Low	112 Å²	112	96.3 Å²	96.3	73%	0.727	52%	0.522	S	S	*	.	H	α-helix	trans	-51.3	-34.6	-179.8	-29.2	34.3	0	0	0	113.9	L68 Y69	P65-L68 PolarHBondContact O-N 2.89Å; P65-Y69 PolarHBondContact O-N 2.9Å
66	S	54.8	Low	54	Low	85 Å²	85	92.8 Å²	92.8	59%	0.594	50%	0.499	S	S	*	.	H	α-helix	trans	-68	-32.9	175.3	54.4	0	0	0	0	114	K64 Y69 G70	K64-S66 PolarHBondContact O-N 3.31Å; S66-Y69 WeakPolarHBondContact O-CB 3.29Å; S66-Y69 PolarHBondContact O-N 2.82Å; S66-G70 PolarHBondContact O-N 3.43Å; S66-G70 VanDerWaalsContact O-N 3.08Å
67	W	57.5	Low	54	Low	173 Å²	173	95.7 Å²	95.7	66%	0.655	52%	0.519	S	S	*	.	H	α-helix	trans	-72.8	-39.8	175.2	-96.5	79.4	0	0	0	111.9	M63 K64 Y69 G70 Q71	M63-W67 HydrophobicContact CB-CB 4.49Å; M63-W67 HydrophobicContact CE-CB 3.81Å; M63-W67 HydrophobicContact CE-CE3 4Å; K64-W67 HydrophobicContact CB-CB 4.48Å; K64-W67 WeakPolarHBondContact O-CA 3.37Å; K64-W67 WeakPolarHBondContact O-CB 3.11Å; K64-W67 PolarHBondContact O-N 3.45Å; W67-Y69 VanDerWaalsContact C-N 3.26Å; W67-Y69 PolarHBondContact O-N 3.27Å; W67-G70 PolarHBondContact O-N 3.27Å; W67-Q71 PolarHBondContact O-N 3.16Å
68	L	56	Low	54.3	Low	35 Å²	35	99 Å²	99	18%	0.183	53%	0.532	C	S	.	.	H	α-helix	trans	-62	-38	172.8	-174.5	132.8	0	0	0	111.1	L60 K64 P65 Q71 L72	L60-L68 HydrophobicContact CD2-CD1 3.63Å; L60-L68 HydrophobicContact CG-CD1 3.83Å; K64-L68 PolarHBondContact O-N 2.75Å; K64-L68 VanDerWaalsContact O-N 3.13Å; P65-L68 PolarHBondContact O-N 2.89Å; L68-Q71 PolarHBondContact O-N 2.97Å; L68-L72 HydrophobicContact CD2-CD1 3.67Å; L68-L72 HydrophobicContact CD2-CG 4.5Å; L68-L72 HydrophobicContact CG-CD1 4.48Å; L68-L72 WeakPolarHBondContact O-CG 3.12Å; L68-L72 PolarHBondContact O-N 2.71Å
69	Y	54.4	Low	54.9	Low	95 Å²	95	93.2 Å²	93.2	37%	0.373	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-49.7	172.3	-166.9	-88.9	0	0	0	111.9	P65 S66 W67 Q71 L72 E73	P65-Y69 PolarHBondContact O-N 2.9Å; S66-Y69 WeakPolarHBondContact O-CB 3.29Å; S66-Y69 PolarHBondContact O-N 2.82Å; W67-Y69 VanDerWaalsContact C-N 3.26Å; W67-Y69 PolarHBondContact O-N 3.27Å; Y69-Q71 VanDerWaalsContact C-N 3.3Å; Y69-Q71 PolarHBondContact O-N 2.79Å; Y69-L72 PolarHBondContact O-N 2.98Å; Y69-L72 VanDerWaalsContact O-N 3.16Å; Y69-E73 WeakPolarHBondContact O-CB 3.25Å; Y69-E73 PolarHBondContact O-N 2.9Å
70	G	62.8	Low	55	Low	29 Å²	29	91.1 Å²	91.1	30%	0.299	49%	0.485	S	S	.	.	H	α-helix	trans	-61.8	-34.2	177.8	0	0	0	0	0	113.8	S66 W67 Q74	S66-G70 PolarHBondContact O-N 3.43Å; S66-G70 VanDerWaalsContact O-N 3.08Å; W67-G70 PolarHBondContact O-N 3.27Å; G70-Q74 PolarHBondContact O-N 3.31Å
71	Q	61	Low	55.1	Low	78 Å²	78	95 Å²	95	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-69.3	-42.4	172.9	-76.2	-62.5	-70.8	0	0	112.4	M63 W67 L68 Y69 E73 Q74 L75	M63-Q71 HydrophobicContact CE-CG 3.63Å; W67-Q71 PolarHBondContact O-N 3.16Å; L68-Q71 PolarHBondContact O-N 2.97Å; Y69-Q71 VanDerWaalsContact C-N 3.3Å; Y69-Q71 PolarHBondContact O-N 2.79Å; Q71-E73 VanDerWaalsContact C-N 3.3Å; Q71-E73 PolarHBondContact O-N 3.45Å; Q71-Q74 PolarHBondContact O-N 2.89Å; Q71-L75 WeakPolarHBondContact O-CB 3.32Å; Q71-L75 VanDerWaalsContact O-CG 3.25Å; Q71-L75 WeakPolarHBondContact O-CG 3.29Å; Q71-L75 PolarHBondContact O-N 2.78Å
72	L	55.1	Low	55.6	Low	14 Å²	14	96.2 Å²	96.2	7%	0.073	49%	0.492	C	S	.	.	H	α-helix	trans	-63.5	-38.1	174.7	-76.9	170.6	0	0	0	111.6	L68 Y69 L75 Y76 M88	L68-L72 HydrophobicContact CD2-CD1 3.67Å; L68-L72 HydrophobicContact CD2-CG 4.5Å; L68-L72 HydrophobicContact CG-CD1 4.48Å; L68-L72 WeakPolarHBondContact O-CG 3.12Å; L68-L72 PolarHBondContact O-N 2.71Å; Y69-L72 PolarHBondContact O-N 2.98Å; Y69-L72 VanDerWaalsContact O-N 3.16Å; L72-L75 PolarHBondContact O-N 2.92Å; L72-Y76 HydrophobicContact CD2-CD2 4.03Å; L72-Y76 HydrophobicContact CD2-CE2 3.92Å; L72-Y76 WeakPolarHBondContact O-CB 3.24Å; L72-Y76 WeakPolarHBondContact O-CD2 3.31Å; L72-Y76 PolarHBondContact O-N 2.81Å; L72-M88 HydrophobicContact CD1-CE 4.45Å
73	E	59.7	Low	55.7	Low	97 Å²	97	96.6 Å²	96.6	45%	0.453	49%	0.486	S	S	.	.	H	α-helix	trans	-66	-38.5	176.6	-165.6	168.7	-155.8	0	0	111.8	Y69 Q71 T77 V80	Y69-E73 WeakPolarHBondContact O-CB 3.25Å; Y69-E73 PolarHBondContact O-N 2.9Å; Q71-E73 VanDerWaalsContact C-N 3.3Å; Q71-E73 PolarHBondContact O-N 3.45Å; E73-T77 PolarHBondContact O-N 2.98Å; E73-V80 HydrophobicContact CG-CG1 4.37Å; E73-V80 HydrophobicContact CG-CG2 4.22Å
74	Q	62	Low	55.5	Low	137 Å²	137	97 Å²	97	64%	0.64	49%	0.489	S	S	*	.	H	α-helix	trans	-65	-42.4	171.3	-98.3	-178.6	-20.4	0	0	113.1	G70 Q71	G70-Q74 PolarHBondContact O-N 3.31Å; Q71-Q74 PolarHBondContact O-N 2.89Å
75	L	56	Low	55.4	Low	94 Å²	94	90.9 Å²	90.9	49%	0.492	46%	0.463	S	S	.	.	H	α-helix	trans	-78.6	-28.2	-174.9	-71.3	168.6	0	0	0	113.5	L56 Q71 L72	L56-L75 HydrophobicContact CD2-CD1 3.62Å; Q71-L75 WeakPolarHBondContact O-CB 3.32Å; Q71-L75 VanDerWaalsContact O-CG 3.25Å; Q71-L75 WeakPolarHBondContact O-CG 3.29Å; Q71-L75 PolarHBondContact O-N 2.78Å; L72-L75 PolarHBondContact O-N 2.92Å
76	Y	54.6	Low	55.5	Low	74 Å²	74	92.7 Å²	92.7	29%	0.29	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	47.3	-175.2	-64.1	-81.6	0	0	0	111.7	L72 N78 D79 V80	L72-Y76 HydrophobicContact CD2-CD2 4.03Å; L72-Y76 HydrophobicContact CD2-CE2 3.92Å; L72-Y76 WeakPolarHBondContact O-CB 3.24Å; L72-Y76 WeakPolarHBondContact O-CD2 3.31Å; L72-Y76 PolarHBondContact O-N 2.81Å; Y76-N78 PolarHBondContact O-N 2.97Å; Y76-D79 HydrophobicContact CD1-CB 4.44Å; Y76-D79 PolarHBondContact O-N 3.12Å; Y76-V80 WeakPolarHBondContact O-CG2 3.18Å; Y76-V80 PolarHBondContact O-N 2.85Å
77	T	55.9	Low	55.6	Low	105 Å²	105	93.9 Å²	93.9	64%	0.644	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-21.5	-174.8	6.8	0	0	0	0	115.5	E73	E73-T77 PolarHBondContact O-N 2.98Å
78	N	54.4	Low	55.2	Low	163 Å²	163	88.2 Å²	88.2	87%	0.872	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	4.7	-180	-63.9	-44.8	0	0	0	114.2	Y76	Y76-N78 PolarHBondContact O-N 2.97Å
79	D	56.4	Low	55	Low	59 Å²	59	88.7 Å²	88.7	32%	0.316	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	0.7	-172	-124.2	-9.4	0	0	0	112.7	Y76 D81 H82 I85	Y76-D79 HydrophobicContact CD1-CB 4.44Å; Y76-D79 PolarHBondContact O-N 3.12Å; D79-D81 VanDerWaalsContact C-N 3.27Å; D79-D81 PolarHBondContact O-N 2.98Å; D79-H82 WeakPolarHBondContact O-CB 3.27Å; D79-H82 PolarHBondContact O-N 3.38Å; D79-H82 VanDerWaalsContact O-N 3.12Å; D79-H82 IonicContact OD1-CD2 3.24Å; D79-H82 PolarHBondContact OD1-CD2 3.23Å; D79-I85 WeakPolarHBondContact O-CD1 3.19Å
80	V	50.1	Low	55.1	Low	33 Å²	33	89.7 Å²	89.7	20%	0.2	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-29	-171.5	-155.9	0	0	0	0	113.4	E73 Y76 H82 I85	E73-V80 HydrophobicContact CG-CG1 4.37Å; E73-V80 HydrophobicContact CG-CG2 4.22Å; Y76-V80 WeakPolarHBondContact O-CG2 3.18Å; Y76-V80 PolarHBondContact O-N 2.85Å; V80-H82 VanDerWaalsContact C-N 3.32Å; V80-H82 PolarHBondContact O-N 3.23Å; V80-I85 HydrophobicContact CG1-CD1 4.46Å
81	D	51.5	Low	54.6	Low	169 Å²	169	95.4 Å²	95.4	90%	0.904	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-2.7	179.6	-104.5	-30.1	0	0	0	114.3	D79 K83	D79-D81 VanDerWaalsContact C-N 3.27Å; D79-D81 PolarHBondContact O-N 2.98Å; D81-K83 PolarHBondContact O-N 3.41Å
82	H	53.5	Low	54.1	Low	99 Å²	99	95.5 Å²	95.5	46%	0.458	47%	0.465	S	S	.	.	S	Bend	trans	-67.5	125.5	175.7	-110.1	-71	0	0	0	109.3	D79 V80 I84 I85	D79-H82 WeakPolarHBondContact O-CB 3.27Å; D79-H82 PolarHBondContact O-N 3.38Å; D79-H82 VanDerWaalsContact O-N 3.12Å; D79-H82 IonicContact OD1-CD2 3.24Å; D79-H82 PolarHBondContact OD1-CD2 3.23Å; V80-H82 VanDerWaalsContact C-N 3.32Å; V80-H82 PolarHBondContact O-N 3.23Å; H82-I84 HydrophobicContact CB-CB 4.4Å; H82-I84 CarbonylContact O-C 3.45Å; H82-I84 PolarHBondContact O-N 2.87Å; H82-I85 PolarHBondContact O-N 3.03Å
83	K	55	Low	54	Low	170 Å²	170	97.7 Å²	97.7	74%	0.739	49%	0.485	S	S	*	.	H	α-helix	trans	-35.5	-25.1	167	-152.7	174.3	-171.3	175.6	0	114.7	D81 E87	D81-K83 PolarHBondContact O-N 3.41Å; K83-E87 WeakPolarHBondContact O-CB 3.35Å; K83-E87 PolarHBondContact O-N 3.24Å
84	I	50.2	Low	53.7	Low	68 Å²	68	98.1 Å²	98.1	35%	0.349	49%	0.487	S	S	.	.	H	α-helix	trans	-64.4	-43.3	174.8	-59.7	172.2	0	0	0	112.4	R49 H82 E87 M88	R49-I84 VanDerWaalsContact NH1-CD1 3.3Å; H82-I84 HydrophobicContact CB-CB 4.4Å; H82-I84 CarbonylContact O-C 3.45Å; H82-I84 PolarHBondContact O-N 2.87Å; I84-E87 PolarHBondContact O-N 3.3Å; I84-M88 WeakPolarHBondContact O-CB 3.01Å; I84-M88 PolarHBondContact O-N 2.9Å
85	I	51	Low	53	Low	19 Å²	19	95.7 Å²	95.7	10%	0.097	48%	0.481	C	S	.	.	H	α-helix	trans	-70.2	-38.3	177.4	-70	167	0	0	0	110.1	D79 V80 H82 M88 N89	D79-I85 WeakPolarHBondContact O-CD1 3.19Å; V80-I85 HydrophobicContact CG1-CD1 4.46Å; H82-I85 PolarHBondContact O-N 3.03Å; I85-M88 PolarHBondContact O-N 3.09Å; I85-N89 VanDerWaalsContact O-CB 3.23Å; I85-N89 WeakPolarHBondContact O-CB 3.08Å; I85-N89 PolarHBondContact O-N 3.3Å
86	H	54.1	Low	52.7	Low	150 Å²	150	93.4 Å²	93.4	69%	0.694	48%	0.476	S	S	*	.	H	α-helix	trans	-67.4	-37.7	175.2	-150.3	-51.5	0	0	0	112.7	H90	H86-H90 PolarHBondContact O-N 2.8Å
87	E	55.5	Low	52.4	Low	111 Å²	111	98.3 Å²	98.3	52%	0.519	50%	0.495	S	S	.	.	H	α-helix	trans	-71.4	-39.2	174.9	-170	88.3	-164.5	0	0	111.4	K83 I84 N89 H90 R91	K83-E87 WeakPolarHBondContact O-CB 3.35Å; K83-E87 PolarHBondContact O-N 3.24Å; I84-E87 PolarHBondContact O-N 3.3Å; E87-N89 VanDerWaalsContact C-N 3.35Å; E87-H90 PolarHBondContact O-N 3.36Å; E87-R91 WeakPolarHBondContact O-CG 3.49Å; E87-R91 PolarHBondContact O-N 2.83Å
88	M	50.9	Low	51.8	Low	53 Å²	53	98.4 Å²	98.4	26%	0.261	49%	0.489	S	S	.	.	H	α-helix	trans	-68.8	-36.8	176.1	-160.7	171.2	76.9	0	0	110.6	L53 L72 I84 I85 R91 L92	L53-M88 HydrophobicContact CD1-SD 4.2Å; L72-M88 HydrophobicContact CD1-CE 4.45Å; I84-M88 WeakPolarHBondContact O-CB 3.01Å; I84-M88 PolarHBondContact O-N 2.9Å; I85-M88 PolarHBondContact O-N 3.09Å; M88-R91 PolarHBondContact O-N 3.42Å; M88-L92 HydrophobicContact CG-CD1 4.25Å; M88-L92 VanDerWaalsContact O-CB 3.32Å; M88-L92 WeakPolarHBondContact O-CB 3.32Å; M88-L92 VanDerWaalsContact O-CG 3.31Å; M88-L92 WeakPolarHBondContact O-CG 3.28Å; M88-L92 PolarHBondContact O-N 3.42Å
89	N	50.6	Low	51.5	Low	46 Å²	46	94.1 Å²	94.1	25%	0.246	47%	0.469	C	S	.	.	H	α-helix	trans	-63.3	-43.1	170	-80.3	-12.3	0	0	0	111.8	I85 E87 R91 L92 A93	I85-N89 VanDerWaalsContact O-CB 3.23Å; I85-N89 WeakPolarHBondContact O-CB 3.08Å; I85-N89 PolarHBondContact O-N 3.3Å; E87-N89 VanDerWaalsContact C-N 3.35Å; N89-R91 VanDerWaalsContact C-N 3.3Å; N89-R91 PolarHBondContact O-N 2.83Å; N89-L92 PolarHBondContact O-N 2.8Å; N89-A93 WeakPolarHBondContact O-CB 3.4Å; N89-A93 PolarHBondContact O-N 3.45Å
90	H	57.8	Low	51	Low	116 Å²	116	96.7 Å²	96.7	54%	0.537	48%	0.483	S	S	.	.	H	α-helix	trans	-62.9	-39.1	174.8	-173.1	-69.8	0	0	0	111.3	H86 E87 Q94	H86-H90 PolarHBondContact O-N 2.8Å; E87-H90 PolarHBondContact O-N 3.36Å; H90-Q94 VanDerWaalsContact O-CB 3.29Å; H90-Q94 WeakPolarHBondContact O-CB 3.39Å; H90-Q94 PolarHBondContact O-N 3.46Å
91	R	51.3	Low	51.2	Low	149 Å²	149	98.5 Å²	98.5	56%	0.562	50%	0.502	S	S	*	.	H	α-helix	trans	-70.8	-41.7	176.8	-77	-176.5	166.9	-125.9	-7.6	112.9	E87 M88 N89 Q94 V95	E87-R91 WeakPolarHBondContact O-CG 3.49Å; E87-R91 PolarHBondContact O-N 2.83Å; M88-R91 PolarHBondContact O-N 3.42Å; N89-R91 VanDerWaalsContact C-N 3.3Å; N89-R91 PolarHBondContact O-N 2.83Å; R91-Q94 PolarHBondContact O-N 2.77Å; R91-V95 VanDerWaalsContact O-CG2 3.29Å; R91-V95 WeakPolarHBondContact O-CG2 3.25Å; R91-V95 PolarHBondContact O-N 3.33Å
92	L	51.4	Low	51.2	Low	79 Å²	79	97.2 Å²	97.2	41%	0.414	49%	0.49	S	S	.	.	H	α-helix	trans	-66.1	-40.5	175.7	-75.7	169.1	0	0	0	111	M88 N89 Q94 V95 A96	M88-L92 HydrophobicContact CG-CD1 4.25Å; M88-L92 VanDerWaalsContact O-CB 3.32Å; M88-L92 WeakPolarHBondContact O-CB 3.32Å; M88-L92 VanDerWaalsContact O-CG 3.31Å; M88-L92 WeakPolarHBondContact O-CG 3.28Å; M88-L92 PolarHBondContact O-N 3.42Å; N89-L92 PolarHBondContact O-N 2.8Å; L92-Q94 VanDerWaalsContact C-N 3.31Å; L92-Q94 PolarHBondContact O-N 3.32Å; L92-V95 PolarHBondContact O-N 2.87Å; L92-A96 VanDerWaalsContact O-CB 3.28Å; L92-A96 WeakPolarHBondContact O-CB 3.32Å; L92-A96 PolarHBondContact O-N 2.93Å
93	A	52.2	Low	50.5	Low	60 Å²	60	100 Å²	100	50%	0.496	50%	0.501	S	S	.	.	H	α-helix	trans	-62.4	-38.6	172.6	0	0	0	0	0	111.8	N89 Y97	N89-A93 WeakPolarHBondContact O-CB 3.4Å; N89-A93 PolarHBondContact O-N 3.45Å; A93-Y97 VanDerWaalsContact O-CB 3.3Å; A93-Y97 WeakPolarHBondContact O-CB 3.43Å; A93-Y97 PolarHBondContact O-N 3.5Å
94	Q	53.3	Low	49.7	Very low	107 Å²	107	97.8 Å²	97.8	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-71	-38.3	176.5	-161.2	170.7	36.4	0	0	112	H90 R91 L92 M98	H90-Q94 VanDerWaalsContact O-CB 3.29Å; H90-Q94 WeakPolarHBondContact O-CB 3.39Å; H90-Q94 PolarHBondContact O-N 3.46Å; R91-Q94 PolarHBondContact O-N 2.77Å; L92-Q94 VanDerWaalsContact C-N 3.31Å; L92-Q94 PolarHBondContact O-N 3.32Å; Q94-M98 WeakPolarHBondContact O-CB 3.48Å; Q94-M98 WeakPolarHBondContact O-CG 3.38Å; Q94-M98 PolarHBondContact O-N 3.05Å
95	V	47.7	Very low	49.1	Very low	86 Å²	86	101.2 Å²	101.2	52%	0.521	52%	0.522	S	S	.	.	H	α-helix	trans	-65.9	-43.9	173.4	171.4	0	0	0	0	110.5	R91 L92 M98 T99	R91-V95 VanDerWaalsContact O-CG2 3.29Å; R91-V95 WeakPolarHBondContact O-CG2 3.25Å; R91-V95 PolarHBondContact O-N 3.33Å; L92-V95 PolarHBondContact O-N 2.87Å; V95-M98 CarbonylContact O-C 3.58Å; V95-M98 PolarHBondContact O-N 2.91Å; V95-M98 VanDerWaalsContact O-N 3.14Å; V95-T99 HydrophobicContact CG1-CG2 4.44Å; V95-T99 PolarHBondContact O-N 3.44Å; V95-T99 PolarHBondContact O-OG1 3.32Å; V95-T99 VanDerWaalsContact O-OG1 3.06Å
96	A	49.1	Very low	48.2	Very low	45 Å²	45	109.4 Å²	109.4	37%	0.372	56%	0.56	S	S	.	*	H	α-helix	trans	-59.6	-46.4	175.2	0	0	0	0	0	111.6	L92 M98 T99 D100	L92-A96 VanDerWaalsContact O-CB 3.28Å; L92-A96 WeakPolarHBondContact O-CB 3.32Å; L92-A96 PolarHBondContact O-N 2.93Å; A96-M98 VanDerWaalsContact C-N 3.3Å; A96-M98 PolarHBondContact O-N 3.23Å; A96-T99 VanDerWaalsContact CA-OG1 3.29Å; A96-T99 WeakPolarHBondContact CA-OG1 3.36Å; A96-T99 PolarHBondContact O-N 3.02Å; A96-T99 PolarHBondContact O-OG1 3.46Å; A96-D100 PolarHBondContact O-N 2.85Å
97	Y	48.4	Very low	47.5	Very low	178 Å²	178	105.5 Å²	105.5	70%	0.698	55%	0.55	S	S	*	.	H	α-helix	trans	-61.1	-39.3	174	-177	-92.2	0	0	0	112.1	A93 A101	A93-Y97 VanDerWaalsContact O-CB 3.3Å; A93-Y97 WeakPolarHBondContact O-CB 3.43Å; A93-Y97 PolarHBondContact O-N 3.5Å; Y97-A101 WeakPolarHBondContact O-CB 3.45Å; Y97-A101 PolarHBondContact O-N 2.93Å; Y97-A101 VanDerWaalsContact O-N 3.08Å
98	M	43.5	Very low	46.4	Very low	106 Å²	106	107.7 Å²	107.7	52%	0.522	57%	0.565	S	S	.	*	H	α-helix	trans	-70.4	-36.4	176.2	-74	-174.1	75	0	0	112.3	Q94 V95 A96 A101 H102	Q94-M98 WeakPolarHBondContact O-CB 3.48Å; Q94-M98 WeakPolarHBondContact O-CG 3.38Å; Q94-M98 PolarHBondContact O-N 3.05Å; V95-M98 CarbonylContact O-C 3.58Å; V95-M98 PolarHBondContact O-N 2.91Å; V95-M98 VanDerWaalsContact O-N 3.14Å; A96-M98 VanDerWaalsContact C-N 3.3Å; A96-M98 PolarHBondContact O-N 3.23Å; M98-A101 PolarHBondContact O-N 3.39Å; M98-H102 PolarHBondContact O-N 2.71Å; M98-H102 PolarHBondContact O-ND1 2.7Å
99	T	47.7	Very low	45.8	Very low	74 Å²	74	114.7 Å²	114.7	45%	0.454	59%	0.59	S	S	.	*	H	α-helix	trans	-69.3	-38.6	176.3	44.7	0	0	0	0	111.8	V95 A96 A101 H102 F103	V95-T99 HydrophobicContact CG1-CG2 4.44Å; V95-T99 PolarHBondContact O-N 3.44Å; V95-T99 PolarHBondContact O-OG1 3.32Å; V95-T99 VanDerWaalsContact O-OG1 3.06Å; A96-T99 VanDerWaalsContact CA-OG1 3.29Å; A96-T99 WeakPolarHBondContact CA-OG1 3.36Å; A96-T99 PolarHBondContact O-N 3.02Å; A96-T99 PolarHBondContact O-OG1 3.46Å; T99-A101 VanDerWaalsContact C-N 3.31Å; T99-A101 PolarHBondContact O-N 3.49Å; T99-H102 PolarHBondContact O-N 3.35Å; T99-H102 VanDerWaalsContact O-N 3.15Å; T99-F103 PolarHBondContact O-N 3.08Å; T99-F103 VanDerWaalsContact O-N 3.09Å
100	D	45.3	Very low	44.9	Very low	113 Å²	113	119.2 Å²	119.2	60%	0.604	62%	0.619	S	S	*	*	H	α-helix	trans	-66.2	-33.8	174.6	-72.2	-11.3	0	0	0	111.9	A96 H102	A96-D100 PolarHBondContact O-N 2.85Å; D100-H102 VanDerWaalsContact C-N 3.27Å; D100-H102 PolarHBondContact O-N 3.36Å
101	A	56	Low	43.8	Very low	71 Å²	71	118.2 Å²	118.2	59%	0.587	63%	0.631	S	S	*	*	H	α-helix	trans	-71.3	-18.6	175.2	0	0	0	0	0	113.8	Y97 M98 T99	Y97-A101 WeakPolarHBondContact O-CB 3.45Å; Y97-A101 PolarHBondContact O-N 2.93Å; Y97-A101 VanDerWaalsContact O-N 3.08Å; M98-A101 PolarHBondContact O-N 3.39Å; T99-A101 VanDerWaalsContact C-N 3.31Å; T99-A101 PolarHBondContact O-N 3.49Å
102	H	51.6	Low	42.9	Very low	141 Å²	141	117.3 Å²	117.3	65%	0.653	65%	0.647	S	S	*	*	H	α-helix	trans	-107.8	-2.3	-178.9	-67.1	82.5	0	0	0	113.8	M98 T99 D100	M98-H102 PolarHBondContact O-N 2.71Å; M98-H102 PolarHBondContact O-ND1 2.7Å; T99-H102 PolarHBondContact O-N 3.35Å; T99-H102 VanDerWaalsContact O-N 3.15Å; D100-H102 VanDerWaalsContact C-N 3.27Å; D100-H102 PolarHBondContact O-N 3.36Å
103	F	37.8	Very low	42.3	Very low	157 Å²	157	118 Å²	118	69%	0.689	66%	0.664	S	S	*	*	S	Bend	trans	-126.2	100.6	169.5	-92.3	-93.1	0	0	0	109	T99 L105	T99-F103 PolarHBondContact O-N 3.08Å; T99-F103 VanDerWaalsContact O-N 3.09Å; F103-L105 VanDerWaalsContact C-N 3.31Å; F103-L105 PolarHBondContact O-N 3.46Å
104	P	38.1	Very low	41.5	Very low	124 Å²	124	121.3 Å²	121.3	81%	0.805	68%	0.678	S	S	*	*			trans	-66.7	100.4	165.5	27.5	-27.7	0	0	0	106.9	Q106	P104-Q106 PolarHBondContact O-N 3.24Å
105	L	37.6	Very low	40.7	Very low	140 Å²	140	122.5 Å²	122.5	73%	0.733	69%	0.693	S	S	*	*			trans	-58.6	109	164	-85.4	166.5	0	0	0	107.3	F103 S107	F103-L105 VanDerWaalsContact C-N 3.31Å; F103-L105 PolarHBondContact O-N 3.46Å; L105-S107 VanDerWaalsContact C-N 3.27Å; L105-S107 PolarHBondContact O-N 3.28Å; L105-S107 PolarHBondContact O-OG 2.97Å
106	Q	32.2	Very low	40.2	Very low	191 Å²	191	122.1 Å²	122.1	89%	0.893	70%	0.699	S	S	*	*			trans	-52.8	100.9	154.5	-85.1	174.3	-54.9	0	0	106.7	P104	P104-Q106 PolarHBondContact O-N 3.24Å
107	S	39.6	Very low	39.5	Very low	69 Å²	69	129 Å²	129	48%	0.483	72%	0.724	S	S	.	*			trans	-111.5	96.9	169.8	41.4	0	0	0	0	106.4	L105 Y109	L105-S107 VanDerWaalsContact C-N 3.27Å; L105-S107 PolarHBondContact O-N 3.28Å; L105-S107 PolarHBondContact O-OG 2.97Å; S107-Y109 WeakPolarHBondContact O-CD2 3.49Å; S107-Y109 PolarHBondContact O-N 3.02Å; S107-Y109 VanDerWaalsContact O-N 3.08Å; S107-Y109 WeakPolarHBondContact OG-CE2 3.31Å
108	D	33.1	Very low	39.2	Very low	156 Å²	156	125.4 Å²	125.4	83%	0.834	73%	0.73	S	S	*	*			trans	-61.4	104.9	163.1	-68.7	-39.7	0	0	0	107.6
109	Y	37.6	Very low	39	Very low	201 Å²	201	126 Å²	126	79%	0.788	74%	0.742	S	S	*	*			trans	-96.8	98.6	167.4	-76.4	-82.3	0	0	0	108.8	S107	S107-Y109 WeakPolarHBondContact O-CD2 3.49Å; S107-Y109 PolarHBondContact O-N 3.02Å; S107-Y109 VanDerWaalsContact O-N 3.08Å; S107-Y109 WeakPolarHBondContact OG-CE2 3.31Å
110	T	30.9	Very low	38.9	Very low	141 Å²	141	128.7 Å²	128.7	87%	0.865	76%	0.758	S	S	*	*			trans	-77.7	112.8	158	51.1	0	0	0	0	108.7
111	A	35.8	Very low	38.7	Very low	94 Å²	94	131.3 Å²	131.3	78%	0.777	77%	0.767	S	S	*	*			trans	-147.5	113.9	163.8	0	0	0	0	0	110.3
112	S	31.5	Very low	37.9	Very low	130 Å²	130	134.3 Å²	134.3	91%	0.909	77%	0.773	S	S	*	*			trans	-54	137.2	-179.7	-55.9	0	0	0	0	114.4
113	A	38.6	Very low	37.6	Very low	93 Å²	93	133.7 Å²	133.7	77%	0.769	78%	0.779	S	S	*	*			trans	-149.8	102.5	150.8	0	0	0	0	0	111.3
114	V	37.1	Very low	37.8	Very low	130 Å²	130	131 Å²	131	79%	0.788	78%	0.777	S	S	*	*			trans	60.3	99.3	134.8	-173.5	0	0	0	0	118.8
115	T	34.9	Very low	37.5	Very low	133 Å²	133	134.5 Å²	134.5	82%	0.816	78%	0.78	S	S	*	*				54.2	108.4	121.8	-40.2	0	0	0	0	119.9
116	A	37	Very low	37.3	Very low	78 Å²	78	132.9 Å²	132.9	65%	0.645	78%	0.781	S	S	*	*				173.2	121.9	107.5	0	0	0	0	0	112.7
117	Q	35.4	Very low	37.4	Very low	190 Å²	190	128.9 Å²	128.9	89%	0.888	77%	0.774	S	S	*	*			trans	60.1	98.1	146.1	-61.2	170.8	-41.2	0	0	117.8
118	A	42.2	Very low	37.1	Very low	101 Å²	101	130.4 Å²	130.4	84%	0.835	78%	0.784	S	S	*	*				84.3	140.8	70.6	0	0	0	0	0	115.4
119	P	39	Very low	37.5	Very low	118 Å²	118	127.5 Å²	127.5	77%	0.766	78%	0.776	S	S	*	*			trans	-125.8	163.8	-143.8	39.8	-23.8	0	0	0	115
120	V	45.7	Very low	37.6	Very low	132 Å²	132	125 Å²	125	80%	0.8	78%	0.776	S	S	*	*			trans	-160.3	105.3	158.7	-170.9	0	0	0	0	108.2
121	E	40.6	Very low	38.1	Very low	168 Å²	168	122.2 Å²	122.2	79%	0.785	77%	0.767	S	S	*	*				72.9	135.9	99.3	-62.5	-163	150.3	0	0	118.4
122	D	40.3	Very low	38.2	Very low	133 Å²	133	125.1 Å²	125.1	71%	0.711	77%	0.769	S	S	*	*			trans	83.5	89.2	150.6	-57.2	-22.2	0	0	0	124.1
123	V	44.5	Very low	38.6	Very low	128 Å²	128	125.6 Å²	125.6	78%	0.776	76%	0.76	S	S	*	*				18.3	152.6	109.4	-157.5	0	0	0	0	117.7
124	P	41.1	Very low	38.4	Very low	101 Å²	101	125.5 Å²	125.5	66%	0.656	76%	0.76	S	S	*	*			cis	-141.6	-172.6	-42.1	44.7	-29.1	0	0	0	116
125	F	32.8	Very low	38.2	Very low	198 Å²	198	124 Å²	124	87%	0.868	76%	0.761	S	S	*	*			trans	88.7	113.3	149.2	-91.9	-85.1	0	0	0	122.8
126	S	33.1	Very low	38.4	Very low	106 Å²	106	121.6 Å²	121.6	74%	0.741	75%	0.754	S	S	*	*			trans	53.1	118.6	136.6	-176.9	0	0	0	0	121.9
127	S	34.5	Very low	38.4	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	77%	0.765	S	S	*	*				156.8	122.3	120.8	-179.6	0	0	0	0	112.7
128	S	34	Very low	38.7	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	76%	0.759	S	S	*	*			trans	55.9	135.6	140.6	-147	0	0	0	0	123.4
129	S	41.8	Very low	38.6	Very low	94 Å²	94	130.4 Å²	130.4	66%	0.657	76%	0.759	S	S	*	*			trans	89.1	117.8	144.7	-50.8	0	0	0	0	120.6
130	D	39.1	Very low	38.6	Very low	149 Å²	149	129.3 Å²	129.3	80%	0.797	76%	0.76	S	S	*	*			trans	66.1	101.7	136.6	-56.5	-29.1	0	0	0	121.7
131	A	40.3	Very low	38.4	Very low	82 Å²	82	128.5 Å²	128.5	68%	0.678	76%	0.757	S	S	*	*				69	140.6	114.7	0	0	0	0	0	121.8
132	L	39.1	Very low	38.7	Very low	156 Å²	156	129.1 Å²	129.1	82%	0.817	77%	0.765	S	S	*	*			trans	79.5	145.5	155.3	-48.9	-175.8	0	0	0	115.8
133	I	38.7	Very low	38.6	Very low	139 Å²	139	126.6 Å²	126.6	71%	0.713	77%	0.77	S	S	*	*			cis	-170.3	138.7	-0.7	-107.7	168	0	0	0	106.8
134	A	35.7	Very low	38.4	Very low	92 Å²	92	131.8 Å²	131.8	76%	0.76	78%	0.776	S	S	*	*			trans	61.6	153.6	136.5	0	0	0	0	0	126.7
135	A	33.4	Very low	38.5	Very low	99 Å²	99	132.9 Å²	132.9	82%	0.818	79%	0.786	S	S	*	*			trans	91.4	136.8	148.2	0	0	0	0	0	116
136	A	37.6	Very low	39.1	Very low	82 Å²	82	129.5 Å²	129.5	68%	0.678	78%	0.781	S	S	*	*			cis	-156.7	133.9	24.3	0	0	0	0	0	110.2
137	R	37.3	Very low	39.9	Very low	231 Å²	231	128.7 Å²	128.7	87%	0.872	78%	0.781	S	S	*	*				69.1	125.9	102.3	-63.6	179.6	172.1	171.8	-1.4	115.6
138	L	41.4	Very low	40.6	Very low	145 Å²	145	129.1 Å²	129.1	76%	0.759	78%	0.781	S	S	*	*				-176	127	102	-88.5	162.4	0	0	0	112.8
139	Q	40.1	Very low	41	Very low	177 Å²	177	136.5 Å²	136.5	83%	0.827	79%	0.794	S	S	*	*			trans	70	133.5	144.3	-62.3	170	1.3	0	0	119.7
140	A	40.6	Very low	41.2	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	80%	0.804	S	S	*	*			cis	-165.1	161.6	-4.6	0	0	0	0	0	109.4
141	P	40.7	Very low	41.1	Very low	115 Å²	115	146.2 Å²	146.2	75%	0.747	81%	0.805	S	S	*	*			trans	-115.2	176.6	-162.5	39.8	-26.6	0	0	0	114.3
142	L	46.2	Very low	41.1	Very low	181 Å²	181	154.2 Å²	154.2	95%	0.948	82%	0.818	S	S	*	*			trans	163.3	129.8	133.2	-85.8	159	0	0	0	111.1
143	G	39.2	Very low	41.4	Very low	80 Å²	80	153.6 Å²	153.6	83%	0.825	81%	0.81	S	S	*	*			trans	141.1	71.4	165.3	0	0	0	0	0	115.9
144	R	40.4	Very low	41.9	Very low	238 Å²	238	152.9 Å²	152.9	90%	0.898	82%	0.815	S	S	*	*			trans	-82.8	127.1	179	-167.6	-178.6	-168.6	-172.5	3.5	110.2
145	S	42.1	Very low	42.4	Very low	124 Å²	124	152.8 Å²	152.8	87%	0.867	81%	0.814	S	S	*	*			trans	-155.6	129.7	147.6	-164.4	0	0	0	0	111
146	V	45.1	Very low	42.8	Very low	126 Å²	126	157.4 Å²	157.4	76%	0.764	82%	0.819	S	S	*	*			trans	-96.1	133.5	-169.5	170	0	0	0	0	109.2
147	A	51.2	Low	43.1	Very low	90 Å²	90	157.2 Å²	157.2	74%	0.744	82%	0.817	S	S	*	*			trans	-144.4	146.1	157.6	0	0	0	0	0	110.1
148	P	48.7	Very low	43.3	Very low	115 Å²	115	158 Å²	158	75%	0.747	82%	0.82	S	S	*	*			trans	-82.5	153.9	-155.1	32.6	-34.6	0	0	0	113.4	R150	P148-R150 PolarHBondContact O-N 3.19Å
149	R	42.4	Very low	43.3	Very low	256 Å²	256	154.5 Å²	154.5	97%	0.966	82%	0.819	S	S	*	*			trans	-48.2	108.4	170.6	-74.8	-179.5	170.7	-157.6	-2.4	110.9
150	R	45.1	Very low	43.5	Very low	234 Å²	234	157.6 Å²	157.6	88%	0.883	82%	0.823	S	S	*	*			trans	-86.9	120.5	159.6	-74.4	-159.3	-166.9	-97.3	3.1	109.6	P148 W152	P148-R150 PolarHBondContact O-N 3.19Å; R150-W152 PolarHBondContact O-N 3.5Å
151	R	38.9	Very low	43.8	Very low	213 Å²	213	162.8 Å²	162.8	80%	0.804	83%	0.828	S	S	*	*			trans	-37.1	120.9	160.6	-167.8	179.2	-136.8	-145	2.3	110.3	Q153	R151-Q153 PolarHBondContact O-N 2.86Å
152	W	38.8	Very low	44.3	Very low	251 Å²	251	165.1 Å²	165.1	95%	0.951	83%	0.829	S	S	*	*			trans	-61.2	107.4	167.1	-85.4	76	0	0	0	108.3	R150	R150-W152 PolarHBondContact O-N 3.5Å
153	Q	46	Very low	44.4	Very low	142 Å²	142	161.7 Å²	161.7	66%	0.664	82%	0.817	S	S	*	*			trans	-104.2	134.4	160.7	-65.1	-175.4	9.9	0	0	106.5	R151 A155	R151-Q153 PolarHBondContact O-N 2.86Å; Q153-A155 PolarHBondContact O-N 3.15Å
154	P	49.5	Very low	44.8	Very low	124 Å²	124	163.6 Å²	163.6	81%	0.805	82%	0.815	S	S	*	*			trans	-67	112.7	178.4	27.4	-30.3	0	0	0	108	Q156	P154-Q156 PolarHBondContact O-N 2.89Å; P154-Q156 VanDerWaalsContact O-N 3.16Å
155	A	45.4	Very low	45.3	Very low	90 Å²	90	162 Å²	162	74%	0.744	81%	0.809	S	S	*	*			trans	-58.3	121.6	170.2	0	0	0	0	0	108.1	Q153 A157	Q153-A155 PolarHBondContact O-N 3.15Å; A155-A157 PolarHBondContact O-N 3.45Å
156	Q	42.2	Very low	45.5	Very low	197 Å²	197	164.2 Å²	164.2	92%	0.921	81%	0.81	S	S	*	*			trans	-61.5	78.8	161.6	-73.5	176.9	-35.5	0	0	108.2	P154 R158	P154-Q156 PolarHBondContact O-N 2.89Å; P154-Q156 VanDerWaalsContact O-N 3.16Å; Q156-R158 PolarHBondContact O-N 3.32Å
157	A	44.2	Very low	45.2	Very low	77 Å²	77	163.9 Å²	163.9	64%	0.636	81%	0.808	S	S	*	*			trans	-77.8	93	174.5	0	0	0	0	0	108.1	A155 G159	A155-A157 PolarHBondContact O-N 3.45Å; A157-G159 PolarHBondContact O-N 3.41Å
158	R	42	Very low	45	Very low	247 Å²	247	163.9 Å²	163.9	93%	0.932	81%	0.808	S	S	*	*	S	Bend	trans	-46.1	125.6	157.6	-72.4	179.5	172.2	-168.2	-2.6	108.9	Q156	Q156-R158 PolarHBondContact O-N 3.32Å
159	G	39.9	Very low	45	Very low	72 Å²	72	162.1 Å²	162.1	74%	0.742	80%	0.803	S	S	*	*			trans	86.4	62.5	165.5	0	0	0	0	0	116.5	A157 K161	A157-G159 PolarHBondContact O-N 3.41Å; G159-K161 PolarHBondContact O-N 3.28Å
160	R	44.2	Very low	45.6	Very low	242 Å²	242	152.2 Å²	152.2	91%	0.913	78%	0.776	S	S	*	*			trans	-65	99.7	157.8	-76.4	-174.4	176.2	-176.5	-1.1	108.4	Q162	R160-Q162 PolarHBondContact O-N 3.47Å; R160-Q162 VanDerWaalsContact O-N 3.12Å
161	K	48.8	Very low	46	Very low	205 Å²	205	147 Å²	147	89%	0.891	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-55.5	116.3	162.1	-73.4	-177.2	177.4	179.6	0	106.7	G159	G159-K161 PolarHBondContact O-N 3.28Å
162	Q	50.6	Low	46.6	Very low	163 Å²	163	137.2 Å²	137.2	76%	0.762	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-54.8	134.1	173.2	-68.5	-175	-5.6	0	0	107.9	R160	R160-Q162 PolarHBondContact O-N 3.47Å; R160-Q162 VanDerWaalsContact O-N 3.12Å
163	P	48.7	Very low	47.3	Very low	109 Å²	109	131.5 Å²	131.5	71%	0.708	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-56.1	143	172	25.1	-32	0	0	0	108.2	R165	P163-R165 PolarHBondContact O-N 3.47Å; P163-R165 VanDerWaalsContact O-N 3.08Å
164	P	46.5	Very low	47.6	Very low	120 Å²	120	126.9 Å²	126.9	78%	0.779	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-55.9	122.6	-176.9	22.6	-31.4	0	0	0	109	I166	P164-I166 PolarHBondContact O-N 2.94Å; P164-I166 VanDerWaalsContact O-N 3.11Å
165	R	50.5	Low	47.8	Very low	204 Å²	204	130.8 Å²	130.8	77%	0.77	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-57.9	118.3	174.7	-80.4	174.8	66.4	162.2	-0.3	107.8	P163 V167	P163-R165 PolarHBondContact O-N 3.47Å; P163-R165 VanDerWaalsContact O-N 3.08Å; R165-V167 PolarHBondContact O-N 3.46Å; R165-V167 VanDerWaalsContact O-N 3.15Å
166	I	46.2	Very low	48.7	Very low	172 Å²	172	133.5 Å²	133.5	88%	0.882	71%	0.71	S	S	*	*			trans	-67.2	111.3	170.7	-59	175.2	0	0	0	106.8	P164	P164-I166 PolarHBondContact O-N 2.94Å; P164-I166 VanDerWaalsContact O-N 3.11Å
167	V	39.1	Very low	50.1	Low	118 Å²	118	125.3 Å²	125.3	72%	0.715	68%	0.675	S	S	*	*			trans	-91.5	119.8	177.4	-173.2	0	0	0	0	107.9	R165 A169	R165-V167 PolarHBondContact O-N 3.46Å; R165-V167 VanDerWaalsContact O-N 3.15Å; V167-A169 PolarHBondContact O-N 2.69Å
168	A	48.3	Very low	51.9	Low	90 Å²	90	126.3 Å²	126.3	74%	0.744	67%	0.674	S	S	*	*			trans	-64.9	107.1	164.2	0	0	0	0	0	107.8	A170	A168-A170 VanDerWaalsContact C-N 3.28Å; A168-A170 PolarHBondContact O-N 2.99Å
169	A	48.7	Very low	54.1	Low	79 Å²	79	117.2 Å²	117.2	65%	0.653	64%	0.644	S	S	*	*			trans	-74.9	79.3	-177.6	0	0	0	0	0	110.5	V167 I171	V167-A169 PolarHBondContact O-N 2.69Å; A169-I171 PolarHBondContact O-N 2.86Å
170	A	53.5	Low	56.5	Low	48 Å²	48	113.9 Å²	113.9	40%	0.397	61%	0.609	S	S	.	*			trans	-83.1	27	177.7	0	0	0	0	0	113.4	A168	A168-A170 VanDerWaalsContact C-N 3.28Å; A168-A170 PolarHBondContact O-N 2.99Å
171	I	53.5	Low	58.8	Low	125 Å²	125	102.6 Å²	102.6	64%	0.641	57%	0.567	S	S	*	*			trans	-123.9	81.1	174.9	-50.3	176.6	0	0	0	106.8	A169 N173	A169-I171 PolarHBondContact O-N 2.86Å; I171-N173 HydrophobicContact CG2-CB 4.09Å; I171-N173 PolarHBondContact O-N 3.39Å
172	G	51.8	Low	60.9	Low	6 Å²	6	92.9 Å²	92.9	6%	0.062	53%	0.525	C	S	.	.			trans	-73.3	57.7	178.4	0	0	0	0	0	112.2	G174 R189	G172-G174 VanDerWaalsContact C-N 3.28Å; G172-G174 PolarHBondContact O-N 3.17Å; G172-R189 PolarHBondContact O-NH2 2.9Å
173	N	53.3	Low	63	Low	131 Å²	131	92.3 Å²	92.3	70%	0.701	52%	0.515	S	S	*	.			trans	-88.4	11.2	-177.2	-80.7	9.3	0	0	0	113.9	I171 R189	I171-N173 HydrophobicContact CG2-CB 4.09Å; I171-N173 PolarHBondContact O-N 3.39Å; N173-R189 PolarHBondContact OD1-NH1 2.81Å
174	G	52.1	Low	65.1	Low	45 Å²	45	87.8 Å²	87.8	46%	0.464	49%	0.485	S	S	.	.	S	Bend	trans	-118	144.7	-178.2	0	0	0	0	0	113.4	G172 N176 S177	G172-G174 VanDerWaalsContact C-N 3.28Å; G172-G174 PolarHBondContact O-N 3.17Å; G174-N176 PolarHBondContact O-N 3.38Å; G174-S177 PolarHBondContact O-N 3.16Å; G174-S177 VanDerWaalsContact O-N 3.09Å
175	Y	54.8	Low	67.3	Low	206 Å²	206	86.3 Å²	86.3	81%	0.808	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-6.2	173.7	-61.6	-78.5	0	0	0	114.8
176	N	63.6	Low	69.2	Low	147 Å²	147	81.1 Å²	81.1	79%	0.786	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	9.4	-178.7	-68.8	-24.9	0	0	0	113.5	G174 P178 H291	G174-N176 PolarHBondContact O-N 3.38Å; N176-P178 WeakPolarHBondContact O-CD 3.42Å; N176-H291 PolarHBondContact O-CE1 3.26Å
177	S	71.3	Confident	71.3	Confident	26 Å²	26	74.5 Å²	74.5	18%	0.182	44%	0.44	C	S	.	.			trans	-73	119.9	-177.8	178.5	0	0	0	0	111.3	G174 L179 H291	G174-S177 PolarHBondContact O-N 3.16Å; G174-S177 VanDerWaalsContact O-N 3.09Å; S177-L179 PolarHBondContact O-N 3.42Å; S177-H291 VanDerWaalsContact C-CD2 3.4Å; S177-H291 PolarHBondContact O-CD2 2.79Å; S177-H291 PolarHBondContact O-CE1 3.43Å; S177-H291 PolarHBondContact O-NE2 2.9Å
178	P	82.1	Confident	73.7	Confident	97 Å²	97	75 Å²	75	63%	0.63	43%	0.429	S	S	*	.	S	Bend	trans	-58.5	-8.2	179.2	27.5	-36	0	0	0	114.8	N176 H291	N176-P178 WeakPolarHBondContact O-CD 3.42Å; P178-H291 WeakPolarHBondContact CA-CD2 3.27Å; P178-H291 WeakPolarHBondContact CA-NE2 3.43Å
179	L	88	Confident	75.7	Confident	56 Å²	56	73.4 Å²	73.4	29%	0.293	40%	0.403	S	S	.	.	S	Bend	trans	-75.8	141.8	-179.2	-58.1	179.8	0	0	0	111.5	S177 F181 L191	S177-L179 PolarHBondContact O-N 3.42Å; L179-F181 HydrophobicContact CB-CD2 4.22Å; L179-F181 HydrophobicContact CB-CE2 3.65Å; L179-F181 HydrophobicContact CB-CZ 4.44Å; L179-F181 HydrophobicContact CD1-CE2 4.19Å; L179-F181 HydrophobicContact CD1-CZ 4.32Å; L179-L191 HydrophobicContact CB-CD1 4.02Å; L179-L191 HydrophobicContact CD1-CD1 4.33Å
180	L	91.8	Very high	77.9	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.016	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	113.6	174.9	-64.9	-176.9	0	0	0	109.7	V192 L273 A276 C289	L180-V192 HydrophobicContact CB-CB 3.93Å; L180-V192 HydrophobicContact CB-CG2 4.33Å; L180-V192 PolarHBondContact O-N 3.08Å; L180-L273 HydrophobicContact CD1-CD2 3.7Å; L180-L273 HydrophobicContact CD2-CD2 4.36Å; L180-L273 HydrophobicContact CG-CD2 3.72Å; L180-A276 HydrophobicContact CD2-CB 4.32Å; L180-C289 HydrophobicContact CB-CB 4.13Å; L180-C289 HydrophobicContact CD2-CB 3.76Å; L180-C289 HydrophobicContact CG-CB 4.49Å
181	F	92.5	Very high	79.9	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.018	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.9	164.9	-63.6	-96.8	0	0	0	109.6	L179 R189 L190 L191 C289 S290	L179-F181 HydrophobicContact CB-CD2 4.22Å; L179-F181 HydrophobicContact CB-CE2 3.65Å; L179-F181 HydrophobicContact CB-CZ 4.44Å; L179-F181 HydrophobicContact CD1-CE2 4.19Å; L179-F181 HydrophobicContact CD1-CZ 4.32Å; F181-R189 HydrophobicContact CB-CG 4.08Å; F181-R189 HydrophobicContact CD1-CG 3.88Å; F181-R189 VanDerWaalsContact CD1-CZ 3.43Å; F181-R189 HydrophobicContact CG-CG 4.36Å; F181-R189 VanDerWaalsContact CG-NE 3.33Å; F181-R189 VanDerWaalsContact CG-NH2 3.26Å; F181-L190 CarbonylContact C-O 3.58Å; F181-L190 VanDerWaalsContact CA-O 3.26Å; F181-L190 WeakPolarHBondContact CA-O 3.49Å; F181-L191 HydrophobicContact CD1-CB 4.08Å; F181-L191 HydrophobicContact CD1-CD1 4.23Å; F181-L191 HydrophobicContact CD2-CD1 4.46Å; F181-L191 HydrophobicContact CE1-CB 3.87Å; F181-L191 HydrophobicContact CE1-CD1 3.85Å; F181-L191 HydrophobicContact CE1-CG 4.38Å; F181-L191 HydrophobicContact CE2-CD1 4.05Å; F181-L191 HydrophobicContact CZ-CD1 3.75Å; F181-C289 CarbonylContact O-C 3.58Å; F181-C289 WeakPolarHBondContact O-CA 3.34Å; F181-C289 WeakPolarHBondContact O-CB 3.24Å; F181-S290 WeakPolarHBondContact CB-OG 3.33Å; F181-S290 PolarHBondContact O-N 3.03Å
182	V	93	Very high	81.9	Confident	1 Å²	1	63 Å²	63	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	152.2	171.9	67.9	0	0	0	0	109.1	L190 V192 L239 L259 L278 A287	V182-L190 HydrophobicContact CG1-CB 3.99Å; V182-L190 HydrophobicContact CG1-CD1 4.18Å; V182-L190 PolarHBondContact N-O 3.44Å; V182-L190 PolarHBondContact O-N 2.78Å; V182-V192 HydrophobicContact CB-CG2 4.37Å; V182-V192 HydrophobicContact CG1-CG2 3.93Å; V182-L239 HydrophobicContact CG1-CD2 4Å; V182-L239 HydrophobicContact CG2-CD2 4.02Å; V182-L259 HydrophobicContact CG1-CD1 3.93Å; V182-L278 HydrophobicContact CG1-CD2 4.36Å; V182-A287 HydrophobicContact CG2-CB 3.69Å
183	R	93.5	Very high	83.9	Confident	151 Å²	151	65.4 Å²	65.4	57%	0.57	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	136.7	168.4	-70.8	-176.8	-176.2	-98	3.9	109	G187 R188	R183-G187 PolarHBondContact NH1-O 3.24Å; R183-R188 VanDerWaalsContact CA-O 3.27Å; R183-R188 WeakPolarHBondContact CA-O 3.48Å
184	D	92.9	Very high	85.8	Confident	14 Å²	14	63 Å²	63	8%	0.075	34%	0.336	C	S	.	.			trans	-75.7	175.3	167.2	77.9	-10.1	0	0	0	110.4	T186 G187 R188 L190 L237 D238	D184-T186 PolarHBondContact O-N 2.96Å; D184-T186 VanDerWaalsContact OD1-C 3.31Å; D184-T186 WeakPolarHBondContact OD1-CA 3.49Å; D184-T186 PolarHBondContact OD1-N 3.35Å; D184-T186 PolarHBondContact OD1-OG1 3.38Å; D184-T186 PolarHBondContact OD2-OG1 2.88Å; D184-G187 PolarHBondContact O-N 3.28Å; D184-G187 PolarHBondContact OD1-N 3.08Å; D184-R188 PolarHBondContact N-O 3.02Å; D184-R188 VanDerWaalsContact N-O 3.12Å; D184-R188 WeakPolarHBondContact OD1-CB 3.42Å; D184-R188 PolarHBondContact OD1-N 3.36Å; D184-L190 HydrophobicContact CB-CD1 4.36Å; D184-L237 HydrophobicContact CB-CD1 3.73Å; D184-D238 CarbonylContact C-O 3.49Å; D184-D238 WeakPolarHBondContact CA-O 3.48Å; D184-D238 VanDerWaalsContact CB-O 3.24Å; D184-D238 WeakPolarHBondContact CB-O 3.44Å
185	V	92.1	Very high	87.7	Confident	90 Å²	90	64.2 Å²	64.2	55%	0.545	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20	176.4	-60.7	0	0	0	0	113.5	G187 D238	V185-G187 VanDerWaalsContact C-N 3.25Å; V185-D238 HydrophobicContact CB-CB 4.49Å; V185-D238 HydrophobicContact CG1-CB 4.02Å; V185-D238 VanDerWaalsContact CG1-CG 3.5Å; V185-D238 HydrophobicContact CG2-CB 3.7Å; V185-D238 PolarHBondContact N-O 3.42Å
186	T	90.7	Very high	89.5	Confident	94 Å²	94	55.8 Å²	55.8	58%	0.577	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.8	175	79.8	0	0	0	0	112.5	D184 R188	D184-T186 PolarHBondContact O-N 2.96Å; D184-T186 VanDerWaalsContact OD1-C 3.31Å; D184-T186 WeakPolarHBondContact OD1-CA 3.49Å; D184-T186 PolarHBondContact OD1-N 3.35Å; D184-T186 PolarHBondContact OD1-OG1 3.38Å; D184-T186 PolarHBondContact OD2-OG1 2.88Å; T186-R188 VanDerWaalsContact C-N 3.33Å; T186-R188 WeakPolarHBondContact OG1-CD 3.35Å; T186-R188 VanDerWaalsContact OG1-CG 3.27Å; T186-R188 WeakPolarHBondContact OG1-CG 3.39Å
187	G	89.9	Confident	91	Very high	34 Å²	34	56.8 Å²	56.8	35%	0.351	32%	0.32	S	S	.	.			trans	85.9	-0.5	-178.9	0	0	0	0	0	114.3	R183 D184 V185 R189	R183-G187 PolarHBondContact NH1-O 3.24Å; D184-G187 PolarHBondContact O-N 3.28Å; D184-G187 PolarHBondContact OD1-N 3.08Å; V185-G187 VanDerWaalsContact C-N 3.25Å; G187-R189 PolarHBondContact O-N 3.38Å
188	R	89.9	Confident	92.1	Very high	129 Å²	129	57.5 Å²	57.5	49%	0.487	32%	0.323	S	S	.	.			trans	-62.2	132.5	175.5	-69.8	170.8	178.8	-172.6	-0.1	109.6	R183 D184 T186 L190 E235	R183-R188 VanDerWaalsContact CA-O 3.27Å; R183-R188 WeakPolarHBondContact CA-O 3.48Å; D184-R188 PolarHBondContact N-O 3.02Å; D184-R188 VanDerWaalsContact N-O 3.12Å; D184-R188 WeakPolarHBondContact OD1-CB 3.42Å; D184-R188 PolarHBondContact OD1-N 3.36Å; T186-R188 VanDerWaalsContact C-N 3.33Å; T186-R188 WeakPolarHBondContact OG1-CD 3.35Å; T186-R188 VanDerWaalsContact OG1-CG 3.27Å; T186-R188 WeakPolarHBondContact OG1-CG 3.39Å; R188-L190 HydrophobicContact CB-CD2 4.45Å; R188-E235 IonicContact NH1-OE2 2.78Å; R188-E235 PolarHBondContact NH1-OE2 2.88Å
189	R	91.3	Very high	92.8	Very high	55 Å²	55	52.9 Å²	52.9	21%	0.208	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131.9	-179.8	-172.7	-170.7	-175.7	-160.3	3.5	109.7	G172 N173 F181 G187	G172-R189 PolarHBondContact O-NH2 2.9Å; N173-R189 PolarHBondContact OD1-NH1 2.81Å; F181-R189 HydrophobicContact CB-CG 4.08Å; F181-R189 HydrophobicContact CD1-CG 3.88Å; F181-R189 VanDerWaalsContact CD1-CZ 3.43Å; F181-R189 HydrophobicContact CG-CG 4.36Å; F181-R189 VanDerWaalsContact CG-NE 3.33Å; F181-R189 VanDerWaalsContact CG-NH2 3.26Å; G187-R189 PolarHBondContact O-N 3.38Å
190	L	94.3	Very high	93.2	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.3	-174.2	-42.7	165.2	0	0	0	108.8	F181 V182 D184 R188 L237 L239 T257 L259	F181-L190 CarbonylContact C-O 3.58Å; F181-L190 VanDerWaalsContact CA-O 3.26Å; F181-L190 WeakPolarHBondContact CA-O 3.49Å; V182-L190 HydrophobicContact CG1-CB 3.99Å; V182-L190 HydrophobicContact CG1-CD1 4.18Å; V182-L190 PolarHBondContact N-O 3.44Å; V182-L190 PolarHBondContact O-N 2.78Å; D184-L190 HydrophobicContact CB-CD1 4.36Å; R188-L190 HydrophobicContact CB-CD2 4.45Å; L190-L237 HydrophobicContact CD1-CD1 3.73Å; L190-L237 HydrophobicContact CD1-CD2 3.81Å; L190-L237 HydrophobicContact CD1-CG 4.32Å; L190-L239 HydrophobicContact CD1-CD2 4.2Å; L190-T257 CarbonylContact C-O 3.47Å; L190-T257 WeakPolarHBondContact CA-O 3.3Å; L190-T257 HydrophobicContact CD2-CG2 3.25Å; L190-T257 HydrophobicContact CG-CG2 4.46Å; L190-L259 HydrophobicContact CB-CD1 4.15Å; L190-L259 HydrophobicContact CB-CG 4.08Å; L190-L259 HydrophobicContact CD1-CD1 4Å; L190-L259 HydrophobicContact CD1-CG 4.38Å
191	L	94.6	Very high	93.3	Very high	15 Å²	15	51 Å²	51	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	125.5	172.9	176.7	64.6	0	0	0	109.3	L179 F181 N193 T257 I258 L259	L179-L191 HydrophobicContact CB-CD1 4.02Å; L179-L191 HydrophobicContact CD1-CD1 4.33Å; F181-L191 HydrophobicContact CD1-CB 4.08Å; F181-L191 HydrophobicContact CD1-CD1 4.23Å; F181-L191 HydrophobicContact CD2-CD1 4.46Å; F181-L191 HydrophobicContact CE1-CB 3.87Å; F181-L191 HydrophobicContact CE1-CD1 3.85Å; F181-L191 HydrophobicContact CE1-CG 4.38Å; F181-L191 HydrophobicContact CE2-CD1 4.05Å; F181-L191 HydrophobicContact CZ-CD1 3.75Å; L191-N193 HydrophobicContact CD2-CB 4.35Å; L191-N193 HydrophobicContact CG-CB 4.26Å; L191-T257 PolarHBondContact N-O 2.87Å; L191-I258 CarbonylContact O-C 3.55Å; L191-I258 WeakPolarHBondContact O-CA 3.17Å; L191-L259 PolarHBondContact O-N 2.92Å
192	V	95.6	Very high	93.3	Very high	15 Å²	15	52.8 Å²	52.8	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	110.8	170.6	-178.1	0	0	0	0	108.1	L180 V182 L264 L278	L180-V192 HydrophobicContact CB-CB 3.93Å; L180-V192 HydrophobicContact CB-CG2 4.33Å; L180-V192 PolarHBondContact O-N 3.08Å; V182-V192 HydrophobicContact CB-CG2 4.37Å; V182-V192 HydrophobicContact CG1-CG2 3.93Å; V192-L264 HydrophobicContact CG1-CD1 4Å; V192-L264 HydrophobicContact CG1-CD2 4.12Å; V192-L278 HydrophobicContact CG1-CD1 4.25Å; V192-L278 HydrophobicContact CG2-CD2 4Å
193	N	94	Very high	92.9	Very high	57 Å²	57	54 Å²	54	31%	0.305	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	90.6	-175.3	-176.4	12.7	0	0	0	111.5	L191 G195 S196 I258 L259 S260	L191-N193 HydrophobicContact CD2-CB 4.35Å; L191-N193 HydrophobicContact CG-CB 4.26Å; N193-G195 PolarHBondContact O-N 2.99Å; N193-G195 VanDerWaalsContact O-N 3.12Å; N193-G195 WeakPolarHBondContact OD1-CA 3.4Å; N193-G195 PolarHBondContact OD1-N 3.11Å; N193-S196 PolarHBondContact O-N 3.42Å; N193-I258 HydrophobicContact CB-CG2 3.7Å; N193-L259 PolarHBondContact N-O 2.81Å; N193-S260 WeakPolarHBondContact O-CA 3.26Å
194	S	93.8	Very high	91.7	Very high	79 Å²	79	53.7 Å²	53.7	55%	0.552	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.9	174.8	59.6	0	0	0	0	114	S196	S194-S196 VanDerWaalsContact C-N 3.29Å
195	G	92.6	Very high	90.2	Very high	71 Å²	71	59.4 Å²	59.4	73%	0.732	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	4.6	176.8	0	0	0	0	0	114.4	N193	N193-G195 PolarHBondContact O-N 2.99Å; N193-G195 VanDerWaalsContact O-N 3.12Å; N193-G195 WeakPolarHBondContact OD1-CA 3.4Å; N193-G195 PolarHBondContact OD1-N 3.11Å
196	S	92.3	Very high	88.4	Confident	29 Å²	29	59.9 Å²	59.9	20%	0.203	36%	0.356	C	S	.	.			trans	-113.6	144.7	174.1	177.5	0	0	0	0	109.9	N193 S194 V198 S260 A261	N193-S196 PolarHBondContact O-N 3.42Å; S194-S196 VanDerWaalsContact C-N 3.29Å; S196-V198 PolarHBondContact OG-O 2.95Å; S196-S260 VanDerWaalsContact CB-OG 3.26Å; S196-S260 WeakPolarHBondContact CB-OG 3.41Å; S196-S260 WeakPolarHBondContact O-CB 3.4Å; S196-S260 PolarHBondContact OG-OG 2.89Å; S196-S260 VanDerWaalsContact OG-OG 3.13Å; S196-A261 WeakPolarHBondContact O-CB 3.34Å; S196-A261 PolarHBondContact O-N 2.81Å
197	E	94.6	Very high	86.6	Confident	168 Å²	168	57.3 Å²	57.3	79%	0.785	35%	0.349	S	S	*	.	S	Bend	trans	-79.7	-33.8	179.8	-67.3	-179.1	178.9	0	0	112.6	D262	E197-D262 VanDerWaalsContact O-CB 3.29Å; E197-D262 WeakPolarHBondContact O-CB 3.26Å
198	V	95.1	Very high	84.9	Confident	41 Å²	41	68 Å²	68	25%	0.248	38%	0.379	C	S	.	.	S	Bend	trans	-120.2	132.8	-168.3	-179.4	0	0	0	0	110.9	S196 L218 V250 S260 D262	S196-V198 PolarHBondContact OG-O 2.95Å; V198-L218 HydrophobicContact CG2-CD2 4.37Å; V198-V250 HydrophobicContact CG1-CB 4.04Å; V198-V250 HydrophobicContact CG1-CG2 3.55Å; V198-S260 WeakPolarHBondContact O-CB 3.18Å; V198-S260 PolarHBondContact O-OG 3.15Å; V198-D262 WeakPolarHBondContact CA-OD2 3.26Å
199	S	96.7	Very high	83.5	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.383	C	S	.	.			trans	-80.7	131.1	174.6	-69.6	0	0	0	0	111.4	V250 I258 S260 D262 F263	S199-V250 PolarHBondContact O-N 3.32Å; S199-V250 VanDerWaalsContact O-N 3.16Å; S199-I258 CarbonylContact C-O 3.57Å; S199-I258 VanDerWaalsContact CA-O 3.32Å; S199-I258 WeakPolarHBondContact CA-O 3.35Å; S199-S260 PolarHBondContact OG-N 2.79Å; S199-D262 WeakPolarHBondContact CB-OD1 3.46Å; S199-D262 VanDerWaalsContact N-CG 3.32Å; S199-D262 PolarHBondContact N-OD1 2.91Å; S199-D262 VanDerWaalsContact N-OD1 3.07Å; S199-D262 PolarHBondContact N-OD2 2.87Å; S199-D262 PolarHBondContact OG-OD1 2.87Å; S199-F263 WeakPolarHBondContact OG-CB 3.5Å
200	I	95.4	Very high	82.4	Confident	6 Å²	6	77.2 Å²	77.2	3%	0.031	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125.6	-166.3	-57.8	171.9	0	0	0	110.2	L218 V250 A252 V254 T257 I258	I200-L218 HydrophobicContact CD1-CD1 3.68Å; I200-L218 HydrophobicContact CG1-CD1 4.16Å; I200-V250 CarbonylContact C-O 3.47Å; I200-V250 VanDerWaalsContact CA-O 3.23Å; I200-V250 WeakPolarHBondContact CA-O 2.91Å; I200-A252 HydrophobicContact CG2-CB 3.64Å; I200-V254 HydrophobicContact CB-CG2 4.32Å; I200-V254 HydrophobicContact CD1-CG1 4.35Å; I200-V254 HydrophobicContact CG2-CG1 4.23Å; I200-V254 HydrophobicContact CG2-CG2 3.46Å; I200-V254 VanDerWaalsContact CG2-CG2 3.46Å; I200-T257 CarbonylContact O-C 3.55Å; I200-T257 VanDerWaalsContact O-CA 3.28Å; I200-T257 WeakPolarHBondContact O-CA 3.42Å; I200-T257 VanDerWaalsContact O-CG2 3.27Å; I200-T257 WeakPolarHBondContact O-CG2 3.32Å; I200-I258 HydrophobicContact CB-CB 4.41Å; I200-I258 HydrophobicContact CD1-CD1 4.45Å; I200-I258 PolarHBondContact N-O 3.27Å; I200-I258 PolarHBondContact O-N 2.8Å
201	L	94.6	Very high	81.3	Confident	15 Å²	15	80.4 Å²	80.4	8%	0.079	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	130.7	162.6	-65.7	172.4	0	0	0	109.4	A203 R233 E235 F249 V250 I251 A252 T257	L201-A203 PolarHBondContact O-N 3.02Å; L201-R233 HydrophobicContact CD1-CG 4.2Å; L201-E235 HydrophobicContact CD1-CG 3.84Å; L201-F249 HydrophobicContact CD1-CB 3.67Å; L201-F249 HydrophobicContact CD1-CD2 4.13Å; L201-F249 HydrophobicContact CD1-CG 3.97Å; L201-F249 HydrophobicContact CD2-CD1 4.33Å; L201-F249 HydrophobicContact CD2-CG 4.24Å; L201-F249 HydrophobicContact CG-CB 3.62Å; L201-F249 HydrophobicContact CG-CD1 4.09Å; L201-F249 HydrophobicContact CG-CD2 4.26Å; L201-F249 HydrophobicContact CG-CG 3.74Å; L201-V250 PolarHBondContact N-O 3.42Å; L201-I251 HydrophobicContact CB-CG1 4.46Å; L201-I251 WeakPolarHBondContact O-CA 3.42Å; L201-A252 PolarHBondContact O-N 3.24Å; L201-A252 VanDerWaalsContact O-N 3.14Å; L201-T257 HydrophobicContact CD2-CG2 3.72Å
202	S	91.7	Very high	80.4	Confident	41 Å²	41	83.4 Å²	83.4	29%	0.287	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	133.2	172.4	179.2	0	0	0	0	110.4	V254 T257	S202-V254 WeakPolarHBondContact CB-O 3.48Å; S202-V254 PolarHBondContact OG-O 3.25Å; S202-T257 PolarHBondContact N-OG1 2.99Å; S202-T257 VanDerWaalsContact N-OG1 3.13Å
203	A	85.1	Confident	79.3	Confident	25 Å²	25	88.2 Å²	88.2	21%	0.207	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-67.6	132.1	170.3	0	0	0	0	0	109.7	L201 I251 A252	L201-A203 PolarHBondContact O-N 3.02Å; A203-I251 HydrophobicContact CB-CG2 4.12Å; A203-A252 PolarHBondContact N-O 2.96Å
204	E	69.3	Low	78.5	Confident	146 Å²	146	92.9 Å²	92.9	68%	0.682	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-59.9	139.4	174.2	-76.6	-153.1	177.3	0	0	110.9	S206	E204-S206 PolarHBondContact O-N 2.79Å; E204-S206 PolarHBondContact OE2-OG 2.86Å; E204-S206 VanDerWaalsContact OE2-OG 3.06Å
205	P	60.4	Low	77.5	Confident	134 Å²	134	90 Å²	90	87%	0.87	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22	178.4	-19.9	29.4	0	0	0	113.5	G207	P205-G207 VanDerWaalsContact C-N 3.29Å; P205-G207 PolarHBondContact O-N 2.7Å
206	S	54	Low	76.8	Confident	99 Å²	99	90.5 Å²	90.5	69%	0.692	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-0.5	-167.6	57	0	0	0	0	114.8	E204	E204-S206 PolarHBondContact O-N 2.79Å; E204-S206 PolarHBondContact OE2-OG 2.86Å; E204-S206 VanDerWaalsContact OE2-OG 3.06Å
207	G	53.4	Low	76.4	Confident	41 Å²	41	97.8 Å²	97.8	42%	0.423	51%	0.506	S	S	.	.			trans	-148.3	114.2	174.8	0	0	0	0	0	111.7	P205 R209	P205-G207 VanDerWaalsContact C-N 3.29Å; P205-G207 PolarHBondContact O-N 2.7Å; G207-R209 PolarHBondContact O-N 3.41Å
208	R	53.3	Low	76.2	Confident	257 Å²	257	91.2 Å²	91.2	97%	0.97	48%	0.476	S	S	*	.			trans	-61.7	77.8	161.3	-75.8	-174.6	-175.5	-167.5	1.9	108.5	R210	R208-R210 PolarHBondContact O-N 3.46Å
209	R	61.3	Low	76.1	Confident	152 Å²	152	97.1 Å²	97.1	57%	0.574	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-65.4	121.9	166.7	-75.5	-173.5	177.9	-167.6	-0.9	106	G207	G207-R209 PolarHBondContact O-N 3.41Å
210	R	67.4	Low	75.7	Confident	226 Å²	226	98.6 Å²	98.6	85%	0.853	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.8	138.4	174.1	-70.7	-177.6	-122.2	-174.4	0.4	107.7	R208 L212	R208-R210 PolarHBondContact O-N 3.46Å; R210-L212 PolarHBondContact O-N 3.04Å
211	P	71.6	Confident	75.4	Confident	71 Å²	71	103.9 Å²	103.9	46%	0.461	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-49.9	136.6	170.3	-24.3	33.2	0	0	0	109.3	P213 D227	P211-P213 WeakPolarHBondContact O-CD 3.35Å; P211-D227 HydrophobicContact CG-CB 4.26Å
212	L	76.4	Confident	75.1	Confident	78 Å²	78	108.4 Å²	108.4	41%	0.408	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-69	122	177	-175.2	73.4	0	0	0	107.8	R210 D214 A215 V228	R210-L212 PolarHBondContact O-N 3.04Å; L212-D214 PolarHBondContact O-N 3.44Å; L212-D214 VanDerWaalsContact O-N 3.13Å; L212-A215 HydrophobicContact CB-CB 3.67Å; L212-A215 HydrophobicContact CD2-CB 3.9Å; L212-A215 HydrophobicContact CG-CB 4.13Å; L212-A215 PolarHBondContact O-N 2.86Å; L212-A215 VanDerWaalsContact O-N 3.07Å; L212-V228 PolarHBondContact N-O 2.56Å
213	P	72.5	Confident	74.9	Confident	116 Å²	116	108.2 Å²	108.2	75%	0.753	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-29.9	-168.6	17.6	-28.8	0	0	0	113.6	P211	P211-P213 WeakPolarHBondContact O-CD 3.35Å
214	D	76.8	Confident	75.1	Confident	155 Å²	155	110.5 Å²	110.5	83%	0.829	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	17.7	179.6	-57.2	-44.3	0	0	0	113.3	L212	L212-D214 PolarHBondContact O-N 3.44Å; L212-D214 VanDerWaalsContact O-N 3.13Å
215	A	74	Confident	76.1	Confident	18 Å²	18	107.6 Å²	107.6	15%	0.149	59%	0.588	C	S	.	*	S	Bend	trans	-72.4	149.4	175.2	0	0	0	0	0	112.3	L212 K217 V228	L212-A215 HydrophobicContact CB-CB 3.67Å; L212-A215 HydrophobicContact CD2-CB 3.9Å; L212-A215 HydrophobicContact CG-CB 4.13Å; L212-A215 PolarHBondContact O-N 2.86Å; L212-A215 VanDerWaalsContact O-N 3.07Å; A215-K217 PolarHBondContact O-N 3Å; A215-V228 HydrophobicContact CB-CB 3.99Å; A215-V228 HydrophobicContact CB-CG1 3.95Å
216	P	77.9	Confident	77.4	Confident	82 Å²	82	102.8 Å²	102.8	53%	0.532	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-57	133.2	165.2	25.4	-33.2	0	0	0	110.1	V228 T231	P216-V228 WeakPolarHBondContact O-CG2 3.42Å; P216-T231 HydrophobicContact CG-CG2 3.96Å
217	K	82.6	Confident	79	Confident	183 Å²	183	102.3 Å²	102.3	80%	0.796	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-81	119.6	175	-67.3	-178	-178.1	177.9	0	109.1	A215 T225	A215-K217 PolarHBondContact O-N 3Å; K217-T225 HydrophobicContact CB-CG2 4.16Å; K217-T225 HydrophobicContact CD-CG2 4.42Å; K217-T225 HydrophobicContact CG-CG2 4.4Å
218	L	90.6	Very high	80.8	Confident	29 Å²	29	100.6 Å²	100.6	15%	0.152	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	141.8	171.2	-65.8	-179.7	0	0	0	109.3	V198 I200 T225 I226 V228 V250 A252	V198-L218 HydrophobicContact CG2-CD2 4.37Å; I200-L218 HydrophobicContact CD1-CD1 3.68Å; I200-L218 HydrophobicContact CG1-CD1 4.16Å; L218-T225 CarbonylContact O-C 3.59Å; L218-T225 WeakPolarHBondContact O-CA 3.18Å; L218-I226 HydrophobicContact CB-CB 3.97Å; L218-I226 HydrophobicContact CB-CD1 4.47Å; L218-I226 PolarHBondContact O-N 3.08Å; L218-V228 HydrophobicContact CB-CG2 4.39Å; L218-V228 HydrophobicContact CD1-CG2 3.76Å; L218-V228 HydrophobicContact CG-CG2 3.71Å; L218-V250 HydrophobicContact CD1-CG1 4.05Å; L218-A252 HydrophobicContact CD1-CB 4.11Å
219	K	92.4	Very high	82.5	Confident	165 Å²	165	89.4 Å²	89.4	72%	0.717	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	126	179.7	-171.3	175.5	177.8	-179.6	0	109.6	G223	K219-G223 VanDerWaalsContact CE-CA 3.5Å
220	A	90.2	Very high	83.8	Confident	31 Å²	31	86 Å²	86	26%	0.256	48%	0.477	S	S	.	.			trans	-76.8	162.7	173.3	0	0	0	0	0	111.2	N222 G223 T224 I226	A220-N222 VanDerWaalsContact CB-OD1 3.26Å; A220-N222 WeakPolarHBondContact CB-OD1 3.39Å; A220-N222 PolarHBondContact O-N 2.87Å; A220-N222 VanDerWaalsContact O-N 3.14Å; A220-G223 WeakPolarHBondContact O-CA 3.45Å; A220-G223 PolarHBondContact O-N 3.47Å; A220-T224 PolarHBondContact N-O 3.49Å; A220-I226 HydrophobicContact CB-CD1 4.13Å; A220-I226 HydrophobicContact CB-CG1 4.36Å
221	A	87.6	Confident	85	Confident	118 Å²	118	78 Å²	78	98%	0.975	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-27.1	-180	0	0	0	0	0	114	G223	A221-G223 PolarHBondContact O-N 2.99Å
222	N	88.8	Confident	85.9	Confident	109 Å²	109	76.5 Å²	76.5	58%	0.583	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	1.8	175.2	66.9	-3.8	0	0	0	113.4	A220 T224	A220-N222 VanDerWaalsContact CB-OD1 3.26Å; A220-N222 WeakPolarHBondContact CB-OD1 3.39Å; A220-N222 PolarHBondContact O-N 2.87Å; A220-N222 VanDerWaalsContact O-N 3.14Å; N222-T224 PolarHBondContact ND2-OG1 3.28Å; N222-T224 WeakPolarHBondContact OD1-CB 3.28Å; N222-T224 PolarHBondContact OD1-N 2.89Å; N222-T224 PolarHBondContact OD1-OG1 3.29Å
223	G	87.8	Confident	86.7	Confident	38 Å²	38	77.2 Å²	77.2	39%	0.392	45%	0.448	S	S	.	.	S	Bend	trans	86.5	-2.9	-179.3	0	0	0	0	0	115.8	K219 A220 A221	K219-G223 VanDerWaalsContact CE-CA 3.5Å; A220-G223 WeakPolarHBondContact O-CA 3.45Å; A220-G223 PolarHBondContact O-N 3.47Å; A221-G223 PolarHBondContact O-N 2.99Å
224	T	88.5	Confident	87.8	Confident	72 Å²	72	77.1 Å²	77.1	44%	0.442	44%	0.438	S	S	.	.			trans	-74.4	140	178.6	61.5	0	0	0	0	111.3	A220 N222	A220-T224 PolarHBondContact N-O 3.49Å; N222-T224 PolarHBondContact ND2-OG1 3.28Å; N222-T224 WeakPolarHBondContact OD1-CB 3.28Å; N222-T224 PolarHBondContact OD1-N 2.89Å; N222-T224 PolarHBondContact OD1-OG1 3.29Å
225	T	89.9	Confident	88.7	Confident	85 Å²	85	71.2 Å²	71.2	52%	0.521	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	139	171.4	-49.9	0	0	0	0	110.1	K217 L218	K217-T225 HydrophobicContact CB-CG2 4.16Å; K217-T225 HydrophobicContact CD-CG2 4.42Å; K217-T225 HydrophobicContact CG-CG2 4.4Å; L218-T225 CarbonylContact O-C 3.59Å; L218-T225 WeakPolarHBondContact O-CA 3.18Å
226	I	88.2	Confident	89.8	Confident	33 Å²	33	75.7 Å²	75.7	17%	0.169	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.3	172.6	-54.8	169.4	0	0	0	107.4	L218 A220 V228 A252 V254	L218-I226 HydrophobicContact CB-CB 3.97Å; L218-I226 HydrophobicContact CB-CD1 4.47Å; L218-I226 PolarHBondContact O-N 3.08Å; A220-I226 HydrophobicContact CB-CD1 4.13Å; A220-I226 HydrophobicContact CB-CG1 4.36Å; I226-V228 PolarHBondContact O-N 2.91Å; I226-A252 HydrophobicContact CG2-CB 3.79Å; I226-V254 HydrophobicContact CD1-CG1 4.28Å; I226-V254 HydrophobicContact CG2-CG1 3.79Å
227	D	89.1	Confident	90.7	Very high	89 Å²	89	72.2 Å²	72.2	48%	0.476	40%	0.402	S	S	.	.			trans	-72.2	128.4	-179.1	-69.1	-21.8	0	0	0	111.3	P211 A252 A253	P211-D227 HydrophobicContact CG-CB 4.26Å; D227-A252 VanDerWaalsContact O-CA 3.26Å; D227-A252 WeakPolarHBondContact O-CA 3.36Å; D227-A252 WeakPolarHBondContact O-CB 3.11Å; D227-A253 PolarHBondContact O-N 2.71Å
228	V	90.6	Very high	91.3	Very high	6 Å²	6	65.9 Å²	65.9	4%	0.036	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.8	178.4	175.7	0	0	0	0	109.5	L212 A215 P216 L218 I226 T231 V250 A252	L212-V228 PolarHBondContact N-O 2.56Å; A215-V228 HydrophobicContact CB-CB 3.99Å; A215-V228 HydrophobicContact CB-CG1 3.95Å; P216-V228 WeakPolarHBondContact O-CG2 3.42Å; L218-V228 HydrophobicContact CB-CG2 4.39Å; L218-V228 HydrophobicContact CD1-CG2 3.76Å; L218-V228 HydrophobicContact CG-CG2 3.71Å; I226-V228 PolarHBondContact O-N 2.91Å; V228-T231 HydrophobicContact CG1-CG2 3.83Å; V228-V250 HydrophobicContact CB-CG1 4.38Å; V228-V250 HydrophobicContact CG1-CG1 3.56Å; V228-V250 HydrophobicContact CG2-CG1 3.91Å; V228-A252 HydrophobicContact CG2-CB 4.25Å
229	S	88.7	Confident	91.5	Very high	22 Å²	22	65 Å²	65	15%	0.154	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-25	177.9	-62.9	0	0	0	0	113	I251	S229-I251 PolarHBondContact N-O 3.39Å
230	H	89.2	Confident	91.4	Very high	80 Å²	80	59.8 Å²	59.8	37%	0.37	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	145.4	-179.3	-175.1	87.2	0	0	0	110.8	R233 I251	H230-R233 PolarHBondContact CD2-N 3.3Å; H230-I251 HydrophobicContact CB-CB 4.06Å; H230-I251 HydrophobicContact CB-CD1 3.61Å; H230-I251 HydrophobicContact CB-CG1 3.93Å; H230-I251 PolarHBondContact N-O 2.79Å; H230-I251 PolarHBondContact O-N 3.15Å
231	T	91.1	Very high	91.3	Very high	57 Å²	57	58.6 Å²	58.6	35%	0.35	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.4	174.6	51.8	0	0	0	0	110.1	P216 V228	P216-T231 HydrophobicContact CG-CG2 3.96Å; V228-T231 HydrophobicContact CG1-CG2 3.83Å
232	G	91	Very high	91.3	Very high	40 Å²	40	56.3 Å²	56.3	41%	0.412	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	79.8	24	174.4	0	0	0	0	0	115.4	H234 F249	G232-H234 PolarHBondContact O-N 3.12Å; G232-H234 VanDerWaalsContact O-N 3.09Å; G232-F249 PolarHBondContact N-O 2.76Å; G232-F249 VanDerWaalsContact N-O 3.15Å
233	R	93.4	Very high	91.4	Very high	93 Å²	93	54.6 Å²	54.6	35%	0.351	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	112.1	175.1	174.3	165.7	168.9	161.5	11.9	109.4	L201 H230 E235 K248 F249 I251	L201-R233 HydrophobicContact CD1-CG 4.2Å; H230-R233 PolarHBondContact CD2-N 3.3Å; R233-E235 HydrophobicContact CG-CG 4.07Å; R233-E235 IonicContact CZ-OE1 3.07Å; R233-E235 IonicContact NE-OE1 3.03Å; R233-E235 PolarHBondContact NE-OE1 3.05Å; R233-E235 IonicContact NH2-OE1 2.74Å; R233-E235 PolarHBondContact NH2-OE1 2.88Å; R233-E235 PolarHBondContact O-N 3.5Å; R233-K248 CarbonylContact O-C 3.48Å; R233-K248 WeakPolarHBondContact O-CA 3.24Å; R233-F249 PolarHBondContact N-O 3.45Å; R233-F249 PolarHBondContact O-N 3.3Å; R233-I251 HydrophobicContact CB-CD1 4.21Å; R233-I251 HydrophobicContact CB-CG1 4.15Å; R233-I251 HydrophobicContact CG-CD1 4.39Å
234	H	96.4	Very high	91.8	Very high	115 Å²	115	56.4 Å²	56.4	53%	0.532	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	120.6	177	-169.2	-91.6	0	0	0	110.4	G232 F247	G232-H234 PolarHBondContact O-N 3.12Å; G232-H234 VanDerWaalsContact O-N 3.09Å; H234-F247 WeakPolarHBondContact CA-O 3.48Å
235	E	95.3	Very high	92.2	Very high	31 Å²	31	53 Å²	53	15%	0.145	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155	170.2	-65.4	-146.5	164.3	0	0	110.9	R188 L201 R233 P246 F247 F249	R188-E235 IonicContact NH1-OE2 2.78Å; R188-E235 PolarHBondContact NH1-OE2 2.88Å; L201-E235 HydrophobicContact CD1-CG 3.84Å; R233-E235 HydrophobicContact CG-CG 4.07Å; R233-E235 IonicContact CZ-OE1 3.07Å; R233-E235 IonicContact NE-OE1 3.03Å; R233-E235 PolarHBondContact NE-OE1 3.05Å; R233-E235 IonicContact NH2-OE1 2.74Å; R233-E235 PolarHBondContact NH2-OE1 2.88Å; R233-E235 PolarHBondContact O-N 3.5Å; E235-P246 WeakPolarHBondContact O-CA 3.11Å; E235-F247 PolarHBondContact N-O 3.44Å; E235-F247 PolarHBondContact O-N 3.02Å; E235-F249 HydrophobicContact CB-CD2 3.97Å; E235-F249 HydrophobicContact CB-CE2 4Å; E235-F249 HydrophobicContact CG-CD2 4.42Å
236	I	96.5	Very high	92.5	Very high	111 Å²	111	51.8 Å²	51.8	57%	0.569	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	112.7	173.7	-59.4	176.1	0	0	0	106.9	T244 P246	I236-T244 HydrophobicContact CG2-CG2 4.15Å; I236-P246 HydrophobicContact CG1-CB 4.33Å
237	L	96.4	Very high	93	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.052	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	139.5	179.2	-168.4	67.5	0	0	0	110.6	D184 L190 L239 T244 Y245 L259 F263	D184-L237 HydrophobicContact CB-CD1 3.73Å; L190-L237 HydrophobicContact CD1-CD1 3.73Å; L190-L237 HydrophobicContact CD1-CD2 3.81Å; L190-L237 HydrophobicContact CD1-CG 4.32Å; L237-L239 HydrophobicContact CD2-CD2 3.67Å; L237-L239 HydrophobicContact CD2-CG 4.11Å; L237-L239 HydrophobicContact CG-CD2 3.96Å; L237-L239 HydrophobicContact CG-CG 4.31Å; L237-T244 CarbonylContact O-C 3.56Å; L237-T244 VanDerWaalsContact O-CA 3.3Å; L237-T244 WeakPolarHBondContact O-CA 3.33Å; L237-Y245 PolarHBondContact N-O 2.94Å; L237-Y245 WeakPolarHBondContact O-CD2 3.18Å; L237-Y245 PolarHBondContact O-N 3.09Å; L237-L259 HydrophobicContact CD2-CD1 4.01Å; L237-L259 HydrophobicContact CD2-CD2 3.92Å; L237-F263 HydrophobicContact CB-CZ 4.4Å; L237-F263 HydrophobicContact CD2-CE1 4.16Å; L237-F263 HydrophobicContact CD2-CE2 4.17Å; L237-F263 HydrophobicContact CD2-CZ 3.59Å
238	D	95.7	Very high	93.3	Very high	50 Å²	50	53.5 Å²	53.5	27%	0.267	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	115.2	170.9	-176.5	-7.2	0	0	0	109.4	D184 V185 G240 T244	D184-D238 CarbonylContact C-O 3.49Å; D184-D238 WeakPolarHBondContact CA-O 3.48Å; D184-D238 VanDerWaalsContact CB-O 3.24Å; D184-D238 WeakPolarHBondContact CB-O 3.44Å; V185-D238 HydrophobicContact CB-CB 4.49Å; V185-D238 HydrophobicContact CG1-CB 4.02Å; V185-D238 VanDerWaalsContact CG1-CG 3.5Å; V185-D238 HydrophobicContact CG2-CB 3.7Å; V185-D238 PolarHBondContact N-O 3.42Å; D238-G240 PolarHBondContact OD1-N 2.79Å; D238-T244 HydrophobicContact CB-CG2 4.1Å
239	L	94.4	Very high	93.6	Very high	9 Å²	9	53.4 Å²	53.4	5%	0.047	31%	0.306	C	S	.	.			trans	-94	5.9	-178.1	-59.2	176.5	0	0	0	112.7	V182 L190 L237 V241 Y245 L269 L278	V182-L239 HydrophobicContact CG1-CD2 4Å; V182-L239 HydrophobicContact CG2-CD2 4.02Å; L190-L239 HydrophobicContact CD1-CD2 4.2Å; L237-L239 HydrophobicContact CD2-CD2 3.67Å; L237-L239 HydrophobicContact CD2-CG 4.11Å; L237-L239 HydrophobicContact CG-CD2 3.96Å; L237-L239 HydrophobicContact CG-CG 4.31Å; L239-V241 VanDerWaalsContact C-N 3.34Å; L239-V241 HydrophobicContact CB-CG2 4.14Å; L239-V241 PolarHBondContact O-N 3.34Å; L239-Y245 HydrophobicContact CB-CE2 3.96Å; L239-Y245 HydrophobicContact CD1-CD2 4.13Å; L239-Y245 HydrophobicContact CD1-CE2 3.71Å; L239-Y245 HydrophobicContact CG-CD2 4.04Å; L239-Y245 HydrophobicContact CG-CE2 3.76Å; L239-L269 HydrophobicContact CD1-CD1 4.09Å; L239-L278 HydrophobicContact CD1-CD2 3.86Å
240	G	90.5	Very high	93.8	Very high	57 Å²	57	53.2 Å²	53.2	59%	0.588	30%	0.304	S	S	*	.	S	Bend	trans	73.6	22.6	-179.9	0	0	0	0	0	114.2	D238	D238-G240 PolarHBondContact OD1-N 2.79Å
241	V	89.2	Confident	94	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.036	29%	0.287	C	S	.	.	S	Bend	trans	-113.8	29.6	-176.3	-64	0	0	0	0	112.9	L239 Y245 D280 T283 L285 A287	L239-V241 VanDerWaalsContact C-N 3.34Å; L239-V241 HydrophobicContact CB-CG2 4.14Å; L239-V241 PolarHBondContact O-N 3.34Å; V241-Y245 HydrophobicContact CG2-CE2 4.16Å; V241-Y245 WeakPolarHBondContact CG2-OH 3.36Å; V241-D280 HydrophobicContact CG2-CB 4.46Å; V241-T283 PolarHBondContact O-OG1 3.02Å; V241-T283 VanDerWaalsContact O-OG1 3.08Å; V241-L285 HydrophobicContact CB-CB 3.94Å; V241-L285 HydrophobicContact CG1-CB 4.37Å; V241-L285 WeakPolarHBondContact O-CD1 3.42Å; V241-A287 HydrophobicContact CG1-CB 3.82Å; V241-A287 VanDerWaalsContact CG1-N 3.29Å
242	G	85.8	Confident	94	Very high	69 Å²	69	47 Å²	47	71%	0.711	27%	0.271	S	S	*	.	S	Bend	trans	87.6	3.1	169.9	0	0	0	0	0	115.8
243	R	91.8	Very high	93.9	Very high	74 Å²	74	48.2 Å²	48.2	28%	0.279	28%	0.278	S	S	.	.	S	Bend	trans	-154.8	165	170.3	67.2	176	178.8	159.5	4.2	112.4	Y245 H267 D280 T283	R243-Y245 HydrophobicContact CG-CE1 4.11Å; R243-H267 PolarHBondContact NH2-O 3.16Å; R243-D280 IonicContact CZ-OD1 2.79Å; R243-D280 IonicContact CZ-OD2 2.91Å; R243-D280 VanDerWaalsContact CZ-OD2 3.24Å; R243-D280 IonicContact NE-OD1 3.22Å; R243-D280 IonicContact NE-OD2 3.47Å; R243-D280 PolarHBondContact NE-OD2 2.96Å; R243-D280 IonicContact NH2-OD1 3.6Å; R243-D280 PolarHBondContact NH2-OD1 2.81Å; R243-D280 IonicContact NH2-OD2 2.71Å; R243-D280 PolarHBondContact NH2-OD2 2.81Å; R243-T283 HydrophobicContact CG-CG2 4.28Å
244	T	95.7	Very high	93.6	Very high	75 Å²	75	44.5 Å²	44.5	46%	0.46	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	158.8	175.2	62.2	0	0	0	0	111.7	I236 L237 D238	I236-T244 HydrophobicContact CG2-CG2 4.15Å; L237-T244 CarbonylContact O-C 3.56Å; L237-T244 VanDerWaalsContact O-CA 3.3Å; L237-T244 WeakPolarHBondContact O-CA 3.33Å; D238-T244 HydrophobicContact CB-CG2 4.1Å
245	Y	96.8	Very high	93.1	Very high	0 Å²	0	44 Å²	44	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	90.6	-172.8	-52.9	-81.5	0	0	0	109.8	L237 L239 V241 R243 F247 F263 H267 L269 D280	L237-Y245 PolarHBondContact N-O 2.94Å; L237-Y245 WeakPolarHBondContact O-CD2 3.18Å; L237-Y245 PolarHBondContact O-N 3.09Å; L239-Y245 HydrophobicContact CB-CE2 3.96Å; L239-Y245 HydrophobicContact CD1-CD2 4.13Å; L239-Y245 HydrophobicContact CD1-CE2 3.71Å; L239-Y245 HydrophobicContact CG-CD2 4.04Å; L239-Y245 HydrophobicContact CG-CE2 3.76Å; V241-Y245 HydrophobicContact CG2-CE2 4.16Å; V241-Y245 WeakPolarHBondContact CG2-OH 3.36Å; R243-Y245 HydrophobicContact CG-CE1 4.11Å; Y245-F247 PolarHBondContact O-N 2.93Å; Y245-F263 HydrophobicContact CD1-CZ 4.49Å; Y245-F263 HydrophobicContact CD2-CZ 4.38Å; Y245-F263 AromaticContact CG-CZ 3.92Å; Y245-F263 HydrophobicContact CG-CZ 3.92Å; Y245-H267 HydrophobicContact CD1-CB 3.65Å; Y245-H267 AromaticContact CD1-CG 3.51Å; Y245-H267 AromaticContact CD1-ND1 3.69Å; Y245-H267 HydrophobicContact CE1-CB 4.01Å; Y245-L269 HydrophobicContact CE1-CD1 4.35Å; Y245-L269 HydrophobicContact CE1-CD2 3.9Å; Y245-L269 HydrophobicContact CE1-CG 4.43Å; Y245-D280 WeakPolarHBondContact CE1-OD2 3.4Å; Y245-D280 PolarHBondContact OH-OD2 3.48Å
246	P	97.3	Very high	92.7	Very high	60 Å²	60	44.1 Å²	44.1	39%	0.39	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	127.3	172.6	28.1	-32.9	0	0	0	110.2	E235 I236 Q266 H267	E235-P246 WeakPolarHBondContact O-CA 3.11Å; I236-P246 HydrophobicContact CG1-CB 4.33Å; P246-Q266 PolarHBondContact O-NE2 2.81Å; P246-H267 PolarHBondContact O-CE1 2.98Å; P246-H267 PolarHBondContact O-NE2 2.84Å
247	F	97.7	Very high	92.6	Very high	11 Å²	11	39.8 Å²	39.8	5%	0.048	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	154.2	-176.7	-162.3	-96.4	0	0	0	112.7	H234 E235 Y245 F249 D262 F263 Q266 H267	H234-F247 WeakPolarHBondContact CA-O 3.48Å; E235-F247 PolarHBondContact N-O 3.44Å; E235-F247 PolarHBondContact O-N 3.02Å; Y245-F247 PolarHBondContact O-N 2.93Å; F247-F249 HydrophobicContact CB-CD2 4.31Å; F247-F249 HydrophobicContact CB-CE2 3.69Å; F247-F249 HydrophobicContact CB-CZ 3.99Å; F247-F249 HydrophobicContact CD1-CD1 4.01Å; F247-F249 HydrophobicContact CD1-CD2 4.04Å; F247-F249 AromaticContact CD1-CE1 3.91Å; F247-F249 HydrophobicContact CD1-CE1 3.91Å; F247-F249 AromaticContact CD1-CE2 3.95Å; F247-F249 HydrophobicContact CD1-CE2 3.95Å; F247-F249 HydrophobicContact CD1-CG 4.07Å; F247-F249 AromaticContact CD1-CZ 3.88Å; F247-F249 HydrophobicContact CD1-CZ 3.88Å; F247-F249 HydrophobicContact CE1-CD1 4.49Å; F247-F249 HydrophobicContact CG-CE2 4.28Å; F247-F249 HydrophobicContact CG-CZ 4.28Å; F247-D262 HydrophobicContact CZ-CB 4.05Å; F247-D262 WeakPolarHBondContact CZ-OD2 3.27Å; F247-F263 HydrophobicContact CB-CD2 3.77Å; F247-F263 HydrophobicContact CB-CE2 3.91Å; F247-F263 AromaticContact CD1-CD2 3.95Å; F247-F263 HydrophobicContact CD1-CD2 3.95Å; F247-F263 HydrophobicContact CD2-CB 4.34Å; F247-F263 AromaticContact CD2-CD2 3.63Å; F247-F263 HydrophobicContact CD2-CD2 3.63Å; F247-F263 HydrophobicContact CD2-CE2 4.4Å; F247-F263 HydrophobicContact CD2-CG 4.42Å; F247-F263 HydrophobicContact CE1-CB 4.31Å; F247-F263 HydrophobicContact CE1-CD2 4.49Å; F247-F263 HydrophobicContact CE2-CB 4.07Å; F247-F263 HydrophobicContact CE2-CD2 4.21Å; F247-F263 AromaticContact CG-CD2 3.51Å; F247-F263 HydrophobicContact CG-CD2 3.51Å; F247-F263 HydrophobicContact CG-CE2 4.17Å; F247-F263 HydrophobicContact CZ-CB 4.06Å; F247-Q266 VanDerWaalsContact CD2-NE2 3.35Å; F247-Q266 HydrophobicContact CE2-CB 4.14Å; F247-Q266 HydrophobicContact CE2-CG 4.45Å; F247-Q266 VanDerWaalsContact CE2-OE1 3.29Å; F247-H267 AromaticContact CD2-NE2 3.77Å
248	K	96.8	Very high	92.5	Very high	148 Å²	148	40.5 Å²	40.5	64%	0.643	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	103.6	177	-70.3	-178.3	-177.4	178	0	110	R233	R233-K248 CarbonylContact O-C 3.48Å; R233-K248 WeakPolarHBondContact O-CA 3.24Å
249	F	95.8	Very high	92.6	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.013	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	156.1	-178	-67.2	-87.8	0	0	0	113.2	L201 G232 R233 E235 F247 L259 F263	L201-F249 HydrophobicContact CD1-CB 3.67Å; L201-F249 HydrophobicContact CD1-CD2 4.13Å; L201-F249 HydrophobicContact CD1-CG 3.97Å; L201-F249 HydrophobicContact CD2-CD1 4.33Å; L201-F249 HydrophobicContact CD2-CG 4.24Å; L201-F249 HydrophobicContact CG-CB 3.62Å; L201-F249 HydrophobicContact CG-CD1 4.09Å; L201-F249 HydrophobicContact CG-CD2 4.26Å; L201-F249 HydrophobicContact CG-CG 3.74Å; G232-F249 PolarHBondContact N-O 2.76Å; G232-F249 VanDerWaalsContact N-O 3.15Å; R233-F249 PolarHBondContact N-O 3.45Å; R233-F249 PolarHBondContact O-N 3.3Å; E235-F249 HydrophobicContact CB-CD2 3.97Å; E235-F249 HydrophobicContact CB-CE2 4Å; E235-F249 HydrophobicContact CG-CD2 4.42Å; F247-F249 HydrophobicContact CB-CD2 4.31Å; F247-F249 HydrophobicContact CB-CE2 3.69Å; F247-F249 HydrophobicContact CB-CZ 3.99Å; F247-F249 HydrophobicContact CD1-CD1 4.01Å; F247-F249 HydrophobicContact CD1-CD2 4.04Å; F247-F249 AromaticContact CD1-CE1 3.91Å; F247-F249 HydrophobicContact CD1-CE1 3.91Å; F247-F249 AromaticContact CD1-CE2 3.95Å; F247-F249 HydrophobicContact CD1-CE2 3.95Å; F247-F249 HydrophobicContact CD1-CG 4.07Å; F247-F249 AromaticContact CD1-CZ 3.88Å; F247-F249 HydrophobicContact CD1-CZ 3.88Å; F247-F249 HydrophobicContact CE1-CD1 4.49Å; F247-F249 HydrophobicContact CG-CE2 4.28Å; F247-F249 HydrophobicContact CG-CZ 4.28Å; F249-L259 HydrophobicContact CE1-CD2 3.92Å; F249-L259 HydrophobicContact CZ-CD2 4.22Å; F249-F263 HydrophobicContact CE1-CD2 4.35Å; F249-F263 AromaticContact CZ-CD2 3.96Å; F249-F263 HydrophobicContact CZ-CD2 3.96Å; F249-F263 HydrophobicContact CZ-CE2 4.06Å
250	V	93.9	Very high	92.7	Very high	19 Å²	19	37.7 Å²	37.7	12%	0.115	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	137.4	162.2	178.5	0	0	0	0	108.8	V198 S199 I200 L201 L218 V228	V198-V250 HydrophobicContact CG1-CB 4.04Å; V198-V250 HydrophobicContact CG1-CG2 3.55Å; S199-V250 PolarHBondContact O-N 3.32Å; S199-V250 VanDerWaalsContact O-N 3.16Å; I200-V250 CarbonylContact C-O 3.47Å; I200-V250 VanDerWaalsContact CA-O 3.23Å; I200-V250 WeakPolarHBondContact CA-O 2.91Å; L201-V250 PolarHBondContact N-O 3.42Å; L218-V250 HydrophobicContact CD1-CG1 4.05Å; V228-V250 HydrophobicContact CB-CG1 4.38Å; V228-V250 HydrophobicContact CG1-CG1 3.56Å; V228-V250 HydrophobicContact CG2-CG1 3.91Å
251	I	92.7	Very high	93	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	120.3	171.4	-50	175.8	0	0	0	107.9	L201 A203 S229 H230 R233	L201-I251 HydrophobicContact CB-CG1 4.46Å; L201-I251 WeakPolarHBondContact O-CA 3.42Å; A203-I251 HydrophobicContact CB-CG2 4.12Å; S229-I251 PolarHBondContact N-O 3.39Å; H230-I251 HydrophobicContact CB-CB 4.06Å; H230-I251 HydrophobicContact CB-CD1 3.61Å; H230-I251 HydrophobicContact CB-CG1 3.93Å; H230-I251 PolarHBondContact N-O 2.79Å; H230-I251 PolarHBondContact O-N 3.15Å; R233-I251 HydrophobicContact CB-CD1 4.21Å; R233-I251 HydrophobicContact CB-CG1 4.15Å; R233-I251 HydrophobicContact CG-CD1 4.39Å
252	A	91.1	Very high	93.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	162.9	-178.4	0	0	0	0	0	112.2	I200 L201 A203 L218 I226 D227 V228 V254	I200-A252 HydrophobicContact CG2-CB 3.64Å; L201-A252 PolarHBondContact O-N 3.24Å; L201-A252 VanDerWaalsContact O-N 3.14Å; A203-A252 PolarHBondContact N-O 2.96Å; L218-A252 HydrophobicContact CD1-CB 4.11Å; I226-A252 HydrophobicContact CG2-CB 3.79Å; D227-A252 VanDerWaalsContact O-CA 3.26Å; D227-A252 WeakPolarHBondContact O-CA 3.36Å; D227-A252 WeakPolarHBondContact O-CB 3.11Å; V228-A252 HydrophobicContact CG2-CB 4.25Å; A252-V254 PolarHBondContact O-N 3.06Å
253	A	88.2	Confident	94	Very high	67 Å²	67	35.4 Å²	35.4	55%	0.554	20%	0.204	S	C	*	.	S	Bend	trans	-74.7	72.5	178.2	0	0	0	0	0	111.5	D227	D227-A253 PolarHBondContact O-N 2.71Å
254	V	87.3	Confident	94.2	Very high	14 Å²	14	32.4 Å²	32.4	9%	0.085	19%	0.194	C	C	.	.			trans	-119.9	148.3	176.2	-63.6	0	0	0	0	110.6	I200 S202 I226 A252 D256	I200-V254 HydrophobicContact CB-CG2 4.32Å; I200-V254 HydrophobicContact CD1-CG1 4.35Å; I200-V254 HydrophobicContact CG2-CG1 4.23Å; I200-V254 HydrophobicContact CG2-CG2 3.46Å; I200-V254 VanDerWaalsContact CG2-CG2 3.46Å; S202-V254 WeakPolarHBondContact CB-O 3.48Å; S202-V254 PolarHBondContact OG-O 3.25Å; I226-V254 HydrophobicContact CD1-CG1 4.28Å; I226-V254 HydrophobicContact CG2-CG1 3.79Å; A252-V254 PolarHBondContact O-N 3.06Å; V254-D256 VanDerWaalsContact CG2-O 3.24Å; V254-D256 WeakPolarHBondContact CG2-O 3.29Å
255	P	85	Confident	94.3	Very high	105 Å²	105	39.3 Å²	39.3	68%	0.682	21%	0.211	S	C	*	.	S	Bend	trans	-69.7	-35.1	-175.8	26.3	-34.6	0	0	0	113.7
256	D	87.9	Confident	94.3	Very high	33 Å²	33	45 Å²	45	18%	0.176	24%	0.238	C	C	.	.	S	Bend	trans	-124.4	146.5	178	-72.4	-59.8	0	0	0	109.2	V254 I258	V254-D256 VanDerWaalsContact CG2-O 3.24Å; V254-D256 WeakPolarHBondContact CG2-O 3.29Å; D256-I258 WeakPolarHBondContact O-CG1 3.33Å
257	T	93.7	Very high	94.3	Very high	21 Å²	21	43.2 Å²	43.2	13%	0.129	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	136.9	168.2	-68.7	0	0	0	0	109.9	L190 L191 I200 L201 S202	L190-T257 CarbonylContact C-O 3.47Å; L190-T257 WeakPolarHBondContact CA-O 3.3Å; L190-T257 HydrophobicContact CD2-CG2 3.25Å; L190-T257 HydrophobicContact CG-CG2 4.46Å; L191-T257 PolarHBondContact N-O 2.87Å; I200-T257 CarbonylContact O-C 3.55Å; I200-T257 VanDerWaalsContact O-CA 3.28Å; I200-T257 WeakPolarHBondContact O-CA 3.42Å; I200-T257 VanDerWaalsContact O-CG2 3.27Å; I200-T257 WeakPolarHBondContact O-CG2 3.32Å; L201-T257 HydrophobicContact CD2-CG2 3.72Å; S202-T257 PolarHBondContact N-OG1 2.99Å; S202-T257 VanDerWaalsContact N-OG1 3.13Å
258	I	95.3	Very high	94.2	Very high	24 Å²	24	44.4 Å²	44.4	12%	0.123	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.6	-173.4	-50.5	-176.9	0	0	0	109.6	L191 N193 S199 I200 D256 S260	L191-I258 CarbonylContact O-C 3.55Å; L191-I258 WeakPolarHBondContact O-CA 3.17Å; N193-I258 HydrophobicContact CB-CG2 3.7Å; S199-I258 CarbonylContact C-O 3.57Å; S199-I258 VanDerWaalsContact CA-O 3.32Å; S199-I258 WeakPolarHBondContact CA-O 3.35Å; I200-I258 HydrophobicContact CB-CB 4.41Å; I200-I258 HydrophobicContact CD1-CD1 4.45Å; I200-I258 PolarHBondContact N-O 3.27Å; I200-I258 PolarHBondContact O-N 2.8Å; D256-I258 WeakPolarHBondContact O-CG1 3.33Å; I258-S260 WeakPolarHBondContact CG2-OG 3.12Å
259	L	96.9	Very high	94.2	Very high	1 Å²	1	38 Å²	38	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.9	163.6	-59.7	-178	0	0	0	108.4	V182 L190 L191 N193 L237 F249 F263	V182-L259 HydrophobicContact CG1-CD1 3.93Å; L190-L259 HydrophobicContact CB-CD1 4.15Å; L190-L259 HydrophobicContact CB-CG 4.08Å; L190-L259 HydrophobicContact CD1-CD1 4Å; L190-L259 HydrophobicContact CD1-CG 4.38Å; L191-L259 PolarHBondContact O-N 2.92Å; N193-L259 PolarHBondContact N-O 2.81Å; L237-L259 HydrophobicContact CD2-CD1 4.01Å; L237-L259 HydrophobicContact CD2-CD2 3.92Å; F249-L259 HydrophobicContact CE1-CD2 3.92Å; F249-L259 HydrophobicContact CZ-CD2 4.22Å; L259-F263 HydrophobicContact CB-CD1 4.21Å; L259-F263 HydrophobicContact CD1-CD1 4.26Å; L259-F263 HydrophobicContact CD1-CE1 4.01Å; L259-F263 HydrophobicContact CD2-CD1 3.94Å; L259-F263 HydrophobicContact CD2-CD2 4.39Å; L259-F263 HydrophobicContact CD2-CE1 4.08Å; L259-F263 HydrophobicContact CD2-CG 4.12Å; L259-F263 HydrophobicContact CD2-CZ 4.41Å; L259-F263 HydrophobicContact CG-CD1 4.36Å
260	S	96.6	Very high	94.2	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-178.1	-169.6	-66.9	0	0	0	0	112.3	N193 S196 V198 S199 I258 D262 F263 L264	N193-S260 WeakPolarHBondContact O-CA 3.26Å; S196-S260 VanDerWaalsContact CB-OG 3.26Å; S196-S260 WeakPolarHBondContact CB-OG 3.41Å; S196-S260 WeakPolarHBondContact O-CB 3.4Å; S196-S260 PolarHBondContact OG-OG 2.89Å; S196-S260 VanDerWaalsContact OG-OG 3.13Å; V198-S260 WeakPolarHBondContact O-CB 3.18Å; V198-S260 PolarHBondContact O-OG 3.15Å; S199-S260 PolarHBondContact OG-N 2.79Å; I258-S260 WeakPolarHBondContact CG2-OG 3.12Å; S260-D262 VanDerWaalsContact CB-OD1 3.26Å; S260-D262 WeakPolarHBondContact CB-OD1 3.37Å; S260-D262 PolarHBondContact O-N 2.83Å; S260-F263 PolarHBondContact O-N 3.07Å; S260-L264 VanDerWaalsContact O-CG 3.24Å; S260-L264 WeakPolarHBondContact O-CG 3.45Å; S260-L264 PolarHBondContact O-N 2.87Å
261	A	97	Very high	94.1	Very high	39 Å²	39	43.1 Å²	43.1	32%	0.322	25%	0.246	S	C	.	.	H	α-helix	trans	-57.2	-34.5	-177.9	0	0	0	0	0	113.2	S196 R265	S196-A261 WeakPolarHBondContact O-CB 3.34Å; S196-A261 PolarHBondContact O-N 2.81Å; A261-R265 WeakPolarHBondContact O-CB 3.42Å; A261-R265 PolarHBondContact O-N 3.21Å
262	D	97.4	Very high	94.1	Very high	45 Å²	45	46.4 Å²	46.4	24%	0.241	26%	0.263	C	S	.	.	H	α-helix	trans	-57.7	-54.5	175.5	58.4	-13.4	0	0	0	112.9	E197 V198 S199 F247 S260 R265 Q266	E197-D262 VanDerWaalsContact O-CB 3.29Å; E197-D262 WeakPolarHBondContact O-CB 3.26Å; V198-D262 WeakPolarHBondContact CA-OD2 3.26Å; S199-D262 WeakPolarHBondContact CB-OD1 3.46Å; S199-D262 VanDerWaalsContact N-CG 3.32Å; S199-D262 PolarHBondContact N-OD1 2.91Å; S199-D262 VanDerWaalsContact N-OD1 3.07Å; S199-D262 PolarHBondContact N-OD2 2.87Å; S199-D262 PolarHBondContact OG-OD1 2.87Å; F247-D262 HydrophobicContact CZ-CB 4.05Å; F247-D262 WeakPolarHBondContact CZ-OD2 3.27Å; S260-D262 VanDerWaalsContact CB-OD1 3.26Å; S260-D262 WeakPolarHBondContact CB-OD1 3.37Å; S260-D262 PolarHBondContact O-N 2.83Å; D262-R265 PolarHBondContact O-N 2.67Å; D262-Q266 VanDerWaalsContact O-CB 3.29Å; D262-Q266 WeakPolarHBondContact O-CB 3.5Å; D262-Q266 PolarHBondContact O-N 3.15Å
263	F	98	Very high	94	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-45.3	179	178.5	-89.3	0	0	0	111.3	S199 L237 Y245 F247 F249 L259 S260 R265 Q266 H267 L269	S199-F263 WeakPolarHBondContact OG-CB 3.5Å; L237-F263 HydrophobicContact CB-CZ 4.4Å; L237-F263 HydrophobicContact CD2-CE1 4.16Å; L237-F263 HydrophobicContact CD2-CE2 4.17Å; L237-F263 HydrophobicContact CD2-CZ 3.59Å; Y245-F263 HydrophobicContact CD1-CZ 4.49Å; Y245-F263 HydrophobicContact CD2-CZ 4.38Å; Y245-F263 AromaticContact CG-CZ 3.92Å; Y245-F263 HydrophobicContact CG-CZ 3.92Å; F247-F263 HydrophobicContact CB-CD2 3.77Å; F247-F263 HydrophobicContact CB-CE2 3.91Å; F247-F263 AromaticContact CD1-CD2 3.95Å; F247-F263 HydrophobicContact CD1-CD2 3.95Å; F247-F263 HydrophobicContact CD2-CB 4.34Å; F247-F263 AromaticContact CD2-CD2 3.63Å; F247-F263 HydrophobicContact CD2-CD2 3.63Å; F247-F263 HydrophobicContact CD2-CE2 4.4Å; F247-F263 HydrophobicContact CD2-CG 4.42Å; F247-F263 HydrophobicContact CE1-CB 4.31Å; F247-F263 HydrophobicContact CE1-CD2 4.49Å; F247-F263 HydrophobicContact CE2-CB 4.07Å; F247-F263 HydrophobicContact CE2-CD2 4.21Å; F247-F263 AromaticContact CG-CD2 3.51Å; F247-F263 HydrophobicContact CG-CD2 3.51Å; F247-F263 HydrophobicContact CG-CE2 4.17Å; F247-F263 HydrophobicContact CZ-CB 4.06Å; F249-F263 HydrophobicContact CE1-CD2 4.35Å; F249-F263 AromaticContact CZ-CD2 3.96Å; F249-F263 HydrophobicContact CZ-CD2 3.96Å; F249-F263 HydrophobicContact CZ-CE2 4.06Å; L259-F263 HydrophobicContact CB-CD1 4.21Å; L259-F263 HydrophobicContact CD1-CD1 4.26Å; L259-F263 HydrophobicContact CD1-CE1 4.01Å; L259-F263 HydrophobicContact CD2-CD1 3.94Å; L259-F263 HydrophobicContact CD2-CD2 4.39Å; L259-F263 HydrophobicContact CD2-CE1 4.08Å; L259-F263 HydrophobicContact CD2-CG 4.12Å; L259-F263 HydrophobicContact CD2-CZ 4.41Å; L259-F263 HydrophobicContact CG-CD1 4.36Å; S260-F263 PolarHBondContact O-N 3.07Å; F263-R265 PolarHBondContact O-N 3.08Å; F263-Q266 PolarHBondContact O-N 3.43Å; F263-H267 AromaticContact CD2-CD2 3.73Å; F263-H267 AromaticContact CE2-CD2 3.55Å; F263-H267 AromaticContact CE2-NE2 3.81Å; F263-H267 AromaticContact CZ-CD2 3.84Å; F263-H267 PolarHBondContact O-CD2 2.74Å; F263-H267 PolarHBondContact O-N 3.04Å; F263-H267 VanDerWaalsContact O-N 3.15Å; F263-L269 HydrophobicContact CD1-CD1 3.96Å; F263-L269 HydrophobicContact CE1-CD1 3.38Å; F263-L269 HydrophobicContact CZ-CD1 4.27Å
264	L	97.5	Very high	94	Very high	11 Å²	11	58.9 Å²	58.9	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-61.1	-45.3	179.8	-65.8	175.8	0	0	0	111.5	V192 S260 G268 L269 L278	V192-L264 HydrophobicContact CG1-CD1 4Å; V192-L264 HydrophobicContact CG1-CD2 4.12Å; S260-L264 VanDerWaalsContact O-CG 3.24Å; S260-L264 WeakPolarHBondContact O-CG 3.45Å; S260-L264 PolarHBondContact O-N 2.87Å; L264-G268 PolarHBondContact O-N 3.46Å; L264-L269 HydrophobicContact CD2-CB 3.71Å; L264-L269 HydrophobicContact CD2-CD1 4.23Å; L264-L269 PolarHBondContact O-N 2.86Å; L264-L278 HydrophobicContact CD2-CD1 3.87Å
265	R	97.3	Very high	94	Very high	219 Å²	219	60.1 Å²	60.1	83%	0.826	32%	0.322	S	S	*	.	H	α-helix	trans	-67.3	-46.5	178.6	-177.5	178.5	177.9	174.8	0.1	111.6	A261 D262 F263 H267 G268	A261-R265 WeakPolarHBondContact O-CB 3.42Å; A261-R265 PolarHBondContact O-N 3.21Å; D262-R265 PolarHBondContact O-N 2.67Å; F263-R265 PolarHBondContact O-N 3.08Å; R265-H267 PolarHBondContact O-N 3.11Å; R265-G268 PolarHBondContact O-N 3.49Å
266	Q	97.4	Very high	94.3	Very high	121 Å²	121	55.2 Å²	55.2	57%	0.565	29%	0.29	S	S	*	.	H	α-helix	trans	-58.5	-38.4	-178.3	-179	174.1	-57.3	0	0	112	P246 F247 D262 F263	P246-Q266 PolarHBondContact O-NE2 2.81Å; F247-Q266 VanDerWaalsContact CD2-NE2 3.35Å; F247-Q266 HydrophobicContact CE2-CB 4.14Å; F247-Q266 HydrophobicContact CE2-CG 4.45Å; F247-Q266 VanDerWaalsContact CE2-OE1 3.29Å; D262-Q266 VanDerWaalsContact O-CB 3.29Å; D262-Q266 WeakPolarHBondContact O-CB 3.5Å; D262-Q266 PolarHBondContact O-N 3.15Å; F263-Q266 PolarHBondContact O-N 3.43Å
267	H	96.6	Very high	94.5	Very high	22 Å²	22	58.7 Å²	58.7	10%	0.102	30%	0.301	C	S	.	.	H	α-helix	trans	-100.3	0.2	-176.7	-64.9	-63.2	0	0	0	114.3	R243 Y245 P246 F247 F263 R265 L269	R243-H267 PolarHBondContact NH2-O 3.16Å; Y245-H267 HydrophobicContact CD1-CB 3.65Å; Y245-H267 AromaticContact CD1-CG 3.51Å; Y245-H267 AromaticContact CD1-ND1 3.69Å; Y245-H267 HydrophobicContact CE1-CB 4.01Å; P246-H267 PolarHBondContact O-CE1 2.98Å; P246-H267 PolarHBondContact O-NE2 2.84Å; F247-H267 AromaticContact CD2-NE2 3.77Å; F263-H267 AromaticContact CD2-CD2 3.73Å; F263-H267 AromaticContact CE2-CD2 3.55Å; F263-H267 AromaticContact CE2-NE2 3.81Å; F263-H267 AromaticContact CZ-CD2 3.84Å; F263-H267 PolarHBondContact O-CD2 2.74Å; F263-H267 PolarHBondContact O-N 3.04Å; F263-H267 VanDerWaalsContact O-N 3.15Å; R265-H267 PolarHBondContact O-N 3.11Å; H267-L269 VanDerWaalsContact C-N 3.35Å; H267-L269 HydrophobicContact CB-CD1 4.25Å; H267-L269 HydrophobicContact CB-CG 4.02Å
268	G	95.8	Very high	94.5	Very high	35 Å²	35	57.8 Å²	57.8	36%	0.361	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	37.3	-179.7	0	0	0	0	0	113	L264 R265 G281	L264-G268 PolarHBondContact O-N 3.46Å; R265-G268 PolarHBondContact O-N 3.49Å; G268-G281 WeakPolarHBondContact O-CA 3.44Å; G268-G281 PolarHBondContact O-N 3.12Å
269	L	96.4	Very high	94.5	Very high	13 Å²	13	61.3 Å²	61.3	7%	0.068	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	133.7	179.1	-60.3	177.1	0	0	0	110.5	L239 Y245 F263 L264 H267 L278 R279 D280	L239-L269 HydrophobicContact CD1-CD1 4.09Å; Y245-L269 HydrophobicContact CE1-CD1 4.35Å; Y245-L269 HydrophobicContact CE1-CD2 3.9Å; Y245-L269 HydrophobicContact CE1-CG 4.43Å; F263-L269 HydrophobicContact CD1-CD1 3.96Å; F263-L269 HydrophobicContact CE1-CD1 3.38Å; F263-L269 HydrophobicContact CZ-CD1 4.27Å; L264-L269 HydrophobicContact CD2-CB 3.71Å; L264-L269 HydrophobicContact CD2-CD1 4.23Å; L264-L269 PolarHBondContact O-N 2.86Å; H267-L269 VanDerWaalsContact C-N 3.35Å; H267-L269 HydrophobicContact CB-CD1 4.25Å; H267-L269 HydrophobicContact CB-CG 4.02Å; L269-L278 HydrophobicContact CB-CD1 4.01Å; L269-L278 HydrophobicContact CB-CG 4.42Å; L269-L278 HydrophobicContact CD1-CD2 4.27Å; L269-R279 CarbonylContact C-O 3.52Å; L269-R279 WeakPolarHBondContact CA-O 3.18Å; L269-D280 HydrophobicContact CD2-CB 3.99Å
270	V	95.4	Very high	94.3	Very high	89 Å²	89	61.2 Å²	61.2	54%	0.539	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.2	-177	-176.6	0	0	0	0	109.7	R279	V270-R279 PolarHBondContact N-O 2.93Å; V270-R279 PolarHBondContact O-N 2.74Å
271	S	93.7	Very high	94	Very high	42 Å²	42	62.9 Å²	62.9	29%	0.294	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	122.7	174.2	48.5	0	0	0	0	110.8
272	N	91.5	Very high	93.4	Very high	74 Å²	74	65.4 Å²	65.4	40%	0.396	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	93.6	172.2	-174.1	-20.8	0	0	0	109.1	K274 A275 A276 R277	N272-K274 VanDerWaalsContact C-N 3.34Å; N272-K274 PolarHBondContact O-N 3.29Å; N272-K274 PolarHBondContact OD1-N 2.59Å; N272-A275 HydrophobicContact CB-CB 4.27Å; N272-A275 VanDerWaalsContact CG-CB 3.48Å; N272-A275 WeakPolarHBondContact ND2-CB 3.29Å; N272-A275 PolarHBondContact O-N 2.56Å; N272-A275 WeakPolarHBondContact OD1-CB 3.46Å; N272-A275 PolarHBondContact OD1-N 3.07Å; N272-A276 WeakPolarHBondContact O-CA 3.37Å; N272-A276 PolarHBondContact O-N 3.14Å; N272-R277 PolarHBondContact N-O 2.72Å; N272-R277 PolarHBondContact O-N 2.78Å
273	L	89.4	Confident	92.9	Very high	121 Å²	121	65.4 Å²	65.4	63%	0.634	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-42	-179.4	-61.8	174.8	0	0	0	111.9	L180 A275 A276	L180-L273 HydrophobicContact CD1-CD2 3.7Å; L180-L273 HydrophobicContact CD2-CD2 4.36Å; L180-L273 HydrophobicContact CG-CD2 3.72Å; L273-A275 PolarHBondContact O-N 2.88Å; L273-A276 PolarHBondContact O-N 3.13Å
274	K	87.5	Confident	92.5	Very high	207 Å²	207	69.7 Å²	69.7	90%	0.9	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-42.1	-178.4	-176	177.8	-178.2	178.1	0	112.2	N272 A276	N272-K274 VanDerWaalsContact C-N 3.34Å; N272-K274 PolarHBondContact O-N 3.29Å; N272-K274 PolarHBondContact OD1-N 2.59Å; K274-A276 VanDerWaalsContact C-N 3.34Å
275	A	88.1	Confident	92.2	Very high	41 Å²	41	73.7 Å²	73.7	34%	0.339	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-7.7	179.3	0	0	0	0	0	113.2	N272 L273 R277	N272-A275 HydrophobicContact CB-CB 4.27Å; N272-A275 VanDerWaalsContact CG-CB 3.48Å; N272-A275 WeakPolarHBondContact ND2-CB 3.29Å; N272-A275 PolarHBondContact O-N 2.56Å; N272-A275 WeakPolarHBondContact OD1-CB 3.46Å; N272-A275 PolarHBondContact OD1-N 3.07Å; L273-A275 PolarHBondContact O-N 2.88Å; A275-R277 VanDerWaalsContact C-N 3.35Å; A275-R277 HydrophobicContact CB-CB 4.44Å; A275-R277 HydrophobicContact CB-CG 4.1Å; A275-R277 WeakPolarHBondContact O-CG 3.27Å
276	A	90.2	Very high	92	Very high	2 Å²	2	64.2 Å²	64.2	2%	0.017	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	49.6	-168.3	0	0	0	0	0	112.4	L180 N272 L273 K274 C289 H291 C292	L180-A276 HydrophobicContact CD2-CB 4.32Å; N272-A276 WeakPolarHBondContact O-CA 3.37Å; N272-A276 PolarHBondContact O-N 3.14Å; L273-A276 PolarHBondContact O-N 3.13Å; K274-A276 VanDerWaalsContact C-N 3.34Å; A276-C289 WeakPolarHBondContact O-CA 3.32Å; A276-C289 WeakPolarHBondContact O-CB 3.47Å; A276-C289 PolarHBondContact O-N 2.9Å; A276-H291 HydrophobicContact CB-CB 3.75Å; A276-C292 HydrophobicContact CB-CB 4.12Å
277	R	92.8	Very high	91.7	Very high	105 Å²	105	59 Å²	59	40%	0.396	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.5	-178	-60.1	-180	86	-172.7	-1.3	112	N272 A275 S286 A287	N272-R277 PolarHBondContact N-O 2.72Å; N272-R277 PolarHBondContact O-N 2.78Å; A275-R277 VanDerWaalsContact C-N 3.35Å; A275-R277 HydrophobicContact CB-CB 4.44Å; A275-R277 HydrophobicContact CB-CG 4.1Å; A275-R277 WeakPolarHBondContact O-CG 3.27Å; R277-S286 PolarHBondContact NH2-O 3.34Å; R277-S286 VanDerWaalsContact NH2-O 3.15Å; R277-A287 VanDerWaalsContact CA-O 3.28Å; R277-A287 WeakPolarHBondContact CA-O 3.35Å
278	L	94.8	Very high	91.5	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.016	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	110.1	166.6	-175.3	61	0	0	0	108	V182 V192 L239 L264 L269 S286 A287	V182-L278 HydrophobicContact CG1-CD2 4.36Å; V192-L278 HydrophobicContact CG1-CD1 4.25Å; V192-L278 HydrophobicContact CG2-CD2 4Å; L239-L278 HydrophobicContact CD1-CD2 3.86Å; L264-L278 HydrophobicContact CD2-CD1 3.87Å; L269-L278 HydrophobicContact CB-CD1 4.01Å; L269-L278 HydrophobicContact CB-CG 4.42Å; L269-L278 HydrophobicContact CD1-CD2 4.27Å; L278-S286 CarbonylContact O-C 3.49Å; L278-S286 WeakPolarHBondContact O-CA 3.41Å; L278-S286 WeakPolarHBondContact O-CB 3.28Å; L278-A287 PolarHBondContact N-O 2.89Å; L278-A287 PolarHBondContact O-N 3.12Å
279	R	94.4	Very high	91.2	Very high	97 Å²	97	60.8 Å²	60.8	37%	0.366	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.5	-176.6	-177.4	172.6	-172.3	-130.8	11.2	110.4	L269 V270 F284 L285 S286	L269-R279 CarbonylContact C-O 3.52Å; L269-R279 WeakPolarHBondContact CA-O 3.18Å; V270-R279 PolarHBondContact N-O 2.93Å; V270-R279 PolarHBondContact O-N 2.74Å; R279-F284 PolarHBondContact NE-O 3.37Å; R279-L285 WeakPolarHBondContact CA-O 3.23Å; R279-S286 WeakPolarHBondContact CB-OG 3.24Å; R279-S286 WeakPolarHBondContact CG-OG 3.49Å
280	D	92.9	Very high	90.1	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.3	170.9	-166.7	-44.3	0	0	0	110.3	V241 R243 Y245 L269 V282 T283 F284 L285	V241-D280 HydrophobicContact CG2-CB 4.46Å; R243-D280 IonicContact CZ-OD1 2.79Å; R243-D280 IonicContact CZ-OD2 2.91Å; R243-D280 VanDerWaalsContact CZ-OD2 3.24Å; R243-D280 IonicContact NE-OD1 3.22Å; R243-D280 IonicContact NE-OD2 3.47Å; R243-D280 PolarHBondContact NE-OD2 2.96Å; R243-D280 IonicContact NH2-OD1 3.6Å; R243-D280 PolarHBondContact NH2-OD1 2.81Å; R243-D280 IonicContact NH2-OD2 2.71Å; R243-D280 PolarHBondContact NH2-OD2 2.81Å; Y245-D280 WeakPolarHBondContact CE1-OD2 3.4Å; Y245-D280 PolarHBondContact OH-OD2 3.48Å; L269-D280 HydrophobicContact CD2-CB 3.99Å; D280-V282 PolarHBondContact O-N 2.77Å; D280-V282 WeakPolarHBondContact OD1-CA 3.36Å; D280-V282 WeakPolarHBondContact OD1-CB 3.42Å; D280-V282 PolarHBondContact OD1-N 2.86Å; D280-T283 WeakPolarHBondContact CB-OG1 3.46Å; D280-T283 PolarHBondContact OD1-N 2.85Å; D280-F284 WeakPolarHBondContact O-CA 3.26Å; D280-F284 PolarHBondContact O-N 2.98Å; D280-L285 PolarHBondContact N-O 3.42Å
281	G	89.6	Confident	88.3	Confident	35 Å²	35	61.5 Å²	61.5	36%	0.361	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-18.3	178.4	0	0	0	0	0	114.4	G268 F284	G268-G281 WeakPolarHBondContact O-CA 3.44Å; G268-G281 PolarHBondContact O-N 3.12Å; G281-F284 WeakPolarHBondContact O-CE1 3.41Å
282	V	86	Confident	85.9	Confident	92 Å²	92	62.4 Å²	62.4	56%	0.558	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-49.9	-179.5	-178.4	0	0	0	0	111.3	D280	D280-V282 PolarHBondContact O-N 2.77Å; D280-V282 WeakPolarHBondContact OD1-CA 3.36Å; D280-V282 WeakPolarHBondContact OD1-CB 3.42Å; D280-V282 PolarHBondContact OD1-N 2.86Å
283	T	86	Confident	83.9	Confident	45 Å²	45	70.2 Å²	70.2	28%	0.276	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.8	-177.4	68.8	0	0	0	0	113	V241 R243 D280 L285	V241-T283 PolarHBondContact O-OG1 3.02Å; V241-T283 VanDerWaalsContact O-OG1 3.08Å; R243-T283 HydrophobicContact CG-CG2 4.28Å; D280-T283 WeakPolarHBondContact CB-OG1 3.46Å; D280-T283 PolarHBondContact OD1-N 2.85Å; T283-L285 PolarHBondContact O-N 3.24Å; T283-L285 PolarHBondContact OG1-N 2.84Å
284	F	89.1	Confident	81.6	Confident	90 Å²	90	75 Å²	75	40%	0.395	37%	0.37	S	S	.	.			trans	58.8	0.9	-172.4	-55.2	-64.9	0	0	0	115.4	L46 R279 D280 G281	L46-F284 HydrophobicContact CD1-CE2 3.83Å; L46-F284 HydrophobicContact CD1-CZ 3.81Å; L46-F284 HydrophobicContact CD2-CZ 4.43Å; R279-F284 PolarHBondContact NE-O 3.37Å; D280-F284 WeakPolarHBondContact O-CA 3.26Å; D280-F284 PolarHBondContact O-N 2.98Å; G281-F284 WeakPolarHBondContact O-CE1 3.41Å
285	L	91.6	Very high	79.2	Confident	94 Å²	94	75.1 Å²	75.1	49%	0.492	37%	0.371	S	S	.	.			trans	-72.4	160.4	170.9	-61.3	179.8	0	0	0	109.6	V241 R279 D280 T283	V241-L285 HydrophobicContact CB-CB 3.94Å; V241-L285 HydrophobicContact CG1-CB 4.37Å; V241-L285 WeakPolarHBondContact O-CD1 3.42Å; R279-L285 WeakPolarHBondContact CA-O 3.23Å; D280-L285 PolarHBondContact N-O 3.42Å; T283-L285 PolarHBondContact O-N 3.24Å; T283-L285 PolarHBondContact OG1-N 2.84Å
286	S	92.6	Very high	76.8	Confident	21 Å²	21	77.4 Å²	77.4	15%	0.147	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	132.6	179.8	-36.1	0	0	0	0	111.9	R277 L278 R279	R277-S286 PolarHBondContact NH2-O 3.34Å; R277-S286 VanDerWaalsContact NH2-O 3.15Å; L278-S286 CarbonylContact O-C 3.49Å; L278-S286 WeakPolarHBondContact O-CA 3.41Å; L278-S286 WeakPolarHBondContact O-CB 3.28Å; R279-S286 WeakPolarHBondContact CB-OG 3.24Å; R279-S286 WeakPolarHBondContact CG-OG 3.49Å
287	A	92.1	Very high	74.1	Confident	12 Å²	12	81.1 Å²	81.1	10%	0.099	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	135.1	173.1	0	0	0	0	0	109.2	V182 V241 R277 L278	V182-A287 HydrophobicContact CG2-CB 3.69Å; V241-A287 HydrophobicContact CG1-CB 3.82Å; V241-A287 VanDerWaalsContact CG1-N 3.29Å; R277-A287 VanDerWaalsContact CA-O 3.28Å; R277-A287 WeakPolarHBondContact CA-O 3.35Å; L278-A287 PolarHBondContact N-O 2.89Å; L278-A287 PolarHBondContact O-N 3.12Å
288	T	91.6	Very high	71.3	Confident	92 Å²	92	80.5 Å²	80.5	56%	0.564	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	127.1	174.2	-57.3	0	0	0	0	109.2
289	C	90	Very high	68.3	Low	1 Å²	1	91.1 Å²	91.1	1%	0.007	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-92.1	151.7	172.7	-57.7	0	0	0	0	110	L180 F181 A276 H291	L180-C289 HydrophobicContact CB-CB 4.13Å; L180-C289 HydrophobicContact CD2-CB 3.76Å; L180-C289 HydrophobicContact CG-CB 4.49Å; F181-C289 CarbonylContact O-C 3.58Å; F181-C289 WeakPolarHBondContact O-CA 3.34Å; F181-C289 WeakPolarHBondContact O-CB 3.24Å; A276-C289 WeakPolarHBondContact O-CA 3.32Å; A276-C289 WeakPolarHBondContact O-CB 3.47Å; A276-C289 PolarHBondContact O-N 2.9Å; C289-H291 PolarHBondContact O-N 3.05Å
290	S	72.7	Confident	65.4	Low	64 Å²	64	93.5 Å²	93.5	45%	0.448	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	22.4	-167.7	70.4	0	0	0	0	116.1	F181	F181-S290 WeakPolarHBondContact CB-OG 3.33Å; F181-S290 PolarHBondContact O-N 3.03Å
291	H	58.5	Low	62.6	Low	53 Å²	53	99.4 Å²	99.4	25%	0.245	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	7.5	171.5	-153.8	-11.7	0	0	0	113	N176 S177 P178 A276 C289	N176-H291 PolarHBondContact O-CE1 3.26Å; S177-H291 VanDerWaalsContact C-CD2 3.4Å; S177-H291 PolarHBondContact O-CD2 2.79Å; S177-H291 PolarHBondContact O-CE1 3.43Å; S177-H291 PolarHBondContact O-NE2 2.9Å; P178-H291 WeakPolarHBondContact CA-CD2 3.27Å; P178-H291 WeakPolarHBondContact CA-NE2 3.43Å; A276-H291 HydrophobicContact CB-CB 3.75Å; C289-H291 PolarHBondContact O-N 3.05Å
292	C	41.7	Very low	59.8	Low	61 Å²	61	106 Å²	106	41%	0.412	55%	0.554	S	S	.	*			trans	-141.8	79.3	177.8	-86	0	0	0	0	112	A276	A276-C292 HydrophobicContact CB-CB 4.12Å
293	R	50	Low	57.3	Low	238 Å²	238	106 Å²	106	90%	0.898	56%	0.563	S	S	*	*			trans	-106.3	60.7	140.9	-74.1	-161.8	-173.3	-169.8	3.8	109.3	K295	R293-K295 PolarHBondContact O-N 3.42Å
294	R	42.1	Very low	54.8	Low	222 Å²	222	111.9 Å²	111.9	84%	0.838	59%	0.585	S	S	*	*			trans	-67.9	124.2	139.6	-70.1	-173.3	-173.9	144.3	3	103.9	A296	R294-A296 PolarHBondContact O-N 3.16Å
295	K	36.8	Very low	52.2	Low	210 Å²	210	115.6 Å²	115.6	91%	0.913	61%	0.608	S	S	*	*			trans	-58.1	87.1	158.4	-75.9	-179.5	178.9	178.1	0	105.1	R293 A297	R293-K295 PolarHBondContact O-N 3.42Å; K295-A297 PolarHBondContact O-N 2.8Å
296	A	36.8	Very low	49.6	Very low	89 Å²	89	117.6 Å²	117.6	74%	0.736	62%	0.615	S	S	*	*			trans	-67.6	88.5	156.5	0	0	0	0	0	103.1	R294 A298	R294-A296 PolarHBondContact O-N 3.16Å; A296-A298 VanDerWaalsContact C-N 3.32Å; A296-A298 PolarHBondContact O-N 3.22Å
297	A	33.3	Very low	47	Very low	80 Å²	80	123.2 Å²	123.2	66%	0.661	64%	0.638	S	S	*	*			trans	-48.1	114.6	151.4	0	0	0	0	0	103.8	K295 R299	K295-A297 PolarHBondContact O-N 2.8Å; A297-R299 PolarHBondContact O-N 2.9Å
298	A	34.5	Very low	44.6	Very low	91 Å²	91	130.4 Å²	130.4	75%	0.752	68%	0.675	S	S	*	*			trans	-59.1	93.1	173.7	0	0	0	0	0	106.1	A296 L300	A296-A298 VanDerWaalsContact C-N 3.32Å; A296-A298 PolarHBondContact O-N 3.22Å; A298-L300 PolarHBondContact O-N 2.81Å
299	R	32.7	Very low	42.4	Very low	226 Å²	226	128.4 Å²	128.4	85%	0.853	67%	0.665	S	S	*	*			trans	-73.6	95	163.5	-80.1	-172.3	168	-175.6	-3.5	103.9	A297 V301	A297-R299 PolarHBondContact O-N 2.9Å; R299-V301 VanDerWaalsContact C-N 3.35Å; R299-V301 PolarHBondContact O-N 3.13Å
300	L	32.4	Very low	40.7	Very low	148 Å²	148	136.7 Å²	136.7	78%	0.775	71%	0.709	S	S	*	*			trans	-53	107.5	159.2	-100.1	118.5	0	0	0	106.4	A298 H302	A298-L300 PolarHBondContact O-N 2.81Å; L300-H302 PolarHBondContact O-N 3.14Å
301	V	34.1	Very low	39.8	Very low	124 Å²	124	140.1 Å²	140.1	75%	0.752	72%	0.722	S	S	*	*			trans	-82.9	102.9	166.2	-176.6	0	0	0	0	105.2	R299 A303	R299-V301 VanDerWaalsContact C-N 3.35Å; R299-V301 PolarHBondContact O-N 3.13Å; V301-A303 VanDerWaalsContact C-N 3.34Å; V301-A303 PolarHBondContact O-N 3.44Å
302	H	30.4	Very low	39.1	Very low	174 Å²	174	143 Å²	143	81%	0.806	75%	0.745	S	S	*	*			trans	-66.7	99.2	161	-96.8	-91.7	0	0	0	107.1	L300 K304	L300-H302 PolarHBondContact O-N 3.14Å; H302-K304 PolarHBondContact O-N 3.39Å
303	A	33.6	Very low	39.5	Very low	92 Å²	92	146 Å²	146	76%	0.76	76%	0.756	S	S	*	*			trans	-77.5	104.4	163.9	0	0	0	0	0	107.2	V301 L305	V301-A303 VanDerWaalsContact C-N 3.34Å; V301-A303 PolarHBondContact O-N 3.44Å; A303-L305 PolarHBondContact O-N 2.63Å
304	K	33.9	Very low	39.6	Very low	167 Å²	167	137.3 Å²	137.3	73%	0.726	73%	0.727	S	S	*	*			trans	-79.7	108.8	167.9	-164.8	-177	-177.6	-161	0	106.7	H302 E306	H302-K304 PolarHBondContact O-N 3.39Å; K304-E306 HydrophobicContact CD-CG 4Å; K304-E306 WeakPolarHBondContact CD-OE1 3.41Å; K304-E306 VanDerWaalsContact CE-OE1 3.25Å; K304-E306 WeakPolarHBondContact CE-OE1 3.26Å; K304-E306 HydrophobicContact CG-CG 4.04Å; K304-E306 IonicContact NZ-OE1 3.16Å; K304-E306 PolarHBondContact NZ-OE1 3.09Å; K304-E306 PolarHBondContact O-N 3.15Å
305	L	34.3	Very low	39.8	Very low	169 Å²	169	128.6 Å²	128.6	89%	0.885	71%	0.706	S	S	*	*			trans	-79.3	98	169.5	-165.1	80	0	0	0	106.8	A303	A303-L305 PolarHBondContact O-N 2.63Å
306	E	36.8	Very low	40.8	Very low	135 Å²	135	124.2 Å²	124.2	63%	0.631	70%	0.699	S	S	*	*			trans	-85.1	113.5	169.4	-66.2	-169.2	160.8	0	0	108.1	K304	K304-E306 HydrophobicContact CD-CG 4Å; K304-E306 WeakPolarHBondContact CD-OE1 3.41Å; K304-E306 VanDerWaalsContact CE-OE1 3.25Å; K304-E306 WeakPolarHBondContact CE-OE1 3.26Å; K304-E306 HydrophobicContact CG-CG 4.04Å; K304-E306 IonicContact NZ-OE1 3.16Å; K304-E306 PolarHBondContact NZ-OE1 3.09Å; K304-E306 PolarHBondContact O-N 3.15Å
307	H	38.8	Very low	41.8	Very low	139 Å²	139	124.7 Å²	124.7	64%	0.644	70%	0.697	S	S	*	*			trans	-95.6	110.4	170.7	-163.6	61.1	0	0	0	108	S309	H307-S309 PolarHBondContact CD2-OG 2.88Å; H307-S309 PolarHBondContact O-N 3.48Å; H307-S309 VanDerWaalsContact O-N 3.09Å
308	N	41.4	Very low	42.7	Very low	164 Å²	164	126.7 Å²	126.7	88%	0.877	69%	0.691	S	S	*	*			trans	-75	86.1	171.5	-86.5	-20.4	0	0	0	109.1
309	S	46.7	Very low	43.4	Very low	49 Å²	49	128.5 Å²	128.5	34%	0.343	68%	0.684	S	S	.	*			trans	-148.7	124.4	164.5	65.5	0	0	0	0	109.7	H307 L311	H307-S309 PolarHBondContact CD2-OG 2.88Å; H307-S309 PolarHBondContact O-N 3.48Å; H307-S309 VanDerWaalsContact O-N 3.09Å; S309-L311 PolarHBondContact O-N 3.36Å
310	D	53.2	Low	44.6	Very low	176 Å²	176	125.4 Å²	125.4	94%	0.941	68%	0.679	S	S	*	*	S	Bend	trans	-71.3	31.5	-175.9	-67	-47.7	0	0	0	114.7
311	L	53.3	Low	45.6	Very low	135 Å²	135	123.1 Å²	123.1	71%	0.707	67%	0.671	S	S	*	*	S	Bend	trans	-123.3	126.4	177.6	-74.9	163.2	0	0	0	109.7	S309 I313	S309-L311 PolarHBondContact O-N 3.36Å; L311-I313 PolarHBondContact O-N 2.78Å
312	P	44.6	Very low	46.1	Very low	113 Å²	113	126.2 Å²	126.2	73%	0.734	67%	0.669	S	S	*	*			trans	-68.3	107.5	178.9	13.3	-10	0	0	0	110.1	D314	P312-D314 PolarHBondContact O-N 2.84Å
313	I	50.5	Low	47.2	Very low	125 Å²	125	124.4 Å²	124.4	64%	0.641	67%	0.665	S	S	*	*			trans	-70.3	-19.4	179.1	-66.9	168.4	0	0	0	111.8	L311	L311-I313 PolarHBondContact O-N 2.78Å
314	D	50.6	Low	47.7	Very low	55 Å²	55	123.8 Å²	123.8	29%	0.294	65%	0.653	S	S	.	*	S	Bend	trans	-105.1	123.8	-179.5	-55.8	-61.3	0	0	0	110.6	P312 F318 R322	P312-D314 PolarHBondContact O-N 2.84Å; D314-F318 HydrophobicContact CB-CB 3.96Å; D314-R322 IonicContact OD2-CZ 2.68Å; D314-R322 IonicContact OD2-NH1 2.66Å; D314-R322 PolarHBondContact OD2-NH1 2.74Å; D314-R322 IonicContact OD2-NH2 2.69Å; D314-R322 PolarHBondContact OD2-NH2 3.49Å
315	G	48.1	Very low	48	Very low	39 Å²	39	121.4 Å²	121.4	40%	0.402	65%	0.654	S	S	.	*			trans	-54.3	164	173.9	0	0	0	0	0	112.7	S317 F318	G315-S317 PolarHBondContact O-N 2.98Å; G315-F318 PolarHBondContact O-N 3.02Å; G315-F318 VanDerWaalsContact O-N 3.11Å
316	P	57.2	Low	48.5	Very low	118 Å²	118	120.3 Å²	120.3	77%	0.766	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-54.4	-16.3	-172.2	19.9	-32.2	0	0	0	114.7	F318	P316-F318 VanDerWaalsContact C-N 3.33Å; P316-F318 PolarHBondContact O-N 2.87Å
317	S	58.3	Low	48.5	Very low	99 Å²	99	120.9 Å²	120.9	69%	0.692	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-67.5	-19.6	178.2	-37.2	0	0	0	0	115.5	G315	G315-S317 PolarHBondContact O-N 2.98Å
318	F	50.5	Low	48.5	Very low	122 Å²	122	120.1 Å²	120.1	54%	0.535	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-109.6	-1.1	-170.1	-71.5	-80.9	0	0	0	115.2	D314 G315 P316 H320 V321	D314-F318 HydrophobicContact CB-CB 3.96Å; G315-F318 PolarHBondContact O-N 3.02Å; G315-F318 VanDerWaalsContact O-N 3.11Å; P316-F318 VanDerWaalsContact C-N 3.33Å; P316-F318 PolarHBondContact O-N 2.87Å; F318-H320 PolarHBondContact O-N 3.07Å; F318-V321 PolarHBondContact O-N 3.13Å
319	Q	51.2	Low	48.2	Very low	129 Å²	129	118.7 Å²	118.7	60%	0.603	65%	0.652	S	S	*	*	H	α-helix	trans	-64.3	-28.7	180	-65.9	-175	-5	0	0	113	N323	Q319-N323 PolarHBondContact O-ND2 2.84Å
320	H	56.8	Low	47.7	Very low	161 Å²	161	125.1 Å²	125.1	75%	0.745	67%	0.671	S	S	*	*	H	α-helix	trans	-75.1	-21.8	178.4	-110.1	80.9	0	0	0	114	F318	F318-H320 PolarHBondContact O-N 3.07Å
321	V	52.8	Low	46.9	Very low	101 Å²	101	122.4 Å²	122.4	61%	0.612	66%	0.663	S	S	*	*	H	α-helix	trans	-86	-24.2	-174.5	-176.4	0	0	0	0	111.9	F318 T324	F318-V321 PolarHBondContact O-N 3.13Å; V321-T324 PolarHBondContact O-OG1 3.07Å
322	R	45.6	Very low	45.9	Very low	188 Å²	188	121.9 Å²	121.9	71%	0.709	67%	0.665	S	S	*	*	H	α-helix	trans	-80.9	-21	174.5	-76.5	-168.6	173.5	126.2	7.8	113.8	D314	D314-R322 IonicContact OD2-CZ 2.68Å; D314-R322 IonicContact OD2-NH1 2.66Å; D314-R322 PolarHBondContact OD2-NH1 2.74Å; D314-R322 IonicContact OD2-NH2 2.69Å; D314-R322 PolarHBondContact OD2-NH2 3.49Å
323	N	53.2	Low	45.4	Very low	136 Å²	136	123.6 Å²	123.6	73%	0.727	67%	0.666	S	S	*	*	S	Bend	trans	-102.3	5.6	-173.6	-66.6	-14.7	0	0	0	113.5	Q319 P325	Q319-N323 PolarHBondContact O-ND2 2.84Å; N323-P325 WeakPolarHBondContact O-CD 3.46Å
324	T	44.1	Very low	44.6	Very low	80 Å²	80	125.2 Å²	125.2	49%	0.491	68%	0.675	S	S	.	*	S	Bend	trans	-89	117.2	175	35	0	0	0	0	111.2	V321 I326	V321-T324 PolarHBondContact O-OG1 3.07Å; T324-I326 PolarHBondContact O-N 3.37Å
325	P	40.8	Very low	44.2	Very low	117 Å²	117	129.9 Å²	129.9	76%	0.76	70%	0.699	S	S	*	*			trans	-68.3	115.9	174.2	26	-31.3	0	0	0	110.1	N323 N327	N323-P325 WeakPolarHBondContact O-CD 3.46Å; P325-N327 PolarHBondContact O-N 3.42Å
326	I	44.8	Very low	44.1	Very low	145 Å²	145	136.7 Å²	136.7	74%	0.744	74%	0.74	S	S	*	*			trans	-81.7	97	174.1	-55.7	176.3	0	0	0	108.1	T324 L328	T324-I326 PolarHBondContact O-N 3.37Å; I326-L328 HydrophobicContact CG2-CD2 4.22Å; I326-L328 HydrophobicContact CG2-CG 4.1Å; I326-L328 PolarHBondContact O-N 3.06Å
327	N	36.7	Very low	43.4	Very low	148 Å²	148	137.7 Å²	137.7	79%	0.791	74%	0.739	S	S	*	*			trans	-69.4	106.8	165.4	-91.2	-51.6	0	0	0	109.2	P325 T329	P325-N327 PolarHBondContact O-N 3.42Å; N327-T329 PolarHBondContact O-N 2.7Å
328	L	37	Very low	42.6	Very low	122 Å²	122	139.7 Å²	139.7	64%	0.639	74%	0.742	S	S	*	*			trans	-89.5	89.4	170.5	-72.9	169.5	0	0	0	109.6	I326 Y330	I326-L328 HydrophobicContact CG2-CD2 4.22Å; I326-L328 HydrophobicContact CG2-CG 4.1Å; I326-L328 PolarHBondContact O-N 3.06Å; L328-Y330 HydrophobicContact CB-CE2 4Å; L328-Y330 PolarHBondContact O-N 3.06Å
329	T	35.5	Very low	42.2	Very low	134 Å²	134	140.7 Å²	140.7	82%	0.822	75%	0.753	S	S	*	*			trans	-80	106.4	166.2	-9	0	0	0	0	108.6	N327	N327-T329 PolarHBondContact O-N 2.7Å
330	Y	36.5	Very low	41.7	Very low	185 Å²	185	141.4 Å²	141.4	73%	0.725	76%	0.762	S	S	*	*			trans	-85.2	131	168.7	-67.8	-86.6	0	0	0	109.5	L328 T332	L328-Y330 HydrophobicContact CB-CE2 4Å; L328-Y330 PolarHBondContact O-N 3.06Å; Y330-T332 PolarHBondContact O-N 3.25Å
331	P	37	Very low	40.7	Very low	119 Å²	119	140.1 Å²	140.1	77%	0.773	76%	0.763	S	S	*	*			trans	-79.9	114.9	170.1	29.5	-28.2	0	0	0	110	I333	P331-I333 PolarHBondContact O-N 3.31Å
332	T	32.8	Very low	39.9	Very low	123 Å²	123	142.7 Å²	142.7	76%	0.755	77%	0.773	S	S	*	*			trans	-64.5	118.3	165	-55.7	0	0	0	0	109.4	Y330 L334	Y330-T332 PolarHBondContact O-N 3.25Å; T332-L334 HydrophobicContact CG2-CG 4.47Å
333	I	33.9	Very low	39.5	Very low	150 Å²	150	139.5 Å²	139.5	77%	0.769	78%	0.778	S	S	*	*			trans	-91.7	104.4	164.3	-62.7	175.8	0	0	0	107	P331 I335	P331-I333 PolarHBondContact O-N 3.31Å; I333-I335 HydrophobicContact CG2-CG1 4.43Å
334	L	33.1	Very low	38.4	Very low	158 Å²	158	139.8 Å²	139.8	83%	0.827	78%	0.781	S	S	*	*			trans	-77.7	123.4	162.1	-93.3	154.6	0	0	0	108.1	T332	T332-L334 HydrophobicContact CG2-CG 4.47Å
335	I	43.1	Very low	38	Very low	154 Å²	154	144.8 Å²	144.8	79%	0.79	81%	0.806	S	S	*	*			trans	-92.1	125.1	164.1	-58.5	174.1	0	0	0	105.5	I333	I333-I335 HydrophobicContact CG2-CG1 4.43Å
336	S	44.4	Very low	37.7	Very low	182 Å²	182	147.3 Å²	147.3	100%	1.273	81%	0.81	S	S	*	*			trans	-64.1	0	172.8	-177	0	0	0	0	112.6

Retrieved 336 of 336 residues in 124.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).