A0A077Z0N8_TRITR Loading...

Protection of telomeres protein 1 ssDNA-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z0N8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 457 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	33.8	Very low	48.2	Very low	227 Å²	227	80.7 Å²	80.7	100%	1.118	47%	0.469	S	S	*	.				0	136.5	0	-78.1	173.8	162.2	0	0	107.5	P3	M1-P3 WeakPolarHBondContact O-CD 3.41Å
2	S	38.8	Very low	49.2	Very low	109 Å²	109	81.1 Å²	81.1	76%	0.762	46%	0.46	S	S	*	.			trans	-72.8	108.6	168.8	177.1	0	0	0	0	107	A4	S2-A4 VanDerWaalsContact C-N 3.32Å; S2-A4 PolarHBondContact O-N 3.43Å
3	P	42.4	Very low	49.7	Very low	43 Å²	43	79.3 Å²	79.3	28%	0.279	45%	0.449	S	S	.	.			trans	-86.7	1.5	-165.3	29.2	-25.5	0	0	0	115	M1 F140	M1-P3 WeakPolarHBondContact O-CD 3.41Å; P3-F140 HydrophobicContact CB-CD2 3.07Å; P3-F140 HydrophobicContact CB-CE2 3.08Å; P3-F140 HydrophobicContact CB-CG 3.92Å; P3-F140 HydrophobicContact CB-CZ 3.96Å; P3-F140 HydrophobicContact CG-CD2 4.17Å; P3-F140 HydrophobicContact CG-CE2 3.67Å; P3-F140 HydrophobicContact CG-CZ 4.27Å
4	A	46.8	Very low	50.4	Low	14 Å²	14	73.6 Å²	73.6	12%	0.116	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.7	-176.5	0	0	0	0	0	111.7	S2 I7 W134 I135	S2-A4 VanDerWaalsContact C-N 3.32Å; S2-A4 PolarHBondContact O-N 3.43Å; A4-I7 HydrophobicContact CB-CG1 4.44Å; A4-W134 HydrophobicContact CB-CB 4.17Å; A4-W134 HydrophobicContact CB-CD2 4.49Å; A4-W134 HydrophobicContact CB-CE3 3.57Å; A4-W134 HydrophobicContact CB-CZ3 4.35Å; A4-I135 WeakPolarHBondContact CA-O 2.7Å; A4-I135 VanDerWaalsContact CB-O 3.31Å; A4-I135 WeakPolarHBondContact CB-O 3.5Å
5	D	50.1	Low	50.8	Low	132 Å²	132	70.9 Å²	70.9	71%	0.706	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	-29.8	169.9	-74.3	-25.3	0	0	0	111.1
6	K	57.1	Low	51.1	Low	99 Å²	99	66.5 Å²	66.5	43%	0.43	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	132.9	-174.6	-65.9	179.5	179.9	-178.3	0	110.9	Q95 I135	K6-Q95 HydrophobicContact CD-CB 4.29Å; K6-I135 HydrophobicContact CB-CD1 3.91Å; K6-I135 HydrophobicContact CD-CD1 4.3Å; K6-I135 PolarHBondContact O-N 3.22Å
7	I	53.8	Low	51.3	Low	80 Å²	80	63 Å²	63	41%	0.41	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.9	174.3	-56.8	175	0	0	0	107.1	A4 K132 W134	A4-I7 HydrophobicContact CB-CG1 4.44Å; I7-K132 HydrophobicContact CG2-CB 4.31Å; I7-K132 HydrophobicContact CG2-CD 4Å; I7-K132 HydrophobicContact CG2-CG 4.09Å; I7-W134 HydrophobicContact CD1-CE3 3.92Å; I7-W134 HydrophobicContact CD1-CH2 3.82Å; I7-W134 HydrophobicContact CD1-CZ3 3.32Å; I7-W134 HydrophobicContact CG1-CD2 4.49Å; I7-W134 HydrophobicContact CG1-CE3 3.66Å; I7-W134 HydrophobicContact CG1-CH2 4.42Å; I7-W134 HydrophobicContact CG1-CZ3 3.64Å
8	C	58	Low	51.2	Low	4 Å²	4	59.6 Å²	59.6	3%	0.027	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105.6	169.1	-64.4	0	0	0	0	106.8	T92 I133	C8-T92 HydrophobicContact CB-CG2 3.23Å; C8-T92 WeakPolarHBondContact SG-CG2 3.42Å; C8-I133 HydrophobicContact CB-CB 4.03Å; C8-I133 PolarHBondContact N-O 3.02Å; C8-I133 PolarHBondContact O-N 3.14Å
9	A	51.6	Low	50.7	Low	63 Å²	63	59.4 Å²	59.4	52%	0.521	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132.7	177.1	0	0	0	0	0	109.6
10	G	52.1	Low	50.3	Low	18 Å²	18	62.1 Å²	62.1	19%	0.186	35%	0.346	C	S	.	.			trans	-154.4	143.3	178.6	0	0	0	0	0	111.1	K12	G10-K12 PolarHBondContact O-N 3.06Å
11	V	46.1	Very low	49.8	Very low	99 Å²	99	67.4 Å²	67.4	60%	0.6	37%	0.368	S	S	*	.	S	Bend	trans	-89.9	38.6	176.4	-161.2	0	0	0	0	110.3	A126	V11-A126 CarbonylContact C-O 3.32Å
12	K	59.5	Low	50.4	Low	85 Å²	85	66.4 Å²	66.4	37%	0.37	36%	0.361	S	S	.	.			trans	-139.3	142.2	-161.1	-54.8	-175.9	179.2	174.6	0	115.3	G10 N87 A126	G10-K12 PolarHBondContact O-N 3.06Å; K12-N87 HydrophobicContact CB-CB 4.4Å; K12-N87 HydrophobicContact CD-CB 3.74Å; K12-N87 WeakPolarHBondContact CD-O 3.11Å; K12-N87 VanDerWaalsContact CE-O 3.28Å; K12-N87 WeakPolarHBondContact CE-O 3.4Å; K12-N87 HydrophobicContact CG-CB 4.46Å; K12-N87 PolarHBondContact NZ-O 3.45Å; K12-A126 VanDerWaalsContact O-CB 3.23Å; K12-A126 WeakPolarHBondContact O-CB 3.43Å
13	D	55.9	Low	50.1	Low	58 Å²	58	63.5 Å²	63.5	31%	0.31	35%	0.348	S	S	.	.			trans	-69.7	143.9	-170.8	-62	-5.8	0	0	0	113	A86 L124 R125 A126	D13-A86 VanDerWaalsContact O-O 3.12Å; D13-L124 CarbonylContact C-O 3.5Å; D13-L124 VanDerWaalsContact CA-O 3.31Å; D13-L124 WeakPolarHBondContact CA-O 3.34Å; D13-R125 WeakPolarHBondContact OD1-CA 3.27Å; D13-R125 WeakPolarHBondContact OD1-CB 3.32Å; D13-A126 PolarHBondContact OD1-N 3.1Å; D13-A126 VanDerWaalsContact OD1-N 3.16Å
14	I	60	Low	49.5	Very low	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.9	172.9	-60.1	171.8	0	0	0	107.9	I16 V83 F88 L104 F107 L124 I133	I14-I16 HydrophobicContact CG2-CG1 4.22Å; I14-V83 HydrophobicContact CG2-CG1 3.35Å; I14-F88 HydrophobicContact CD1-CE2 4.17Å; I14-F88 HydrophobicContact CD1-CZ 4.04Å; I14-F88 HydrophobicContact CG1-CE2 3.61Å; I14-F88 HydrophobicContact CG1-CZ 3.99Å; I14-L104 HydrophobicContact CD1-CD1 3.88Å; I14-L104 HydrophobicContact CD1-CD2 3.94Å; I14-L104 HydrophobicContact CD1-CG 4.48Å; I14-L104 HydrophobicContact CG2-CD1 4.41Å; I14-F107 HydrophobicContact CD1-CD1 4.19Å; I14-F107 HydrophobicContact CD1-CE1 3.42Å; I14-F107 VanDerWaalsContact CD1-CE1 3.42Å; I14-F107 HydrophobicContact CD1-CE2 4.09Å; I14-F107 HydrophobicContact CD1-CZ 3.37Å; I14-F107 HydrophobicContact CG1-CE1 3.85Å; I14-F107 HydrophobicContact CG1-CZ 4.28Å; I14-L124 HydrophobicContact CB-CB 4.13Å; I14-L124 PolarHBondContact N-O 2.94Å; I14-L124 PolarHBondContact O-N 3.06Å; I14-I133 HydrophobicContact CD1-CD1 3.83Å; I14-I133 HydrophobicContact CD1-CG1 4.27Å
15	V	55.7	Low	48.9	Very low	33 Å²	33	68.1 Å²	68.1	20%	0.2	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.3	174.9	-177.2	0	0	0	0	109.4	V83 E84 H121 T123	V15-V83 WeakPolarHBondContact O-CA 3.38Å; V15-E84 HydrophobicContact CB-CB 4.21Å; V15-E84 PolarHBondContact N-O 2.96Å; V15-E84 PolarHBondContact O-N 2.9Å; V15-H121 HydrophobicContact CG1-CB 4.38Å; V15-T123 HydrophobicContact CG2-CG2 4.47Å
16	I	56.6	Low	48.2	Very low	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.3	176.5	-51.5	-170.5	0	0	0	109.1	I14 C41 M81 L82 V83 L104 L122 L124	I14-I16 HydrophobicContact CG2-CG1 4.22Å; I16-C41 HydrophobicContact CD1-CB 4.36Å; I16-M81 HydrophobicContact CG2-CB 3.66Å; I16-M81 HydrophobicContact CG2-CG 4.08Å; I16-M81 HydrophobicContact CG2-SD 3.36Å; I16-M81 WeakPolarHBondContact CG2-SD 2.98Å; I16-L82 CarbonylContact C-O 3.55Å; I16-L82 VanDerWaalsContact CA-O 3.26Å; I16-L82 WeakPolarHBondContact CA-O 3.27Å; I16-V83 HydrophobicContact CB-CG2 4.49Å; I16-V83 HydrophobicContact CD1-CG2 4.43Å; I16-V83 HydrophobicContact CG1-CG2 4.02Å; I16-V83 HydrophobicContact CG2-CG2 4.22Å; I16-L104 HydrophobicContact CD1-CD1 4.49Å; I16-L122 WeakPolarHBondContact CA-O 3.33Å; I16-L122 HydrophobicContact CB-CB 4.24Å; I16-L122 WeakPolarHBondContact CB-O 3.28Å; I16-L122 HydrophobicContact CD1-CD2 4.17Å; I16-L122 PolarHBondContact N-O 3.16Å; I16-L122 PolarHBondContact O-N 3.42Å; I16-L124 HydrophobicContact CD1-CD1 3.57Å; I16-L124 HydrophobicContact CD1-CG 4Å; I16-L124 HydrophobicContact CG1-CD1 4.32Å; I16-L124 HydrophobicContact CG1-CG 4.33Å
17	A	53.7	Low	47.2	Very low	7 Å²	7	62.2 Å²	62.2	6%	0.058	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	154.1	179.2	0	0	0	0	0	111.4	M81 L82 H121	A17-M81 CarbonylContact O-C 3.51Å; A17-M81 VanDerWaalsContact O-C 3.28Å; A17-M81 WeakPolarHBondContact O-CA 3.31Å; A17-M81 WeakPolarHBondContact O-CB 3.31Å; A17-L82 HydrophobicContact CB-CB 4.19Å; A17-L82 PolarHBondContact N-O 2.76Å; A17-L82 PolarHBondContact O-N 2.76Å; A17-H121 WeakPolarHBondContact CB-ND1 3.25Å
18	S	49.5	Very low	46.5	Very low	1 Å²	1	64.3 Å²	64.3	1%	0.007	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	132.5	175.6	-177	0	0	0	0	112.2	R79	S18-R79 WeakPolarHBondContact OG-CD 3.15Å
19	L	42	Very low	45.6	Very low	57 Å²	57	65.2 Å²	65.2	30%	0.298	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.1	169.8	-98.7	157	0	0	0	110.6	P62 R80 L82	L19-P62 HydrophobicContact CD1-CB 3.97Å; L19-R80 HydrophobicContact CB-CB 3.68Å; L19-R80 HydrophobicContact CD1-CB 4.22Å; L19-R80 PolarHBondContact N-O 3.18Å; L19-L82 HydrophobicContact CD1-CD1 4.24Å; L19-L82 HydrophobicContact CD1-CD2 3.44Å; L19-L82 VanDerWaalsContact CD1-CD2 3.44Å; L19-L82 HydrophobicContact CD1-CG 3.49Å; L19-L82 VanDerWaalsContact CD1-CG 3.49Å; L19-L82 HydrophobicContact CD2-CD1 4.15Å; L19-L82 HydrophobicContact CD2-CD2 4.36Å; L19-L82 HydrophobicContact CD2-CG 4.3Å; L19-L82 HydrophobicContact CG-CD1 3.74Å; L19-L82 HydrophobicContact CG-CD2 3.89Å; L19-L82 HydrophobicContact CG-CG 3.51Å
20	E	41.7	Very low	44.8	Very low	112 Å²	112	69.8 Å²	69.8	52%	0.523	37%	0.365	S	S	.	.			trans	-132.5	151.2	152.9	-73.1	-162.1	173.6	0	0	112	Q22 G23	E20-Q22 PolarHBondContact O-N 3.28Å; E20-G23 PolarHBondContact O-N 3.38Å
21	H	41.6	Very low	44.1	Very low	175 Å²	175	72 Å²	72	81%	0.81	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	110.2	-175.7	-75.1	-77.1	0	0	0	111
22	Q	45.1	Very low	43.4	Very low	206 Å²	206	71.9 Å²	71.9	96%	0.963	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	23.7	173	-53.6	-172.1	-21.3	0	0	118.3	E20	E20-Q22 PolarHBondContact O-N 3.28Å
23	G	32.1	Very low	42.4	Very low	47 Å²	47	73.4 Å²	73.4	49%	0.485	39%	0.392	S	S	.	.	S	Bend	trans	164.9	134.9	171.2	0	0	0	0	0	111.6	E20	E20-G23 PolarHBondContact O-N 3.38Å
24	Y	30.7	Very low	41.3	Very low	128 Å²	128	75.8 Å²	75.8	50%	0.502	41%	0.413	S	S	.	.			trans	-66.8	128.4	-178.4	-66.9	-70.3	0	0	0	111.6	L82 S119	Y24-L82 HydrophobicContact CE1-CD1 4.28Å; Y24-S119 WeakPolarHBondContact CB-OG 3.42Å
25	A	34.6	Very low	40.2	Very low	27 Å²	27	78.7 Å²	78.7	22%	0.223	43%	0.433	C	S	.	.			trans	-108.6	155.5	-178.7	0	0	0	0	0	112.8	L27 S119	A25-L27 PolarHBondContact O-N 3.41Å; A25-S119 WeakPolarHBondContact O-CB 3.46Å
26	H	34.2	Very low	39.1	Very low	102 Å²	102	83 Å²	83	47%	0.472	46%	0.463	S	S	.	.			trans	-65.7	124.6	-177.4	-142.5	-77.9	0	0	0	111.9	D28 R79 Y111	H26-D28 PolarHBondContact O-N 3.4Å; H26-R79 PolarHBondContact O-NH1 2.87Å; H26-Y111 PolarHBondContact CE1-OH 2.94Å; H26-Y111 VanDerWaalsContact CE1-OH 3.32Å
27	L	36.9	Very low	38.2	Very low	5 Å²	5	84.7 Å²	84.7	3%	0.026	47%	0.473	C	S	.	.			trans	-62.7	125.2	161.5	-93.1	100.1	0	0	0	108.1	A25 L29 T77 A120 L122	A25-L27 PolarHBondContact O-N 3.41Å; L27-L29 HydrophobicContact CB-CD1 4.43Å; L27-L29 HydrophobicContact CB-CG 4.14Å; L27-L29 HydrophobicContact CD2-CD1 4.29Å; L27-L29 HydrophobicContact CD2-CD2 4.13Å; L27-L29 HydrophobicContact CD2-CG 4.36Å; L27-T77 HydrophobicContact CD2-CG2 3.9Å; L27-A120 HydrophobicContact CB-CB 4.13Å; L27-A120 WeakPolarHBondContact CD1-O 3.45Å; L27-L122 HydrophobicContact CD2-CB 4.48Å
28	D	38.6	Very low	37.4	Very low	123 Å²	123	88.9 Å²	88.9	66%	0.658	49%	0.494	S	S	*	.			trans	-93.2	100.1	176	-159.3	6.8	0	0	0	107.6	H26	H26-D28 PolarHBondContact O-N 3.4Å
29	L	39.4	Very low	37.1	Very low	23 Å²	23	88.9 Å²	88.9	12%	0.12	49%	0.494	C	S	.	.			trans	-120.5	97	-177.8	-57.9	-179.5	0	0	0	108	L27 F31 F75 Y111 L122	L27-L29 HydrophobicContact CB-CD1 4.43Å; L27-L29 HydrophobicContact CB-CG 4.14Å; L27-L29 HydrophobicContact CD2-CD1 4.29Å; L27-L29 HydrophobicContact CD2-CD2 4.13Å; L27-L29 HydrophobicContact CD2-CG 4.36Å; L29-F31 HydrophobicContact CB-CB 4.45Å; L29-F31 PolarHBondContact O-N 3Å; L29-F75 HydrophobicContact CD2-CD2 3.77Å; L29-F75 HydrophobicContact CD2-CE1 4.37Å; L29-F75 HydrophobicContact CD2-CE2 3.1Å; L29-F75 HydrophobicContact CD2-CZ 3.43Å; L29-F75 VanDerWaalsContact CD2-CZ 3.43Å; L29-F75 HydrophobicContact CG-CE2 4.47Å; L29-F75 HydrophobicContact CG-CZ 4.49Å; L29-Y111 HydrophobicContact CD1-CD2 3.51Å; L29-Y111 HydrophobicContact CD1-CE2 3.65Å; L29-Y111 HydrophobicContact CD1-CG 4.29Å; L29-Y111 HydrophobicContact CG-CE2 4.35Å; L29-L122 HydrophobicContact CD1-CD1 3.69Å
30	D	34.8	Very low	37.3	Very low	159 Å²	159	89.6 Å²	89.6	85%	0.85	49%	0.493	S	S	*	.			trans	-72.2	75.8	163.2	-79.9	-28.5	0	0	0	108.1
31	F	37.8	Very low	37.7	Very low	66 Å²	66	84.3 Å²	84.3	29%	0.289	47%	0.468	S	S	.	.			trans	-128.9	127.5	-178.1	-163.9	-99	0	0	0	112.5	L29 S33 V69 F75	L29-F31 HydrophobicContact CB-CB 4.45Å; L29-F31 PolarHBondContact O-N 3Å; F31-S33 PolarHBondContact O-N 3.44Å; F31-V69 HydrophobicContact CD2-CB 4.18Å; F31-V69 HydrophobicContact CD2-CG1 4.09Å; F31-V69 HydrophobicContact CD2-CG2 4.34Å; F31-V69 HydrophobicContact CE1-CG1 3.94Å; F31-V69 HydrophobicContact CE2-CB 3.64Å; F31-V69 HydrophobicContact CE2-CG1 3.31Å; F31-V69 HydrophobicContact CE2-CG2 4.26Å; F31-V69 HydrophobicContact CZ-CB 4.1Å; F31-V69 HydrophobicContact CZ-CG1 3.23Å; F31-F75 HydrophobicContact CB-CE1 4.45Å; F31-F75 AromaticContact CD2-CE1 3.93Å; F31-F75 HydrophobicContact CD2-CE1 3.93Å; F31-F75 HydrophobicContact CG-CE1 4.49Å
32	P	32.1	Very low	37.9	Very low	96 Å²	96	76.5 Å²	76.5	62%	0.623	43%	0.433	S	S	*	.			trans	-77.8	117.5	168.7	28.5	-28.4	0	0	0	110.4	S34	P32-S34 PolarHBondContact O-N 2.75Å
33	S	37.2	Very low	38.1	Very low	116 Å²	116	66.8 Å²	66.8	81%	0.811	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	30	-169.4	67	0	0	0	0	117	F31	F31-S33 PolarHBondContact O-N 3.44Å
34	S	33.6	Very low	38.8	Very low	109 Å²	109	67.4 Å²	67.4	76%	0.762	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	12.4	-170.9	59.7	0	0	0	0	117	P32	P32-S34 PolarHBondContact O-N 2.75Å
35	S	36.7	Very low	39.6	Very low	60 Å²	60	61.3 Å²	61.3	42%	0.42	36%	0.358	S	S	.	.			trans	-109.3	122.1	173.6	-177.1	0	0	0	0	111.7	T37	S35-T37 PolarHBondContact O-N 3.16Å; S35-T37 PolarHBondContact O-OG1 3.03Å; S35-T37 WeakPolarHBondContact OG-CG2 3.48Å; S35-T37 PolarHBondContact OG-OG1 2.82Å; S35-T37 VanDerWaalsContact OG-OG1 3.07Å
36	P	33.2	Very low	40.1	Very low	125 Å²	125	63.5 Å²	63.5	81%	0.812	36%	0.361	S	S	*	.			trans	-76.2	70.7	165.7	33.1	-31.6	0	0	0	108.3
37	T	35.7	Very low	40.8	Very low	35 Å²	35	59.7 Å²	59.7	22%	0.215	35%	0.345	C	S	.	.			trans	-97.7	138.9	174.5	23.4	0	0	0	0	109.4	S35 L39 V69 D70	S35-T37 PolarHBondContact O-N 3.16Å; S35-T37 PolarHBondContact O-OG1 3.03Å; S35-T37 WeakPolarHBondContact OG-CG2 3.48Å; S35-T37 PolarHBondContact OG-OG1 2.82Å; S35-T37 VanDerWaalsContact OG-OG1 3.07Å; T37-L39 PolarHBondContact O-N 2.82Å; T37-V69 CarbonylContact C-O 3.56Å; T37-V69 WeakPolarHBondContact CB-O 3.23Å; T37-V69 PolarHBondContact OG1-O 3.42Å; T37-D70 HydrophobicContact CG2-CB 4.05Å
38	L	37.4	Very low	41.3	Very low	95 Å²	95	63.1 Å²	63.1	50%	0.497	36%	0.363	S	S	.	.			trans	-49.6	108.5	178.4	-101.2	143.1	0	0	0	110.1	Y40 V69	L38-Y40 HydrophobicContact CB-CE2 4.08Å; L38-Y40 HydrophobicContact CD2-CE1 4.1Å; L38-Y40 HydrophobicContact CD2-CE2 4.42Å; L38-V69 CarbonylContact O-C 3.58Å
39	L	43.3	Very low	41.6	Very low	1 Å²	1	61.2 Å²	61.2	1%	0.005	36%	0.359	C	S	.	.			trans	-77.7	122.4	166.4	-166.4	98.5	0	0	0	109.5	T37 C41 V67 E68 V69 V109 L122 L124	T37-L39 PolarHBondContact O-N 2.82Å; L39-C41 HydrophobicContact CD2-CB 4.28Å; L39-V67 HydrophobicContact CD1-CG1 3.27Å; L39-V67 HydrophobicContact CD2-CG1 4.13Å; L39-V67 HydrophobicContact CG-CG1 3.97Å; L39-E68 CarbonylContact C-O 3.59Å; L39-E68 WeakPolarHBondContact CA-O 3.33Å; L39-V69 HydrophobicContact CD1-CB 3.76Å; L39-V69 HydrophobicContact CD1-CG1 3.93Å; L39-V69 HydrophobicContact CD1-CG2 3.3Å; L39-V109 HydrophobicContact CB-CG2 3.56Å; L39-V109 HydrophobicContact CD1-CG2 3.65Å; L39-V109 HydrophobicContact CD2-CG2 4.07Å; L39-V109 HydrophobicContact CG-CG2 3.94Å; L39-L122 HydrophobicContact CD2-CD2 4.48Å; L39-L124 HydrophobicContact CD2-CD1 3.47Å; L39-L124 VanDerWaalsContact CD2-CD1 3.47Å; L39-L124 HydrophobicContact CD2-CD2 3.32Å; L39-L124 HydrophobicContact CD2-CG 4.02Å
40	Y	45.7	Very low	41.8	Very low	71 Å²	71	61.9 Å²	61.9	28%	0.278	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	107.2	160	-59.9	-73.3	0	0	0	109	L38 E68 L103 L104	L38-Y40 HydrophobicContact CB-CE2 4.08Å; L38-Y40 HydrophobicContact CD2-CE1 4.1Å; L38-Y40 HydrophobicContact CD2-CE2 4.42Å; Y40-E68 PolarHBondContact N-O 3.38Å; Y40-E68 PolarHBondContact O-N 3.03Å; Y40-L103 HydrophobicContact CD1-CD1 3.59Å; Y40-L103 HydrophobicContact CD1-CD2 4.35Å; Y40-L103 HydrophobicContact CD1-CG 4.13Å; Y40-L103 HydrophobicContact CG-CD1 4.13Å; Y40-L104 WeakPolarHBondContact CA-O 3.26Å
41	C	50.4	Low	42.2	Very low	1 Å²	1	57.2 Å²	57.2	1%	0.007	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	114.6	162.1	-173.9	0	0	0	0	107.9	I16 L39 S65 F66 V67 L103 L104 L124	I16-C41 HydrophobicContact CD1-CB 4.36Å; L39-C41 HydrophobicContact CD2-CB 4.28Å; C41-S65 WeakPolarHBondContact SG-CB 3.21Å; C41-F66 CarbonylContact C-O 3.28Å; C41-F66 VanDerWaalsContact CA-O 3.24Å; C41-F66 WeakPolarHBondContact CA-O 3.44Å; C41-V67 HydrophobicContact CB-CG2 4.39Å; C41-L103 WeakPolarHBondContact O-CA 3.24Å; C41-L104 HydrophobicContact CB-CB 3.92Å; C41-L104 HydrophobicContact CB-CD1 3.71Å; C41-L104 HydrophobicContact CB-CG 3.9Å; C41-L104 PolarHBondContact N-O 2.91Å; C41-L104 PolarHBondContact O-N 3.38Å; C41-L124 HydrophobicContact CB-CD1 4.45Å
42	V	47.1	Very low	42.4	Very low	11 Å²	11	61 Å²	61	7%	0.067	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	113.9	175.7	178.4	0	0	0	0	108.4	S65 F66 L101 L102 L103 L141	V42-S65 CarbonylContact O-C 3.6Å; V42-S65 WeakPolarHBondContact O-CA 3.39Å; V42-F66 HydrophobicContact CB-CB 4.46Å; V42-F66 HydrophobicContact CB-CD1 4.16Å; V42-F66 HydrophobicContact CG2-CD1 4.38Å; V42-F66 PolarHBondContact N-O 2.83Å; V42-F66 PolarHBondContact O-N 3.34Å; V42-L101 HydrophobicContact CG1-CD1 3.68Å; V42-L101 HydrophobicContact CG1-CG 4.25Å; V42-L102 VanDerWaalsContact CA-O 3.27Å; V42-L102 WeakPolarHBondContact CA-O 3.28Å; V42-L103 HydrophobicContact CG2-CD1 3.56Å; V42-L141 HydrophobicContact CG1-CD1 3.95Å; V42-L141 HydrophobicContact CG1-CD2 4.01Å; V42-L141 HydrophobicContact CG2-CD2 4.34Å
43	G	49.6	Very low	43.1	Very low	2 Å²	2	66.2 Å²	66.2	2%	0.021	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	153.8	180	0	0	0	0	0	113.9	H64 L101 L102	G43-H64 WeakPolarHBondContact CA-O 3.18Å; G43-L101 WeakPolarHBondContact O-CA 3.49Å; G43-L102 PolarHBondContact N-O 2.9Å; G43-L102 PolarHBondContact O-N 3.4Å
44	V	46.2	Very low	43.9	Very low	61 Å²	61	66.7 Å²	66.7	37%	0.37	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.1	170.8	-178.8	0	0	0	0	108.7	R46 L63 H64 Q100 L101	V44-R46 PolarHBondContact O-N 2.97Å; V44-L63 WeakPolarHBondContact O-CD2 3.23Å; V44-H64 PolarHBondContact N-O 3.25Å; V44-H64 VanDerWaalsContact N-O 3.16Å; V44-Q100 WeakPolarHBondContact CA-O 3.47Å; V44-L101 HydrophobicContact CG2-CD1 3.93Å
45	L	48.1	Very low	44.9	Very low	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	122.3	177	-166.4	77.7	0	0	0	110.2	T47 L55 V61 L63 L96 V97 G99 Q100 L102	L45-T47 HydrophobicContact CD2-CG2 4.36Å; L45-L55 HydrophobicContact CD2-CD1 4.46Å; L45-V61 HydrophobicContact CD1-CB 4.36Å; L45-V61 HydrophobicContact CD1-CG1 3.6Å; L45-V61 HydrophobicContact CG-CG1 4.26Å; L45-L63 HydrophobicContact CB-CD2 4.35Å; L45-L63 HydrophobicContact CD1-CD2 4.19Å; L45-L96 HydrophobicContact CD2-CB 3.75Å; L45-V97 WeakPolarHBondContact CD2-O 3.14Å; L45-G99 PolarHBondContact O-N 2.93Å; L45-Q100 PolarHBondContact N-O 2.82Å; L45-L102 HydrophobicContact CB-CD1 4.5Å; L45-L102 HydrophobicContact CD1-CD1 4.06Å
46	R	45.1	Very low	45.8	Very low	73 Å²	73	62.2 Å²	62.2	28%	0.275	34%	0.344	S	S	.	.			trans	-115.3	125.7	168.6	-64.1	-172.9	68.4	132.8	10	109.3	V44 D48 V61 P62	V44-R46 PolarHBondContact O-N 2.97Å; R46-D48 IonicContact CZ-OD2 2.69Å; R46-D48 VanDerWaalsContact CZ-OD2 3.23Å; R46-D48 IonicContact NE-OD2 3.65Å; R46-D48 PolarHBondContact NE-OD2 2.87Å; R46-D48 IonicContact NH2-OD2 2.86Å; R46-D48 PolarHBondContact NH2-OD2 2.78Å; R46-V61 WeakPolarHBondContact O-CG1 3.38Å; R46-P62 HydrophobicContact CB-CG 4.47Å; R46-P62 PolarHBondContact N-O 3.17Å; R46-P62 WeakPolarHBondContact O-CG 3.26Å
47	T	48.2	Very low	46.8	Very low	21 Å²	21	58.1 Å²	58.1	13%	0.129	32%	0.319	C	S	.	.			trans	-107.6	21.2	173.5	50.9	0	0	0	0	111.3	L45 S49 L50 E98	L45-T47 HydrophobicContact CD2-CG2 4.36Å; T47-S49 PolarHBondContact O-N 2.87Å; T47-L50 CarbonylContact O-C 3.51Å; T47-L50 PolarHBondContact O-N 2.74Å; T47-E98 VanDerWaalsContact OG1-CB 3.3Å; T47-E98 WeakPolarHBondContact OG1-CB 2.91Å; T47-E98 WeakPolarHBondContact OG1-CG 3.37Å; T47-E98 PolarHBondContact OG1-OE2 3.15Å; T47-E98 VanDerWaalsContact OG1-OE2 3.08Å
48	D	46.2	Very low	47.5	Very low	77 Å²	77	62.2 Å²	62.2	41%	0.412	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-21	-177.1	51.4	-2.9	0	0	0	113.5	R46	R46-D48 IonicContact CZ-OD2 2.69Å; R46-D48 VanDerWaalsContact CZ-OD2 3.23Å; R46-D48 IonicContact NE-OD2 3.65Å; R46-D48 PolarHBondContact NE-OD2 2.87Å; R46-D48 IonicContact NH2-OD2 2.86Å; R46-D48 PolarHBondContact NH2-OD2 2.78Å
49	S	46	Very low	48.2	Very low	83 Å²	83	59 Å²	59	58%	0.58	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-16.8	171.1	54.4	0	0	0	0	115.2	T47	T47-S49 PolarHBondContact O-N 2.87Å
50	L	44.1	Very low	48.6	Very low	37 Å²	37	61.8 Å²	61.8	19%	0.194	34%	0.34	C	S	.	.	S	Bend	trans	-113.7	78.4	-175.7	-74.6	152.4	0	0	0	108	T47 C52 L55 D59 V61	T47-L50 CarbonylContact O-C 3.51Å; T47-L50 PolarHBondContact O-N 2.74Å; L50-C52 PolarHBondContact O-N 2.83Å; L50-L55 HydrophobicContact CD1-CD2 3.74Å; L50-D59 HydrophobicContact CD1-CB 4.41Å; L50-V61 HydrophobicContact CD1-CG2 4.22Å
51	G	42.3	Very low	49	Very low	61 Å²	61	58.4 Å²	58.4	63%	0.629	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	111	-174.4	0	0	0	0	0	112.5	R53	G51-R53 WeakPolarHBondContact O-CG 3.21Å; G51-R53 PolarHBondContact O-N 2.74Å
52	C	43	Very low	48.8	Very low	145 Å²	145	58.9 Å²	58.9	98%	0.98	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	34	37.9	173.4	-70.5	0	0	0	0	116.3	L50	L50-C52 PolarHBondContact O-N 2.83Å
53	R	47.2	Very low	48.8	Very low	207 Å²	207	58.5 Å²	58.5	78%	0.781	33%	0.327	S	S	*	.			trans	-111.9	148.6	177.5	-78.7	179.9	-176.8	-163.6	0.9	109.9	G51	G51-R53 WeakPolarHBondContact O-CG 3.21Å; G51-R53 PolarHBondContact O-N 2.74Å
54	H	52.6	Low	48.6	Very low	126 Å²	126	60.5 Å²	60.5	58%	0.583	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-58.6	141.5	168.9	-69.2	-60.6	0	0	0	110.4	Q94	H54-Q94 HydrophobicContact CB-CG 3.86Å
55	L	54.1	Low	48.5	Very low	5 Å²	5	57.8 Å²	57.8	3%	0.026	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-73.1	129.4	176	-68.7	176.6	0	0	0	110.7	L45 L50 D59 V61 L93 L96	L45-L55 HydrophobicContact CD2-CD1 4.46Å; L50-L55 HydrophobicContact CD1-CD2 3.74Å; L55-D59 VanDerWaalsContact CA-OD2 3.29Å; L55-D59 WeakPolarHBondContact CA-OD2 3.13Å; L55-D59 HydrophobicContact CD2-CB 4.27Å; L55-V61 HydrophobicContact CD1-CG2 4.13Å; L55-V61 HydrophobicContact CD2-CG2 3.43Å; L55-V61 VanDerWaalsContact CD2-CG2 3.43Å; L55-V61 HydrophobicContact CG-CG2 4.42Å; L55-L93 HydrophobicContact CB-CB 3.86Å; L55-L96 HydrophobicContact CD1-CB 4.03Å; L55-L96 HydrophobicContact CD1-CD1 4.13Å
56	N	55.9	Low	48.1	Very low	69 Å²	69	60.1 Å²	60.1	37%	0.369	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-96.4	166	172	-52.9	-62.6	0	0	0	111.5	D58 D59 L93	N56-D58 PolarHBondContact O-N 3.35Å; N56-D58 VanDerWaalsContact O-N 3.13Å; N56-D59 VanDerWaalsContact N-CG 3.32Å; N56-D59 PolarHBondContact N-OD2 3.01Å; N56-D59 PolarHBondContact ND2-OD1 2.83Å; N56-D59 PolarHBondContact ND2-OD2 2.99Å; N56-D59 WeakPolarHBondContact O-CB 3.33Å; N56-D59 PolarHBondContact O-N 2.9Å; N56-D59 VanDerWaalsContact O-N 3.1Å; N56-L93 WeakPolarHBondContact O-CD1 3.23Å
57	S	54.1	Low	47.9	Very low	39 Å²	39	56.7 Å²	56.7	27%	0.273	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.3	179	59.4	0	0	0	0	114.6
58	D	52.2	Low	47.6	Very low	121 Å²	121	56.4 Å²	56.4	65%	0.647	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	4.1	-175.6	-52.9	-11.2	0	0	0	111.3	N56 V60	N56-D58 PolarHBondContact O-N 3.35Å; N56-D58 VanDerWaalsContact O-N 3.13Å; D58-V60 PolarHBondContact O-N 2.78Å
59	D	50.5	Low	47.2	Very low	29 Å²	29	53 Å²	53	16%	0.155	30%	0.296	C	S	.	.			trans	-74.7	127.1	180	-74.7	-7	0	0	0	110	L50 L55 N56	L50-D59 HydrophobicContact CD1-CB 4.41Å; L55-D59 VanDerWaalsContact CA-OD2 3.29Å; L55-D59 WeakPolarHBondContact CA-OD2 3.13Å; L55-D59 HydrophobicContact CD2-CB 4.27Å; N56-D59 VanDerWaalsContact N-CG 3.32Å; N56-D59 PolarHBondContact N-OD2 3.01Å; N56-D59 PolarHBondContact ND2-OD1 2.83Å; N56-D59 PolarHBondContact ND2-OD2 2.99Å; N56-D59 WeakPolarHBondContact O-CB 3.33Å; N56-D59 PolarHBondContact O-N 2.9Å; N56-D59 VanDerWaalsContact O-N 3.1Å
60	V	52.2	Low	46.7	Very low	59 Å²	59	50.8 Å²	50.8	36%	0.358	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	113.4	173.3	-156.3	0	0	0	0	109.2	D58 L82 E84	D58-V60 PolarHBondContact O-N 2.78Å; V60-L82 HydrophobicContact CB-CD2 3.96Å; V60-L82 HydrophobicContact CG1-CB 3.46Å; V60-L82 VanDerWaalsContact CG1-CB 3.46Å; V60-L82 HydrophobicContact CG1-CD1 4.18Å; V60-L82 HydrophobicContact CG1-CD2 3.27Å; V60-L82 HydrophobicContact CG1-CG 3.72Å; V60-E84 HydrophobicContact CG1-CB 4.35Å
61	V	53.3	Low	46.1	Very low	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.7	-175.4	-166.6	0	0	0	0	110.1	L45 R46 L50 L55 L63 V83 F85	L45-V61 HydrophobicContact CD1-CB 4.36Å; L45-V61 HydrophobicContact CD1-CG1 3.6Å; L45-V61 HydrophobicContact CG-CG1 4.26Å; R46-V61 WeakPolarHBondContact O-CG1 3.38Å; L50-V61 HydrophobicContact CD1-CG2 4.22Å; L55-V61 HydrophobicContact CD1-CG2 4.13Å; L55-V61 HydrophobicContact CD2-CG2 3.43Å; L55-V61 VanDerWaalsContact CD2-CG2 3.43Å; L55-V61 HydrophobicContact CG-CG2 4.42Å; V61-L63 PolarHBondContact O-N 2.83Å; V61-L63 VanDerWaalsContact O-N 3.15Å; V61-V83 PolarHBondContact N-O 3.01Å; V61-V83 PolarHBondContact O-N 3.19Å; V61-F85 HydrophobicContact CB-CE2 4.31Å; V61-F85 HydrophobicContact CG2-CD2 4.28Å; V61-F85 HydrophobicContact CG2-CE2 4.04Å
62	P	47.4	Very low	45.6	Very low	11 Å²	11	58.6 Å²	58.6	7%	0.071	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	113.2	170.5	26.8	-30.5	0	0	0	109.8	L19 R46 M81	L19-P62 HydrophobicContact CD1-CB 3.97Å; R46-P62 HydrophobicContact CB-CG 4.47Å; R46-P62 PolarHBondContact N-O 3.17Å; R46-P62 WeakPolarHBondContact O-CG 3.26Å; P62-M81 CarbonylContact C-O 3.56Å; P62-M81 WeakPolarHBondContact CA-O 3.39Å
63	L	47.5	Very low	45.1	Very low	3 Å²	3	55 Å²	55	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.6	163.9	-78.6	174.1	0	0	0	110.3	V44 L45 V61 S65 M81 V83 L102	V44-L63 WeakPolarHBondContact O-CD2 3.23Å; L45-L63 HydrophobicContact CB-CD2 4.35Å; L45-L63 HydrophobicContact CD1-CD2 4.19Å; V61-L63 PolarHBondContact O-N 2.83Å; V61-L63 VanDerWaalsContact O-N 3.15Å; L63-S65 PolarHBondContact O-N 3.41Å; L63-M81 PolarHBondContact N-O 2.8Å; L63-M81 PolarHBondContact O-N 2.87Å; L63-M81 VanDerWaalsContact O-O 3.09Å; L63-V83 HydrophobicContact CB-CG2 3.87Å; L63-V83 HydrophobicContact CD1-CB 3.56Å; L63-V83 HydrophobicContact CD1-CG1 3.92Å; L63-V83 HydrophobicContact CD1-CG2 3.26Å; L63-V83 HydrophobicContact CG-CB 4.13Å; L63-V83 HydrophobicContact CG-CG2 3.88Å; L63-L102 HydrophobicContact CD2-CD1 4.3Å
64	H	44	Very low	44.6	Very low	44 Å²	44	46.3 Å²	46.3	20%	0.204	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	95.9	152.3	-86.4	-45.3	0	0	0	107.6	G43 V44 R80 R245	G43-H64 WeakPolarHBondContact CA-O 3.18Å; V44-H64 PolarHBondContact N-O 3.25Å; V44-H64 VanDerWaalsContact N-O 3.16Å; H64-R80 VanDerWaalsContact CE1-CG 3.4Å; H64-R80 WeakPolarHBondContact CE1-CG 3.38Å; H64-R245 PolarHBondContact NE2-NH1 2.77Å
65	S	44.4	Very low	43.9	Very low	3 Å²	3	42.3 Å²	42.3	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	147.4	-175	37.1	0	0	0	0	113.5	C41 V42 L63 M81	C41-S65 WeakPolarHBondContact SG-CB 3.21Å; V42-S65 CarbonylContact O-C 3.6Å; V42-S65 WeakPolarHBondContact O-CA 3.39Å; L63-S65 PolarHBondContact O-N 3.41Å; S65-M81 VanDerWaalsContact O-CE 3.28Å; S65-M81 WeakPolarHBondContact O-CE 3.26Å; S65-M81 WeakPolarHBondContact OG-CB 3.35Å; S65-M81 WeakPolarHBondContact OG-CE 3.5Å; S65-M81 VanDerWaalsContact OG-CG 3.3Å; S65-M81 WeakPolarHBondContact OG-CG 3.48Å; S65-M81 PolarHBondContact OG-SD 2.94Å; S65-M81 VanDerWaalsContact OG-SD 3.4Å
66	F	39.9	Very low	43.2	Very low	49 Å²	49	45.4 Å²	45.4	22%	0.215	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	135.2	163.3	165.4	-98.8	0	0	0	106.3	C41 V42 E68 Y76	C41-F66 CarbonylContact C-O 3.28Å; C41-F66 VanDerWaalsContact CA-O 3.24Å; C41-F66 WeakPolarHBondContact CA-O 3.44Å; V42-F66 HydrophobicContact CB-CB 4.46Å; V42-F66 HydrophobicContact CB-CD1 4.16Å; V42-F66 HydrophobicContact CG2-CD1 4.38Å; V42-F66 PolarHBondContact N-O 2.83Å; V42-F66 PolarHBondContact O-N 3.34Å; F66-E68 HydrophobicContact CD1-CB 4.35Å; F66-E68 HydrophobicContact CE1-CB 3.51Å; F66-E68 HydrophobicContact CE1-CG 4.43Å; F66-E68 HydrophobicContact CZ-CB 3.85Å; F66-Y76 HydrophobicContact CB-CD2 4.29Å; F66-Y76 HydrophobicContact CD2-CD2 4.01Å
67	V	41.9	Very low	42.4	Very low	1 Å²	1	43.2 Å²	43.2	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	99.4	-177.8	178	0	0	0	0	107.9	L39 C41 V69 F75 M81 L122	L39-V67 HydrophobicContact CD1-CG1 3.27Å; L39-V67 HydrophobicContact CD2-CG1 4.13Å; L39-V67 HydrophobicContact CG-CG1 3.97Å; C41-V67 HydrophobicContact CB-CG2 4.39Å; V67-V69 HydrophobicContact CG1-CG2 4.09Å; V67-F75 CarbonylContact C-O 3.59Å; V67-F75 HydrophobicContact CB-CE2 4.15Å; V67-F75 HydrophobicContact CG1-CE2 4.03Å; V67-F75 HydrophobicContact CG1-CZ 4.38Å; V67-F75 PolarHBondContact O-N 3.02Å; V67-M81 HydrophobicContact CG2-CE 3.63Å; V67-M81 HydrophobicContact CG2-SD 4.44Å; V67-L122 HydrophobicContact CG1-CD2 4.14Å
68	E	40.3	Very low	41.6	Very low	16 Å²	16	43.3 Å²	43.3	8%	0.075	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	112.1	170.4	-177.9	171	-171.5	0	0	108.1	L39 Y40 F66 D70	L39-E68 CarbonylContact C-O 3.59Å; L39-E68 WeakPolarHBondContact CA-O 3.33Å; Y40-E68 PolarHBondContact N-O 3.38Å; Y40-E68 PolarHBondContact O-N 3.03Å; F66-E68 HydrophobicContact CD1-CB 4.35Å; F66-E68 HydrophobicContact CE1-CB 3.51Å; F66-E68 HydrophobicContact CE1-CG 4.43Å; F66-E68 HydrophobicContact CZ-CB 3.85Å; E68-D70 WeakPolarHBondContact CG-O 3.31Å
69	V	37.7	Very low	41.1	Very low	4 Å²	4	41 Å²	41	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-17.6	179.8	-170.2	0	0	0	0	111.9	F31 T37 L38 L39 V67 F75	F31-V69 HydrophobicContact CD2-CB 4.18Å; F31-V69 HydrophobicContact CD2-CG1 4.09Å; F31-V69 HydrophobicContact CD2-CG2 4.34Å; F31-V69 HydrophobicContact CE1-CG1 3.94Å; F31-V69 HydrophobicContact CE2-CB 3.64Å; F31-V69 HydrophobicContact CE2-CG1 3.31Å; F31-V69 HydrophobicContact CE2-CG2 4.26Å; F31-V69 HydrophobicContact CZ-CB 4.1Å; F31-V69 HydrophobicContact CZ-CG1 3.23Å; T37-V69 CarbonylContact C-O 3.56Å; T37-V69 WeakPolarHBondContact CB-O 3.23Å; T37-V69 PolarHBondContact OG1-O 3.42Å; L38-V69 CarbonylContact O-C 3.58Å; L39-V69 HydrophobicContact CD1-CB 3.76Å; L39-V69 HydrophobicContact CD1-CG1 3.93Å; L39-V69 HydrophobicContact CD1-CG2 3.3Å; V67-V69 HydrophobicContact CG1-CG2 4.09Å; V69-F75 HydrophobicContact CB-CE1 4.07Å; V69-F75 HydrophobicContact CB-CZ 4.33Å; V69-F75 HydrophobicContact CG2-CD1 4.28Å; V69-F75 HydrophobicContact CG2-CE1 3.19Å; V69-F75 HydrophobicContact CG2-CE2 4.05Å; V69-F75 HydrophobicContact CG2-CZ 3.04Å
70	D	36.1	Very low	40.7	Very low	37 Å²	37	44.4 Å²	44.4	20%	0.198	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	140.7	179.3	179.1	0.9	0	0	0	108.8	T37 E68 K72 C73	T37-D70 HydrophobicContact CG2-CB 4.05Å; E68-D70 WeakPolarHBondContact CG-O 3.31Å; D70-K72 PolarHBondContact O-N 3.02Å; D70-K72 PolarHBondContact OD1-N 3.18Å; D70-K72 VanDerWaalsContact OD1-N 3.1Å; D70-C73 HydrophobicContact CB-CB 4.06Å; D70-C73 CarbonylContact O-C 3.56Å; D70-C73 VanDerWaalsContact O-C 3.26Å; D70-C73 PolarHBondContact O-N 3.4Å
71	A	31.1	Very low	40.7	Very low	75 Å²	75	41.6 Å²	41.6	62%	0.62	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-14.2	172.8	0	0	0	0	0	113.5
72	K	31.8	Very low	40.7	Very low	187 Å²	187	42.9 Å²	42.9	81%	0.813	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-21.9	173.1	-63.4	-178.5	-179.2	177	0	114.5	D70	D70-K72 PolarHBondContact O-N 3.02Å; D70-K72 PolarHBondContact OD1-N 3.18Å; D70-K72 VanDerWaalsContact OD1-N 3.1Å
73	C	33	Very low	41.2	Very low	69 Å²	69	42.4 Å²	42.4	47%	0.466	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	79.6	-172.8	-59.1	0	0	0	0	109.7	D70	D70-C73 HydrophobicContact CB-CB 4.06Å; D70-C73 CarbonylContact O-C 3.56Å; D70-C73 VanDerWaalsContact O-C 3.26Å; D70-C73 PolarHBondContact O-N 3.4Å
74	G	37.5	Very low	41.8	Very low	26 Å²	26	45.8 Å²	45.8	27%	0.268	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134.8	165.3	0	0	0	0	0	110.6
75	F	36.3	Very low	42.7	Very low	41 Å²	41	43.8 Å²	43.8	18%	0.18	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	155.8	166.2	55.4	-106.5	0	0	0	110.9	L29 F31 V67 V69	L29-F75 HydrophobicContact CD2-CD2 3.77Å; L29-F75 HydrophobicContact CD2-CE1 4.37Å; L29-F75 HydrophobicContact CD2-CE2 3.1Å; L29-F75 HydrophobicContact CD2-CZ 3.43Å; L29-F75 VanDerWaalsContact CD2-CZ 3.43Å; L29-F75 HydrophobicContact CG-CE2 4.47Å; L29-F75 HydrophobicContact CG-CZ 4.49Å; F31-F75 HydrophobicContact CB-CE1 4.45Å; F31-F75 AromaticContact CD2-CE1 3.93Å; F31-F75 HydrophobicContact CD2-CE1 3.93Å; F31-F75 HydrophobicContact CG-CE1 4.49Å; V67-F75 CarbonylContact C-O 3.59Å; V67-F75 HydrophobicContact CB-CE2 4.15Å; V67-F75 HydrophobicContact CG1-CE2 4.03Å; V67-F75 HydrophobicContact CG1-CZ 4.38Å; V67-F75 PolarHBondContact O-N 3.02Å; V69-F75 HydrophobicContact CB-CE1 4.07Å; V69-F75 HydrophobicContact CB-CZ 4.33Å; V69-F75 HydrophobicContact CG2-CD1 4.28Å; V69-F75 HydrophobicContact CG2-CE1 3.19Å; V69-F75 HydrophobicContact CG2-CE2 4.05Å; V69-F75 HydrophobicContact CG2-CZ 3.04Å
76	Y	39.3	Very low	43.1	Very low	70 Å²	70	44.5 Å²	44.5	28%	0.275	24%	0.238	S	C	.	.			trans	-129.1	118.5	-171.8	172.7	-95.5	0	0	0	108.6	F66 G78 R246	F66-Y76 HydrophobicContact CB-CD2 4.29Å; F66-Y76 HydrophobicContact CD2-CD2 4.01Å; Y76-G78 VanDerWaalsContact C-N 3.33Å; Y76-G78 VanDerWaalsContact CD1-N 3.35Å; Y76-G78 PolarHBondContact O-N 3.18Å; Y76-G78 WeakPolarHBondContact OH-CA 3.43Å; Y76-R246 HydrophobicContact CE2-CG 4.08Å; Y76-R246 PolarHBondContact OH-NE 3.41Å; Y76-R246 PolarHBondContact OH-NH2 2.58Å
77	T	40.4	Very low	43.7	Very low	24 Å²	24	47.3 Å²	47.3	15%	0.147	26%	0.256	C	S	.	.			trans	-74.3	-25.2	-176.6	65.6	0	0	0	0	112.4	L27 R79 M81	L27-T77 HydrophobicContact CD2-CG2 3.9Å; T77-R79 WeakPolarHBondContact O-CG 3.1Å; T77-R79 PolarHBondContact O-N 2.76Å; T77-R79 VanDerWaalsContact O-N 3.12Å; T77-R79 PolarHBondContact OG1-N 3.18Å; T77-M81 HydrophobicContact CG2-CE 3.79Å; T77-M81 HydrophobicContact CG2-SD 4.17Å; T77-M81 WeakPolarHBondContact OG1-CE 3.38Å
78	G	35.8	Very low	44.5	Very low	40 Å²	40	47.7 Å²	47.7	41%	0.412	26%	0.257	S	S	.	.			trans	73.3	-6	-174.9	0	0	0	0	0	116.2	Y76	Y76-G78 VanDerWaalsContact C-N 3.33Å; Y76-G78 VanDerWaalsContact CD1-N 3.35Å; Y76-G78 PolarHBondContact O-N 3.18Å; Y76-G78 WeakPolarHBondContact OH-CA 3.43Å
79	R	42.1	Very low	45.6	Very low	74 Å²	74	50 Å²	50	28%	0.279	27%	0.27	S	S	.	.	S	Bend	trans	-104.2	152.6	-167.4	-66.9	172.3	-165	-171.4	8.5	109.8	S18 H26 T77 M81	S18-R79 WeakPolarHBondContact OG-CD 3.15Å; H26-R79 PolarHBondContact O-NH1 2.87Å; T77-R79 WeakPolarHBondContact O-CG 3.1Å; T77-R79 PolarHBondContact O-N 2.76Å; T77-R79 VanDerWaalsContact O-N 3.12Å; T77-R79 PolarHBondContact OG1-N 3.18Å; R79-M81 PolarHBondContact O-N 2.74Å
80	R	43.1	Very low	46.8	Very low	99 Å²	99	54.6 Å²	54.6	37%	0.374	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	130.2	163.4	-76.9	178.1	170.8	170	-6.8	106	L19 H64	L19-R80 HydrophobicContact CB-CB 3.68Å; L19-R80 HydrophobicContact CD1-CB 4.22Å; L19-R80 PolarHBondContact N-O 3.18Å; H64-R80 VanDerWaalsContact CE1-CG 3.4Å; H64-R80 WeakPolarHBondContact CE1-CG 3.38Å
81	M	50.7	Low	48.2	Very low	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	133.4	172.7	-53.2	-160.3	-121.2	0	0	108.7	I16 A17 P62 L63 S65 V67 T77 R79	I16-M81 HydrophobicContact CG2-CB 3.66Å; I16-M81 HydrophobicContact CG2-CG 4.08Å; I16-M81 HydrophobicContact CG2-SD 3.36Å; I16-M81 WeakPolarHBondContact CG2-SD 2.98Å; A17-M81 CarbonylContact O-C 3.51Å; A17-M81 VanDerWaalsContact O-C 3.28Å; A17-M81 WeakPolarHBondContact O-CA 3.31Å; A17-M81 WeakPolarHBondContact O-CB 3.31Å; P62-M81 CarbonylContact C-O 3.56Å; P62-M81 WeakPolarHBondContact CA-O 3.39Å; L63-M81 PolarHBondContact N-O 2.8Å; L63-M81 PolarHBondContact O-N 2.87Å; L63-M81 VanDerWaalsContact O-O 3.09Å; S65-M81 VanDerWaalsContact O-CE 3.28Å; S65-M81 WeakPolarHBondContact O-CE 3.26Å; S65-M81 WeakPolarHBondContact OG-CB 3.35Å; S65-M81 WeakPolarHBondContact OG-CE 3.5Å; S65-M81 VanDerWaalsContact OG-CG 3.3Å; S65-M81 WeakPolarHBondContact OG-CG 3.48Å; S65-M81 PolarHBondContact OG-SD 2.94Å; S65-M81 VanDerWaalsContact OG-SD 3.4Å; V67-M81 HydrophobicContact CG2-CE 3.63Å; V67-M81 HydrophobicContact CG2-SD 4.44Å; T77-M81 HydrophobicContact CG2-CE 3.79Å; T77-M81 HydrophobicContact CG2-SD 4.17Å; T77-M81 WeakPolarHBondContact OG1-CE 3.38Å; R79-M81 PolarHBondContact O-N 2.74Å
82	L	53.3	Low	49.8	Very low	28 Å²	28	53.7 Å²	53.7	15%	0.147	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	127.9	160.2	-75.3	161.4	0	0	0	106.8	I16 A17 L19 Y24 V60	I16-L82 CarbonylContact C-O 3.55Å; I16-L82 VanDerWaalsContact CA-O 3.26Å; I16-L82 WeakPolarHBondContact CA-O 3.27Å; A17-L82 HydrophobicContact CB-CB 4.19Å; A17-L82 PolarHBondContact N-O 2.76Å; A17-L82 PolarHBondContact O-N 2.76Å; L19-L82 HydrophobicContact CD1-CD1 4.24Å; L19-L82 HydrophobicContact CD1-CD2 3.44Å; L19-L82 VanDerWaalsContact CD1-CD2 3.44Å; L19-L82 HydrophobicContact CD1-CG 3.49Å; L19-L82 VanDerWaalsContact CD1-CG 3.49Å; L19-L82 HydrophobicContact CD2-CD1 4.15Å; L19-L82 HydrophobicContact CD2-CD2 4.36Å; L19-L82 HydrophobicContact CD2-CG 4.3Å; L19-L82 HydrophobicContact CG-CD1 3.74Å; L19-L82 HydrophobicContact CG-CD2 3.89Å; L19-L82 HydrophobicContact CG-CG 3.51Å; Y24-L82 HydrophobicContact CE1-CD1 4.28Å; V60-L82 HydrophobicContact CB-CD2 3.96Å; V60-L82 HydrophobicContact CG1-CB 3.46Å; V60-L82 VanDerWaalsContact CG1-CB 3.46Å; V60-L82 HydrophobicContact CG1-CD1 4.18Å; V60-L82 HydrophobicContact CG1-CD2 3.27Å; V60-L82 HydrophobicContact CG1-CG 3.72Å
83	V	58.7	Low	51.3	Low	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	112.1	166.8	178.5	0	0	0	0	106.8	I14 V15 I16 V61 L63 F85	I14-V83 HydrophobicContact CG2-CG1 3.35Å; V15-V83 WeakPolarHBondContact O-CA 3.38Å; I16-V83 HydrophobicContact CB-CG2 4.49Å; I16-V83 HydrophobicContact CD1-CG2 4.43Å; I16-V83 HydrophobicContact CG1-CG2 4.02Å; I16-V83 HydrophobicContact CG2-CG2 4.22Å; V61-V83 PolarHBondContact N-O 3.01Å; V61-V83 PolarHBondContact O-N 3.19Å; L63-V83 HydrophobicContact CB-CG2 3.87Å; L63-V83 HydrophobicContact CD1-CB 3.56Å; L63-V83 HydrophobicContact CD1-CG1 3.92Å; L63-V83 HydrophobicContact CD1-CG2 3.26Å; L63-V83 HydrophobicContact CG-CB 4.13Å; L63-V83 HydrophobicContact CG-CG2 3.88Å; V83-F85 HydrophobicContact CG1-CD1 4.4Å; V83-F85 HydrophobicContact CG1-CE1 3.98Å; V83-F85 HydrophobicContact CG1-CE2 4.21Å; V83-F85 HydrophobicContact CG1-CZ 3.9Å
84	E	61.2	Low	52.9	Low	75 Å²	75	45.5 Å²	45.5	35%	0.35	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.9	171.3	-170.8	-178.1	170.4	0	0	107.3	V15 V60 A86	V15-E84 HydrophobicContact CB-CB 4.21Å; V15-E84 PolarHBondContact N-O 2.96Å; V15-E84 PolarHBondContact O-N 2.9Å; V60-E84 HydrophobicContact CG1-CB 4.35Å; E84-A86 HydrophobicContact CG-CB 4.42Å; E84-A86 PolarHBondContact O-N 2.86Å
85	F	61	Low	54.3	Low	2 Å²	2	47.5 Å²	47.5	1%	0.009	24%	0.243	C	C	.	.			trans	-83.6	61.5	173.6	-63.4	-78.1	0	0	0	109.6	V61 V83 N87 F88 L93 L96 L102 I133	V61-F85 HydrophobicContact CB-CE2 4.31Å; V61-F85 HydrophobicContact CG2-CD2 4.28Å; V61-F85 HydrophobicContact CG2-CE2 4.04Å; V83-F85 HydrophobicContact CG1-CD1 4.4Å; V83-F85 HydrophobicContact CG1-CE1 3.98Å; V83-F85 HydrophobicContact CG1-CE2 4.21Å; V83-F85 HydrophobicContact CG1-CZ 3.9Å; F85-N87 PolarHBondContact O-N 3.03Å; F85-N87 VanDerWaalsContact O-N 3.16Å; F85-F88 HydrophobicContact CB-CB 4.17Å; F85-F88 HydrophobicContact CB-CD2 3.71Å; F85-F88 HydrophobicContact CB-CE2 4.42Å; F85-F88 HydrophobicContact CB-CG 4.05Å; F85-F88 HydrophobicContact CD1-CD2 4.24Å; F85-F88 HydrophobicContact CD1-CE2 4.23Å; F85-F88 HydrophobicContact CG-CD2 4.48Å; F85-F88 PolarHBondContact O-N 3.12Å; F85-L93 HydrophobicContact CB-CD1 4.15Å; F85-L93 HydrophobicContact CB-CD2 3.76Å; F85-L93 HydrophobicContact CD1-CD2 4.09Å; F85-L93 HydrophobicContact CD2-CD2 3.98Å; F85-L93 HydrophobicContact CG-CD2 3.67Å; F85-L96 HydrophobicContact CE2-CD1 4.45Å; F85-L96 HydrophobicContact CZ-CD1 4.22Å; F85-L102 HydrophobicContact CZ-CD1 4.33Å; F85-I133 HydrophobicContact CD1-CD1 3.95Å; F85-I133 HydrophobicContact CE1-CD1 3.68Å
86	A	54.8	Low	55.7	Low	17 Å²	17	46.3 Å²	46.3	14%	0.14	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	125.4	-176.3	0	0	0	0	0	110.4	D13 E84 F88	D13-A86 VanDerWaalsContact O-O 3.12Å; E84-A86 HydrophobicContact CG-CB 4.42Å; E84-A86 PolarHBondContact O-N 2.86Å; A86-F88 VanDerWaalsContact C-N 3.28Å; A86-F88 PolarHBondContact O-N 2.88Å
87	N	51.7	Low	56.8	Low	109 Å²	109	47.1 Å²	47.1	58%	0.583	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	7	176.8	-53.3	-64.5	0	0	0	116.7	K12 F85	K12-N87 HydrophobicContact CB-CB 4.4Å; K12-N87 HydrophobicContact CD-CB 3.74Å; K12-N87 WeakPolarHBondContact CD-O 3.11Å; K12-N87 VanDerWaalsContact CE-O 3.28Å; K12-N87 WeakPolarHBondContact CE-O 3.4Å; K12-N87 HydrophobicContact CG-CB 4.46Å; K12-N87 PolarHBondContact NZ-O 3.45Å; F85-N87 PolarHBondContact O-N 3.03Å; F85-N87 VanDerWaalsContact O-N 3.16Å
88	F	58.7	Low	57.6	Low	8 Å²	8	51 Å²	51	4%	0.035	27%	0.267	C	S	.	.			trans	-59.1	148.6	173.7	-86.4	-105.6	0	0	0	111.6	I14 F85 A86 T92 L93 I133	I14-F88 HydrophobicContact CD1-CE2 4.17Å; I14-F88 HydrophobicContact CD1-CZ 4.04Å; I14-F88 HydrophobicContact CG1-CE2 3.61Å; I14-F88 HydrophobicContact CG1-CZ 3.99Å; F85-F88 HydrophobicContact CB-CB 4.17Å; F85-F88 HydrophobicContact CB-CD2 3.71Å; F85-F88 HydrophobicContact CB-CE2 4.42Å; F85-F88 HydrophobicContact CB-CG 4.05Å; F85-F88 HydrophobicContact CD1-CD2 4.24Å; F85-F88 HydrophobicContact CD1-CE2 4.23Å; F85-F88 HydrophobicContact CG-CD2 4.48Å; F85-F88 PolarHBondContact O-N 3.12Å; A86-F88 VanDerWaalsContact C-N 3.28Å; A86-F88 PolarHBondContact O-N 2.88Å; F88-T92 HydrophobicContact CD1-CG2 4.39Å; F88-L93 HydrophobicContact CB-CD1 3.84Å; F88-L93 HydrophobicContact CB-CD2 3.86Å; F88-L93 HydrophobicContact CB-CG 3.75Å; F88-L93 HydrophobicContact CD1-CD2 4.32Å; F88-L93 HydrophobicContact CG-CD2 4.17Å; F88-I133 HydrophobicContact CD1-CD1 4.41Å; F88-I133 HydrophobicContact CE1-CD1 3.47Å; F88-I133 VanDerWaalsContact CE1-CD1 3.47Å; F88-I133 HydrophobicContact CE1-CG1 4.12Å; F88-I133 HydrophobicContact CE2-CD1 4.44Å; F88-I133 HydrophobicContact CZ-CD1 3.49Å; F88-I133 VanDerWaalsContact CZ-CD1 3.49Å; F88-I133 HydrophobicContact CZ-CG1 4.17Å
89	D	63.8	Low	58.4	Low	65 Å²	65	51.6 Å²	51.6	35%	0.348	27%	0.273	S	S	.	.			trans	-69.8	138.7	171.9	76.7	74.6	0	0	0	109.8	S91 T92 L93	D89-S91 PolarHBondContact O-N 2.83Å; D89-S91 WeakPolarHBondContact OD1-CB 3.38Å; D89-S91 PolarHBondContact OD1-N 2.83Å; D89-S91 PolarHBondContact OD1-OG 2.84Å; D89-T92 PolarHBondContact O-N 2.94Å; D89-T92 WeakPolarHBondContact OD1-CB 3.47Å; D89-T92 PolarHBondContact OD1-N 2.87Å; D89-T92 PolarHBondContact OD1-OG1 3.06Å; D89-T92 WeakPolarHBondContact OD2-CB 3.34Å; D89-T92 PolarHBondContact OD2-OG1 3.36Å; D89-L93 PolarHBondContact O-N 3.34Å
90	E	61.8	Low	59.2	Low	100 Å²	100	50.2 Å²	50.2	47%	0.467	27%	0.27	S	S	.	.	H	α-helix	trans	-60.6	-33.6	-175.3	-160.4	-174.3	153.1	0	0	111.7	T92 L93 Q94	E90-T92 VanDerWaalsContact C-N 3.28Å; E90-T92 PolarHBondContact O-N 2.89Å; E90-L93 PolarHBondContact O-N 2.82Å; E90-Q94 WeakPolarHBondContact O-CB 3.19Å; E90-Q94 VanDerWaalsContact O-CG 3.24Å; E90-Q94 WeakPolarHBondContact O-CG 3.44Å; E90-Q94 PolarHBondContact O-N 3.24Å; E90-Q94 PolarHBondContact OE1-NE2 3.18Å
91	S	65.4	Low	59.9	Low	78 Å²	78	46.4 Å²	46.4	55%	0.545	26%	0.256	S	S	.	.	H	α-helix	trans	-66.2	-30.4	-179	74.5	0	0	0	0	113.4	D89 Q95	D89-S91 PolarHBondContact O-N 2.83Å; D89-S91 WeakPolarHBondContact OD1-CB 3.38Å; D89-S91 PolarHBondContact OD1-N 2.83Å; D89-S91 PolarHBondContact OD1-OG 2.84Å; S91-Q95 WeakPolarHBondContact O-CG 3.48Å
92	T	65.6	Low	60.5	Low	15 Å²	15	46.4 Å²	46.4	9%	0.092	26%	0.257	C	S	.	.	H	α-helix	trans	-78.1	-42.5	177.7	-70.5	0	0	0	0	110.6	C8 F88 D89 E90 Q94 Q95	C8-T92 HydrophobicContact CB-CG2 3.23Å; C8-T92 WeakPolarHBondContact SG-CG2 3.42Å; F88-T92 HydrophobicContact CD1-CG2 4.39Å; D89-T92 PolarHBondContact O-N 2.94Å; D89-T92 WeakPolarHBondContact OD1-CB 3.47Å; D89-T92 PolarHBondContact OD1-N 2.87Å; D89-T92 PolarHBondContact OD1-OG1 3.06Å; D89-T92 WeakPolarHBondContact OD2-CB 3.34Å; D89-T92 PolarHBondContact OD2-OG1 3.36Å; E90-T92 VanDerWaalsContact C-N 3.28Å; E90-T92 PolarHBondContact O-N 2.89Å; T92-Q94 VanDerWaalsContact C-N 3.32Å; T92-Q94 PolarHBondContact O-N 3.25Å; T92-Q95 WeakPolarHBondContact O-CB 3.38Å; T92-Q95 PolarHBondContact O-N 3.31Å
93	L	62.6	Low	61	Low	2 Å²	2	45.6 Å²	45.6	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-33.5	176.5	-65.5	179.6	0	0	0	112.5	L55 N56 F85 F88 D89 E90 Q95 L96	L55-L93 HydrophobicContact CB-CB 3.86Å; N56-L93 WeakPolarHBondContact O-CD1 3.23Å; F85-L93 HydrophobicContact CB-CD1 4.15Å; F85-L93 HydrophobicContact CB-CD2 3.76Å; F85-L93 HydrophobicContact CD1-CD2 4.09Å; F85-L93 HydrophobicContact CD2-CD2 3.98Å; F85-L93 HydrophobicContact CG-CD2 3.67Å; F88-L93 HydrophobicContact CB-CD1 3.84Å; F88-L93 HydrophobicContact CB-CD2 3.86Å; F88-L93 HydrophobicContact CB-CG 3.75Å; F88-L93 HydrophobicContact CD1-CD2 4.32Å; F88-L93 HydrophobicContact CG-CD2 4.17Å; D89-L93 PolarHBondContact O-N 3.34Å; E90-L93 PolarHBondContact O-N 2.82Å; L93-Q95 PolarHBondContact O-N 3.25Å; L93-Q95 VanDerWaalsContact O-N 3.1Å; L93-L96 HydrophobicContact CD2-CD1 4.05Å; L93-L96 WeakPolarHBondContact O-CB 3.34Å; L93-L96 PolarHBondContact O-N 3.03Å
94	Q	66.2	Low	61.4	Low	83 Å²	83	45.8 Å²	45.8	39%	0.388	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.3	174.3	-79.1	179.7	11.9	0	0	114.3	H54 E90 T92 L96	H54-Q94 HydrophobicContact CB-CG 3.86Å; E90-Q94 WeakPolarHBondContact O-CB 3.19Å; E90-Q94 VanDerWaalsContact O-CG 3.24Å; E90-Q94 WeakPolarHBondContact O-CG 3.44Å; E90-Q94 PolarHBondContact O-N 3.24Å; E90-Q94 PolarHBondContact OE1-NE2 3.18Å; T92-Q94 VanDerWaalsContact C-N 3.32Å; T92-Q94 PolarHBondContact O-N 3.25Å; Q94-L96 VanDerWaalsContact C-N 3.33Å
95	Q	67.7	Low	61.5	Low	68 Å²	68	42.9 Å²	42.9	32%	0.318	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-16.6	176.1	-55.5	-176.6	19.8	0	0	113.1	K6 S91 T92 L93	K6-Q95 HydrophobicContact CD-CB 4.29Å; S91-Q95 WeakPolarHBondContact O-CG 3.48Å; T92-Q95 WeakPolarHBondContact O-CB 3.38Å; T92-Q95 PolarHBondContact O-N 3.31Å; L93-Q95 PolarHBondContact O-N 3.25Å; L93-Q95 VanDerWaalsContact O-N 3.1Å
96	L	64.8	Low	61.6	Low	16 Å²	16	43.8 Å²	43.8	8%	0.084	25%	0.251	C	S	.	.			trans	-79.9	130.4	-179.1	-56.7	-178.1	0	0	0	110	L45 L55 F85 L93 Q94 L102 I135	L45-L96 HydrophobicContact CD2-CB 3.75Å; L55-L96 HydrophobicContact CD1-CB 4.03Å; L55-L96 HydrophobicContact CD1-CD1 4.13Å; F85-L96 HydrophobicContact CE2-CD1 4.45Å; F85-L96 HydrophobicContact CZ-CD1 4.22Å; L93-L96 HydrophobicContact CD2-CD1 4.05Å; L93-L96 WeakPolarHBondContact O-CB 3.34Å; L93-L96 PolarHBondContact O-N 3.03Å; Q94-L96 VanDerWaalsContact C-N 3.33Å; L96-L102 HydrophobicContact CD1-CD1 4.43Å; L96-L102 HydrophobicContact CD2-CD2 3.77Å; L96-I135 HydrophobicContact CD2-CD1 3.95Å; L96-I135 HydrophobicContact CD2-CG1 3.98Å
97	V	63.6	Low	62.2	Low	86 Å²	86	43.5 Å²	43.5	52%	0.521	25%	0.247	S	C	.	.			trans	-123.3	146.1	-177.9	-173.1	0	0	0	0	109.6	L45 G99 Q100	L45-V97 WeakPolarHBondContact CD2-O 3.14Å; V97-G99 PolarHBondContact O-N 2.75Å; V97-Q100 HydrophobicContact CB-CG 4.19Å; V97-Q100 VanDerWaalsContact O-CB 3.25Å; V97-Q100 WeakPolarHBondContact O-CB 3.38Å; V97-Q100 VanDerWaalsContact O-CG 3.29Å; V97-Q100 WeakPolarHBondContact O-CG 3.5Å; V97-Q100 PolarHBondContact O-N 2.65Å; V97-Q100 VanDerWaalsContact O-N 3.14Å
98	E	57.5	Low	62.7	Low	106 Å²	106	41.2 Å²	41.2	50%	0.495	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	138.4	175.5	-162.8	174.4	173.7	0	0	112.3	T47 Q100	T47-E98 VanDerWaalsContact OG1-CB 3.3Å; T47-E98 WeakPolarHBondContact OG1-CB 2.91Å; T47-E98 WeakPolarHBondContact OG1-CG 3.37Å; T47-E98 PolarHBondContact OG1-OE2 3.15Å; T47-E98 VanDerWaalsContact OG1-OE2 3.08Å; E98-Q100 PolarHBondContact O-N 3.27Å
99	G	51.6	Low	62.7	Low	53 Å²	53	43.5 Å²	43.5	55%	0.546	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-5.9	179.3	0	0	0	0	0	114.4	L45 V97	L45-G99 PolarHBondContact O-N 2.93Å; V97-G99 PolarHBondContact O-N 2.75Å
100	Q	60.4	Low	62.5	Low	45 Å²	45	41.7 Å²	41.7	21%	0.21	25%	0.246	C	C	.	.			trans	-66.5	143.9	171.4	-73.9	-179.4	-23.5	0	0	111.2	V44 L45 V97 E98 I135	V44-Q100 WeakPolarHBondContact CA-O 3.47Å; L45-Q100 PolarHBondContact N-O 2.82Å; V97-Q100 HydrophobicContact CB-CG 4.19Å; V97-Q100 VanDerWaalsContact O-CB 3.25Å; V97-Q100 WeakPolarHBondContact O-CB 3.38Å; V97-Q100 VanDerWaalsContact O-CG 3.29Å; V97-Q100 WeakPolarHBondContact O-CG 3.5Å; V97-Q100 PolarHBondContact O-N 2.65Å; V97-Q100 VanDerWaalsContact O-N 3.14Å; E98-Q100 PolarHBondContact O-N 3.27Å; Q100-I135 HydrophobicContact CB-CG2 4.3Å; Q100-I135 HydrophobicContact CG-CG2 4.14Å
101	L	56.7	Low	62.2	Low	18 Å²	18	41.1 Å²	41.1	9%	0.094	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127	173.6	-178.1	77.7	0	0	0	108.7	V42 G43 V44 V136 L141	V42-L101 HydrophobicContact CG1-CD1 3.68Å; V42-L101 HydrophobicContact CG1-CG 4.25Å; G43-L101 WeakPolarHBondContact O-CA 3.49Å; V44-L101 HydrophobicContact CG2-CD1 3.93Å; L101-V136 HydrophobicContact CB-CG2 3.99Å; L101-V136 WeakPolarHBondContact CB-O 3.28Å; L101-V136 HydrophobicContact CD2-CB 4.4Å; L101-V136 HydrophobicContact CD2-CG2 3.41Å; L101-V136 VanDerWaalsContact CD2-CG2 3.41Å; L101-V136 HydrophobicContact CG-CG2 3.55Å; L101-V136 WeakPolarHBondContact O-CG2 3.22Å; L101-V136 PolarHBondContact O-N 2.93Å; L101-L141 HydrophobicContact CD1-CD1 4.11Å; L101-L141 HydrophobicContact CD2-CD1 3.26Å; L101-L141 HydrophobicContact CD2-CD2 4.01Å; L101-L141 HydrophobicContact CD2-CG 3.39Å; L101-L141 HydrophobicContact CG-CD1 4.28Å
102	L	64.2	Low	61.8	Low	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	136.2	-179	-54.9	-177.1	0	0	0	110	V42 G43 L45 L63 F85 L96 I133 W134 I135	V42-L102 VanDerWaalsContact CA-O 3.27Å; V42-L102 WeakPolarHBondContact CA-O 3.28Å; G43-L102 PolarHBondContact N-O 2.9Å; G43-L102 PolarHBondContact O-N 3.4Å; L45-L102 HydrophobicContact CB-CD1 4.5Å; L45-L102 HydrophobicContact CD1-CD1 4.06Å; L63-L102 HydrophobicContact CD2-CD1 4.3Å; F85-L102 HydrophobicContact CZ-CD1 4.33Å; L96-L102 HydrophobicContact CD1-CD1 4.43Å; L96-L102 HydrophobicContact CD2-CD2 3.77Å; L102-I133 HydrophobicContact CB-CG2 4.43Å; L102-I133 HydrophobicContact CD2-CG2 4.35Å; L102-W134 CarbonylContact C-O 3.53Å; L102-W134 WeakPolarHBondContact CA-O 3.48Å; L102-I135 HydrophobicContact CD2-CG1 3.94Å
103	L	62.6	Low	60.9	Low	11 Å²	11	46.6 Å²	46.6	6%	0.058	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.9	166.9	179.3	76.9	0	0	0	108.2	Y40 C41 V42 I133 W134 V136 F140	Y40-L103 HydrophobicContact CD1-CD1 3.59Å; Y40-L103 HydrophobicContact CD1-CD2 4.35Å; Y40-L103 HydrophobicContact CD1-CG 4.13Å; Y40-L103 HydrophobicContact CG-CD1 4.13Å; C41-L103 WeakPolarHBondContact O-CA 3.24Å; V42-L103 HydrophobicContact CG2-CD1 3.56Å; L103-I133 CarbonylContact O-C 3.59Å; L103-I133 WeakPolarHBondContact O-CA 3.44Å; L103-W134 HydrophobicContact CB-CB 4.1Å; L103-W134 HydrophobicContact CB-CG 4.47Å; L103-W134 HydrophobicContact CD2-CG 4.24Å; L103-W134 PolarHBondContact N-O 3.41Å; L103-W134 PolarHBondContact O-N 2.66Å; L103-V136 HydrophobicContact CB-CG1 4.08Å; L103-V136 HydrophobicContact CB-CG2 4.22Å; L103-F140 HydrophobicContact CD2-CE1 3.93Å; L103-F140 HydrophobicContact CD2-CZ 4.33Å
104	L	68	Low	60.1	Low	3 Å²	3	48.1 Å²	48.1	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124	170.6	-49.1	-177.7	0	0	0	108.2	I14 I16 Y40 C41 F107 L124 I133	I14-L104 HydrophobicContact CD1-CD1 3.88Å; I14-L104 HydrophobicContact CD1-CD2 3.94Å; I14-L104 HydrophobicContact CD1-CG 4.48Å; I14-L104 HydrophobicContact CG2-CD1 4.41Å; I16-L104 HydrophobicContact CD1-CD1 4.49Å; Y40-L104 WeakPolarHBondContact CA-O 3.26Å; C41-L104 HydrophobicContact CB-CB 3.92Å; C41-L104 HydrophobicContact CB-CD1 3.71Å; C41-L104 HydrophobicContact CB-CG 3.9Å; C41-L104 PolarHBondContact N-O 2.91Å; C41-L104 PolarHBondContact O-N 3.38Å; L104-F107 HydrophobicContact CB-CD2 4.13Å; L104-F107 HydrophobicContact CB-CE2 3.97Å; L104-L124 HydrophobicContact CD1-CD1 3.87Å; L104-I133 HydrophobicContact CD2-CB 3.93Å; L104-I133 HydrophobicContact CD2-CD1 3.75Å; L104-I133 HydrophobicContact CD2-CG1 3.49Å; L104-I133 VanDerWaalsContact CD2-CG1 3.49Å; L104-I133 HydrophobicContact CD2-CG2 3.69Å
105	S	63.7	Low	59	Low	15 Å²	15	48.7 Å²	48.7	11%	0.105	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	148.7	179.7	69.5	0	0	0	0	111.7	F107 S131 K132 W134	S105-F107 WeakPolarHBondContact O-CD2 3.23Å; S105-S131 CarbonylContact O-C 3.48Å; S105-S131 WeakPolarHBondContact O-CA 3.46Å; S105-K132 PolarHBondContact N-O 3.21Å; S105-K132 PolarHBondContact O-N 2.78Å; S105-W134 PolarHBondContact OG-NE1 3.12Å
106	G	62.6	Low	57.5	Low	21 Å²	21	49.2 Å²	49.2	22%	0.216	31%	0.313	C	S	.	.	S	Bend	trans	78.3	17.7	173.3	0	0	0	0	0	114.5	S131	G106-S131 PolarHBondContact O-OG 3.11Å
107	F	67.2	Low	56.4	Low	11 Å²	11	55.2 Å²	55.2	5%	0.048	35%	0.351	C	S	.	.			trans	-93.8	143.3	172.1	-63.1	-98.6	0	0	0	110.5	I14 L104 S105 L124 R125 A126 I133	I14-F107 HydrophobicContact CD1-CD1 4.19Å; I14-F107 HydrophobicContact CD1-CE1 3.42Å; I14-F107 VanDerWaalsContact CD1-CE1 3.42Å; I14-F107 HydrophobicContact CD1-CE2 4.09Å; I14-F107 HydrophobicContact CD1-CZ 3.37Å; I14-F107 HydrophobicContact CG1-CE1 3.85Å; I14-F107 HydrophobicContact CG1-CZ 4.28Å; L104-F107 HydrophobicContact CB-CD2 4.13Å; L104-F107 HydrophobicContact CB-CE2 3.97Å; S105-F107 WeakPolarHBondContact O-CD2 3.23Å; F107-L124 HydrophobicContact CB-CB 3.74Å; F107-L124 HydrophobicContact CD1-CB 4.03Å; F107-L124 HydrophobicContact CG-CB 4.02Å; F107-R125 CarbonylContact C-O 3.56Å; F107-R125 VanDerWaalsContact CA-O 3.28Å; F107-R125 WeakPolarHBondContact CA-O 3.44Å; F107-A126 HydrophobicContact CD1-CB 3.8Å; F107-A126 HydrophobicContact CE1-CB 3.77Å; F107-I133 HydrophobicContact CZ-CG1 4.13Å
108	D	61.2	Low	55.3	Low	61 Å²	61	57 Å²	57	33%	0.326	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.8	169.7	-68	-50.5	0	0	0	110.3	L124 R125	D108-L124 CarbonylContact O-C 3.44Å; D108-L124 WeakPolarHBondContact O-CA 3.17Å; D108-R125 HydrophobicContact CB-CB 4.34Å; D108-R125 PolarHBondContact N-O 3Å; D108-R125 PolarHBondContact O-N 2.99Å
109	V	60.2	Low	54.9	Low	55 Å²	55	52.1 Å²	52.1	33%	0.333	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	113.4	-174.3	-172.6	0	0	0	0	110.1	L39 L122 L124	L39-V109 HydrophobicContact CB-CG2 3.56Å; L39-V109 HydrophobicContact CD1-CG2 3.65Å; L39-V109 HydrophobicContact CD2-CG2 4.07Å; L39-V109 HydrophobicContact CG-CG2 3.94Å; V109-L122 HydrophobicContact CG1-CD1 3.57Å; V109-L122 HydrophobicContact CG1-CD2 4.34Å; V109-L122 HydrophobicContact CG1-CG 3.93Å; V109-L124 HydrophobicContact CB-CD2 4.39Å; V109-L124 HydrophobicContact CG1-CD2 4.18Å; V109-L124 HydrophobicContact CG2-CD2 3.96Å
110	G	59.5	Low	55	Low	28 Å²	28	49.6 Å²	49.6	29%	0.289	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.5	164.9	0	0	0	0	0	110.7	T123	G110-T123 PolarHBondContact N-O 2.73Å; G110-T123 PolarHBondContact O-N 2.73Å
111	Y	55.8	Low	54.9	Low	87 Å²	87	49.7 Å²	49.7	34%	0.341	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.4	168.5	176.5	-118.1	0	0	0	109.3	H26 L29 P113 A120	H26-Y111 PolarHBondContact CE1-OH 2.94Å; H26-Y111 VanDerWaalsContact CE1-OH 3.32Å; L29-Y111 HydrophobicContact CD1-CD2 3.51Å; L29-Y111 HydrophobicContact CD1-CE2 3.65Å; L29-Y111 HydrophobicContact CD1-CG 4.29Å; L29-Y111 HydrophobicContact CG-CE2 4.35Å; Y111-P113 HydrophobicContact CD1-CB 4.42Å; Y111-P113 HydrophobicContact CD1-CG 4.12Å; Y111-P113 HydrophobicContact CE1-CB 3.63Å; Y111-P113 HydrophobicContact CE1-CG 3.76Å; Y111-P113 WeakPolarHBondContact O-CD 3.25Å; Y111-A120 HydrophobicContact CE2-CB 3.95Å
112	Q	55.4	Low	55	Low	128 Å²	128	49 Å²	49	60%	0.598	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	101.1	168	-89	-176.1	-21.6	0	0	109.1	S114 H121	Q112-S114 PolarHBondContact O-N 3.37Å; Q112-H121 PolarHBondContact N-O 2.91Å; Q112-H121 VanDerWaalsContact N-O 3.15Å; Q112-H121 PolarHBondContact O-N 2.92Å
113	P	47.9	Very low	54.9	Low	81 Å²	81	50 Å²	50	53%	0.526	31%	0.307	S	S	.	.			trans	-68.2	116.7	164.3	23.8	-23.9	0	0	0	107.9	Y111	Y111-P113 HydrophobicContact CD1-CB 4.42Å; Y111-P113 HydrophobicContact CD1-CG 4.12Å; Y111-P113 HydrophobicContact CE1-CB 3.63Å; Y111-P113 HydrophobicContact CE1-CG 3.76Å; Y111-P113 WeakPolarHBondContact O-CD 3.25Å
114	S	45.2	Very low	55	Low	34 Å²	34	49.4 Å²	49.4	24%	0.238	31%	0.305	C	S	.	.			trans	-75.7	127.4	177.7	59	0	0	0	0	110.2	Q112 S116 E118 S119	Q112-S114 PolarHBondContact O-N 3.37Å; S114-S116 PolarHBondContact OG-O 3.46Å; S114-E118 WeakPolarHBondContact CB-O 3.5Å; S114-E118 PolarHBondContact OG-O 3.47Å; S114-S119 PolarHBondContact OG-O 3.08Å
115	G	44.3	Very low	54.7	Low	95 Å²	95	55.3 Å²	55.3	98%	0.979	33%	0.327	S	S	*	.	S	Bend	trans	-81.7	2.8	166.5	0	0	0	0	0	113.4
116	S	36.1	Very low	54.8	Low	78 Å²	78	54.8 Å²	54.8	55%	0.545	32%	0.323	S	S	.	.	S	Bend	trans	-124.5	164.3	-176.3	59.2	0	0	0	0	110.7	S114 E118	S114-S116 PolarHBondContact OG-O 3.46Å; S116-E118 PolarHBondContact O-N 3.04Å; S116-E118 VanDerWaalsContact O-O 3.05Å
117	T	40.1	Very low	54.8	Low	142 Å²	142	60.2 Å²	60.2	87%	0.871	34%	0.343	S	S	*	.	S	Bend	trans	-61.9	8.9	-176.1	44.1	0	0	0	0	116.5
118	E	42.2	Very low	54.5	Low	125 Å²	125	62.9 Å²	62.9	58%	0.584	36%	0.358	S	S	*	.	S	Bend	trans	-102.2	140.4	173.9	-64.7	179.1	169.7	0	0	107.5	S114 S116	S114-E118 WeakPolarHBondContact CB-O 3.5Å; S114-E118 PolarHBondContact OG-O 3.47Å; S116-E118 PolarHBondContact O-N 3.04Å; S116-E118 VanDerWaalsContact O-O 3.05Å
119	S	48.9	Very low	54.6	Low	2 Å²	2	68.3 Å²	68.3	1%	0.014	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-50.2	159.9	-167	34.7	0	0	0	0	114.6	Y24 A25 S114 H121	Y24-S119 WeakPolarHBondContact CB-OG 3.42Å; A25-S119 WeakPolarHBondContact O-CB 3.46Å; S114-S119 PolarHBondContact OG-O 3.08Å; S119-H121 PolarHBondContact O-CD2 2.97Å; S119-H121 PolarHBondContact O-N 2.68Å; S119-H121 PolarHBondContact O-NE2 3.25Å; S119-H121 VanDerWaalsContact O-NE2 3.17Å; S119-H121 PolarHBondContact OG-CE1 2.84Å; S119-H121 VanDerWaalsContact OG-CE1 3.27Å; S119-H121 PolarHBondContact OG-NE2 3.15Å
120	A	54	Low	54.8	Low	0 Å²	0	68.4 Å²	68.4	0%	0	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-61.7	137.5	157.4	0	0	0	0	0	109.8	L27 Y111	L27-A120 HydrophobicContact CB-CB 4.13Å; L27-A120 WeakPolarHBondContact CD1-O 3.45Å; Y111-A120 HydrophobicContact CE2-CB 3.95Å
121	H	57.8	Low	55.1	Low	48 Å²	48	67.1 Å²	67.1	22%	0.222	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.9	178.8	-63.3	-84.5	0	0	0	109.8	V15 A17 Q112 S119	V15-H121 HydrophobicContact CG1-CB 4.38Å; A17-H121 WeakPolarHBondContact CB-ND1 3.25Å; Q112-H121 PolarHBondContact N-O 2.91Å; Q112-H121 VanDerWaalsContact N-O 3.15Å; Q112-H121 PolarHBondContact O-N 2.92Å; S119-H121 PolarHBondContact O-CD2 2.97Å; S119-H121 PolarHBondContact O-N 2.68Å; S119-H121 PolarHBondContact O-NE2 3.25Å; S119-H121 VanDerWaalsContact O-NE2 3.17Å; S119-H121 PolarHBondContact OG-CE1 2.84Å; S119-H121 VanDerWaalsContact OG-CE1 3.27Å; S119-H121 PolarHBondContact OG-NE2 3.15Å
122	L	58.5	Low	55.6	Low	3 Å²	3	66.1 Å²	66.1	2%	0.016	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	111.8	167.1	-169.9	100.9	0	0	0	107.2	I16 L27 L29 L39 V67 V109 L124	I16-L122 WeakPolarHBondContact CA-O 3.33Å; I16-L122 HydrophobicContact CB-CB 4.24Å; I16-L122 WeakPolarHBondContact CB-O 3.28Å; I16-L122 HydrophobicContact CD1-CD2 4.17Å; I16-L122 PolarHBondContact N-O 3.16Å; I16-L122 PolarHBondContact O-N 3.42Å; L27-L122 HydrophobicContact CD2-CB 4.48Å; L29-L122 HydrophobicContact CD1-CD1 3.69Å; L39-L122 HydrophobicContact CD2-CD2 4.48Å; V67-L122 HydrophobicContact CG1-CD2 4.14Å; V109-L122 HydrophobicContact CG1-CD1 3.57Å; V109-L122 HydrophobicContact CG1-CD2 4.34Å; V109-L122 HydrophobicContact CG1-CG 3.93Å; L122-L124 HydrophobicContact CD2-CD2 3.57Å; L122-L124 HydrophobicContact CD2-CG 4.3Å; L122-L124 HydrophobicContact CG-CD2 4.13Å
123	T	61.7	Low	56.3	Low	21 Å²	21	60.1 Å²	60.1	13%	0.129	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	125	174.8	-53.3	0	0	0	0	108.7	V15 G110 R125	V15-T123 HydrophobicContact CG2-CG2 4.47Å; G110-T123 PolarHBondContact N-O 2.73Å; G110-T123 PolarHBondContact O-N 2.73Å; T123-R125 HydrophobicContact CG2-CG 4Å
124	L	64.7	Low	57.2	Low	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	101.5	171.8	-54.9	-169.2	0	0	0	108.1	D13 I14 I16 L39 C41 L104 F107 D108 V109 L122	D13-L124 CarbonylContact C-O 3.5Å; D13-L124 VanDerWaalsContact CA-O 3.31Å; D13-L124 WeakPolarHBondContact CA-O 3.34Å; I14-L124 HydrophobicContact CB-CB 4.13Å; I14-L124 PolarHBondContact N-O 2.94Å; I14-L124 PolarHBondContact O-N 3.06Å; I16-L124 HydrophobicContact CD1-CD1 3.57Å; I16-L124 HydrophobicContact CD1-CG 4Å; I16-L124 HydrophobicContact CG1-CD1 4.32Å; I16-L124 HydrophobicContact CG1-CG 4.33Å; L39-L124 HydrophobicContact CD2-CD1 3.47Å; L39-L124 VanDerWaalsContact CD2-CD1 3.47Å; L39-L124 HydrophobicContact CD2-CD2 3.32Å; L39-L124 HydrophobicContact CD2-CG 4.02Å; C41-L124 HydrophobicContact CB-CD1 4.45Å; L104-L124 HydrophobicContact CD1-CD1 3.87Å; F107-L124 HydrophobicContact CB-CB 3.74Å; F107-L124 HydrophobicContact CD1-CB 4.03Å; F107-L124 HydrophobicContact CG-CB 4.02Å; D108-L124 CarbonylContact O-C 3.44Å; D108-L124 WeakPolarHBondContact O-CA 3.17Å; V109-L124 HydrophobicContact CB-CD2 4.39Å; V109-L124 HydrophobicContact CG1-CD2 4.18Å; V109-L124 HydrophobicContact CG2-CD2 3.96Å; L122-L124 HydrophobicContact CD2-CD2 3.57Å; L122-L124 HydrophobicContact CD2-CG 4.3Å; L122-L124 HydrophobicContact CG-CD2 4.13Å
125	R	62.1	Low	58.1	Low	127 Å²	127	57.5 Å²	57.5	48%	0.479	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	139.5	178.8	-64.7	-166.5	175.9	162.2	1	111.5	D13 F107 D108 T123 E127	D13-R125 WeakPolarHBondContact OD1-CA 3.27Å; D13-R125 WeakPolarHBondContact OD1-CB 3.32Å; F107-R125 CarbonylContact C-O 3.56Å; F107-R125 VanDerWaalsContact CA-O 3.28Å; F107-R125 WeakPolarHBondContact CA-O 3.44Å; D108-R125 HydrophobicContact CB-CB 4.34Å; D108-R125 PolarHBondContact N-O 3Å; D108-R125 PolarHBondContact O-N 2.99Å; T123-R125 HydrophobicContact CG2-CG 4Å; R125-E127 HydrophobicContact CB-CG 4.37Å
126	A	66.6	Low	58.8	Low	4 Å²	4	53.3 Å²	53.3	3%	0.033	28%	0.275	C	S	.	.			trans	-106.8	84.6	175.3	0	0	0	0	0	109.9	V11 K12 D13 F107 N128 S131	V11-A126 CarbonylContact C-O 3.32Å; K12-A126 VanDerWaalsContact O-CB 3.23Å; K12-A126 WeakPolarHBondContact O-CB 3.43Å; D13-A126 PolarHBondContact OD1-N 3.1Å; D13-A126 VanDerWaalsContact OD1-N 3.16Å; F107-A126 HydrophobicContact CD1-CB 3.8Å; F107-A126 HydrophobicContact CE1-CB 3.77Å; A126-N128 VanDerWaalsContact C-N 3.33Å; A126-S131 WeakPolarHBondContact CA-OG 3.19Å; A126-S131 VanDerWaalsContact CB-CB 3.41Å; A126-S131 VanDerWaalsContact CB-OG 3.27Å; A126-S131 WeakPolarHBondContact CB-OG 3.46Å
127	E	61.4	Low	59.7	Low	134 Å²	134	55.2 Å²	55.2	63%	0.626	28%	0.275	S	S	*	.			trans	-82.2	-11.1	-179.4	-62.5	-163.7	170.2	0	0	113.2	R125	R125-E127 HydrophobicContact CB-CG 4.37Å
128	N	61.1	Low	60.3	Low	67 Å²	67	53.8 Å²	53.8	36%	0.358	27%	0.266	S	S	.	.	S	Bend	trans	-144.8	163.9	-172.8	62	55.6	0	0	0	113.4	A126 A130 S131	A126-N128 VanDerWaalsContact C-N 3.33Å; N128-A130 PolarHBondContact O-N 2.9Å; N128-A130 VanDerWaalsContact OD1-CA 3.28Å; N128-A130 WeakPolarHBondContact OD1-CA 3.47Å; N128-A130 WeakPolarHBondContact OD1-CB 3.5Å; N128-A130 PolarHBondContact OD1-N 3.23Å; N128-S131 WeakPolarHBondContact O-CB 3.34Å; N128-S131 PolarHBondContact O-N 2.82Å; N128-S131 VanDerWaalsContact O-N 3.13Å; N128-S131 PolarHBondContact O-OG 2.77Å; N128-S131 PolarHBondContact OD1-N 3.41Å
129	E	62.4	Low	60.4	Low	175 Å²	175	50.6 Å²	50.6	82%	0.818	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-4.6	176.5	-61.4	-175.3	168.1	0	0	114	S131	E129-S131 VanDerWaalsContact C-N 3.35Å
130	A	64.6	Low	60.4	Low	57 Å²	57	52.3 Å²	52.3	47%	0.471	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-15.3	174.2	0	0	0	0	0	112.6	N128 K132	N128-A130 PolarHBondContact O-N 2.9Å; N128-A130 VanDerWaalsContact OD1-CA 3.28Å; N128-A130 WeakPolarHBondContact OD1-CA 3.47Å; N128-A130 WeakPolarHBondContact OD1-CB 3.5Å; N128-A130 PolarHBondContact OD1-N 3.23Å; A130-K132 PolarHBondContact O-N 3.17Å
131	S	66.4	Low	60	Low	1 Å²	1	53.2 Å²	53.2	1%	0.007	27%	0.273	C	S	.	.			trans	-65.5	111.8	172.8	-60.2	0	0	0	0	111.3	S105 G106 A126 N128 E129	S105-S131 CarbonylContact O-C 3.48Å; S105-S131 WeakPolarHBondContact O-CA 3.46Å; G106-S131 PolarHBondContact O-OG 3.11Å; A126-S131 WeakPolarHBondContact CA-OG 3.19Å; A126-S131 VanDerWaalsContact CB-CB 3.41Å; A126-S131 VanDerWaalsContact CB-OG 3.27Å; A126-S131 WeakPolarHBondContact CB-OG 3.46Å; N128-S131 WeakPolarHBondContact O-CB 3.34Å; N128-S131 PolarHBondContact O-N 2.82Å; N128-S131 VanDerWaalsContact O-N 3.13Å; N128-S131 PolarHBondContact O-OG 2.77Å; N128-S131 PolarHBondContact OD1-N 3.41Å; E129-S131 VanDerWaalsContact C-N 3.35Å
132	K	67.1	Low	59.3	Low	66 Å²	66	54.6 Å²	54.6	29%	0.287	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	137.7	-173.3	-69.8	178.6	-178.1	-178.9	0	111.5	I7 S105 A130 W134	I7-K132 HydrophobicContact CG2-CB 4.31Å; I7-K132 HydrophobicContact CG2-CD 4Å; I7-K132 HydrophobicContact CG2-CG 4.09Å; S105-K132 PolarHBondContact N-O 3.21Å; S105-K132 PolarHBondContact O-N 2.78Å; A130-K132 PolarHBondContact O-N 3.17Å; K132-W134 HydrophobicContact CB-CZ2 4.28Å; K132-W134 HydrophobicContact CD-CH2 4.12Å; K132-W134 HydrophobicContact CD-CZ2 3.51Å
133	I	69.4	Low	58.4	Low	3 Å²	3	58.8 Å²	58.8	2%	0.015	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.3	164.4	-47.8	-169.6	0	0	0	107.5	C8 I14 F85 F88 L102 L103 L104 F107	C8-I133 HydrophobicContact CB-CB 4.03Å; C8-I133 PolarHBondContact N-O 3.02Å; C8-I133 PolarHBondContact O-N 3.14Å; I14-I133 HydrophobicContact CD1-CD1 3.83Å; I14-I133 HydrophobicContact CD1-CG1 4.27Å; F85-I133 HydrophobicContact CD1-CD1 3.95Å; F85-I133 HydrophobicContact CE1-CD1 3.68Å; F88-I133 HydrophobicContact CD1-CD1 4.41Å; F88-I133 HydrophobicContact CE1-CD1 3.47Å; F88-I133 VanDerWaalsContact CE1-CD1 3.47Å; F88-I133 HydrophobicContact CE1-CG1 4.12Å; F88-I133 HydrophobicContact CE2-CD1 4.44Å; F88-I133 HydrophobicContact CZ-CD1 3.49Å; F88-I133 VanDerWaalsContact CZ-CD1 3.49Å; F88-I133 HydrophobicContact CZ-CG1 4.17Å; L102-I133 HydrophobicContact CB-CG2 4.43Å; L102-I133 HydrophobicContact CD2-CG2 4.35Å; L103-I133 CarbonylContact O-C 3.59Å; L103-I133 WeakPolarHBondContact O-CA 3.44Å; L104-I133 HydrophobicContact CD2-CB 3.93Å; L104-I133 HydrophobicContact CD2-CD1 3.75Å; L104-I133 HydrophobicContact CD2-CG1 3.49Å; L104-I133 VanDerWaalsContact CD2-CG1 3.49Å; L104-I133 HydrophobicContact CD2-CG2 3.69Å; F107-I133 HydrophobicContact CZ-CG1 4.13Å
134	W	66.5	Low	57.2	Low	46 Å²	46	61.4 Å²	61.4	17%	0.174	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	130.2	177	-47.2	77.1	0	0	0	109.5	A4 I7 L102 L103 S105 K132 V136	A4-W134 HydrophobicContact CB-CB 4.17Å; A4-W134 HydrophobicContact CB-CD2 4.49Å; A4-W134 HydrophobicContact CB-CE3 3.57Å; A4-W134 HydrophobicContact CB-CZ3 4.35Å; I7-W134 HydrophobicContact CD1-CE3 3.92Å; I7-W134 HydrophobicContact CD1-CH2 3.82Å; I7-W134 HydrophobicContact CD1-CZ3 3.32Å; I7-W134 HydrophobicContact CG1-CD2 4.49Å; I7-W134 HydrophobicContact CG1-CE3 3.66Å; I7-W134 HydrophobicContact CG1-CH2 4.42Å; I7-W134 HydrophobicContact CG1-CZ3 3.64Å; L102-W134 CarbonylContact C-O 3.53Å; L102-W134 WeakPolarHBondContact CA-O 3.48Å; L103-W134 HydrophobicContact CB-CB 4.1Å; L103-W134 HydrophobicContact CB-CG 4.47Å; L103-W134 HydrophobicContact CD2-CG 4.24Å; L103-W134 PolarHBondContact N-O 3.41Å; L103-W134 PolarHBondContact O-N 2.66Å; S105-W134 PolarHBondContact OG-NE1 3.12Å; K132-W134 HydrophobicContact CB-CZ2 4.28Å; K132-W134 HydrophobicContact CD-CH2 4.12Å; K132-W134 HydrophobicContact CD-CZ2 3.51Å; W134-V136 HydrophobicContact CB-CG1 3.88Å; W134-V136 PolarHBondContact O-N 3.47Å
135	I	64.5	Low	56	Low	14 Å²	14	62.9 Å²	62.9	7%	0.072	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	114	160.6	-63.9	162.8	0	0	0	106.6	A4 K6 L96 Q100 L102	A4-I135 WeakPolarHBondContact CA-O 2.7Å; A4-I135 VanDerWaalsContact CB-O 3.31Å; A4-I135 WeakPolarHBondContact CB-O 3.5Å; K6-I135 HydrophobicContact CB-CD1 3.91Å; K6-I135 HydrophobicContact CD-CD1 4.3Å; K6-I135 PolarHBondContact O-N 3.22Å; L96-I135 HydrophobicContact CD2-CD1 3.95Å; L96-I135 HydrophobicContact CD2-CG1 3.98Å; Q100-I135 HydrophobicContact CB-CG2 4.3Å; Q100-I135 HydrophobicContact CG-CG2 4.14Å; L102-I135 HydrophobicContact CD2-CG1 3.94Å
136	V	59.1	Low	54.6	Low	7 Å²	7	61.4 Å²	61.4	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	143.1	-175	-73.3	0	0	0	0	110.7	L101 L103 W134 F140	L101-V136 HydrophobicContact CB-CG2 3.99Å; L101-V136 WeakPolarHBondContact CB-O 3.28Å; L101-V136 HydrophobicContact CD2-CB 4.4Å; L101-V136 HydrophobicContact CD2-CG2 3.41Å; L101-V136 VanDerWaalsContact CD2-CG2 3.41Å; L101-V136 HydrophobicContact CG-CG2 3.55Å; L101-V136 WeakPolarHBondContact O-CG2 3.22Å; L101-V136 PolarHBondContact O-N 2.93Å; L103-V136 HydrophobicContact CB-CG1 4.08Å; L103-V136 HydrophobicContact CB-CG2 4.22Å; W134-V136 HydrophobicContact CB-CG1 3.88Å; W134-V136 PolarHBondContact O-N 3.47Å; V136-F140 HydrophobicContact CB-CB 4.27Å; V136-F140 HydrophobicContact CB-CD1 3.72Å; V136-F140 HydrophobicContact CB-CE1 4.49Å; V136-F140 HydrophobicContact CB-CG 4.26Å; V136-F140 HydrophobicContact CG1-CD1 3.45Å; V136-F140 VanDerWaalsContact CG1-CD1 3.45Å; V136-F140 HydrophobicContact CG1-CE1 3.79Å; V136-F140 HydrophobicContact CG1-CG 4.1Å; V136-F140 HydrophobicContact CG2-CD1 4.4Å
137	E	55.7	Low	53.3	Low	118 Å²	118	64 Å²	64	55%	0.551	37%	0.37	S	S	*	.			trans	-74.1	154.7	169.3	-64.7	-169.1	152	0	0	110.8	A139 F140	E137-A139 PolarHBondContact O-N 2.99Å; E137-F140 WeakPolarHBondContact O-CB 3.46Å; E137-F140 PolarHBondContact O-N 2.81Å
138	T	50.8	Low	52.2	Low	112 Å²	112	64.9 Å²	64.9	69%	0.687	37%	0.367	S	S	*	.	H	α-helix	trans	-57.6	-31.6	173.8	48.5	0	0	0	0	112.3	F140 L141 S142	T138-F140 VanDerWaalsContact C-N 3.31Å; T138-F140 PolarHBondContact O-N 3.21Å; T138-L141 PolarHBondContact O-N 2.66Å; T138-S142 PolarHBondContact O-N 2.88Å; T138-S142 PolarHBondContact O-OG 2.74Å
139	A	45.7	Very low	51.3	Low	57 Å²	57	67.6 Å²	67.6	47%	0.471	39%	0.391	S	S	.	.	H	α-helix	trans	-61.6	-35.4	174.6	0	0	0	0	0	113	E137 L141 S142 S143	E137-A139 PolarHBondContact O-N 2.99Å; A139-L141 VanDerWaalsContact C-N 3.32Å; A139-L141 PolarHBondContact O-N 3.48Å; A139-S142 WeakPolarHBondContact O-CB 3.4Å; A139-S142 PolarHBondContact O-N 2.97Å; A139-S142 VanDerWaalsContact O-N 3.15Å; A139-S143 PolarHBondContact O-N 2.78Å
140	F	47.4	Very low	51.2	Low	39 Å²	39	61.8 Å²	61.8	17%	0.171	38%	0.379	C	S	.	.	H	α-helix	trans	-63.5	-36.9	178.4	172.2	-100.9	0	0	0	112.2	P3 L103 V136 E137 T138 S142 S143 T144	P3-F140 HydrophobicContact CB-CD2 3.07Å; P3-F140 HydrophobicContact CB-CE2 3.08Å; P3-F140 HydrophobicContact CB-CG 3.92Å; P3-F140 HydrophobicContact CB-CZ 3.96Å; P3-F140 HydrophobicContact CG-CD2 4.17Å; P3-F140 HydrophobicContact CG-CE2 3.67Å; P3-F140 HydrophobicContact CG-CZ 4.27Å; L103-F140 HydrophobicContact CD2-CE1 3.93Å; L103-F140 HydrophobicContact CD2-CZ 4.33Å; V136-F140 HydrophobicContact CB-CB 4.27Å; V136-F140 HydrophobicContact CB-CD1 3.72Å; V136-F140 HydrophobicContact CB-CE1 4.49Å; V136-F140 HydrophobicContact CB-CG 4.26Å; V136-F140 HydrophobicContact CG1-CD1 3.45Å; V136-F140 VanDerWaalsContact CG1-CD1 3.45Å; V136-F140 HydrophobicContact CG1-CE1 3.79Å; V136-F140 HydrophobicContact CG1-CG 4.1Å; V136-F140 HydrophobicContact CG2-CD1 4.4Å; E137-F140 WeakPolarHBondContact O-CB 3.46Å; E137-F140 PolarHBondContact O-N 2.81Å; T138-F140 VanDerWaalsContact C-N 3.31Å; T138-F140 PolarHBondContact O-N 3.21Å; F140-S142 VanDerWaalsContact C-N 3.3Å; F140-S142 PolarHBondContact O-N 3.26Å; F140-S143 PolarHBondContact O-N 2.92Å; F140-S143 PolarHBondContact O-OG 2.95Å; F140-T144 VanDerWaalsContact CD2-OG1 3.25Å; F140-T144 WeakPolarHBondContact CD2-OG1 3.41Å; F140-T144 HydrophobicContact CE2-CG2 3.89Å; F140-T144 WeakPolarHBondContact CE2-OG1 3.44Å; F140-T144 HydrophobicContact CZ-CG2 3.87Å; F140-T144 WeakPolarHBondContact O-CB 3.31Å; F140-T144 PolarHBondContact O-N 3.36Å; F140-T144 VanDerWaalsContact O-N 3.11Å; F140-T144 PolarHBondContact O-OG1 3.17Å
141	L	46.8	Very low	51.4	Low	18 Å²	18	60.8 Å²	60.8	9%	0.094	36%	0.363	C	S	.	.	H	α-helix	trans	-67.6	-34.1	175.4	-67.6	-172.2	0	0	0	112.5	V42 L101 T138 A139 S143 L145 R227	V42-L141 HydrophobicContact CG1-CD1 3.95Å; V42-L141 HydrophobicContact CG1-CD2 4.01Å; V42-L141 HydrophobicContact CG2-CD2 4.34Å; L101-L141 HydrophobicContact CD1-CD1 4.11Å; L101-L141 HydrophobicContact CD2-CD1 3.26Å; L101-L141 HydrophobicContact CD2-CD2 4.01Å; L101-L141 HydrophobicContact CD2-CG 3.39Å; L101-L141 HydrophobicContact CG-CD1 4.28Å; T138-L141 PolarHBondContact O-N 2.66Å; A139-L141 VanDerWaalsContact C-N 3.32Å; A139-L141 PolarHBondContact O-N 3.48Å; L141-S143 VanDerWaalsContact C-N 3.25Å; L141-S143 PolarHBondContact O-N 2.89Å; L141-L145 HydrophobicContact CB-CD1 4.06Å; L141-L145 HydrophobicContact CD1-CD1 4.26Å; L141-L145 HydrophobicContact CD2-CD1 3.46Å; L141-L145 VanDerWaalsContact CD2-CD1 3.46Å; L141-L145 HydrophobicContact CD2-CG 3.97Å; L141-L145 HydrophobicContact CG-CD1 4.11Å; L141-L145 PolarHBondContact O-N 3.16Å; L141-R227 PolarHBondContact O-NH2 2.89Å
142	S	42.7	Very low	51.9	Low	77 Å²	77	61.4 Å²	61.4	54%	0.538	37%	0.366	S	S	.	.	H	α-helix	trans	-66.1	-31.3	178.8	-56	0	0	0	0	111.8	T138 A139 F140	T138-S142 PolarHBondContact O-N 2.88Å; T138-S142 PolarHBondContact O-OG 2.74Å; A139-S142 WeakPolarHBondContact O-CB 3.4Å; A139-S142 PolarHBondContact O-N 2.97Å; A139-S142 VanDerWaalsContact O-N 3.15Å; F140-S142 VanDerWaalsContact C-N 3.3Å; F140-S142 PolarHBondContact O-N 3.26Å
143	S	39.6	Very low	52.4	Low	91 Å²	91	59.1 Å²	59.1	64%	0.636	36%	0.358	S	S	*	.	H	α-helix	trans	-89.6	-26.9	-178.9	61.1	0	0	0	0	115	A139 F140 L141	A139-S143 PolarHBondContact O-N 2.78Å; F140-S143 PolarHBondContact O-N 2.92Å; F140-S143 PolarHBondContact O-OG 2.95Å; L141-S143 VanDerWaalsContact C-N 3.25Å; L141-S143 PolarHBondContact O-N 2.89Å
144	T	36	Very low	53.2	Low	77 Å²	77	59.2 Å²	59.2	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-118.6	-27.6	-161.1	-28.4	0	0	0	0	114.3	F140	F140-T144 VanDerWaalsContact CD2-OG1 3.25Å; F140-T144 WeakPolarHBondContact CD2-OG1 3.41Å; F140-T144 HydrophobicContact CE2-CG2 3.89Å; F140-T144 WeakPolarHBondContact CE2-OG1 3.44Å; F140-T144 HydrophobicContact CZ-CG2 3.87Å; F140-T144 WeakPolarHBondContact O-CB 3.31Å; F140-T144 PolarHBondContact O-N 3.36Å; F140-T144 VanDerWaalsContact O-N 3.11Å; F140-T144 PolarHBondContact O-OG1 3.17Å
145	L	40.6	Very low	53.7	Low	31 Å²	31	59.9 Å²	59.9	16%	0.162	37%	0.37	C	S	.	.	S	Bend	trans	-79.3	136.2	171.8	-69.4	174.1	0	0	0	108.8	L141 A147	L141-L145 HydrophobicContact CB-CD1 4.06Å; L141-L145 HydrophobicContact CD1-CD1 4.26Å; L141-L145 HydrophobicContact CD2-CD1 3.46Å; L141-L145 VanDerWaalsContact CD2-CD1 3.46Å; L141-L145 HydrophobicContact CD2-CG 3.97Å; L141-L145 HydrophobicContact CG-CD1 4.11Å; L141-L145 PolarHBondContact O-N 3.16Å; L145-A147 VanDerWaalsContact C-N 3.28Å; L145-A147 PolarHBondContact O-N 3.31Å
146	P	33.3	Very low	54.3	Low	95 Å²	95	62.6 Å²	62.6	62%	0.617	39%	0.385	S	S	*	.			trans	-66.8	88.7	176.9	27.3	-32.3	0	0	0	109.6	R148	P146-R148 PolarHBondContact O-N 3.07Å
147	A	38.5	Very low	55.2	Low	59 Å²	59	62.3 Å²	62.3	49%	0.488	38%	0.383	S	S	.	.			trans	-66.3	119.6	143.9	0	0	0	0	0	104.5	L145 S149	L145-A147 VanDerWaalsContact C-N 3.28Å; L145-A147 PolarHBondContact O-N 3.31Å; A147-S149 PolarHBondContact O-N 2.96Å
148	R	38.6	Very low	55.6	Low	152 Å²	152	62.5 Å²	62.5	57%	0.574	38%	0.38	S	S	*	.			trans	-52	112.5	164.1	-79.6	-172.5	175.2	175.4	0.2	106	P146 I152 M159 S160	P146-R148 PolarHBondContact O-N 3.07Å; R148-I152 HydrophobicContact CB-CD1 4.5Å; R148-M159 PolarHBondContact NH1-O 3.44Å; R148-S160 PolarHBondContact NH1-OG 3.41Å
149	S	42.6	Very low	55.7	Low	124 Å²	124	64.4 Å²	64.4	87%	0.867	38%	0.382	S	S	*	.			trans	-68.9	134.4	177	46	0	0	0	0	107.8	A147	A147-S149 PolarHBondContact O-N 2.96Å
150	G	59.9	Low	56	Low	54 Å²	54	62.3 Å²	62.3	56%	0.557	36%	0.364	S	S	*	.	S	Bend	trans	113.5	159	177.6	0	0	0	0	0	114.4	I152	G150-I152 PolarHBondContact O-N 3.44Å
151	Y	67.5	Low	56.2	Low	35 Å²	35	62.5 Å²	62.5	14%	0.137	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-68.3	118.9	174.8	162.6	-114.7	0	0	0	110	P153 Y167 D191 L411 Y412	Y151-P153 HydrophobicContact CE1-CG 4.34Å; Y151-Y167 HydrophobicContact CD2-CD2 4.09Å; Y151-Y167 HydrophobicContact CD2-CG 4.35Å; Y151-Y167 VanDerWaalsContact CE2-O 3.28Å; Y151-Y167 WeakPolarHBondContact CE2-O 3.36Å; Y151-D191 VanDerWaalsContact OH-CB 3.23Å; Y151-D191 WeakPolarHBondContact OH-CB 3.44Å; Y151-D191 PolarHBondContact OH-OD2 2.95Å; Y151-L411 HydrophobicContact CE1-CD2 4.04Å; Y151-L411 WeakPolarHBondContact OH-CD2 3.34Å; Y151-Y412 HydrophobicContact CE1-CE1 4.25Å
152	I	77.5	Confident	56.7	Low	15 Å²	15	64.7 Å²	64.7	8%	0.077	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-90.2	122.4	170.1	-60.7	175.1	0	0	0	108	R148 G150 D156 L164 L166	R148-I152 HydrophobicContact CB-CD1 4.5Å; G150-I152 PolarHBondContact O-N 3.44Å; I152-D156 HydrophobicContact CG2-CB 4.45Å; I152-L164 HydrophobicContact CD1-CB 4.3Å; I152-L164 HydrophobicContact CD1-CD2 3.77Å; I152-L166 WeakPolarHBondContact O-CD1 3.34Å
153	P	78.6	Confident	57.7	Low	17 Å²	17	63.4 Å²	63.4	11%	0.11	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-64.3	146.8	176.5	-18.9	33.5	0	0	0	111.2	Y151 S155 D156 S193 Y412	Y151-P153 HydrophobicContact CE1-CG 4.34Å; P153-S155 PolarHBondContact O-N 2.83Å; P153-D156 PolarHBondContact O-N 2.79Å; P153-S193 WeakPolarHBondContact CB-OG 3.19Å; P153-Y412 WeakPolarHBondContact CB-OH 3.35Å; P153-Y412 WeakPolarHBondContact CG-OH 3.42Å
154	L	85.9	Confident	59.2	Low	5 Å²	5	59.3 Å²	59.3	3%	0.026	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-61	-23.1	175.7	-70.3	175.7	0	0	0	113	D156 L157 L166 A168 L189 I190 D191 S193 I194 V200	L154-D156 PolarHBondContact O-N 2.71Å; L154-L157 HydrophobicContact CD2-CD1 3.98Å; L154-L157 HydrophobicContact CD2-CD2 4.4Å; L154-L157 WeakPolarHBondContact O-CD1 3.41Å; L154-L157 VanDerWaalsContact O-CG 3.29Å; L154-L157 WeakPolarHBondContact O-CG 2.98Å; L154-L166 HydrophobicContact CD2-CD1 3.76Å; L154-L166 HydrophobicContact CD2-CD2 3.72Å; L154-L166 HydrophobicContact CD2-CG 4.31Å; L154-L166 HydrophobicContact CG-CD1 4.28Å; L154-A168 HydrophobicContact CD1-CB 4.2Å; L154-L189 HydrophobicContact CD1-CB 4.16Å; L154-I190 VanDerWaalsContact CD1-C 3.49Å; L154-D191 WeakPolarHBondContact CB-OD2 3.4Å; L154-D191 HydrophobicContact CD1-CB 4.23Å; L154-D191 VanDerWaalsContact CG-OD2 3.31Å; L154-D191 WeakPolarHBondContact CG-OD2 3.33Å; L154-D191 PolarHBondContact N-OD2 3.38Å; L154-S193 PolarHBondContact N-OG 2.83Å; L154-S193 VanDerWaalsContact N-OG 3.13Å; L154-I194 HydrophobicContact CB-CD1 4.09Å; L154-I194 HydrophobicContact CB-CG1 4.26Å; L154-I194 HydrophobicContact CB-CG2 3.57Å; L154-I194 HydrophobicContact CD1-CD1 3.64Å; L154-I194 HydrophobicContact CD1-CG1 4.17Å; L154-V200 HydrophobicContact CB-CG2 4.2Å; L154-V200 HydrophobicContact CD1-CG2 4.48Å; L154-V200 HydrophobicContact CD2-CB 4.22Å; L154-V200 HydrophobicContact CD2-CG1 4.43Å; L154-V200 HydrophobicContact CD2-CG2 4.21Å
155	S	77.1	Confident	61.2	Low	60 Å²	60	56.6 Å²	56.6	42%	0.42	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-65.6	-26.3	172.2	60.9	0	0	0	0	113.4	P153 S193	P153-S155 PolarHBondContact O-N 2.83Å; S155-S193 PolarHBondContact N-OG 2.75Å; S155-S193 WeakPolarHBondContact OG-CB 3.1Å; S155-S193 PolarHBondContact OG-OG 2.94Å
156	D	76.3	Confident	63.4	Low	72 Å²	72	55.2 Å²	55.2	39%	0.385	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-108.4	14.7	-165.6	-59.4	-7.7	0	0	0	112.6	I152 P153 L154 Y158 M159	I152-D156 HydrophobicContact CG2-CB 4.45Å; P153-D156 PolarHBondContact O-N 2.79Å; L154-D156 PolarHBondContact O-N 2.71Å; D156-Y158 PolarHBondContact O-N 2.8Å; D156-M159 PolarHBondContact O-N 3.35Å; D156-M159 VanDerWaalsContact O-N 3.09Å
157	L	77.3	Confident	66.1	Low	1 Å²	1	51.2 Å²	51.2	1%	0.005	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-57.3	-32.7	-177	-66.7	173.9	0	0	0	113	L154 M159 L164 V200 V237 L239	L154-L157 HydrophobicContact CD2-CD1 3.98Å; L154-L157 HydrophobicContact CD2-CD2 4.4Å; L154-L157 WeakPolarHBondContact O-CD1 3.41Å; L154-L157 VanDerWaalsContact O-CG 3.29Å; L154-L157 WeakPolarHBondContact O-CG 2.98Å; L157-M159 VanDerWaalsContact C-N 3.34Å; L157-M159 PolarHBondContact O-N 3.25Å; L157-L164 HydrophobicContact CD2-CD1 3.47Å; L157-L164 VanDerWaalsContact CD2-CD1 3.47Å; L157-V200 HydrophobicContact CD1-CG1 3.98Å; L157-V200 HydrophobicContact CD1-CG2 4.01Å; L157-V237 HydrophobicContact CB-CG1 3.9Å; L157-V237 HydrophobicContact CD1-CB 4.35Å; L157-V237 HydrophobicContact CD1-CG1 3.59Å; L157-V237 HydrophobicContact CG-CG1 4.4Å; L157-L239 HydrophobicContact CD1-CD2 4.07Å; L157-L239 HydrophobicContact CD2-CD2 4.19Å
158	Y	64.8	Low	68.7	Low	122 Å²	122	48.4 Å²	48.4	48%	0.478	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-71.6	-22.6	179.2	-82.4	-66.3	0	0	0	114.6	D156 S160 K232 V237	D156-Y158 PolarHBondContact O-N 2.8Å; Y158-S160 VanDerWaalsContact C-N 3.25Å; Y158-S160 PolarHBondContact O-N 3.06Å; Y158-K232 HydrophobicContact CE1-CB 3.88Å; Y158-K232 HydrophobicContact CE1-CD 4.05Å; Y158-K232 HydrophobicContact CE1-CG 4.36Å; Y158-K232 WeakPolarHBondContact OH-CB 3.34Å; Y158-K232 WeakPolarHBondContact OH-CD 3.27Å; Y158-K232 WeakPolarHBondContact OH-CE 2.9Å; Y158-K232 WeakPolarHBondContact OH-CG 3.23Å; Y158-V237 HydrophobicContact CD2-CG2 3.56Å; Y158-V237 HydrophobicContact CE1-CG2 4.2Å; Y158-V237 HydrophobicContact CE2-CB 4.41Å; Y158-V237 HydrophobicContact CE2-CG2 2.96Å; Y158-V237 HydrophobicContact CG-CG2 4.38Å; Y158-V237 WeakPolarHBondContact OH-CG2 2.78Å
159	M	53.9	Low	71.3	Confident	151 Å²	151	41.2 Å²	41.2	74%	0.744	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-85.8	0.5	-176.7	-77.7	-164.2	49.2	0	0	113.6	R148 D156 L157	R148-M159 PolarHBondContact NH1-O 3.44Å; D156-M159 PolarHBondContact O-N 3.35Å; D156-M159 VanDerWaalsContact O-N 3.09Å; L157-M159 VanDerWaalsContact C-N 3.34Å; L157-M159 PolarHBondContact O-N 3.25Å
160	S	51	Low	73.7	Confident	13 Å²	13	35.5 Å²	35.5	9%	0.091	22%	0.217	C	C	.	.	S	Bend	trans	-128	129.1	-166.8	-55.9	0	0	0	0	107.6	R148 Y158	R148-S160 PolarHBondContact NH1-OG 3.41Å; Y158-S160 VanDerWaalsContact C-N 3.25Å; Y158-S160 PolarHBondContact O-N 3.06Å
161	G	52.8	Low	74.9	Confident	43 Å²	43	35 Å²	35	44%	0.443	21%	0.206	S	C	.	.			trans	-58.5	-164.5	-169.2	0	0	0	0	0	115.9	S163 L164	G161-S163 PolarHBondContact O-N 2.82Å; G161-L164 WeakPolarHBondContact O-CD2 3.23Å
162	P	56.4	Low	75.9	Confident	65 Å²	65	36.1 Å²	36.1	42%	0.422	22%	0.218	S	C	.	.	S	Bend	trans	-66.6	-8	-161.2	26.5	-36	0	0	0	116	S229	P162-S229 WeakPolarHBondContact O-CA 3.31Å; P162-S229 WeakPolarHBondContact O-CB 3.45Å; P162-S229 PolarHBondContact O-OG 3.46Å
163	S	63.4	Low	76.6	Confident	50 Å²	50	39.7 Å²	39.7	35%	0.35	23%	0.231	S	C	.	.	S	Bend	trans	-148.3	125	-176.6	-68.3	0	0	0	0	111	G161 I228	G161-S163 PolarHBondContact O-N 2.82Å; S163-I228 CarbonylContact C-O 3.36Å; S163-I228 WeakPolarHBondContact CA-O 3.48Å
164	L	70.5	Confident	77.4	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	141	-168.5	-53.8	178.5	0	0	0	112.1	I152 L157 G161 R227 I228 C230	I152-L164 HydrophobicContact CD1-CB 4.3Å; I152-L164 HydrophobicContact CD1-CD2 3.77Å; L157-L164 HydrophobicContact CD2-CD1 3.47Å; L157-L164 VanDerWaalsContact CD2-CD1 3.47Å; G161-L164 WeakPolarHBondContact O-CD2 3.23Å; L164-R227 WeakPolarHBondContact O-CA 3.16Å; L164-R227 PolarHBondContact O-N 2.91Å; L164-I228 HydrophobicContact CB-CG2 4.12Å; L164-I228 PolarHBondContact N-O 2.84Å; L164-I228 PolarHBondContact O-N 3.03Å; L164-C230 HydrophobicContact CD1-CB 4.28Å
165	G	78.4	Confident	77.6	Confident	21 Å²	21	50 Å²	50	22%	0.216	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.7	154.5	0	0	0	0	0	108.3	F225	G165-F225 WeakPolarHBondContact CA-O 3.29Å
166	L	86.6	Confident	78.3	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	140.8	-173	173.4	69	0	0	0	110.8	I152 L154 L189 R224 F225 I228 L239	I152-L166 WeakPolarHBondContact O-CD1 3.34Å; L154-L166 HydrophobicContact CD2-CD1 3.76Å; L154-L166 HydrophobicContact CD2-CD2 3.72Å; L154-L166 HydrophobicContact CD2-CG 4.31Å; L154-L166 HydrophobicContact CG-CD1 4.28Å; L166-L189 HydrophobicContact CD2-CD1 4.48Å; L166-R224 CarbonylContact O-C 3.53Å; L166-R224 WeakPolarHBondContact O-CA 3.39Å; L166-F225 HydrophobicContact CB-CB 4.26Å; L166-F225 HydrophobicContact CB-CD2 4.26Å; L166-F225 HydrophobicContact CD2-CD2 3.9Å; L166-F225 HydrophobicContact CD2-CE2 4.34Å; L166-F225 HydrophobicContact CG-CD2 4.26Å; L166-F225 PolarHBondContact N-O 2.69Å; L166-F225 VanDerWaalsContact N-O 3.13Å; L166-F225 PolarHBondContact O-N 2.79Å; L166-I228 HydrophobicContact CB-CG2 4.22Å; L166-I228 HydrophobicContact CD2-CG2 4.32Å; L166-L239 HydrophobicContact CD2-CD1 3.32Å
167	Y	90.4	Very high	78.9	Confident	12 Å²	12	55.3 Å²	55.3	5%	0.047	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142.6	163.8	-67.9	-95.2	0	0	0	109.3	Y151 I223 R224 D277 Q280 V281	Y151-Y167 HydrophobicContact CD2-CD2 4.09Å; Y151-Y167 HydrophobicContact CD2-CG 4.35Å; Y151-Y167 VanDerWaalsContact CE2-O 3.28Å; Y151-Y167 WeakPolarHBondContact CE2-O 3.36Å; Y167-I223 CarbonylContact C-O 3.59Å; Y167-I223 WeakPolarHBondContact CA-O 3.29Å; Y167-R224 HydrophobicContact CD1-CB 3.9Å; Y167-R224 HydrophobicContact CD1-CG 4.15Å; Y167-R224 HydrophobicContact CE1-CB 3.59Å; Y167-R224 HydrophobicContact CE1-CG 3.56Å; Y167-R224 HydrophobicContact CE2-CG 4.22Å; Y167-R224 WeakPolarHBondContact OH-CD 3.43Å; Y167-R224 PolarHBondContact OH-NE 3.21Å; Y167-D277 WeakPolarHBondContact OH-CA 3.45Å; Y167-D277 WeakPolarHBondContact OH-CB 3.28Å; Y167-D277 PolarHBondContact OH-OD1 3.48Å; Y167-Q280 HydrophobicContact CD1-CB 4.02Å; Y167-Q280 HydrophobicContact CD2-CB 4.27Å; Y167-Q280 HydrophobicContact CD2-CG 4.42Å; Y167-Q280 HydrophobicContact CE1-CB 4.07Å; Y167-Q280 HydrophobicContact CE2-CB 4.32Å; Y167-Q280 HydrophobicContact CE2-CG 4.32Å; Y167-Q280 HydrophobicContact CG-CB 4.13Å; Y167-V281 HydrophobicContact CD1-CG2 4.41Å; Y167-V281 HydrophobicContact CE1-CG2 4.22Å
168	A	93.4	Very high	79.3	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	163.3	173.2	0	0	0	0	0	110.8	L154 L189 V222 I223	L154-A168 HydrophobicContact CD1-CB 4.2Å; A168-L189 HydrophobicContact CB-CB 3.99Å; A168-L189 HydrophobicContact CB-CD1 4.42Å; A168-L189 HydrophobicContact CB-CD2 4.25Å; A168-L189 HydrophobicContact CB-CG 4.46Å; A168-V222 CarbonylContact O-C 3.54Å; A168-V222 WeakPolarHBondContact O-CA 3.38Å; A168-I223 HydrophobicContact CB-CG2 4.11Å; A168-I223 PolarHBondContact N-O 3.24Å; A168-I223 WeakPolarHBondContact O-CG2 3.34Å; A168-I223 PolarHBondContact O-N 3.03Å
169	V	92.3	Very high	80.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	134.5	165.1	173.5	0	0	0	0	109.2	L189 I190 F220 Y221 V222 L284 W287 Y288	V169-L189 CarbonylContact O-C 3.48Å; V169-L189 WeakPolarHBondContact O-CA 3.41Å; V169-I190 HydrophobicContact CB-CG1 3.99Å; V169-I190 HydrophobicContact CG1-CG1 4.22Å; V169-I190 PolarHBondContact N-O 3.22Å; V169-I190 PolarHBondContact O-N 3.11Å; V169-F220 HydrophobicContact CG1-CD2 3.95Å; V169-Y221 CarbonylContact C-O 3.59Å; V169-Y221 WeakPolarHBondContact CA-O 3.43Å; V169-V222 HydrophobicContact CG2-CG2 4.32Å; V169-L284 HydrophobicContact CG2-CB 4.04Å; V169-L284 HydrophobicContact CG2-CD2 4.41Å; V169-W287 HydrophobicContact CB-CZ3 4.24Å; V169-W287 HydrophobicContact CG2-CE3 4.15Å; V169-W287 HydrophobicContact CG2-CZ3 3.86Å; V169-Y288 HydrophobicContact CB-CG 4.41Å; V169-Y288 HydrophobicContact CG1-CD1 3.67Å; V169-Y288 HydrophobicContact CG1-CD2 3.8Å; V169-Y288 HydrophobicContact CG1-CE1 3.83Å; V169-Y288 HydrophobicContact CG1-CE2 4.05Å; V169-Y288 HydrophobicContact CG1-CG 3.6Å; V169-Y288 HydrophobicContact CG2-CG 4.28Å
170	V	93.5	Very high	81.6	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.03	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	103.5	171	-176	0	0	0	0	108.1	S172 W173 L187 K188 L189 Y221 I223	V170-S172 WeakPolarHBondContact CG1-O 3.46Å; V170-W173 HydrophobicContact CG1-CB 4.18Å; V170-L187 HydrophobicContact CG1-CB 4.36Å; V170-L187 HydrophobicContact CG1-CD2 3.86Å; V170-L187 HydrophobicContact CG2-CD1 4.46Å; V170-K188 WeakPolarHBondContact CA-O 3.2Å; V170-L189 HydrophobicContact CG2-CD2 3.89Å; V170-Y221 PolarHBondContact N-O 2.73Å; V170-I223 HydrophobicContact CG2-CB 3.99Å; V170-I223 HydrophobicContact CG2-CG2 3.73Å
171	S	84.5	Confident	83.2	Confident	44 Å²	44	58.4 Å²	58.4	31%	0.308	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-31.5	178.3	62.1	0	0	0	0	112.6	K188	S171-K188 PolarHBondContact N-O 2.85Å; S171-K188 PolarHBondContact OG-O 3.47Å
172	S	89	Confident	84.8	Confident	58 Å²	58	56.5 Å²	56.5	41%	0.406	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.2	172.1	61.7	0	0	0	0	111.2	V170 K188	V170-S172 WeakPolarHBondContact CG1-O 3.46Å; S172-K188 PolarHBondContact O-N 2.8Å; S172-K188 VanDerWaalsContact OG-CB 3.31Å; S172-K188 WeakPolarHBondContact OG-CB 3.46Å; S172-K188 WeakPolarHBondContact OG-CG 3.41Å
173	W	93.7	Very high	86.4	Confident	89 Å²	89	57.3 Å²	57.3	34%	0.337	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	151.9	-179.9	59.2	-92.2	0	0	0	111.1	V170 C175 L185 T186 L187 L215 Y221	V170-W173 HydrophobicContact CG1-CB 4.18Å; W173-C175 HydrophobicContact CZ3-CB 4.28Å; W173-L185 HydrophobicContact CB-CD1 4.26Å; W173-L185 HydrophobicContact CE3-CD1 4.19Å; W173-T186 CarbonylContact C-O 3.57Å; W173-T186 VanDerWaalsContact CA-O 3.23Å; W173-T186 WeakPolarHBondContact CA-O 3.34Å; W173-L187 HydrophobicContact CB-CD2 3.47Å; W173-L187 VanDerWaalsContact CB-CD2 3.47Å; W173-L215 HydrophobicContact CB-CD1 4.43Å; W173-L215 HydrophobicContact CD2-CB 4.09Å; W173-L215 HydrophobicContact CD2-CD1 3.6Å; W173-L215 HydrophobicContact CD2-CG 4.46Å; W173-L215 HydrophobicContact CE3-CB 4.26Å; W173-L215 HydrophobicContact CE3-CD1 3.63Å; W173-L215 HydrophobicContact CG-CD1 3.96Å; W173-L215 HydrophobicContact CH2-CB 3.7Å; W173-L215 HydrophobicContact CZ2-CB 3.48Å; W173-L215 VanDerWaalsContact CZ2-CB 3.48Å; W173-L215 HydrophobicContact CZ3-CB 4.08Å; W173-L215 HydrophobicContact CZ3-CD1 4.12Å; W173-Y221 AromaticContact NE1-CE2 3.97Å
174	R	93.5	Very high	87.8	Confident	182 Å²	182	56.3 Å²	56.3	69%	0.687	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	123.5	172.5	-175.9	177.1	-179.6	174.1	0.5	109.5	L185 T186	R174-L185 WeakPolarHBondContact O-CA 3.46Å; R174-T186 PolarHBondContact N-O 3.38Å; R174-T186 PolarHBondContact O-N 3.45Å
175	C	91.5	Very high	88.9	Confident	57 Å²	57	56.2 Å²	56.2	39%	0.385	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	137	171.1	-172.2	0	0	0	0	109.5	W173 S184 L185 I212	W173-C175 HydrophobicContact CZ3-CB 4.28Å; C175-S184 CarbonylContact C-O 3.53Å; C175-S184 WeakPolarHBondContact CA-O 3.44Å; C175-L185 HydrophobicContact CB-CD1 4.27Å; C175-I212 WeakPolarHBondContact SG-CD1 3.41Å
176	Q	90.9	Very high	89.7	Confident	110 Å²	110	57.4 Å²	57.4	51%	0.514	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.2	174.7	176.4	173.3	0.7	0	0	109.3	K183 S184	Q176-K183 CarbonylContact O-C 3.6Å; Q176-K183 WeakPolarHBondContact O-CA 3.47Å; Q176-S184 PolarHBondContact N-O 2.99Å; Q176-S184 PolarHBondContact O-N 2.86Å
177	E	88.6	Confident	90.1	Very high	134 Å²	134	57.6 Å²	57.6	63%	0.626	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	131.1	166.8	-167.3	160.3	-151.9	0	0	108.7
178	N	86.2	Confident	90.3	Very high	37 Å²	37	60.3 Å²	60.3	20%	0.198	31%	0.312	C	S	.	.			trans	-94.8	162.6	-178	-55.8	-50.6	0	0	0	109.9	D180 G181 S182 S184	N178-D180 VanDerWaalsContact CB-OD1 3.23Å; N178-D180 WeakPolarHBondContact CB-OD1 3.49Å; N178-D180 PolarHBondContact O-N 3.38Å; N178-D180 VanDerWaalsContact O-N 3.14Å; N178-G181 PolarHBondContact O-N 2.82Å; N178-S182 WeakPolarHBondContact CB-O 3.42Å; N178-S182 PolarHBondContact N-O 2.75Å; N178-S182 PolarHBondContact ND2-O 3.26Å; N178-S182 PolarHBondContact ND2-OG 2.81Å; N178-S184 PolarHBondContact ND2-OG 3.42Å; N178-S184 PolarHBondContact OD1-OG 3.36Å
179	N	84.8	Confident	90.3	Very high	182 Å²	182	60.3 Å²	60.3	97%	0.973	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.5	-178.1	-64	-11.3	0	0	0	114	G181	N179-G181 PolarHBondContact O-N 2.93Å
180	D	83.6	Confident	90.2	Very high	95 Å²	95	60.5 Å²	60.5	51%	0.508	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	6.9	176.5	64.7	-7.4	0	0	0	113	N178 S182 K205	N178-D180 VanDerWaalsContact CB-OD1 3.23Å; N178-D180 WeakPolarHBondContact CB-OD1 3.49Å; N178-D180 PolarHBondContact O-N 3.38Å; N178-D180 VanDerWaalsContact O-N 3.14Å; D180-S182 PolarHBondContact O-N 2.85Å; D180-S182 WeakPolarHBondContact OD1-CB 3.14Å; D180-S182 PolarHBondContact OD1-N 2.81Å; D180-S182 PolarHBondContact OD1-OG 2.84Å; D180-S182 PolarHBondContact OD2-OG 2.99Å; D180-K205 IonicContact OD2-NZ 2.92Å; D180-K205 PolarHBondContact OD2-NZ 2.99Å
181	G	83	Confident	89.8	Confident	37 Å²	37	60.2 Å²	60.2	38%	0.381	31%	0.312	S	S	.	.	S	Bend	trans	73.5	-1.4	-175.2	0	0	0	0	0	114.1	N178 N179	N178-G181 PolarHBondContact O-N 2.82Å; N179-G181 PolarHBondContact O-N 2.93Å
182	S	86.5	Confident	89.1	Confident	4 Å²	4	59.5 Å²	59.5	3%	0.028	31%	0.307	C	S	.	.			trans	-73.3	160.1	171	75.3	0	0	0	0	110.4	N178 D180 K205 F206	N178-S182 WeakPolarHBondContact CB-O 3.42Å; N178-S182 PolarHBondContact N-O 2.75Å; N178-S182 PolarHBondContact ND2-O 3.26Å; N178-S182 PolarHBondContact ND2-OG 2.81Å; D180-S182 PolarHBondContact O-N 2.85Å; D180-S182 WeakPolarHBondContact OD1-CB 3.14Å; D180-S182 PolarHBondContact OD1-N 2.81Å; D180-S182 PolarHBondContact OD1-OG 2.84Å; D180-S182 PolarHBondContact OD2-OG 2.99Å; S182-K205 WeakPolarHBondContact OG-CE 3.43Å; S182-K205 PolarHBondContact OG-NZ 3.43Å; S182-F206 WeakPolarHBondContact CB-O 3.29Å
183	K	89.9	Confident	88.4	Confident	82 Å²	82	57.6 Å²	57.6	36%	0.357	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142.9	178.1	-60.2	179.5	-178.5	178.2	0	110.6	Q176 F206 I212	Q176-K183 CarbonylContact O-C 3.6Å; Q176-K183 WeakPolarHBondContact O-CA 3.47Å; K183-F206 PolarHBondContact O-N 3.26Å; K183-I212 HydrophobicContact CB-CD1 3.35Å; K183-I212 HydrophobicContact CB-CG1 4.22Å; K183-I212 HydrophobicContact CD-CD1 3.76Å; K183-I212 HydrophobicContact CD-CG1 4.17Å; K183-I212 HydrophobicContact CG-CD1 4.17Å
184	S	92.4	Very high	87.3	Confident	28 Å²	28	54.8 Å²	54.8	20%	0.196	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	135.9	177.7	-65.7	0	0	0	0	109.9	C175 Q176 N178 L204	C175-S184 CarbonylContact C-O 3.53Å; C175-S184 WeakPolarHBondContact CA-O 3.44Å; Q176-S184 PolarHBondContact N-O 2.99Å; Q176-S184 PolarHBondContact O-N 2.86Å; N178-S184 PolarHBondContact ND2-OG 3.42Å; N178-S184 PolarHBondContact OD1-OG 3.36Å; S184-L204 CarbonylContact C-O 3.26Å; S184-L204 WeakPolarHBondContact CA-O 3.39Å
185	L	94.2	Very high	85.9	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.1	174.8	-175.8	63.7	0	0	0	108.6	W173 R174 C175 L187 L204 F206 L215	W173-L185 HydrophobicContact CB-CD1 4.26Å; W173-L185 HydrophobicContact CE3-CD1 4.19Å; R174-L185 WeakPolarHBondContact O-CA 3.46Å; C175-L185 HydrophobicContact CB-CD1 4.27Å; L185-L187 HydrophobicContact CD1-CD2 3.98Å; L185-L187 HydrophobicContact CD2-CD1 4.41Å; L185-L187 HydrophobicContact CD2-CD2 3.76Å; L185-L187 HydrophobicContact CD2-CG 4.26Å; L185-L187 HydrophobicContact CG-CD2 3.59Å; L185-L187 HydrophobicContact CG-CG 4.04Å; L185-L204 HydrophobicContact CB-CB 4.32Å; L185-L204 HydrophobicContact CD2-CD1 4.45Å; L185-L204 PolarHBondContact N-O 3.13Å; L185-L204 PolarHBondContact O-N 3.47Å; L185-F206 HydrophobicContact CB-CE2 3.75Å; L185-F206 HydrophobicContact CD2-CE2 4.26Å; L185-F206 HydrophobicContact CD2-CZ 4.32Å; L185-L215 HydrophobicContact CD1-CD1 3.71Å; L185-L215 HydrophobicContact CD2-CD1 4.03Å
186	T	95.4	Very high	84.8	Confident	46 Å²	46	47.2 Å²	47.2	28%	0.282	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.7	170.4	-59	0	0	0	0	108.8	W173 R174 T201 C202 H203	W173-T186 CarbonylContact C-O 3.57Å; W173-T186 VanDerWaalsContact CA-O 3.23Å; W173-T186 WeakPolarHBondContact CA-O 3.34Å; R174-T186 PolarHBondContact N-O 3.38Å; R174-T186 PolarHBondContact O-N 3.45Å; T186-T201 HydrophobicContact CG2-CG2 3.9Å; T186-C202 CarbonylContact C-O 3.58Å; T186-C202 WeakPolarHBondContact CA-O 3.32Å; T186-H203 PolarHBondContact OG1-ND1 3.31Å
187	L	95.7	Very high	83.8	Confident	5 Å²	5	45 Å²	45	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.8	179.4	-53.4	176.4	0	0	0	109.8	V170 W173 L185 L189 C202 L204 I223 F225	V170-L187 HydrophobicContact CG1-CB 4.36Å; V170-L187 HydrophobicContact CG1-CD2 3.86Å; V170-L187 HydrophobicContact CG2-CD1 4.46Å; W173-L187 HydrophobicContact CB-CD2 3.47Å; W173-L187 VanDerWaalsContact CB-CD2 3.47Å; L185-L187 HydrophobicContact CD1-CD2 3.98Å; L185-L187 HydrophobicContact CD2-CD1 4.41Å; L185-L187 HydrophobicContact CD2-CD2 3.76Å; L185-L187 HydrophobicContact CD2-CG 4.26Å; L185-L187 HydrophobicContact CG-CD2 3.59Å; L185-L187 HydrophobicContact CG-CG 4.04Å; L187-L189 HydrophobicContact CB-CD2 3.9Å; L187-L189 HydrophobicContact CB-CG 4.35Å; L187-L189 HydrophobicContact CD1-CD2 4.31Å; L187-C202 HydrophobicContact CB-CB 4.16Å; L187-C202 PolarHBondContact N-O 3.28Å; L187-C202 PolarHBondContact O-N 2.88Å; L187-L204 HydrophobicContact CD1-CD1 3.98Å; L187-I223 HydrophobicContact CD1-CD1 3.84Å; L187-F225 HydrophobicContact CD1-CZ 4.22Å
188	K	93.8	Very high	83.5	Confident	69 Å²	69	45.2 Å²	45.2	30%	0.3	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	116.3	164.4	-63.5	-58.8	-173.3	171.4	0	107.8	V170 S171 S172 P199 T201	V170-K188 WeakPolarHBondContact CA-O 3.2Å; S171-K188 PolarHBondContact N-O 2.85Å; S171-K188 PolarHBondContact OG-O 3.47Å; S172-K188 PolarHBondContact O-N 2.8Å; S172-K188 VanDerWaalsContact OG-CB 3.31Å; S172-K188 WeakPolarHBondContact OG-CB 3.46Å; S172-K188 WeakPolarHBondContact OG-CG 3.41Å; K188-P199 HydrophobicContact CB-CB 3.87Å; K188-P199 HydrophobicContact CB-CG 4.05Å; K188-P199 HydrophobicContact CD-CB 4.37Å; K188-P199 HydrophobicContact CD-CG 3.98Å; K188-P199 HydrophobicContact CG-CG 4.28Å; K188-T201 HydrophobicContact CD-CG2 4.37Å; K188-T201 PolarHBondContact NZ-OG1 3.41Å
189	L	94.2	Very high	83.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.9	-173.5	-57.4	-178.6	0	0	0	110	L154 L166 A168 V169 V170 L187 I194 P199 V200 C202 I223 F225 L239	L154-L189 HydrophobicContact CD1-CB 4.16Å; L166-L189 HydrophobicContact CD2-CD1 4.48Å; A168-L189 HydrophobicContact CB-CB 3.99Å; A168-L189 HydrophobicContact CB-CD1 4.42Å; A168-L189 HydrophobicContact CB-CD2 4.25Å; A168-L189 HydrophobicContact CB-CG 4.46Å; V169-L189 CarbonylContact O-C 3.48Å; V169-L189 WeakPolarHBondContact O-CA 3.41Å; V170-L189 HydrophobicContact CG2-CD2 3.89Å; L187-L189 HydrophobicContact CB-CD2 3.9Å; L187-L189 HydrophobicContact CB-CG 4.35Å; L187-L189 HydrophobicContact CD1-CD2 4.31Å; L189-I194 WeakPolarHBondContact O-CD1 3.31Å; L189-P199 CarbonylContact O-C 3.44Å; L189-P199 WeakPolarHBondContact O-CA 3.47Å; L189-P199 WeakPolarHBondContact O-CB 3.46Å; L189-V200 HydrophobicContact CB-CB 4.43Å; L189-V200 WeakPolarHBondContact CB-O 3.22Å; L189-V200 PolarHBondContact N-O 2.97Å; L189-V200 PolarHBondContact O-N 3.06Å; L189-C202 HydrophobicContact CD1-CB 3.53Å; L189-C202 HydrophobicContact CG-CB 3.97Å; L189-I223 HydrophobicContact CD2-CG2 3.86Å; L189-F225 HydrophobicContact CD1-CE2 3.65Å; L189-F225 HydrophobicContact CD1-CZ 4.12Å; L189-F225 HydrophobicContact CD2-CE2 4.42Å; L189-L239 HydrophobicContact CD1-CD1 3.62Å
190	I	89.1	Confident	83.9	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.6	175.1	60.5	176.4	0	0	0	110.8	L154 V169 I194 P199 W287 Y288	L154-I190 VanDerWaalsContact CD1-C 3.49Å; V169-I190 HydrophobicContact CB-CG1 3.99Å; V169-I190 HydrophobicContact CG1-CG1 4.22Å; V169-I190 PolarHBondContact N-O 3.22Å; V169-I190 PolarHBondContact O-N 3.11Å; I190-I194 HydrophobicContact CG2-CD1 4.32Å; I190-P199 HydrophobicContact CG2-CB 3.65Å; I190-W287 HydrophobicContact CB-CH2 4.48Å; I190-W287 HydrophobicContact CD1-CH2 4.19Å; I190-W287 HydrophobicContact CG1-CH2 4.18Å; I190-W287 HydrophobicContact CG1-CZ3 4.42Å; I190-Y288 HydrophobicContact CD1-CD2 3.79Å; I190-Y288 HydrophobicContact CD1-CE2 3.37Å; I190-Y288 HydrophobicContact CG1-CE2 4.48Å
191	D	85.5	Confident	84.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.			trans	-145.7	-174.8	161.8	64.3	21	0	0	0	106.2	Y151 L154 S193 I194 L284 L411	Y151-D191 VanDerWaalsContact OH-CB 3.23Å; Y151-D191 WeakPolarHBondContact OH-CB 3.44Å; Y151-D191 PolarHBondContact OH-OD2 2.95Å; L154-D191 WeakPolarHBondContact CB-OD2 3.4Å; L154-D191 HydrophobicContact CD1-CB 4.23Å; L154-D191 VanDerWaalsContact CG-OD2 3.31Å; L154-D191 WeakPolarHBondContact CG-OD2 3.33Å; L154-D191 PolarHBondContact N-OD2 3.38Å; D191-S193 VanDerWaalsContact C-N 3.28Å; D191-S193 VanDerWaalsContact CG-OG 3.23Å; D191-S193 PolarHBondContact O-N 3.11Å; D191-S193 WeakPolarHBondContact OD1-CA 3.33Å; D191-S193 VanDerWaalsContact OD1-CB 3.28Å; D191-S193 WeakPolarHBondContact OD1-CB 3.5Å; D191-S193 PolarHBondContact OD1-N 3.36Å; D191-S193 PolarHBondContact OD1-OG 3.45Å; D191-S193 PolarHBondContact OD2-OG 2.9Å; D191-I194 PolarHBondContact OD1-N 2.78Å; D191-L284 HydrophobicContact CB-CD2 4.23Å; D191-L411 HydrophobicContact CB-CD2 4.42Å
192	S	70.7	Confident	84.9	Confident	29 Å²	29	31.7 Å²	31.7	20%	0.203	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-4.7	178.4	103	0	0	0	0	114.7	I194 L411	S192-I194 VanDerWaalsContact C-N 3.28Å; S192-L411 VanDerWaalsContact CB-CB 3.4Å; S192-L411 WeakPolarHBondContact OG-CB 3.42Å; S192-L411 PolarHBondContact OG-N 2.81Å
193	S	73.4	Confident	85.3	Confident	17 Å²	17	34.4 Å²	34.4	12%	0.119	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-23.7	178.4	76.1	0	0	0	0	111.4	P153 L154 S155 D191	P153-S193 WeakPolarHBondContact CB-OG 3.19Å; L154-S193 PolarHBondContact N-OG 2.83Å; L154-S193 VanDerWaalsContact N-OG 3.13Å; S155-S193 PolarHBondContact N-OG 2.75Å; S155-S193 WeakPolarHBondContact OG-CB 3.1Å; S155-S193 PolarHBondContact OG-OG 2.94Å; D191-S193 VanDerWaalsContact C-N 3.28Å; D191-S193 VanDerWaalsContact CG-OG 3.23Å; D191-S193 PolarHBondContact O-N 3.11Å; D191-S193 WeakPolarHBondContact OD1-CA 3.33Å; D191-S193 VanDerWaalsContact OD1-CB 3.28Å; D191-S193 WeakPolarHBondContact OD1-CB 3.5Å; D191-S193 PolarHBondContact OD1-N 3.36Å; D191-S193 PolarHBondContact OD1-OG 3.45Å; D191-S193 PolarHBondContact OD2-OG 2.9Å
194	I	70.1	Confident	85.4	Confident	31 Å²	31	30.7 Å²	30.7	16%	0.159	16%	0.158	C	C	.	.	S	Bend	trans	-109.7	169.4	174.8	67.7	169.3	0	0	0	111.5	L154 L189 I190 D191 S192 V200	L154-I194 HydrophobicContact CB-CD1 4.09Å; L154-I194 HydrophobicContact CB-CG1 4.26Å; L154-I194 HydrophobicContact CB-CG2 3.57Å; L154-I194 HydrophobicContact CD1-CD1 3.64Å; L154-I194 HydrophobicContact CD1-CG1 4.17Å; L189-I194 WeakPolarHBondContact O-CD1 3.31Å; I190-I194 HydrophobicContact CG2-CD1 4.32Å; D191-I194 PolarHBondContact OD1-N 2.78Å; S192-I194 VanDerWaalsContact C-N 3.28Å; I194-V200 HydrophobicContact CD1-CB 4.5Å; I194-V200 HydrophobicContact CD1-CG2 3.92Å
195	R	65.3	Low	85.4	Confident	34 Å²	34	33 Å²	33	13%	0.128	17%	0.165	C	C	.	.			trans	-78	138.7	174.3	-55.7	-172.4	174.1	133.5	22.8	111.3	D197 R198 D334	R195-D197 WeakPolarHBondContact CB-OD1 3.34Å; R195-D197 WeakPolarHBondContact CD-OD1 3.24Å; R195-D197 PolarHBondContact O-N 3.4Å; R195-R198 HydrophobicContact CB-CB 4.37Å; R195-R198 CarbonylContact O-C 3.53Å; R195-R198 PolarHBondContact O-N 2.88Å; R195-D334 IonicContact CZ-OD1 3.48Å; R195-D334 IonicContact CZ-OD2 3.81Å; R195-D334 IonicContact NH1-OD2 3.81Å; R195-D334 PolarHBondContact NH1-OD2 3.44Å; R195-D334 IonicContact NH2-OD1 2.78Å; R195-D334 PolarHBondContact NH2-OD1 3.41Å; R195-D334 IonicContact NH2-OD2 3.29Å; R195-D334 PolarHBondContact NH2-OD2 3.05Å
196	P	68.5	Low	85.1	Confident	46 Å²	46	32.9 Å²	32.9	30%	0.299	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.8	174	-24.7	33.8	0	0	0	113.9	R198	P196-R198 VanDerWaalsContact C-N 3.27Å; P196-R198 PolarHBondContact O-N 3.44Å
197	D	70	Confident	84.3	Confident	63 Å²	63	34.4 Å²	34.4	34%	0.337	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-8.6	178	70.6	-23.1	0	0	0	113.6	R195 P199 S423	R195-D197 WeakPolarHBondContact CB-OD1 3.34Å; R195-D197 WeakPolarHBondContact CD-OD1 3.24Å; R195-D197 PolarHBondContact O-N 3.4Å; D197-P199 VanDerWaalsContact C-CD 3.44Å; D197-S423 PolarHBondContact OD2-OG 3.23Å
198	R	80.7	Confident	83.3	Confident	138 Å²	138	37 Å²	37	52%	0.521	19%	0.19	S	C	.	.	S	Bend	trans	-129	63.2	178.7	-64	-174.9	-176.4	-175.5	0.1	111.3	R195 P196	R195-R198 HydrophobicContact CB-CB 4.37Å; R195-R198 CarbonylContact O-C 3.53Å; R195-R198 PolarHBondContact O-N 2.88Å; P196-R198 VanDerWaalsContact C-N 3.27Å; P196-R198 PolarHBondContact O-N 3.44Å
199	P	88.3	Confident	82.3	Confident	37 Å²	37	41.5 Å²	41.5	24%	0.24	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-63.1	145	179.5	28.2	-36.3	0	0	0	111.8	K188 L189 I190 D197 T201	K188-P199 HydrophobicContact CB-CB 3.87Å; K188-P199 HydrophobicContact CB-CG 4.05Å; K188-P199 HydrophobicContact CD-CB 4.37Å; K188-P199 HydrophobicContact CD-CG 3.98Å; K188-P199 HydrophobicContact CG-CG 4.28Å; L189-P199 CarbonylContact O-C 3.44Å; L189-P199 WeakPolarHBondContact O-CA 3.47Å; L189-P199 WeakPolarHBondContact O-CB 3.46Å; I190-P199 HydrophobicContact CG2-CB 3.65Å; D197-P199 VanDerWaalsContact C-CD 3.44Å; P199-T201 PolarHBondContact O-N 3Å
200	V	91.5	Very high	81.5	Confident	13 Å²	13	43.3 Å²	43.3	8%	0.079	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	128	169.1	171.5	0	0	0	0	108.4	L154 L157 L189 I194 L239	L154-V200 HydrophobicContact CB-CG2 4.2Å; L154-V200 HydrophobicContact CD1-CG2 4.48Å; L154-V200 HydrophobicContact CD2-CB 4.22Å; L154-V200 HydrophobicContact CD2-CG1 4.43Å; L154-V200 HydrophobicContact CD2-CG2 4.21Å; L157-V200 HydrophobicContact CD1-CG1 3.98Å; L157-V200 HydrophobicContact CD1-CG2 4.01Å; L189-V200 HydrophobicContact CB-CB 4.43Å; L189-V200 WeakPolarHBondContact CB-O 3.22Å; L189-V200 PolarHBondContact N-O 2.97Å; L189-V200 PolarHBondContact O-N 3.06Å; I194-V200 HydrophobicContact CD1-CB 4.5Å; I194-V200 HydrophobicContact CD1-CG2 3.92Å; V200-L239 HydrophobicContact CG1-CD1 4.22Å; V200-L239 HydrophobicContact CG1-CG 3.85Å
201	T	93.9	Very high	80.9	Confident	18 Å²	18	45.9 Å²	45.9	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	131.4	178	-52.6	0	0	0	0	109.2	T186 K188 P199 H203 E238 L239	T186-T201 HydrophobicContact CG2-CG2 3.9Å; K188-T201 HydrophobicContact CD-CG2 4.37Å; K188-T201 PolarHBondContact NZ-OG1 3.41Å; P199-T201 PolarHBondContact O-N 3Å; T201-H203 WeakPolarHBondContact CG2-NE2 3.45Å; T201-E238 CarbonylContact O-C 3.45Å; T201-E238 WeakPolarHBondContact O-CA 3.44Å; T201-L239 PolarHBondContact O-N 3.33Å
202	C	94.9	Very high	80.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.8	175.4	177.5	0	0	0	0	110.9	T186 L187 L189 L239	T186-C202 CarbonylContact C-O 3.58Å; T186-C202 WeakPolarHBondContact CA-O 3.32Å; L187-C202 HydrophobicContact CB-CB 4.16Å; L187-C202 PolarHBondContact N-O 3.28Å; L187-C202 PolarHBondContact O-N 2.88Å; L189-C202 HydrophobicContact CD1-CB 3.53Å; L189-C202 HydrophobicContact CG-CB 3.97Å; C202-L239 CarbonylContact C-O 2.98Å; C202-L239 VanDerWaalsContact CA-O 3.27Å; C202-L239 WeakPolarHBondContact CA-O 3.48Å; C202-L239 HydrophobicContact CB-CB 3.81Å; C202-L239 HydrophobicContact CB-CD1 4.45Å
203	H	93.8	Very high	81.3	Confident	61 Å²	61	47.2 Å²	47.2	28%	0.282	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	109.5	180	-61.1	-71.4	0	0	0	110.8	T186 T201 E238 L239 Y240 G241	T186-H203 PolarHBondContact OG1-ND1 3.31Å; T201-H203 WeakPolarHBondContact CG2-NE2 3.45Å; H203-E238 IonicContact CD2-OE2 3.77Å; H203-E238 IonicContact NE2-OE2 3.74Å; H203-L239 PolarHBondContact N-O 3.01Å; H203-Y240 CarbonylContact O-C 3.49Å; H203-Y240 VanDerWaalsContact O-CA 3.25Å; H203-Y240 WeakPolarHBondContact O-CA 3.39Å; H203-G241 PolarHBondContact O-N 2.83Å
204	L	93	Very high	81.8	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.2	176.1	-58	177.2	0	0	0	110	S184 L185 L187 F206 F225 I228 G241 V243 L248 F250	S184-L204 CarbonylContact C-O 3.26Å; S184-L204 WeakPolarHBondContact CA-O 3.39Å; L185-L204 HydrophobicContact CB-CB 4.32Å; L185-L204 HydrophobicContact CD2-CD1 4.45Å; L185-L204 PolarHBondContact N-O 3.13Å; L185-L204 PolarHBondContact O-N 3.47Å; L187-L204 HydrophobicContact CD1-CD1 3.98Å; L204-F206 HydrophobicContact CB-CE2 4.05Å; L204-F225 HydrophobicContact CD1-CE1 3.99Å; L204-F225 HydrophobicContact CD2-CE1 4.01Å; L204-F225 HydrophobicContact CG-CE1 4.48Å; L204-I228 HydrophobicContact CD2-CD1 3.83Å; L204-G241 WeakPolarHBondContact CA-O 3.27Å; L204-V243 HydrophobicContact CB-CG2 4.24Å; L204-L248 HydrophobicContact CD2-CD2 4.22Å; L204-F250 HydrophobicContact CD1-CD1 4.2Å; L204-F250 HydrophobicContact CD1-CE1 4Å; L204-F250 HydrophobicContact CD1-CZ 4.46Å
205	K	90.9	Very high	82.7	Confident	76 Å²	76	50.3 Å²	50.3	33%	0.33	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	138.7	167.4	-170.8	176.2	-176	178	0	109.4	D180 S182 G241 I242 V243	D180-K205 IonicContact OD2-NZ 2.92Å; D180-K205 PolarHBondContact OD2-NZ 2.99Å; S182-K205 WeakPolarHBondContact OG-CE 3.43Å; S182-K205 PolarHBondContact OG-NZ 3.43Å; K205-G241 PolarHBondContact N-O 3.03Å; K205-I242 HydrophobicContact CB-CG1 4.23Å; K205-I242 CarbonylContact O-C 3.36Å; K205-I242 VanDerWaalsContact O-CA 3.29Å; K205-I242 WeakPolarHBondContact O-CA 3.27Å; K205-V243 PolarHBondContact O-N 3.05Å
206	F	87.6	Confident	83.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.9	174.1	-63.7	-100.6	0	0	0	107.8	S182 K183 L185 L204 T210 I212 V243 F250	S182-F206 WeakPolarHBondContact CB-O 3.29Å; K183-F206 PolarHBondContact O-N 3.26Å; L185-F206 HydrophobicContact CB-CE2 3.75Å; L185-F206 HydrophobicContact CD2-CE2 4.26Å; L185-F206 HydrophobicContact CD2-CZ 4.32Å; L204-F206 HydrophobicContact CB-CE2 4.05Å; F206-T210 HydrophobicContact CB-CG2 4.48Å; F206-T210 HydrophobicContact CD1-CG2 4.01Å; F206-I212 HydrophobicContact CB-CG1 4.49Å; F206-I212 HydrophobicContact CD1-CG1 3.99Å; F206-I212 HydrophobicContact CD2-CD1 3.8Å; F206-I212 HydrophobicContact CD2-CG1 3.77Å; F206-I212 HydrophobicContact CE1-CG1 4.11Å; F206-I212 HydrophobicContact CE2-CD1 4.01Å; F206-I212 HydrophobicContact CE2-CG1 3.93Å; F206-I212 HydrophobicContact CG-CD1 4.27Å; F206-I212 HydrophobicContact CG-CG1 3.82Å; F206-I212 HydrophobicContact CZ-CG1 4.08Å; F206-I212 HydrophobicContact CZ-CG2 4.41Å; F206-V243 HydrophobicContact CD1-CB 4.01Å; F206-V243 HydrophobicContact CD1-CG1 4.35Å; F206-V243 HydrophobicContact CD1-CG2 4.02Å; F206-V243 HydrophobicContact CE1-CB 4.04Å; F206-V243 HydrophobicContact CE1-CG1 4.13Å; F206-V243 HydrophobicContact CE1-CG2 3.7Å; F206-V243 HydrophobicContact CE2-CG2 4.29Å; F206-V243 HydrophobicContact CG-CG2 4.47Å; F206-V243 HydrophobicContact CZ-CG2 3.84Å; F206-F250 HydrophobicContact CE1-CE1 4.11Å; F206-F250 HydrophobicContact CE1-CZ 4.17Å; F206-F250 AromaticContact CZ-CE1 3.99Å; F206-F250 HydrophobicContact CZ-CE1 3.99Å; F206-F250 AromaticContact CZ-CZ 3.94Å; F206-F250 HydrophobicContact CZ-CZ 3.94Å
207	E	79.4	Confident	84.3	Confident	79 Å²	79	56 Å²	56	37%	0.369	31%	0.314	S	S	.	.			trans	-62	159.3	172.2	-61.7	-165.8	147.4	0	0	111.1	N209 T210 I242 R245	E207-N209 PolarHBondContact O-N 2.97Å; E207-T210 VanDerWaalsContact O-CB 3.29Å; E207-T210 WeakPolarHBondContact O-CB 3.47Å; E207-T210 PolarHBondContact O-N 3.39Å; E207-T210 PolarHBondContact O-OG1 2.78Å; E207-I242 HydrophobicContact CG-CG2 4.1Å; E207-R245 IonicContact OE1-CZ 3.2Å; E207-R245 IonicContact OE1-NE 3.79Å; E207-R245 PolarHBondContact OE1-NE 2.81Å; E207-R245 IonicContact OE1-NH2 2.79Å; E207-R245 PolarHBondContact OE1-NH2 3.43Å
208	A	75.2	Confident	84.9	Confident	58 Å²	58	60 Å²	60	48%	0.479	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	136	179	0	0	0	0	0	110.2	T210	A208-T210 PolarHBondContact O-N 3.11Å
209	N	73.2	Confident	85.1	Confident	165 Å²	165	55.4 Å²	55.4	88%	0.882	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	-1.6	-175.2	-50.4	-47.6	0	0	0	116.4	E207 P211	E207-N209 PolarHBondContact O-N 2.97Å; N209-P211 WeakPolarHBondContact O-CD 3.38Å
210	T	76.1	Confident	85.1	Confident	37 Å²	37	54 Å²	54	23%	0.227	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-71.2	121.1	172.5	-60.4	0	0	0	0	109.4	F206 E207 A208 I212	F206-T210 HydrophobicContact CB-CG2 4.48Å; F206-T210 HydrophobicContact CD1-CG2 4.01Å; E207-T210 VanDerWaalsContact O-CB 3.29Å; E207-T210 WeakPolarHBondContact O-CB 3.47Å; E207-T210 PolarHBondContact O-N 3.39Å; E207-T210 PolarHBondContact O-OG1 2.78Å; A208-T210 PolarHBondContact O-N 3.11Å; T210-I212 PolarHBondContact O-N 2.84Å
211	P	77.1	Confident	85.3	Confident	59 Å²	59	53.6 Å²	53.6	38%	0.383	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-69.4	133.6	-178.3	26.5	-32.2	0	0	0	110.9	N209 K267	N209-P211 WeakPolarHBondContact O-CD 3.38Å; P211-K267 HydrophobicContact CB-CD 4.32Å; P211-K267 HydrophobicContact CG-CD 3.52Å
212	I	82.1	Confident	85.2	Confident	34 Å²	34	52.7 Å²	52.7	17%	0.174	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-80.9	143.8	169.1	-63.6	-174.9	0	0	0	108.6	C175 K183 F206 T210	C175-I212 WeakPolarHBondContact SG-CD1 3.41Å; K183-I212 HydrophobicContact CB-CD1 3.35Å; K183-I212 HydrophobicContact CB-CG1 4.22Å; K183-I212 HydrophobicContact CD-CD1 3.76Å; K183-I212 HydrophobicContact CD-CG1 4.17Å; K183-I212 HydrophobicContact CG-CD1 4.17Å; F206-I212 HydrophobicContact CB-CG1 4.49Å; F206-I212 HydrophobicContact CD1-CG1 3.99Å; F206-I212 HydrophobicContact CD2-CD1 3.8Å; F206-I212 HydrophobicContact CD2-CG1 3.77Å; F206-I212 HydrophobicContact CE1-CG1 4.11Å; F206-I212 HydrophobicContact CE2-CD1 4.01Å; F206-I212 HydrophobicContact CE2-CG1 3.93Å; F206-I212 HydrophobicContact CG-CD1 4.27Å; F206-I212 HydrophobicContact CG-CG1 3.82Å; F206-I212 HydrophobicContact CZ-CG1 4.08Å; F206-I212 HydrophobicContact CZ-CG2 4.41Å; T210-I212 PolarHBondContact O-N 2.84Å
213	P	83	Confident	85.1	Confident	22 Å²	22	52.8 Å²	52.8	14%	0.143	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-50.7	144	170.7	-26.3	33.5	0	0	0	112.2	L215 F250 L252 L264	P213-L215 VanDerWaalsContact C-N 3.27Å; P213-L215 HydrophobicContact CB-CD2 4.4Å; P213-L215 PolarHBondContact O-N 2.87Å; P213-F250 HydrophobicContact CG-CE2 3.76Å; P213-F250 HydrophobicContact CG-CZ 3.73Å; P213-L252 HydrophobicContact CB-CD1 3.71Å; P213-L252 HydrophobicContact CG-CD1 3.79Å; P213-L264 HydrophobicContact CB-CD1 4.33Å
214	P	83.5	Confident	85	Confident	81 Å²	81	51.2 Å²	51.2	53%	0.526	30%	0.3	S	S	.	.			trans	-73.5	80.9	-179.9	31.1	-35.1	0	0	0	110.7
215	L	88.5	Confident	84.8	Confident	32 Å²	32	51.1 Å²	51.1	17%	0.168	30%	0.3	C	S	.	.			trans	-71.4	137.9	177.3	-57	178.2	0	0	0	110.4	W173 L185 P213 Y221 L252	W173-L215 HydrophobicContact CB-CD1 4.43Å; W173-L215 HydrophobicContact CD2-CB 4.09Å; W173-L215 HydrophobicContact CD2-CD1 3.6Å; W173-L215 HydrophobicContact CD2-CG 4.46Å; W173-L215 HydrophobicContact CE3-CB 4.26Å; W173-L215 HydrophobicContact CE3-CD1 3.63Å; W173-L215 HydrophobicContact CG-CD1 3.96Å; W173-L215 HydrophobicContact CH2-CB 3.7Å; W173-L215 HydrophobicContact CZ2-CB 3.48Å; W173-L215 VanDerWaalsContact CZ2-CB 3.48Å; W173-L215 HydrophobicContact CZ3-CB 4.08Å; W173-L215 HydrophobicContact CZ3-CD1 4.12Å; L185-L215 HydrophobicContact CD1-CD1 3.71Å; L185-L215 HydrophobicContact CD2-CD1 4.03Å; P213-L215 VanDerWaalsContact C-N 3.27Å; P213-L215 HydrophobicContact CB-CD2 4.4Å; P213-L215 PolarHBondContact O-N 2.87Å; L215-Y221 HydrophobicContact CD2-CD1 4.32Å; L215-Y221 HydrophobicContact CD2-CD2 4.36Å; L215-Y221 HydrophobicContact CD2-CE1 4.01Å; L215-Y221 HydrophobicContact CD2-CE2 4.05Å; L215-L252 HydrophobicContact CD2-CD1 3.8Å
216	K	85.7	Confident	84.3	Confident	120 Å²	120	49.4 Å²	49.4	52%	0.522	29%	0.293	S	S	.	.			trans	-116.2	145.6	-178.5	-62.2	179.3	-179	174.7	0	108	Q218 Y221	K216-Q218 VanDerWaalsContact C-N 3.3Å; K216-Y221 WeakPolarHBondContact CB-OH 3.42Å; K216-Y221 PolarHBondContact N-OH 3.24Å; K216-Y221 PolarHBondContact O-OH 2.93Å
217	G	81.3	Confident	83.7	Confident	79 Å²	79	51.8 Å²	51.8	81%	0.814	30%	0.302	S	S	*	.	S	Bend	trans	-74.1	-20.2	177.9	0	0	0	0	0	114
218	Q	82.8	Confident	84	Confident	149 Å²	149	48 Å²	48	70%	0.696	28%	0.284	S	S	*	.	S	Bend	trans	-91	134.1	178	-172.8	-178	9.3	0	0	111.3	K216 H254 L256	K216-Q218 VanDerWaalsContact C-N 3.3Å; Q218-H254 PolarHBondContact O-NE2 3.42Å; Q218-L256 HydrophobicContact CG-CD2 4.01Å
219	G	85.5	Confident	84.3	Confident	40 Å²	40	45.5 Å²	45.5	41%	0.412	26%	0.263	S	S	.	.	S	Bend	trans	87.1	-158.8	-179.2	0	0	0	0	0	111.8	C255	G219-C255 VanDerWaalsContact CA-O 3.31Å; G219-C255 WeakPolarHBondContact CA-O 3.47Å
220	F	89.2	Confident	84.8	Confident	9 Å²	9	38.9 Å²	38.9	4%	0.039	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	178.6	178	64.8	-86.4	0	0	0	110.2	V169 V222 C255 H285 Y288	V169-F220 HydrophobicContact CG1-CD2 3.95Å; F220-V222 HydrophobicContact CE2-CG2 4.32Å; F220-C255 HydrophobicContact CD1-CB 3.99Å; F220-C255 HydrophobicContact CD2-CB 3.76Å; F220-C255 HydrophobicContact CE1-CB 3.72Å; F220-C255 HydrophobicContact CE2-CB 3.49Å; F220-C255 VanDerWaalsContact CE2-CB 3.49Å; F220-C255 HydrophobicContact CG-CB 4.03Å; F220-C255 HydrophobicContact CZ-CB 3.5Å; F220-C255 VanDerWaalsContact CZ-CB 3.5Å; F220-C255 PolarHBondContact N-O 3.46Å; F220-C255 PolarHBondContact O-N 2.81Å; F220-H285 AromaticContact CE2-CD2 3.91Å; F220-H285 AromaticContact CZ-CD2 3.38Å; F220-H285 WeakPolarHBondContact CZ-CD2 3.2Å; F220-Y288 HydrophobicContact CB-CD1 4.05Å; F220-Y288 HydrophobicContact CB-CE1 3.53Å; F220-Y288 AromaticContact CD1-CD1 3.62Å; F220-Y288 HydrophobicContact CD1-CD1 3.62Å; F220-Y288 AromaticContact CD1-CE1 3.75Å; F220-Y288 HydrophobicContact CD1-CE1 3.75Å; F220-Y288 AromaticContact CD2-CD1 3.32Å; F220-Y288 HydrophobicContact CD2-CD1 3.32Å; F220-Y288 AromaticContact CD2-CE1 3.74Å; F220-Y288 HydrophobicContact CD2-CE1 3.74Å; F220-Y288 HydrophobicContact CD2-CG 4.3Å; F220-Y288 AromaticContact CE1-CD1 3.73Å; F220-Y288 HydrophobicContact CE1-CD1 3.73Å; F220-Y288 HydrophobicContact CE1-CE1 4.31Å; F220-Y288 AromaticContact CE2-CD1 3.43Å; F220-Y288 HydrophobicContact CE2-CD1 3.43Å; F220-Y288 VanDerWaalsContact CE2-CD1 3.43Å; F220-Y288 HydrophobicContact CE2-CE1 4.29Å; F220-Y288 HydrophobicContact CE2-CG 4.16Å; F220-Y288 AromaticContact CG-CD1 3.4Å; F220-Y288 HydrophobicContact CG-CD1 3.4Å; F220-Y288 AromaticContact CG-CE1 3.4Å; F220-Y288 HydrophobicContact CG-CE1 3.4Å; F220-Y288 VanDerWaalsContact CG-CE1 3.4Å; F220-Y288 AromaticContact CZ-CD1 3.6Å; F220-Y288 HydrophobicContact CZ-CD1 3.6Å; F220-Y288 HydrophobicContact CZ-CG 4.4Å
221	Y	94	Very high	84.9	Confident	3 Å²	3	39.2 Å²	39.2	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.6	178.1	-60	-90.5	0	0	0	112	V169 V170 W173 L215 K216 L252 W253 H254 L264	V169-Y221 CarbonylContact C-O 3.59Å; V169-Y221 WeakPolarHBondContact CA-O 3.43Å; V170-Y221 PolarHBondContact N-O 2.73Å; W173-Y221 AromaticContact NE1-CE2 3.97Å; L215-Y221 HydrophobicContact CD2-CD1 4.32Å; L215-Y221 HydrophobicContact CD2-CD2 4.36Å; L215-Y221 HydrophobicContact CD2-CE1 4.01Å; L215-Y221 HydrophobicContact CD2-CE2 4.05Å; K216-Y221 WeakPolarHBondContact CB-OH 3.42Å; K216-Y221 PolarHBondContact N-OH 3.24Å; K216-Y221 PolarHBondContact O-OH 2.93Å; Y221-L252 HydrophobicContact CD1-CD2 4.29Å; Y221-L252 HydrophobicContact CG-CD2 4.33Å; Y221-W253 WeakPolarHBondContact CA-O 3.41Å; Y221-W253 WeakPolarHBondContact CD1-O 3.46Å; Y221-H254 HydrophobicContact CD1-CB 4.13Å; Y221-H254 HydrophobicContact CE1-CB 3.65Å; Y221-H254 AromaticContact CE1-CD2 3.5Å; Y221-H254 AromaticContact CE1-CG 3.78Å; Y221-H254 AromaticContact CZ-CD2 3.51Å; Y221-H254 PolarHBondContact OH-CD2 2.85Å; Y221-L264 HydrophobicContact CD1-CD1 4.33Å; Y221-L264 HydrophobicContact CE1-CD1 3.85Å
222	V	93.1	Very high	84.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133	157.8	-177.7	0	0	0	0	107.2	A168 V169 F220 L252 W253 V281 L284 H285	A168-V222 CarbonylContact O-C 3.54Å; A168-V222 WeakPolarHBondContact O-CA 3.38Å; V169-V222 HydrophobicContact CG2-CG2 4.32Å; F220-V222 HydrophobicContact CE2-CG2 4.32Å; V222-L252 WeakPolarHBondContact O-CA 3.13Å; V222-W253 HydrophobicContact CB-CB 4.42Å; V222-W253 PolarHBondContact N-O 3.28Å; V222-W253 PolarHBondContact O-N 3.17Å; V222-V281 HydrophobicContact CB-CG1 4.32Å; V222-V281 HydrophobicContact CG1-CB 4.43Å; V222-V281 HydrophobicContact CG1-CG1 4.31Å; V222-V281 HydrophobicContact CG1-CG2 4.11Å; V222-L284 HydrophobicContact CG1-CB 4.17Å; V222-L284 HydrophobicContact CG1-CD1 3.92Å; V222-L284 HydrophobicContact CG2-CB 4.21Å; V222-H285 HydrophobicContact CG2-CB 4.36Å
223	I	93.4	Very high	84.4	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135.7	178.9	-171.7	160.2	0	0	0	110.2	Y167 A168 V170 L187 L189 F225 F250 E251 L252	Y167-I223 CarbonylContact C-O 3.59Å; Y167-I223 WeakPolarHBondContact CA-O 3.29Å; A168-I223 HydrophobicContact CB-CG2 4.11Å; A168-I223 PolarHBondContact N-O 3.24Å; A168-I223 WeakPolarHBondContact O-CG2 3.34Å; A168-I223 PolarHBondContact O-N 3.03Å; V170-I223 HydrophobicContact CG2-CB 3.99Å; V170-I223 HydrophobicContact CG2-CG2 3.73Å; L187-I223 HydrophobicContact CD1-CD1 3.84Å; L189-I223 HydrophobicContact CD2-CG2 3.86Å; I223-F225 HydrophobicContact CB-CE2 4.39Å; I223-F225 HydrophobicContact CD1-CD1 4.36Å; I223-F225 HydrophobicContact CD1-CD2 4.47Å; I223-F225 HydrophobicContact CD1-CE1 3.62Å; I223-F225 HydrophobicContact CD1-CE2 3.76Å; I223-F225 HydrophobicContact CD1-CZ 3.29Å; I223-F225 HydrophobicContact CG1-CD2 4.2Å; I223-F225 HydrophobicContact CG1-CE1 4.26Å; I223-F225 HydrophobicContact CG1-CE2 3.85Å; I223-F225 HydrophobicContact CG1-CZ 3.91Å; I223-F225 HydrophobicContact CG2-CD2 4.27Å; I223-F225 HydrophobicContact CG2-CE2 3.63Å; I223-F225 HydrophobicContact CG2-CZ 4.24Å; I223-F250 HydrophobicContact CD1-CB 4.16Å; I223-F250 HydrophobicContact CD1-CD2 3.67Å; I223-F250 HydrophobicContact CD1-CE2 4.32Å; I223-F250 HydrophobicContact CD1-CG 4.02Å; I223-F250 HydrophobicContact CG1-CB 4.15Å; I223-F250 HydrophobicContact CG1-CD2 4.08Å; I223-F250 HydrophobicContact CG1-CG 4.43Å; I223-E251 WeakPolarHBondContact CA-O 3.39Å; I223-L252 HydrophobicContact CB-CD2 3.72Å; I223-L252 HydrophobicContact CD1-CD2 3.93Å; I223-L252 HydrophobicContact CD1-CG 4.47Å; I223-L252 HydrophobicContact CG1-CD2 3.9Å; I223-L252 HydrophobicContact CG1-CG 4.48Å
224	R	90.4	Very high	84	Confident	29 Å²	29	55.3 Å²	55.3	11%	0.109	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.5	166.5	177.8	-165.8	-169.7	-158.7	18.3	108.3	L166 Y167 H226 F250 E251 W253 T272 D277	L166-R224 CarbonylContact O-C 3.53Å; L166-R224 WeakPolarHBondContact O-CA 3.39Å; Y167-R224 HydrophobicContact CD1-CB 3.9Å; Y167-R224 HydrophobicContact CD1-CG 4.15Å; Y167-R224 HydrophobicContact CE1-CB 3.59Å; Y167-R224 HydrophobicContact CE1-CG 3.56Å; Y167-R224 HydrophobicContact CE2-CG 4.22Å; Y167-R224 WeakPolarHBondContact OH-CD 3.43Å; Y167-R224 PolarHBondContact OH-NE 3.21Å; R224-H226 VanDerWaalsContact CZ-NE2 3.27Å; R224-H226 PolarHBondContact NE-NE2 2.97Å; R224-H226 PolarHBondContact NH1-CE1 2.87Å; R224-H226 PolarHBondContact NH1-NE2 3.45Å; R224-F250 CarbonylContact O-C 3.43Å; R224-F250 WeakPolarHBondContact O-CA 3.48Å; R224-F250 WeakPolarHBondContact O-CB 2.94Å; R224-E251 HydrophobicContact CB-CB 4.28Å; R224-E251 PolarHBondContact N-O 2.95Å; R224-E251 PolarHBondContact O-N 3.08Å; R224-W253 HydrophobicContact CB-CH2 4.08Å; R224-W253 HydrophobicContact CB-CZ3 3.72Å; R224-T272 PolarHBondContact NH1-O 2.74Å; R224-D277 IonicContact CZ-OD1 2.74Å; R224-D277 VanDerWaalsContact CZ-OD1 3.29Å; R224-D277 IonicContact CZ-OD2 2.97Å; R224-D277 IonicContact NE-OD1 3.23Å; R224-D277 PolarHBondContact NE-OD1 2.84Å; R224-D277 IonicContact NE-OD2 2.75Å; R224-D277 IonicContact NH1-OD2 3.18Å; R224-D277 PolarHBondContact NH1-OD2 2.83Å; R224-D277 IonicContact NH2-OD1 2.89Å; R224-D277 PolarHBondContact NH2-OD1 2.79Å; R224-D277 IonicContact NH2-OD2 2.75Å; R224-D277 PolarHBondContact NH2-OD2 2.85Å
225	F	88.5	Confident	83.5	Confident	1 Å²	1	54.4 Å²	54.4	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.1	169.9	-66.2	-80.8	0	0	0	111.5	G165 L166 L187 L189 L204 I223 I228 L248 F250	G165-F225 WeakPolarHBondContact CA-O 3.29Å; L166-F225 HydrophobicContact CB-CB 4.26Å; L166-F225 HydrophobicContact CB-CD2 4.26Å; L166-F225 HydrophobicContact CD2-CD2 3.9Å; L166-F225 HydrophobicContact CD2-CE2 4.34Å; L166-F225 HydrophobicContact CG-CD2 4.26Å; L166-F225 PolarHBondContact N-O 2.69Å; L166-F225 VanDerWaalsContact N-O 3.13Å; L166-F225 PolarHBondContact O-N 2.79Å; L187-F225 HydrophobicContact CD1-CZ 4.22Å; L189-F225 HydrophobicContact CD1-CE2 3.65Å; L189-F225 HydrophobicContact CD1-CZ 4.12Å; L189-F225 HydrophobicContact CD2-CE2 4.42Å; L204-F225 HydrophobicContact CD1-CE1 3.99Å; L204-F225 HydrophobicContact CD2-CE1 4.01Å; L204-F225 HydrophobicContact CG-CE1 4.48Å; I223-F225 HydrophobicContact CB-CE2 4.39Å; I223-F225 HydrophobicContact CD1-CD1 4.36Å; I223-F225 HydrophobicContact CD1-CD2 4.47Å; I223-F225 HydrophobicContact CD1-CE1 3.62Å; I223-F225 HydrophobicContact CD1-CE2 3.76Å; I223-F225 HydrophobicContact CD1-CZ 3.29Å; I223-F225 HydrophobicContact CG1-CD2 4.2Å; I223-F225 HydrophobicContact CG1-CE1 4.26Å; I223-F225 HydrophobicContact CG1-CE2 3.85Å; I223-F225 HydrophobicContact CG1-CZ 3.91Å; I223-F225 HydrophobicContact CG2-CD2 4.27Å; I223-F225 HydrophobicContact CG2-CE2 3.63Å; I223-F225 HydrophobicContact CG2-CZ 4.24Å; F225-I228 HydrophobicContact CB-CB 3.79Å; F225-I228 HydrophobicContact CB-CG2 3.62Å; F225-I228 HydrophobicContact CD1-CB 3.94Å; F225-I228 HydrophobicContact CD1-CD1 4.14Å; F225-I228 HydrophobicContact CD1-CG1 4.13Å; F225-I228 HydrophobicContact CD1-CG2 4.45Å; F225-I228 HydrophobicContact CD2-CG2 4.33Å; F225-I228 HydrophobicContact CE1-CD1 4.21Å; F225-I228 HydrophobicContact CE1-CG1 4.42Å; F225-I228 HydrophobicContact CG-CB 3.89Å; F225-I228 HydrophobicContact CG-CG1 4.34Å; F225-I228 HydrophobicContact CG-CG2 3.9Å; F225-L248 HydrophobicContact CD1-CD1 4.27Å; F225-F250 HydrophobicContact CD1-CB 3.88Å; F225-F250 HydrophobicContact CE1-CB 4.26Å
226	H	80.2	Confident	83.2	Confident	40 Å²	40	55.4 Å²	55.4	19%	0.185	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.9	159.7	-64.8	-95.3	0	0	0	108.3	R224 I228 L248 S249 C271	R224-H226 VanDerWaalsContact CZ-NE2 3.27Å; R224-H226 PolarHBondContact NE-NE2 2.97Å; R224-H226 PolarHBondContact NH1-CE1 2.87Å; R224-H226 PolarHBondContact NH1-NE2 3.45Å; H226-I228 PolarHBondContact O-N 3.01Å; H226-L248 WeakPolarHBondContact O-CA 3.41Å; H226-L248 WeakPolarHBondContact O-CD1 3.39Å; H226-S249 WeakPolarHBondContact CB-OG 3.48Å; H226-S249 PolarHBondContact N-O 2.89Å; H226-S249 PolarHBondContact O-N 3.1Å; H226-C271 PolarHBondContact CD2-SG 2.96Å; H226-C271 WeakPolarHBondContact NE2-CB 3.23Å; H226-C271 PolarHBondContact NE2-SG 3.42Å
227	R	75.9	Confident	83.1	Confident	49 Å²	49	51 Å²	51	19%	0.185	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	58.9	43.1	171.2	-55.9	-177.1	175.8	-179.1	1.1	114.1	L141 L164 R246	L141-R227 PolarHBondContact O-NH2 2.89Å; L164-R227 WeakPolarHBondContact O-CA 3.16Å; L164-R227 PolarHBondContact O-N 2.91Å; R227-R246 WeakPolarHBondContact CD-O 3.28Å
228	I	85.4	Confident	83.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	136.1	170.8	-171.9	65.4	0	0	0	110	S163 L164 L166 L204 F225 H226 L239 Y240 L248	S163-I228 CarbonylContact C-O 3.36Å; S163-I228 WeakPolarHBondContact CA-O 3.48Å; L164-I228 HydrophobicContact CB-CG2 4.12Å; L164-I228 PolarHBondContact N-O 2.84Å; L164-I228 PolarHBondContact O-N 3.03Å; L166-I228 HydrophobicContact CB-CG2 4.22Å; L166-I228 HydrophobicContact CD2-CG2 4.32Å; L204-I228 HydrophobicContact CD2-CD1 3.83Å; F225-I228 HydrophobicContact CB-CB 3.79Å; F225-I228 HydrophobicContact CB-CG2 3.62Å; F225-I228 HydrophobicContact CD1-CB 3.94Å; F225-I228 HydrophobicContact CD1-CD1 4.14Å; F225-I228 HydrophobicContact CD1-CG1 4.13Å; F225-I228 HydrophobicContact CD1-CG2 4.45Å; F225-I228 HydrophobicContact CD2-CG2 4.33Å; F225-I228 HydrophobicContact CE1-CD1 4.21Å; F225-I228 HydrophobicContact CE1-CG1 4.42Å; F225-I228 HydrophobicContact CG-CB 3.89Å; F225-I228 HydrophobicContact CG-CG1 4.34Å; F225-I228 HydrophobicContact CG-CG2 3.9Å; H226-I228 PolarHBondContact O-N 3.01Å; I228-L239 HydrophobicContact CD1-CB 4.48Å; I228-L239 HydrophobicContact CG1-CB 3.86Å; I228-L239 HydrophobicContact CG1-CD1 4.23Å; I228-L239 HydrophobicContact CG1-CD2 4.49Å; I228-L239 HydrophobicContact CG1-CG 4.43Å; I228-L239 HydrophobicContact CG2-CD1 4.36Å; I228-Y240 WeakPolarHBondContact CD1-O 3.46Å; I228-L248 HydrophobicContact CB-CD1 4.11Å; I228-L248 HydrophobicContact CD1-CD1 3.96Å; I228-L248 HydrophobicContact CD1-CD2 4Å
229	S	82.6	Confident	83.9	Confident	5 Å²	5	41.7 Å²	41.7	4%	0.035	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	149.5	175.8	-66.9	0	0	0	0	111.2	P162 L239 Y240 R246	P162-S229 WeakPolarHBondContact O-CA 3.31Å; P162-S229 WeakPolarHBondContact O-CB 3.45Å; P162-S229 PolarHBondContact O-OG 3.46Å; S229-L239 CarbonylContact O-C 3.41Å; S229-L239 VanDerWaalsContact O-CA 3.27Å; S229-L239 WeakPolarHBondContact O-CA 3.46Å; S229-Y240 WeakPolarHBondContact CB-O 3.39Å; S229-Y240 PolarHBondContact N-O 2.71Å; S229-Y240 PolarHBondContact O-N 3.4Å; S229-R246 PolarHBondContact OG-NH1 3.16Å
230	C	81.8	Confident	84.1	Confident	26 Å²	26	44 Å²	44	18%	0.176	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	149.3	173.9	61.7	0	0	0	0	110.9	L164 V237 E238 L239	L164-C230 HydrophobicContact CD1-CB 4.28Å; C230-V237 HydrophobicContact CB-CG1 4.31Å; C230-E238 CarbonylContact C-O 3.51Å; C230-E238 WeakPolarHBondContact CA-O 3.28Å; C230-L239 HydrophobicContact CB-CD2 3.59Å
231	S	78.8	Confident	83.9	Confident	44 Å²	44	44 Å²	44	31%	0.308	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158.6	169.6	60	0	0	0	0	111.4	E238 Y240	S231-E238 PolarHBondContact N-O 2.84Å; S231-E238 PolarHBondContact O-N 2.78Å; S231-Y240 WeakPolarHBondContact OG-CE1 3.42Å
232	K	77.4	Confident	83.5	Confident	143 Å²	143	46.4 Å²	46.4	62%	0.622	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	116.6	168.4	-168.5	158.2	-161	174.1	0	109.1	Y158 A236	Y158-K232 HydrophobicContact CE1-CB 3.88Å; Y158-K232 HydrophobicContact CE1-CD 4.05Å; Y158-K232 HydrophobicContact CE1-CG 4.36Å; Y158-K232 WeakPolarHBondContact OH-CB 3.34Å; Y158-K232 WeakPolarHBondContact OH-CD 3.27Å; Y158-K232 WeakPolarHBondContact OH-CE 2.9Å; Y158-K232 WeakPolarHBondContact OH-CG 3.23Å; K232-A236 CarbonylContact C-O 3.49Å; K232-A236 WeakPolarHBondContact CA-O 3.39Å
233	R	71.8	Confident	83	Confident	134 Å²	134	46.5 Å²	46.5	51%	0.506	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.9	174.1	-158	-167.3	179.1	162.9	1.8	110	G235 A236 E238	R233-G235 PolarHBondContact O-N 3.16Å; R233-A236 PolarHBondContact N-O 2.81Å; R233-A236 PolarHBondContact O-N 3.34Å; R233-A236 VanDerWaalsContact O-O 3.11Å; R233-E238 HydrophobicContact CB-CG 4.25Å; R233-E238 WeakPolarHBondContact CD-OE2 3.21Å; R233-E238 IonicContact NH1-OE2 3.52Å
234	H	73.3	Confident	82.1	Confident	176 Å²	176	49.4 Å²	49.4	82%	0.815	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	35.8	179.9	-56.1	-65.5	0	0	0	114.1	A236	H234-A236 VanDerWaalsContact C-N 3.34Å; H234-A236 PolarHBondContact O-N 3.29Å
235	G	74.9	Confident	80.9	Confident	62 Å²	62	51.9 Å²	51.9	64%	0.639	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	-9.1	-179.9	0	0	0	0	0	115.9	R233	R233-G235 PolarHBondContact O-N 3.16Å
236	A	81	Confident	79.4	Confident	53 Å²	53	56.4 Å²	56.4	44%	0.438	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	156.2	176.8	0	0	0	0	0	112	K232 R233 H234	K232-A236 CarbonylContact C-O 3.49Å; K232-A236 WeakPolarHBondContact CA-O 3.39Å; R233-A236 PolarHBondContact N-O 2.81Å; R233-A236 PolarHBondContact O-N 3.34Å; R233-A236 VanDerWaalsContact O-O 3.11Å; H234-A236 VanDerWaalsContact C-N 3.34Å; H234-A236 PolarHBondContact O-N 3.29Å
237	V	83.9	Confident	78.9	Confident	28 Å²	28	56.4 Å²	56.4	17%	0.17	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	128.5	166.7	-175.1	0	0	0	0	108.6	L157 Y158 C230	L157-V237 HydrophobicContact CB-CG1 3.9Å; L157-V237 HydrophobicContact CD1-CB 4.35Å; L157-V237 HydrophobicContact CD1-CG1 3.59Å; L157-V237 HydrophobicContact CG-CG1 4.4Å; Y158-V237 HydrophobicContact CD2-CG2 3.56Å; Y158-V237 HydrophobicContact CE1-CG2 4.2Å; Y158-V237 HydrophobicContact CE2-CB 4.41Å; Y158-V237 HydrophobicContact CE2-CG2 2.96Å; Y158-V237 HydrophobicContact CG-CG2 4.38Å; Y158-V237 WeakPolarHBondContact OH-CG2 2.78Å; C230-V237 HydrophobicContact CB-CG1 4.31Å
238	E	90.1	Very high	79	Confident	32 Å²	32	54.3 Å²	54.3	15%	0.15	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.1	168.5	-64	-176.1	173.1	0	0	109.8	T201 H203 C230 S231 R233	T201-E238 CarbonylContact O-C 3.45Å; T201-E238 WeakPolarHBondContact O-CA 3.44Å; H203-E238 IonicContact CD2-OE2 3.77Å; H203-E238 IonicContact NE2-OE2 3.74Å; C230-E238 CarbonylContact C-O 3.51Å; C230-E238 WeakPolarHBondContact CA-O 3.28Å; S231-E238 PolarHBondContact N-O 2.84Å; S231-E238 PolarHBondContact O-N 2.78Å; R233-E238 HydrophobicContact CB-CG 4.25Å; R233-E238 WeakPolarHBondContact CD-OE2 3.21Å; R233-E238 IonicContact NH1-OE2 3.52Å
239	L	90.9	Very high	78.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	146.3	169.4	-60.1	-177.1	0	0	0	109.5	L157 L166 L189 V200 T201 C202 H203 I228 S229 C230	L157-L239 HydrophobicContact CD1-CD2 4.07Å; L157-L239 HydrophobicContact CD2-CD2 4.19Å; L166-L239 HydrophobicContact CD2-CD1 3.32Å; L189-L239 HydrophobicContact CD1-CD1 3.62Å; V200-L239 HydrophobicContact CG1-CD1 4.22Å; V200-L239 HydrophobicContact CG1-CG 3.85Å; T201-L239 PolarHBondContact O-N 3.33Å; C202-L239 CarbonylContact C-O 2.98Å; C202-L239 VanDerWaalsContact CA-O 3.27Å; C202-L239 WeakPolarHBondContact CA-O 3.48Å; C202-L239 HydrophobicContact CB-CB 3.81Å; C202-L239 HydrophobicContact CB-CD1 4.45Å; H203-L239 PolarHBondContact N-O 3.01Å; I228-L239 HydrophobicContact CD1-CB 4.48Å; I228-L239 HydrophobicContact CG1-CB 3.86Å; I228-L239 HydrophobicContact CG1-CD1 4.23Å; I228-L239 HydrophobicContact CG1-CD2 4.49Å; I228-L239 HydrophobicContact CG1-CG 4.43Å; I228-L239 HydrophobicContact CG2-CD1 4.36Å; S229-L239 CarbonylContact O-C 3.41Å; S229-L239 VanDerWaalsContact O-CA 3.27Å; S229-L239 WeakPolarHBondContact O-CA 3.46Å; C230-L239 HydrophobicContact CB-CD2 3.59Å
240	Y	88.7	Confident	79.1	Confident	89 Å²	89	54.7 Å²	54.7	35%	0.349	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	155.1	178.1	66.8	-81.5	0	0	0	112.3	H203 I228 S229 S231	H203-Y240 CarbonylContact O-C 3.49Å; H203-Y240 VanDerWaalsContact O-CA 3.25Å; H203-Y240 WeakPolarHBondContact O-CA 3.39Å; I228-Y240 WeakPolarHBondContact CD1-O 3.46Å; S229-Y240 WeakPolarHBondContact CB-O 3.39Å; S229-Y240 PolarHBondContact N-O 2.71Å; S229-Y240 PolarHBondContact O-N 3.4Å; S231-Y240 WeakPolarHBondContact OG-CE1 3.42Å
241	G	86.2	Confident	79.4	Confident	10 Å²	10	53.5 Å²	53.5	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.7	171.3	168.6	0	0	0	0	0	114.1	H203 L204 K205	H203-G241 PolarHBondContact O-N 2.83Å; L204-G241 WeakPolarHBondContact CA-O 3.27Å; K205-G241 PolarHBondContact N-O 3.03Å
242	I	84.7	Confident	80.1	Confident	52 Å²	52	51.9 Å²	51.9	27%	0.267	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120	174.7	-54.9	174.1	0	0	0	107.4	K205 E207 G244 R245	K205-I242 HydrophobicContact CB-CG1 4.23Å; K205-I242 CarbonylContact O-C 3.36Å; K205-I242 VanDerWaalsContact O-CA 3.29Å; K205-I242 WeakPolarHBondContact O-CA 3.27Å; E207-I242 HydrophobicContact CG-CG2 4.1Å; I242-G244 PolarHBondContact O-N 2.89Å; I242-R245 HydrophobicContact CB-CB 4.07Å; I242-R245 HydrophobicContact CB-CG 4Å; I242-R245 HydrophobicContact CG2-CB 4.37Å; I242-R245 HydrophobicContact CG2-CG 3.79Å; I242-R245 WeakPolarHBondContact O-CB 3.23Å; I242-R245 PolarHBondContact O-N 2.81Å
243	V	83.4	Confident	80.8	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.018	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	132.8	-175.8	-178.2	0	0	0	0	109.8	L204 K205 F206 R245 F250	L204-V243 HydrophobicContact CB-CG2 4.24Å; K205-V243 PolarHBondContact O-N 3.05Å; F206-V243 HydrophobicContact CD1-CB 4.01Å; F206-V243 HydrophobicContact CD1-CG1 4.35Å; F206-V243 HydrophobicContact CD1-CG2 4.02Å; F206-V243 HydrophobicContact CE1-CB 4.04Å; F206-V243 HydrophobicContact CE1-CG1 4.13Å; F206-V243 HydrophobicContact CE1-CG2 3.7Å; F206-V243 HydrophobicContact CE2-CG2 4.29Å; F206-V243 HydrophobicContact CG-CG2 4.47Å; F206-V243 HydrophobicContact CZ-CG2 3.84Å; V243-R245 VanDerWaalsContact C-N 3.27Å; V243-R245 PolarHBondContact O-N 2.79Å; V243-F250 HydrophobicContact CB-CE1 4.48Å; V243-F250 HydrophobicContact CG1-CD1 4.35Å; V243-F250 HydrophobicContact CG1-CE1 3.94Å; V243-F250 HydrophobicContact CG2-CD1 4.16Å; V243-F250 HydrophobicContact CG2-CE1 3.66Å
244	G	74.4	Confident	81.8	Confident	61 Å²	61	39.4 Å²	39.4	63%	0.629	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.2	-14.1	-173.8	0	0	0	0	0	114.3	I242 L248	I242-G244 PolarHBondContact O-N 2.89Å; G244-L248 PolarHBondContact N-O 3.37Å
245	R	66	Low	82.6	Confident	82 Å²	82	31 Å²	31	31%	0.309	19%	0.194	S	C	.	.	S	Bend	trans	-93.2	147.1	173.1	-64.4	-163.4	180	-153.7	-2.4	111.3	H64 E207 I242 V243 G247 L248	H64-R245 PolarHBondContact NE2-NH1 2.77Å; E207-R245 IonicContact OE1-CZ 3.2Å; E207-R245 IonicContact OE1-NE 3.79Å; E207-R245 PolarHBondContact OE1-NE 2.81Å; E207-R245 IonicContact OE1-NH2 2.79Å; E207-R245 PolarHBondContact OE1-NH2 3.43Å; I242-R245 HydrophobicContact CB-CB 4.07Å; I242-R245 HydrophobicContact CB-CG 4Å; I242-R245 HydrophobicContact CG2-CB 4.37Å; I242-R245 HydrophobicContact CG2-CG 3.79Å; I242-R245 WeakPolarHBondContact O-CB 3.23Å; I242-R245 PolarHBondContact O-N 2.81Å; V243-R245 VanDerWaalsContact C-N 3.27Å; V243-R245 PolarHBondContact O-N 2.79Å; R245-G247 PolarHBondContact O-N 3.24Å; R245-L248 WeakPolarHBondContact O-CB 3.37Å; R245-L248 PolarHBondContact O-N 2.75Å
246	R	56.6	Low	83.2	Confident	95 Å²	95	30.6 Å²	30.6	36%	0.358	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	20	179.5	-46.7	179.5	-164	171.8	3	114.6	Y76 R227 S229 L248	Y76-R246 HydrophobicContact CE2-CG 4.08Å; Y76-R246 PolarHBondContact OH-NE 3.41Å; Y76-R246 PolarHBondContact OH-NH2 2.58Å; R227-R246 WeakPolarHBondContact CD-O 3.28Å; S229-R246 PolarHBondContact OG-NH1 3.16Å; R246-L248 PolarHBondContact O-N 2.89Å
247	G	68.8	Low	83.1	Confident	40 Å²	40	30.8 Å²	30.8	41%	0.412	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	9.1	-169.4	0	0	0	0	0	113.7	R245 S249	R245-G247 PolarHBondContact O-N 3.24Å; G247-S249 PolarHBondContact O-N 2.8Å; G247-S249 PolarHBondContact O-OG 2.89Å
248	L	78.2	Confident	82.7	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.026	19%	0.192	C	C	.	.			trans	-61	115.3	172.5	175	58.4	0	0	0	108.8	L204 F225 H226 I228 G244 R245 R246	L204-L248 HydrophobicContact CD2-CD2 4.22Å; F225-L248 HydrophobicContact CD1-CD1 4.27Å; H226-L248 WeakPolarHBondContact O-CA 3.41Å; H226-L248 WeakPolarHBondContact O-CD1 3.39Å; I228-L248 HydrophobicContact CB-CD1 4.11Å; I228-L248 HydrophobicContact CD1-CD1 3.96Å; I228-L248 HydrophobicContact CD1-CD2 4Å; G244-L248 PolarHBondContact N-O 3.37Å; R245-L248 WeakPolarHBondContact O-CB 3.37Å; R245-L248 PolarHBondContact O-N 2.75Å; R246-L248 PolarHBondContact O-N 2.89Å
249	S	81.4	Confident	82.4	Confident	9 Å²	9	33.5 Å²	33.5	6%	0.063	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	160.5	174.7	45.3	0	0	0	0	107.4	H226 G247 C271	H226-S249 WeakPolarHBondContact CB-OG 3.48Å; H226-S249 PolarHBondContact N-O 2.89Å; H226-S249 PolarHBondContact O-N 3.1Å; G247-S249 PolarHBondContact O-N 2.8Å; G247-S249 PolarHBondContact O-OG 2.89Å; S249-C271 VanDerWaalsContact CB-SG 3.57Å; S249-C271 PolarHBondContact OG-SG 3.17Å
250	F	88.5	Confident	82.2	Confident	5 Å²	5	39.9 Å²	39.9	2%	0.022	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	152.9	175.5	67.2	-89.6	0	0	0	110.1	L204 F206 P213 I223 R224 F225 V243 L252	L204-F250 HydrophobicContact CD1-CD1 4.2Å; L204-F250 HydrophobicContact CD1-CE1 4Å; L204-F250 HydrophobicContact CD1-CZ 4.46Å; F206-F250 HydrophobicContact CE1-CE1 4.11Å; F206-F250 HydrophobicContact CE1-CZ 4.17Å; F206-F250 AromaticContact CZ-CE1 3.99Å; F206-F250 HydrophobicContact CZ-CE1 3.99Å; F206-F250 AromaticContact CZ-CZ 3.94Å; F206-F250 HydrophobicContact CZ-CZ 3.94Å; P213-F250 HydrophobicContact CG-CE2 3.76Å; P213-F250 HydrophobicContact CG-CZ 3.73Å; I223-F250 HydrophobicContact CD1-CB 4.16Å; I223-F250 HydrophobicContact CD1-CD2 3.67Å; I223-F250 HydrophobicContact CD1-CE2 4.32Å; I223-F250 HydrophobicContact CD1-CG 4.02Å; I223-F250 HydrophobicContact CG1-CB 4.15Å; I223-F250 HydrophobicContact CG1-CD2 4.08Å; I223-F250 HydrophobicContact CG1-CG 4.43Å; R224-F250 CarbonylContact O-C 3.43Å; R224-F250 WeakPolarHBondContact O-CA 3.48Å; R224-F250 WeakPolarHBondContact O-CB 2.94Å; F225-F250 HydrophobicContact CD1-CB 3.88Å; F225-F250 HydrophobicContact CE1-CB 4.26Å; V243-F250 HydrophobicContact CB-CE1 4.48Å; V243-F250 HydrophobicContact CG1-CD1 4.35Å; V243-F250 HydrophobicContact CG1-CE1 3.94Å; V243-F250 HydrophobicContact CG2-CD1 4.16Å; V243-F250 HydrophobicContact CG2-CE1 3.66Å; F250-L252 HydrophobicContact CD2-CD1 4.28Å; F250-L252 HydrophobicContact CD2-CG 3.91Å; F250-L252 HydrophobicContact CE2-CD1 3.63Å; F250-L252 HydrophobicContact CE2-CG 3.78Å
251	E	89.4	Confident	82.3	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.8	174.3	-64.6	-69.1	156.8	0	0	108.4	I223 R224 W253 R263 C266 C271 L273	I223-E251 WeakPolarHBondContact CA-O 3.39Å; R224-E251 HydrophobicContact CB-CB 4.28Å; R224-E251 PolarHBondContact N-O 2.95Å; R224-E251 PolarHBondContact O-N 3.08Å; E251-W253 HydrophobicContact CB-CE3 4.41Å; E251-W253 HydrophobicContact CB-CH2 3.54Å; E251-W253 HydrophobicContact CB-CZ2 4.45Å; E251-W253 HydrophobicContact CB-CZ3 3.52Å; E251-W253 HydrophobicContact CG-CH2 4.47Å; E251-R263 IonicContact OE1-NH2 3.22Å; E251-R263 PolarHBondContact OE1-NH2 3.35Å; E251-R263 VanDerWaalsContact OE1-NH2 3.09Å; E251-R263 IonicContact OE2-CZ 2.8Å; E251-R263 VanDerWaalsContact OE2-CZ 3.23Å; E251-R263 IonicContact OE2-NE 2.83Å; E251-R263 PolarHBondContact OE2-NE 3.07Å; E251-R263 IonicContact OE2-NH2 3.35Å; E251-R263 PolarHBondContact OE2-NH2 3.06Å; E251-C266 VanDerWaalsContact OE1-CB 3.28Å; E251-C266 WeakPolarHBondContact OE1-CB 3.49Å; E251-C266 PolarHBondContact OE1-SG 3.04Å; E251-C266 WeakPolarHBondContact OE2-CB 3.41Å; E251-C271 HydrophobicContact CG-CB 4.33Å; E251-L273 HydrophobicContact CG-CD2 4.32Å
252	L	92.1	Very high	82.6	Confident	10 Å²	10	39.5 Å²	39.5	5%	0.052	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	138.9	178.8	-82	172.4	0	0	0	110	P213 L215 Y221 V222 I223 F250 L264	P213-L252 HydrophobicContact CB-CD1 3.71Å; P213-L252 HydrophobicContact CG-CD1 3.79Å; L215-L252 HydrophobicContact CD2-CD1 3.8Å; Y221-L252 HydrophobicContact CD1-CD2 4.29Å; Y221-L252 HydrophobicContact CG-CD2 4.33Å; V222-L252 WeakPolarHBondContact O-CA 3.13Å; I223-L252 HydrophobicContact CB-CD2 3.72Å; I223-L252 HydrophobicContact CD1-CD2 3.93Å; I223-L252 HydrophobicContact CD1-CG 4.47Å; I223-L252 HydrophobicContact CG1-CD2 3.9Å; I223-L252 HydrophobicContact CG1-CG 4.48Å; F250-L252 HydrophobicContact CD2-CD1 4.28Å; F250-L252 HydrophobicContact CD2-CG 3.91Å; F250-L252 HydrophobicContact CE2-CD1 3.63Å; F250-L252 HydrophobicContact CE2-CG 3.78Å; L252-L264 HydrophobicContact CB-CB 4.33Å; L252-L264 HydrophobicContact CB-CD1 4.05Å; L252-L264 HydrophobicContact CB-CG 4.38Å; L252-L264 HydrophobicContact CD1-CD1 4.32Å; L252-L264 PolarHBondContact O-N 3.2Å
253	W	93	Very high	82.8	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126.3	166	-66.3	-108.8	0	0	0	108.4	Y221 V222 R224 E251 A261 N262 R263 L273 V281	Y221-W253 WeakPolarHBondContact CA-O 3.41Å; Y221-W253 WeakPolarHBondContact CD1-O 3.46Å; V222-W253 HydrophobicContact CB-CB 4.42Å; V222-W253 PolarHBondContact N-O 3.28Å; V222-W253 PolarHBondContact O-N 3.17Å; R224-W253 HydrophobicContact CB-CH2 4.08Å; R224-W253 HydrophobicContact CB-CZ3 3.72Å; E251-W253 HydrophobicContact CB-CE3 4.41Å; E251-W253 HydrophobicContact CB-CH2 3.54Å; E251-W253 HydrophobicContact CB-CZ2 4.45Å; E251-W253 HydrophobicContact CB-CZ3 3.52Å; E251-W253 HydrophobicContact CG-CH2 4.47Å; W253-A261 HydrophobicContact CB-CB 4.18Å; W253-N262 CarbonylContact C-O 3.57Å; W253-N262 WeakPolarHBondContact CA-O 3.5Å; W253-R263 HydrophobicContact CG-CB 4.42Å; W253-L273 HydrophobicContact CH2-CD1 4.44Å; W253-L273 HydrophobicContact CH2-CD2 3.84Å; W253-L273 HydrophobicContact CZ2-CD1 3.81Å; W253-L273 HydrophobicContact CZ2-CD2 3.95Å; W253-V281 HydrophobicContact CB-CG1 4.08Å; W253-V281 HydrophobicContact CD2-CB 4.4Å; W253-V281 HydrophobicContact CD2-CG1 3.83Å; W253-V281 HydrophobicContact CD2-CG2 3.69Å; W253-V281 HydrophobicContact CE3-CG1 4.42Å; W253-V281 HydrophobicContact CE3-CG2 3.68Å; W253-V281 HydrophobicContact CG-CG1 3.64Å; W253-V281 HydrophobicContact CG-CG2 4.4Å; W253-V281 HydrophobicContact CH2-CG2 3.74Å; W253-V281 HydrophobicContact CZ2-CG2 3.72Å; W253-V281 HydrophobicContact CZ3-CG2 3.72Å
254	H	93.3	Very high	83	Confident	12 Å²	12	43.6 Å²	43.6	6%	0.056	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	121.2	170.5	-175.2	-143.5	0	0	0	109.2	Q218 Y221 N262 L264	Q218-H254 PolarHBondContact O-NE2 3.42Å; Y221-H254 HydrophobicContact CD1-CB 4.13Å; Y221-H254 HydrophobicContact CE1-CB 3.65Å; Y221-H254 AromaticContact CE1-CD2 3.5Å; Y221-H254 AromaticContact CE1-CG 3.78Å; Y221-H254 AromaticContact CZ-CD2 3.51Å; Y221-H254 PolarHBondContact OH-CD2 2.85Å; H254-N262 PolarHBondContact N-O 3.35Å; H254-N262 PolarHBondContact O-N 2.84Å; H254-L264 HydrophobicContact CB-CD2 3.97Å; H254-L264 HydrophobicContact CB-CG 4.26Å
255	C	89.3	Confident	83.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.3	-175.7	-62.4	0	0	0	0	109.6	G219 F220 H285	G219-C255 VanDerWaalsContact CA-O 3.31Å; G219-C255 WeakPolarHBondContact CA-O 3.47Å; F220-C255 HydrophobicContact CD1-CB 3.99Å; F220-C255 HydrophobicContact CD2-CB 3.76Å; F220-C255 HydrophobicContact CE1-CB 3.72Å; F220-C255 HydrophobicContact CE2-CB 3.49Å; F220-C255 VanDerWaalsContact CE2-CB 3.49Å; F220-C255 HydrophobicContact CG-CB 4.03Å; F220-C255 HydrophobicContact CZ-CB 3.5Å; F220-C255 VanDerWaalsContact CZ-CB 3.5Å; F220-C255 PolarHBondContact N-O 3.46Å; F220-C255 PolarHBondContact O-N 2.81Å; C255-H285 VanDerWaalsContact CB-CD2 3.42Å; C255-H285 WeakPolarHBondContact CB-CD2 3.33Å; C255-H285 PolarHBondContact SG-CD2 2.82Å
256	L	86.6	Confident	83.2	Confident	53 Å²	53	43.2 Å²	43.2	28%	0.277	25%	0.25	S	S	.	.			trans	-105.1	135.6	168.1	-67.1	173.8	0	0	0	107.7	Q218 G258 S259	Q218-L256 HydrophobicContact CG-CD2 4.01Å; L256-G258 PolarHBondContact O-N 2.82Å; L256-S259 WeakPolarHBondContact O-CB 3.46Å; L256-S259 PolarHBondContact O-N 3.44Å
257	I	78.9	Confident	83.6	Confident	58 Å²	58	46.3 Å²	46.3	30%	0.297	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	128	176.3	-60.8	178.3	0	0	0	109.1	S259 E289 V292 K293	I257-S259 VanDerWaalsContact C-N 3.32Å; I257-E289 HydrophobicContact CB-CG 4.41Å; I257-E289 HydrophobicContact CG1-CG 4.47Å; I257-E289 HydrophobicContact CG2-CG 3.9Å; I257-V292 HydrophobicContact CD1-CG1 3.82Å; I257-K293 HydrophobicContact CG2-CD 4.26Å; I257-K293 HydrophobicContact CG2-CG 3.92Å
258	G	75.7	Confident	83.2	Confident	61 Å²	61	46.9 Å²	46.9	63%	0.629	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	8.4	-179.4	0	0	0	0	0	114.8	L256 E289	L256-G258 PolarHBondContact O-N 2.82Å; G258-E289 WeakPolarHBondContact CA-OE1 3.36Å; G258-E289 VanDerWaalsContact N-CD 3.32Å; G258-E289 PolarHBondContact N-OE1 2.81Å
259	S	84.9	Confident	82	Confident	56 Å²	56	55.9 Å²	55.9	39%	0.392	30%	0.297	S	S	.	.	S	Bend	trans	-126	159.6	179.4	-57.5	0	0	0	0	110.8	L256 I257 H285	L256-S259 WeakPolarHBondContact O-CB 3.46Å; L256-S259 PolarHBondContact O-N 3.44Å; I257-S259 VanDerWaalsContact C-N 3.32Å; S259-H285 PolarHBondContact O-CE1 3.45Å; S259-H285 PolarHBondContact O-NE2 2.86Å
260	I	87.1	Confident	80.8	Confident	134 Å²	134	58.1 Å²	58.1	69%	0.687	32%	0.316	S	S	*	.			trans	-66.2	152.1	174.3	61.5	172.3	0	0	0	112	N262	I260-N262 PolarHBondContact O-N 2.75Å; I260-N262 PolarHBondContact O-ND2 3.39Å; I260-N262 VanDerWaalsContact O-ND2 3.11Å
261	A	89.9	Confident	79.6	Confident	13 Å²	13	58.8 Å²	58.8	11%	0.107	32%	0.321	C	S	.	.			trans	-68.4	121.6	175.7	0	0	0	0	0	110.9	W253 V281	W253-A261 HydrophobicContact CB-CB 4.18Å; A261-V281 HydrophobicContact CB-CG1 3.97Å
262	N	91.5	Very high	78.5	Confident	77 Å²	77	64.3 Å²	64.3	41%	0.412	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112.7	-177.1	-67.3	-71.4	0	0	0	110.9	W253 H254 I260 L264	W253-N262 CarbonylContact C-O 3.57Å; W253-N262 WeakPolarHBondContact CA-O 3.5Å; H254-N262 PolarHBondContact N-O 3.35Å; H254-N262 PolarHBondContact O-N 2.84Å; I260-N262 PolarHBondContact O-N 2.75Å; I260-N262 PolarHBondContact O-ND2 3.39Å; I260-N262 VanDerWaalsContact O-ND2 3.11Å; N262-L264 PolarHBondContact O-N 3.2Å
263	R	89.9	Confident	77.8	Confident	119 Å²	119	66.5 Å²	66.5	45%	0.449	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	127.5	175.5	-171.4	-178.4	174.4	-167.1	3.9	110.6	E251 W253 L273	E251-R263 IonicContact OE1-NH2 3.22Å; E251-R263 PolarHBondContact OE1-NH2 3.35Å; E251-R263 VanDerWaalsContact OE1-NH2 3.09Å; E251-R263 IonicContact OE2-CZ 2.8Å; E251-R263 VanDerWaalsContact OE2-CZ 3.23Å; E251-R263 IonicContact OE2-NE 2.83Å; E251-R263 PolarHBondContact OE2-NE 3.07Å; E251-R263 IonicContact OE2-NH2 3.35Å; E251-R263 PolarHBondContact OE2-NH2 3.06Å; W253-R263 HydrophobicContact CG-CB 4.42Å; R263-L273 VanDerWaalsContact NH1-CD1 3.26Å
264	L	88.2	Confident	77.2	Confident	22 Å²	22	69.6 Å²	69.6	12%	0.115	39%	0.386	C	S	.	.			trans	-77.7	147	172.3	-67.7	-173.1	0	0	0	110.7	P213 Y221 L252 H254 N262 C266	P213-L264 HydrophobicContact CB-CD1 4.33Å; Y221-L264 HydrophobicContact CD1-CD1 4.33Å; Y221-L264 HydrophobicContact CE1-CD1 3.85Å; L252-L264 HydrophobicContact CB-CB 4.33Å; L252-L264 HydrophobicContact CB-CD1 4.05Å; L252-L264 HydrophobicContact CB-CG 4.38Å; L252-L264 HydrophobicContact CD1-CD1 4.32Å; L252-L264 PolarHBondContact O-N 3.2Å; H254-L264 HydrophobicContact CB-CD2 3.97Å; H254-L264 HydrophobicContact CB-CG 4.26Å; N262-L264 PolarHBondContact O-N 3.2Å; L264-C266 PolarHBondContact O-N 3.49Å
265	P	77.2	Confident	76.5	Confident	108 Å²	108	77.4 Å²	77.4	70%	0.701	42%	0.422	S	S	*	.			trans	-62.5	112.4	175.7	1.8	2.1	0	0	0	110.8
266	C	67.7	Low	76	Confident	28 Å²	28	84.3 Å²	84.3	19%	0.189	46%	0.455	C	S	.	.			trans	-85.3	113	172.5	-178.1	0	0	0	0	109.7	E251 L264 H268	E251-C266 VanDerWaalsContact OE1-CB 3.28Å; E251-C266 WeakPolarHBondContact OE1-CB 3.49Å; E251-C266 PolarHBondContact OE1-SG 3.04Å; E251-C266 WeakPolarHBondContact OE2-CB 3.41Å; L264-C266 PolarHBondContact O-N 3.49Å; C266-H268 PolarHBondContact O-N 2.89Å; C266-H268 PolarHBondContact SG-ND1 2.86Å
267	K	63.5	Low	75.9	Confident	160 Å²	160	82.4 Å²	82.4	70%	0.696	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.3	177.7	-74.1	-174	175.5	-173	0	113.5	P211 K269	P211-K267 HydrophobicContact CB-CD 4.32Å; P211-K267 HydrophobicContact CG-CD 3.52Å; K267-K269 VanDerWaalsContact C-N 3.26Å; K267-K269 PolarHBondContact O-N 3.03Å
268	H	60.7	Low	76.2	Confident	51 Å²	51	83.2 Å²	83.2	24%	0.236	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.5	-175.2	-41.1	101.3	0	0	0	113.1	C266 A270	C266-H268 PolarHBondContact O-N 2.89Å; C266-H268 PolarHBondContact SG-ND1 2.86Å; H268-A270 WeakPolarHBondContact O-CB 3.39Å; H268-A270 PolarHBondContact O-N 2.93Å
269	K	52.9	Low	76.5	Confident	195 Å²	195	84.6 Å²	84.6	85%	0.848	44%	0.443	S	S	*	.			trans	46.3	13.6	175.9	-69.2	-169.7	178.5	-176.5	0	116.8	K267	K267-K269 VanDerWaalsContact C-N 3.26Å; K267-K269 PolarHBondContact O-N 3.03Å
270	A	56.5	Low	76.5	Confident	56 Å²	56	84 Å²	84	46%	0.463	43%	0.434	S	S	.	.			trans	-92	-3.9	-166.8	0	0	0	0	0	114.3	H268	H268-A270 WeakPolarHBondContact O-CB 3.39Å; H268-A270 PolarHBondContact O-N 2.93Å
271	C	63.3	Low	76.6	Confident	19 Å²	19	77.6 Å²	77.6	13%	0.128	40%	0.401	C	S	.	.			trans	-122.4	120.4	-167.1	-53.7	0	0	0	0	111.6	H226 S249 E251	H226-C271 PolarHBondContact CD2-SG 2.96Å; H226-C271 WeakPolarHBondContact NE2-CB 3.23Å; H226-C271 PolarHBondContact NE2-SG 3.42Å; S249-C271 VanDerWaalsContact CB-SG 3.57Å; S249-C271 PolarHBondContact OG-SG 3.17Å; E251-C271 HydrophobicContact CG-CB 4.33Å
272	T	66.9	Low	76.4	Confident	116 Å²	116	80.1 Å²	80.1	71%	0.712	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-74.1	131.4	161.5	47.6	0	0	0	0	108.9	R224	R224-T272 PolarHBondContact NH1-O 2.74Å
273	L	76.1	Confident	75.9	Confident	57 Å²	57	79.8 Å²	79.8	30%	0.298	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-95.3	137	167.7	-71.5	-179.5	0	0	0	109.4	E251 W253 R263 D277	E251-L273 HydrophobicContact CG-CD2 4.32Å; W253-L273 HydrophobicContact CH2-CD1 4.44Å; W253-L273 HydrophobicContact CH2-CD2 3.84Å; W253-L273 HydrophobicContact CZ2-CD1 3.81Å; W253-L273 HydrophobicContact CZ2-CD2 3.95Å; R263-L273 VanDerWaalsContact NH1-CD1 3.26Å; L273-D277 VanDerWaalsContact CA-OD2 3.23Å; L273-D277 WeakPolarHBondContact CA-OD2 3.36Å; L273-D277 HydrophobicContact CD2-CB 3.91Å
274	T	80.2	Confident	75.8	Confident	67 Å²	67	74.2 Å²	74.2	41%	0.411	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-103.6	168.5	170.7	66	0	0	0	0	110.4	E276 D277 Q278	T274-E276 PolarHBondContact O-N 3.13Å; T274-E276 PolarHBondContact OG1-N 2.83Å; T274-D277 PolarHBondContact N-OD2 2.96Å; T274-D277 WeakPolarHBondContact O-CB 3.46Å; T274-D277 PolarHBondContact O-N 3.48Å; T274-D277 VanDerWaalsContact O-N 3.16Å; T274-D277 PolarHBondContact OG1-N 3.17Å; T274-D277 PolarHBondContact OG1-OD2 2.57Å; T274-Q278 PolarHBondContact O-N 2.83Å
275	E	79.5	Confident	75.6	Confident	176 Å²	176	73.7 Å²	73.7	82%	0.822	38%	0.382	S	S	*	.	H	α-helix	trans	-60	-33	171.8	-65.8	179.8	175.3	0	0	111.9	D277 Q278 V279	E275-D277 VanDerWaalsContact C-N 3.28Å; E275-D277 PolarHBondContact O-N 3.43Å; E275-Q278 PolarHBondContact O-N 2.9Å; E275-V279 WeakPolarHBondContact O-CG2 3.32Å; E275-V279 PolarHBondContact O-N 3.03Å
276	E	79.9	Confident	75.6	Confident	145 Å²	145	72.2 Å²	72.2	68%	0.678	37%	0.371	S	S	*	.	H	α-helix	trans	-61.4	-36.5	175.7	-61.5	172.5	169.7	0	0	112.1	T274 Q278 V279 Q280	T274-E276 PolarHBondContact O-N 3.13Å; T274-E276 PolarHBondContact OG1-N 2.83Å; E276-Q278 VanDerWaalsContact C-N 3.34Å; E276-V279 PolarHBondContact O-N 3.22Å; E276-Q280 WeakPolarHBondContact O-CG 3.37Å; E276-Q280 PolarHBondContact O-N 2.96Å
277	D	84.1	Confident	76.1	Confident	12 Å²	12	71.5 Å²	71.5	6%	0.064	36%	0.364	C	S	.	.	H	α-helix	trans	-64.8	-41.1	177.8	-58.3	-34.8	0	0	0	110.8	Y167 R224 L273 T274 E275 Q280 V281	Y167-D277 WeakPolarHBondContact OH-CA 3.45Å; Y167-D277 WeakPolarHBondContact OH-CB 3.28Å; Y167-D277 PolarHBondContact OH-OD1 3.48Å; R224-D277 IonicContact CZ-OD1 2.74Å; R224-D277 VanDerWaalsContact CZ-OD1 3.29Å; R224-D277 IonicContact CZ-OD2 2.97Å; R224-D277 IonicContact NE-OD1 3.23Å; R224-D277 PolarHBondContact NE-OD1 2.84Å; R224-D277 IonicContact NE-OD2 2.75Å; R224-D277 IonicContact NH1-OD2 3.18Å; R224-D277 PolarHBondContact NH1-OD2 2.83Å; R224-D277 IonicContact NH2-OD1 2.89Å; R224-D277 PolarHBondContact NH2-OD1 2.79Å; R224-D277 IonicContact NH2-OD2 2.75Å; R224-D277 PolarHBondContact NH2-OD2 2.85Å; L273-D277 VanDerWaalsContact CA-OD2 3.23Å; L273-D277 WeakPolarHBondContact CA-OD2 3.36Å; L273-D277 HydrophobicContact CD2-CB 3.91Å; T274-D277 PolarHBondContact N-OD2 2.96Å; T274-D277 WeakPolarHBondContact O-CB 3.46Å; T274-D277 PolarHBondContact O-N 3.48Å; T274-D277 VanDerWaalsContact O-N 3.16Å; T274-D277 PolarHBondContact OG1-N 3.17Å; T274-D277 PolarHBondContact OG1-OD2 2.57Å; E275-D277 VanDerWaalsContact C-N 3.28Å; E275-D277 PolarHBondContact O-N 3.43Å; D277-Q280 PolarHBondContact O-N 3.43Å; D277-V281 VanDerWaalsContact O-CG2 3.28Å; D277-V281 WeakPolarHBondContact O-CG2 3.37Å; D277-V281 PolarHBondContact O-N 2.96Å
278	Q	84.6	Confident	76.9	Confident	75 Å²	75	65.2 Å²	65.2	35%	0.35	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-41.9	176.6	-173.6	58.2	50	0	0	111.3	T274 E275 E276 Q280 V281 D282	T274-Q278 PolarHBondContact O-N 2.83Å; E275-Q278 PolarHBondContact O-N 2.9Å; E276-Q278 VanDerWaalsContact C-N 3.34Å; Q278-Q280 VanDerWaalsContact C-N 3.33Å; Q278-Q280 PolarHBondContact O-N 3.14Å; Q278-V281 PolarHBondContact O-N 2.84Å; Q278-D282 PolarHBondContact NE2-OD1 2.83Å; Q278-D282 PolarHBondContact NE2-OD2 3.3Å; Q278-D282 PolarHBondContact O-N 2.86Å
279	V	82.7	Confident	77.4	Confident	90 Å²	90	63.8 Å²	63.8	55%	0.545	33%	0.33	S	S	.	.	H	α-helix	trans	-58.9	-42.5	175.5	172	0	0	0	0	111.7	E275 E276 R283	E275-V279 WeakPolarHBondContact O-CG2 3.32Å; E275-V279 PolarHBondContact O-N 3.03Å; E276-V279 PolarHBondContact O-N 3.22Å; V279-R283 VanDerWaalsContact O-CB 3.28Å; V279-R283 WeakPolarHBondContact O-CB 3.32Å; V279-R283 PolarHBondContact O-N 3.02Å
280	Q	85.1	Confident	78.1	Confident	43 Å²	43	57.9 Å²	57.9	20%	0.201	31%	0.306	C	S	.	.	H	α-helix	trans	-68.5	-38	177.5	-64.7	-48.4	-40.9	0	0	112.4	Y167 E276 D277 Q278 R283 L284	Y167-Q280 HydrophobicContact CD1-CB 4.02Å; Y167-Q280 HydrophobicContact CD2-CB 4.27Å; Y167-Q280 HydrophobicContact CD2-CG 4.42Å; Y167-Q280 HydrophobicContact CE1-CB 4.07Å; Y167-Q280 HydrophobicContact CE2-CB 4.32Å; Y167-Q280 HydrophobicContact CE2-CG 4.32Å; Y167-Q280 HydrophobicContact CG-CB 4.13Å; E276-Q280 WeakPolarHBondContact O-CG 3.37Å; E276-Q280 PolarHBondContact O-N 2.96Å; D277-Q280 PolarHBondContact O-N 3.43Å; Q278-Q280 VanDerWaalsContact C-N 3.33Å; Q278-Q280 PolarHBondContact O-N 3.14Å; Q280-R283 PolarHBondContact O-N 3.16Å; Q280-L284 PolarHBondContact O-N 3.26Å
281	V	89.4	Confident	78.5	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-49.1	176.4	169.7	0	0	0	0	110.9	Y167 V222 W253 A261 D277 Q278 R283 L284 H285	Y167-V281 HydrophobicContact CD1-CG2 4.41Å; Y167-V281 HydrophobicContact CE1-CG2 4.22Å; V222-V281 HydrophobicContact CB-CG1 4.32Å; V222-V281 HydrophobicContact CG1-CB 4.43Å; V222-V281 HydrophobicContact CG1-CG1 4.31Å; V222-V281 HydrophobicContact CG1-CG2 4.11Å; W253-V281 HydrophobicContact CB-CG1 4.08Å; W253-V281 HydrophobicContact CD2-CB 4.4Å; W253-V281 HydrophobicContact CD2-CG1 3.83Å; W253-V281 HydrophobicContact CD2-CG2 3.69Å; W253-V281 HydrophobicContact CE3-CG1 4.42Å; W253-V281 HydrophobicContact CE3-CG2 3.68Å; W253-V281 HydrophobicContact CG-CG1 3.64Å; W253-V281 HydrophobicContact CG-CG2 4.4Å; W253-V281 HydrophobicContact CH2-CG2 3.74Å; W253-V281 HydrophobicContact CZ2-CG2 3.72Å; W253-V281 HydrophobicContact CZ3-CG2 3.72Å; A261-V281 HydrophobicContact CB-CG1 3.97Å; D277-V281 VanDerWaalsContact O-CG2 3.28Å; D277-V281 WeakPolarHBondContact O-CG2 3.37Å; D277-V281 PolarHBondContact O-N 2.96Å; Q278-V281 PolarHBondContact O-N 2.84Å; V281-R283 VanDerWaalsContact C-N 3.29Å; V281-R283 PolarHBondContact O-N 3.35Å; V281-L284 PolarHBondContact O-N 2.83Å; V281-H285 WeakPolarHBondContact O-CB 2.95Å; V281-H285 PolarHBondContact O-N 3.37Å
282	D	85.1	Confident	78.4	Confident	66 Å²	66	56.3 Å²	56.3	35%	0.353	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-38.2	179.9	-70.3	-30.3	0	0	0	111.5	Q278 H285 V286	Q278-D282 PolarHBondContact NE2-OD1 2.83Å; Q278-D282 PolarHBondContact NE2-OD2 3.3Å; Q278-D282 PolarHBondContact O-N 2.86Å; D282-H285 PolarHBondContact O-N 3.46Å; D282-V286 WeakPolarHBondContact O-CB 3.5Å; D282-V286 VanDerWaalsContact O-CG2 3.29Å; D282-V286 WeakPolarHBondContact O-CG2 3.39Å; D282-V286 PolarHBondContact O-N 2.92Å
283	R	81.2	Confident	77.6	Confident	70 Å²	70	56.1 Å²	56.1	26%	0.264	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-48.2	175.8	-178	178.9	172.9	-156.8	2.1	112.7	V279 Q280 V281 H285 W287 L411 Y412	V279-R283 VanDerWaalsContact O-CB 3.28Å; V279-R283 WeakPolarHBondContact O-CB 3.32Å; V279-R283 PolarHBondContact O-N 3.02Å; Q280-R283 PolarHBondContact O-N 3.16Å; V281-R283 VanDerWaalsContact C-N 3.29Å; V281-R283 PolarHBondContact O-N 3.35Å; R283-H285 VanDerWaalsContact C-N 3.32Å; R283-W287 VanDerWaalsContact O-CB 3.29Å; R283-W287 WeakPolarHBondContact O-CB 3.31Å; R283-W287 PolarHBondContact O-N 3.4Å; R283-L411 HydrophobicContact CG-CD1 4.16Å; R283-L411 PolarHBondContact NE-O 2.81Å; R283-L411 VanDerWaalsContact NE-O 3.16Å; R283-L411 PolarHBondContact NH2-O 2.88Å; R283-Y412 VanDerWaalsContact NH2-CA 3.32Å
284	L	86.2	Confident	76.4	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-66.7	-36.7	176.9	-77	174.3	0	0	0	111.9	V169 D191 V222 Q280 V281 W287 Y288 L411	V169-L284 HydrophobicContact CG2-CB 4.04Å; V169-L284 HydrophobicContact CG2-CD2 4.41Å; D191-L284 HydrophobicContact CB-CD2 4.23Å; V222-L284 HydrophobicContact CG1-CB 4.17Å; V222-L284 HydrophobicContact CG1-CD1 3.92Å; V222-L284 HydrophobicContact CG2-CB 4.21Å; Q280-L284 PolarHBondContact O-N 3.26Å; V281-L284 PolarHBondContact O-N 2.83Å; L284-W287 HydrophobicContact CD2-CE3 4.16Å; L284-Y288 WeakPolarHBondContact O-CB 3.28Å; L284-Y288 PolarHBondContact O-N 2.78Å; L284-L411 HydrophobicContact CD2-CD1 4.03Å; L284-L411 HydrophobicContact CD2-CD2 4.31Å
285	H	84.5	Confident	74.9	Confident	11 Å²	11	55.5 Å²	55.5	5%	0.051	27%	0.273	C	S	.	.	H	α-helix	trans	-60.5	-53.9	176.2	175.6	-124.8	0	0	0	111.4	F220 V222 C255 S259 V281 D282 R283 Y288 E289	F220-H285 AromaticContact CE2-CD2 3.91Å; F220-H285 AromaticContact CZ-CD2 3.38Å; F220-H285 WeakPolarHBondContact CZ-CD2 3.2Å; V222-H285 HydrophobicContact CG2-CB 4.36Å; C255-H285 VanDerWaalsContact CB-CD2 3.42Å; C255-H285 WeakPolarHBondContact CB-CD2 3.33Å; C255-H285 PolarHBondContact SG-CD2 2.82Å; S259-H285 PolarHBondContact O-CE1 3.45Å; S259-H285 PolarHBondContact O-NE2 2.86Å; V281-H285 WeakPolarHBondContact O-CB 2.95Å; V281-H285 PolarHBondContact O-N 3.37Å; D282-H285 PolarHBondContact O-N 3.46Å; R283-H285 VanDerWaalsContact C-N 3.32Å; H285-Y288 PolarHBondContact O-N 3.42Å; H285-E289 IonicContact CE1-OE2 3.79Å; H285-E289 IonicContact NE2-OE2 3.86Å; H285-E289 WeakPolarHBondContact O-CB 3.29Å; H285-E289 PolarHBondContact O-N 3.23Å
286	V	77.1	Confident	73.1	Confident	77 Å²	77	55.7 Å²	55.7	47%	0.467	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-46.1	178.2	171.5	0	0	0	0	110.9	D282 Y288 E289 M290	D282-V286 WeakPolarHBondContact O-CB 3.5Å; D282-V286 VanDerWaalsContact O-CG2 3.29Å; D282-V286 WeakPolarHBondContact O-CG2 3.39Å; D282-V286 PolarHBondContact O-N 2.92Å; V286-Y288 PolarHBondContact O-N 3.09Å; V286-E289 PolarHBondContact O-N 2.81Å; V286-M290 HydrophobicContact CG1-SD 4.01Å; V286-M290 VanDerWaalsContact O-CG 3.23Å; V286-M290 WeakPolarHBondContact O-CG 3.27Å; V286-M290 PolarHBondContact O-N 3.06Å; V286-M290 VanDerWaalsContact O-N 3.07Å
287	W	77.9	Confident	71.2	Confident	14 Å²	14	50.9 Å²	50.9	5%	0.053	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-50.8	178.5	164.8	71.5	0	0	0	112.1	V169 I190 R283 L284 M290 D291 L411	V169-W287 HydrophobicContact CB-CZ3 4.24Å; V169-W287 HydrophobicContact CG2-CE3 4.15Å; V169-W287 HydrophobicContact CG2-CZ3 3.86Å; I190-W287 HydrophobicContact CB-CH2 4.48Å; I190-W287 HydrophobicContact CD1-CH2 4.19Å; I190-W287 HydrophobicContact CG1-CH2 4.18Å; I190-W287 HydrophobicContact CG1-CZ3 4.42Å; R283-W287 VanDerWaalsContact O-CB 3.29Å; R283-W287 WeakPolarHBondContact O-CB 3.31Å; R283-W287 PolarHBondContact O-N 3.4Å; L284-W287 HydrophobicContact CD2-CE3 4.16Å; W287-M290 WeakPolarHBondContact O-CB 3.5Å; W287-M290 PolarHBondContact O-N 2.92Å; W287-D291 PolarHBondContact O-N 3.48Å; W287-L411 HydrophobicContact CB-CD1 3.96Å; W287-L411 HydrophobicContact CD2-CD1 4.29Å; W287-L411 HydrophobicContact CG-CD1 3.91Å
288	Y	80.3	Confident	69.2	Low	27 Å²	27	59.2 Å²	59.2	11%	0.106	29%	0.287	C	S	.	.	H	α-helix	trans	-72.9	-31.3	-177.5	-172.4	-110.7	0	0	0	113	V169 I190 F220 L284 H285 V286 M290 D291 V292	V169-Y288 HydrophobicContact CB-CG 4.41Å; V169-Y288 HydrophobicContact CG1-CD1 3.67Å; V169-Y288 HydrophobicContact CG1-CD2 3.8Å; V169-Y288 HydrophobicContact CG1-CE1 3.83Å; V169-Y288 HydrophobicContact CG1-CE2 4.05Å; V169-Y288 HydrophobicContact CG1-CG 3.6Å; V169-Y288 HydrophobicContact CG2-CG 4.28Å; I190-Y288 HydrophobicContact CD1-CD2 3.79Å; I190-Y288 HydrophobicContact CD1-CE2 3.37Å; I190-Y288 HydrophobicContact CG1-CE2 4.48Å; F220-Y288 HydrophobicContact CB-CD1 4.05Å; F220-Y288 HydrophobicContact CB-CE1 3.53Å; F220-Y288 AromaticContact CD1-CD1 3.62Å; F220-Y288 HydrophobicContact CD1-CD1 3.62Å; F220-Y288 AromaticContact CD1-CE1 3.75Å; F220-Y288 HydrophobicContact CD1-CE1 3.75Å; F220-Y288 AromaticContact CD2-CD1 3.32Å; F220-Y288 HydrophobicContact CD2-CD1 3.32Å; F220-Y288 AromaticContact CD2-CE1 3.74Å; F220-Y288 HydrophobicContact CD2-CE1 3.74Å; F220-Y288 HydrophobicContact CD2-CG 4.3Å; F220-Y288 AromaticContact CE1-CD1 3.73Å; F220-Y288 HydrophobicContact CE1-CD1 3.73Å; F220-Y288 HydrophobicContact CE1-CE1 4.31Å; F220-Y288 AromaticContact CE2-CD1 3.43Å; F220-Y288 HydrophobicContact CE2-CD1 3.43Å; F220-Y288 VanDerWaalsContact CE2-CD1 3.43Å; F220-Y288 HydrophobicContact CE2-CE1 4.29Å; F220-Y288 HydrophobicContact CE2-CG 4.16Å; F220-Y288 AromaticContact CG-CD1 3.4Å; F220-Y288 HydrophobicContact CG-CD1 3.4Å; F220-Y288 AromaticContact CG-CE1 3.4Å; F220-Y288 HydrophobicContact CG-CE1 3.4Å; F220-Y288 VanDerWaalsContact CG-CE1 3.4Å; F220-Y288 AromaticContact CZ-CD1 3.6Å; F220-Y288 HydrophobicContact CZ-CD1 3.6Å; F220-Y288 HydrophobicContact CZ-CG 4.4Å; L284-Y288 WeakPolarHBondContact O-CB 3.28Å; L284-Y288 PolarHBondContact O-N 2.78Å; H285-Y288 PolarHBondContact O-N 3.42Å; V286-Y288 PolarHBondContact O-N 3.09Å; Y288-M290 VanDerWaalsContact C-N 3.27Å; Y288-M290 PolarHBondContact O-N 2.84Å; Y288-D291 HydrophobicContact CD2-CB 4.46Å; Y288-D291 PolarHBondContact O-N 2.51Å; Y288-D291 VanDerWaalsContact O-N 3.16Å; Y288-V292 HydrophobicContact CD1-CG2 3.67Å; Y288-V292 HydrophobicContact CD2-CG2 4.02Å; Y288-V292 HydrophobicContact CE1-CB 4.47Å; Y288-V292 HydrophobicContact CE1-CG2 3.23Å; Y288-V292 HydrophobicContact CE2-CG2 3.51Å; Y288-V292 HydrophobicContact CG-CG2 4.1Å; Y288-V292 WeakPolarHBondContact O-CG2 3.36Å; Y288-V292 PolarHBondContact O-N 2.78Å; Y288-V292 WeakPolarHBondContact OH-CG2 3.4Å
289	E	73	Confident	67.2	Low	21 Å²	21	61 Å²	61	10%	0.098	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-38.5	173.5	-167.6	-178.2	159.6	0	0	111.6	I257 G258 H285 V286 D291 K293	I257-E289 HydrophobicContact CB-CG 4.41Å; I257-E289 HydrophobicContact CG1-CG 4.47Å; I257-E289 HydrophobicContact CG2-CG 3.9Å; G258-E289 WeakPolarHBondContact CA-OE1 3.36Å; G258-E289 VanDerWaalsContact N-CD 3.32Å; G258-E289 PolarHBondContact N-OE1 2.81Å; H285-E289 IonicContact CE1-OE2 3.79Å; H285-E289 IonicContact NE2-OE2 3.86Å; H285-E289 WeakPolarHBondContact O-CB 3.29Å; H285-E289 PolarHBondContact O-N 3.23Å; V286-E289 PolarHBondContact O-N 2.81Å; E289-D291 VanDerWaalsContact C-N 3.31Å; E289-K293 HydrophobicContact CG-CD 4.27Å; E289-K293 HydrophobicContact CG-CG 4.46Å; E289-K293 VanDerWaalsContact O-CB 3.32Å; E289-K293 WeakPolarHBondContact O-CB 3.35Å; E289-K293 VanDerWaalsContact O-CG 3.27Å; E289-K293 WeakPolarHBondContact O-CG 3.4Å; E289-K293 PolarHBondContact O-N 2.89Å; E289-K293 VanDerWaalsContact O-N 3.08Å; E289-K293 WeakPolarHBondContact OE1-CE 3.41Å; E289-K293 IonicContact OE1-NZ 2.65Å; E289-K293 PolarHBondContact OE1-NZ 3.47Å
290	M	66	Low	65.2	Low	71 Å²	71	59.9 Å²	59.9	35%	0.35	30%	0.295	S	S	.	.	H	α-helix	trans	-65.1	-34.9	173.5	-65.9	173.8	120.7	0	0	112.3	V286 W287 Y288 G314 Y409	V286-M290 HydrophobicContact CG1-SD 4.01Å; V286-M290 VanDerWaalsContact O-CG 3.23Å; V286-M290 WeakPolarHBondContact O-CG 3.27Å; V286-M290 PolarHBondContact O-N 3.06Å; V286-M290 VanDerWaalsContact O-N 3.07Å; W287-M290 WeakPolarHBondContact O-CB 3.5Å; W287-M290 PolarHBondContact O-N 2.92Å; Y288-M290 VanDerWaalsContact C-N 3.27Å; Y288-M290 PolarHBondContact O-N 2.84Å; M290-G314 WeakPolarHBondContact O-CA 3.4Å; M290-Y409 HydrophobicContact CB-CD2 4.4Å; M290-Y409 HydrophobicContact CE-CD2 3.54Å; M290-Y409 HydrophobicContact CE-CE2 3.03Å; M290-Y409 HydrophobicContact CG-CD2 4.48Å; M290-Y409 HydrophobicContact SD-CD2 3.41Å; M290-Y409 WeakPolarHBondContact SD-CD2 3.36Å; M290-Y409 HydrophobicContact SD-CE2 3.64Å; M290-Y409 HydrophobicContact SD-CG 4.32Å
291	D	65.8	Low	63	Low	18 Å²	18	63.2 Å²	63.2	10%	0.096	32%	0.32	C	S	.	.	H	α-helix	trans	-77.6	-35	179.7	-161	74.9	0	0	0	113.5	W287 Y288 E289 S294 H406	W287-D291 PolarHBondContact O-N 3.48Å; Y288-D291 HydrophobicContact CD2-CB 4.46Å; Y288-D291 PolarHBondContact O-N 2.51Å; Y288-D291 VanDerWaalsContact O-N 3.16Å; E289-D291 VanDerWaalsContact C-N 3.31Å; D291-S294 PolarHBondContact O-OG 3.36Å; D291-H406 IonicContact OD1-CE1 3.76Å; D291-H406 PolarHBondContact OD1-CE1 2.87Å; D291-H406 IonicContact OD1-NE2 3.83Å
292	V	60.5	Low	61	Low	24 Å²	24	71.1 Å²	71.1	15%	0.145	36%	0.357	C	S	.	.	H	α-helix	trans	-84.7	-33.3	179.8	173.8	0	0	0	0	112.9	I257 Y288 S294 D295	I257-V292 HydrophobicContact CD1-CG1 3.82Å; Y288-V292 HydrophobicContact CD1-CG2 3.67Å; Y288-V292 HydrophobicContact CD2-CG2 4.02Å; Y288-V292 HydrophobicContact CE1-CB 4.47Å; Y288-V292 HydrophobicContact CE1-CG2 3.23Å; Y288-V292 HydrophobicContact CE2-CG2 3.51Å; Y288-V292 HydrophobicContact CG-CG2 4.1Å; Y288-V292 WeakPolarHBondContact O-CG2 3.36Å; Y288-V292 PolarHBondContact O-N 2.78Å; Y288-V292 WeakPolarHBondContact OH-CG2 3.4Å; V292-S294 PolarHBondContact O-N 3.41Å; V292-D295 PolarHBondContact O-N 3.26Å
293	K	49.9	Very low	59.6	Low	112 Å²	112	72.5 Å²	72.5	49%	0.487	36%	0.364	S	S	.	.	H	α-helix	trans	-57.1	-22.1	175	-83.3	-179.8	-178.1	169	0	111.8	I257 E289	I257-K293 HydrophobicContact CG2-CD 4.26Å; I257-K293 HydrophobicContact CG2-CG 3.92Å; E289-K293 HydrophobicContact CG-CD 4.27Å; E289-K293 HydrophobicContact CG-CG 4.46Å; E289-K293 VanDerWaalsContact O-CB 3.32Å; E289-K293 WeakPolarHBondContact O-CB 3.35Å; E289-K293 VanDerWaalsContact O-CG 3.27Å; E289-K293 WeakPolarHBondContact O-CG 3.4Å; E289-K293 PolarHBondContact O-N 2.89Å; E289-K293 VanDerWaalsContact O-N 3.08Å; E289-K293 WeakPolarHBondContact OE1-CE 3.41Å; E289-K293 IonicContact OE1-NZ 2.65Å; E289-K293 PolarHBondContact OE1-NZ 3.47Å
294	S	51.2	Low	59.5	Low	2 Å²	2	75.9 Å²	75.9	1%	0.014	38%	0.383	C	S	.	.	H	α-helix	trans	-97	-30.2	-178.2	57.2	0	0	0	0	116.7	D291 V292 R296 S297 G314	D291-S294 PolarHBondContact O-OG 3.36Å; V292-S294 PolarHBondContact O-N 3.41Å; S294-R296 PolarHBondContact O-N 2.87Å; S294-R296 VanDerWaalsContact O-N 3.12Å; S294-S297 PolarHBondContact O-N 3.3Å; S294-S297 PolarHBondContact O-OG 3.13Å; S294-G314 WeakPolarHBondContact CB-O 3.41Å; S294-G314 VanDerWaalsContact OG-C 3.27Å; S294-G314 WeakPolarHBondContact OG-CA 3.19Å; S294-G314 PolarHBondContact OG-O 3.26Å
295	D	48.4	Very low	59.7	Low	109 Å²	109	77.8 Å²	77.8	58%	0.583	39%	0.391	S	S	*	.	H	α-helix	trans	-62	-19.8	168.6	-153.1	25.6	0	0	0	110.7	V292	V292-D295 PolarHBondContact O-N 3.26Å
296	R	41.6	Very low	60.1	Low	181 Å²	181	80.6 Å²	80.6	68%	0.683	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-6.7	174.3	-66.7	-172.8	-178.6	-157.5	-0.2	115.5	S294 Q298	S294-R296 PolarHBondContact O-N 2.87Å; S294-R296 VanDerWaalsContact O-N 3.12Å; R296-Q298 VanDerWaalsContact C-N 3.27Å; R296-Q298 PolarHBondContact O-N 2.76Å
297	S	41.2	Very low	60.9	Low	44 Å²	44	79.2 Å²	79.2	31%	0.308	39%	0.394	S	S	.	.	S	Bend	trans	-64.2	103.4	166.4	62.5	0	0	0	0	105.4	S294 L299	S294-S297 PolarHBondContact O-N 3.3Å; S294-S297 PolarHBondContact O-OG 3.13Å; S297-L299 PolarHBondContact O-N 3.25Å
298	Q	40.9	Very low	61.7	Low	186 Å²	186	78.5 Å²	78.5	87%	0.869	39%	0.392	S	S	*	.			trans	-45.4	116.9	175.2	-68.3	179.1	-0.2	0	0	106	R296 S300	R296-Q298 VanDerWaalsContact C-N 3.27Å; R296-Q298 PolarHBondContact O-N 2.76Å; Q298-S300 PolarHBondContact O-N 3.38Å
299	L	42.8	Very low	62.4	Low	114 Å²	114	82.3 Å²	82.3	60%	0.597	41%	0.411	S	S	*	.			trans	-40	113.1	168.4	-73.6	154.1	0	0	0	105.8	S297 P301	S297-L299 PolarHBondContact O-N 3.25Å; L299-P301 WeakPolarHBondContact O-CD 3.23Å
300	S	40.4	Very low	63.3	Low	65 Å²	65	84.2 Å²	84.2	46%	0.455	43%	0.426	S	S	.	.			trans	-56.4	116.4	162.2	51.9	0	0	0	0	103.8	Q298 E302	Q298-S300 PolarHBondContact O-N 3.38Å; S300-E302 PolarHBondContact O-N 2.8Å
301	P	40.7	Very low	64.4	Low	113 Å²	113	81.1 Å²	81.1	73%	0.734	41%	0.411	S	S	*	.	S	Bend	trans	-58.9	139.6	169.3	-8.2	23.9	0	0	0	105.6	L299	L299-P301 WeakPolarHBondContact O-CD 3.23Å
302	E	45.6	Very low	65.1	Low	167 Å²	167	84 Å²	84	78%	0.78	43%	0.429	S	S	*	.	S	Bend	trans	93.8	146.1	173.5	-53	169.6	-174.7	0	0	115.6	S300 E304	S300-E302 PolarHBondContact O-N 2.8Å; E302-E304 PolarHBondContact O-N 3.17Å
303	D	56.5	Low	66	Low	94 Å²	94	84.1 Å²	84.1	50%	0.503	43%	0.43	S	S	.	.			trans	-65.3	42.5	-168.7	-58.7	-73.3	0	0	0	114.4	F305	D303-F305 HydrophobicContact CB-CE2 4.38Å; D303-F305 WeakPolarHBondContact O-CD2 3.41Å; D303-F305 WeakPolarHBondContact O-CE2 3.06Å; D303-F305 PolarHBondContact O-N 3.09Å; D303-F305 VanDerWaalsContact O-N 3.16Å
304	E	80	Confident	66.8	Low	142 Å²	142	78.9 Å²	78.9	66%	0.664	41%	0.408	S	S	*	.			trans	-75.1	109.7	177.9	-160.5	172.9	-168.6	0	0	109.5	E302	E302-E304 PolarHBondContact O-N 3.17Å
305	F	90.1	Very high	68.2	Low	41 Å²	41	81.4 Å²	81.4	18%	0.18	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-82.4	128.4	176	-65.3	-79.9	0	0	0	109.5	D303 N318 I320 A401 F403 L440	D303-F305 HydrophobicContact CB-CE2 4.38Å; D303-F305 WeakPolarHBondContact O-CD2 3.41Å; D303-F305 WeakPolarHBondContact O-CE2 3.06Å; D303-F305 PolarHBondContact O-N 3.09Å; D303-F305 VanDerWaalsContact O-N 3.16Å; F305-N318 HydrophobicContact CD1-CB 3.76Å; F305-N318 HydrophobicContact CE1-CB 4.1Å; F305-I320 HydrophobicContact CB-CD1 4.12Å; F305-I320 HydrophobicContact CB-CG1 4.13Å; F305-I320 HydrophobicContact CD1-CD1 4.05Å; F305-I320 HydrophobicContact CD1-CG1 3.45Å; F305-I320 VanDerWaalsContact CD1-CG1 3.45Å; F305-I320 HydrophobicContact CD2-CD1 3.6Å; F305-I320 HydrophobicContact CD2-CG1 3.97Å; F305-I320 HydrophobicContact CE1-CD1 4.34Å; F305-I320 HydrophobicContact CE1-CG1 3.69Å; F305-I320 HydrophobicContact CE2-CD1 3.93Å; F305-I320 HydrophobicContact CE2-CG1 4.2Å; F305-I320 HydrophobicContact CG-CD1 3.65Å; F305-I320 HydrophobicContact CG-CG1 3.57Å; F305-I320 HydrophobicContact CZ-CD1 4.27Å; F305-I320 HydrophobicContact CZ-CG1 4.05Å; F305-A401 HydrophobicContact CE1-CB 3.68Å; F305-A401 HydrophobicContact CZ-CB 3.82Å; F305-F403 HydrophobicContact CE1-CE1 4.04Å; F305-F403 HydrophobicContact CE1-CZ 4.1Å; F305-F403 AromaticContact CZ-CE1 3.73Å; F305-F403 HydrophobicContact CZ-CE1 3.73Å; F305-F403 AromaticContact CZ-CZ 3.68Å; F305-F403 HydrophobicContact CZ-CZ 3.68Å; F305-L440 HydrophobicContact CD2-CD2 3.92Å; F305-L440 HydrophobicContact CE2-CD1 3.7Å; F305-L440 HydrophobicContact CE2-CD2 3.68Å; F305-L440 HydrophobicContact CE2-CG 4.3Å; F305-L440 HydrophobicContact CZ-CD1 4.15Å
306	Q	91.9	Very high	69.9	Low	70 Å²	70	78.4 Å²	78.4	33%	0.327	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-100.1	159.3	177.4	-68.4	179.8	45.1	0	0	110.6	F311 N318	Q306-F311 HydrophobicContact CB-CD1 4.36Å; Q306-F311 HydrophobicContact CB-CE1 3.75Å; Q306-N318 PolarHBondContact N-O 3.38Å
307	L	94.4	Very high	72.2	Confident	48 Å²	48	70 Å²	70	25%	0.251	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-80	143.7	171.9	-56.5	174.2	0	0	0	109.3	E309 S310 F311 D342 T344 R447	L307-E309 HydrophobicContact CB-CG 3.82Å; L307-E309 HydrophobicContact CD1-CG 4.41Å; L307-E309 PolarHBondContact O-N 3.17Å; L307-S310 PolarHBondContact O-N 3.31Å; L307-S310 PolarHBondContact O-OG 3.46Å; L307-F311 WeakPolarHBondContact O-CD1 3.17Å; L307-F311 WeakPolarHBondContact O-CE1 3.33Å; L307-D342 WeakPolarHBondContact CA-OD2 3.23Å; L307-T344 HydrophobicContact CB-CG2 4.17Å; L307-T344 HydrophobicContact CD1-CG2 4.12Å; L307-T344 HydrophobicContact CD2-CG2 4.08Å; L307-T344 HydrophobicContact CG-CG2 4.34Å; L307-R447 VanDerWaalsContact CD2-CZ 3.5Å
308	V	94.9	Very high	74.6	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-59.8	-32.9	-179.8	71.3	0	0	0	0	111.3	S310 F311 I319 D342 T344 P346 P347 I350 F379	V308-S310 PolarHBondContact O-N 2.89Å; V308-F311 VanDerWaalsContact O-CB 3.31Å; V308-F311 WeakPolarHBondContact O-CB 3.36Å; V308-F311 PolarHBondContact O-N 3.38Å; V308-I319 HydrophobicContact CB-CD1 3.6Å; V308-I319 HydrophobicContact CG2-CD1 4.37Å; V308-D342 WeakPolarHBondContact CG1-OD1 3.11Å; V308-D342 PolarHBondContact N-OD2 2.99Å; V308-T344 VanDerWaalsContact CG1-OG1 3.31Å; V308-T344 WeakPolarHBondContact CG1-OG1 3.48Å; V308-P346 HydrophobicContact CG1-CB 4.16Å; V308-P346 HydrophobicContact CG1-CG 3.95Å; V308-P346 HydrophobicContact CG2-CB 4.15Å; V308-P347 WeakPolarHBondContact O-CD 3.48Å; V308-I350 HydrophobicContact CG2-CD1 4.13Å; V308-F379 HydrophobicContact CB-CD1 4.09Å; V308-F379 HydrophobicContact CB-CE1 3.9Å; V308-F379 HydrophobicContact CB-CZ 4.42Å; V308-F379 HydrophobicContact CG1-CD1 3.78Å; V308-F379 HydrophobicContact CG1-CE1 3.75Å; V308-F379 HydrophobicContact CG2-CD1 3.91Å; V308-F379 HydrophobicContact CG2-CE1 4.13Å; V308-F379 HydrophobicContact CG2-CG 4.09Å
309	E	94.5	Very high	77.2	Confident	107 Å²	107	60.4 Å²	60.4	50%	0.5	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-57.6	-28	176.7	68.7	177.6	-167.7	0	0	113.7	L307 T344 V345	L307-E309 HydrophobicContact CB-CG 3.82Å; L307-E309 HydrophobicContact CD1-CG 4.41Å; L307-E309 PolarHBondContact O-N 3.17Å; E309-T344 HydrophobicContact CG-CG2 4.33Å; E309-T344 PolarHBondContact N-OG1 2.93Å; E309-V345 WeakPolarHBondContact CA-O 3.37Å; E309-V345 VanDerWaalsContact CB-O 3.23Å; E309-V345 WeakPolarHBondContact CB-O 3.33Å
310	S	91.5	Very high	79.7	Confident	60 Å²	60	55.8 Å²	55.8	42%	0.42	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-88.8	-3.5	179.6	72.2	0	0	0	0	113.3	L307 V308 T312	L307-S310 PolarHBondContact O-N 3.31Å; L307-S310 PolarHBondContact O-OG 3.46Å; V308-S310 PolarHBondContact O-N 2.89Å; S310-T312 PolarHBondContact O-N 2.96Å
311	F	89.2	Confident	82.4	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.026	28%	0.276	C	S	.	.			trans	-69.1	131.5	-176.3	-77.9	29.5	0	0	0	110.3	Q306 L307 V308 C317 I319 P347 L407 L419	Q306-F311 HydrophobicContact CB-CD1 4.36Å; Q306-F311 HydrophobicContact CB-CE1 3.75Å; L307-F311 WeakPolarHBondContact O-CD1 3.17Å; L307-F311 WeakPolarHBondContact O-CE1 3.33Å; V308-F311 VanDerWaalsContact O-CB 3.31Å; V308-F311 WeakPolarHBondContact O-CB 3.36Å; V308-F311 PolarHBondContact O-N 3.38Å; F311-C317 HydrophobicContact CD1-CB 4.07Å; F311-C317 HydrophobicContact CD2-CB 4.1Å; F311-C317 HydrophobicContact CE1-CB 3.54Å; F311-C317 HydrophobicContact CE2-CB 3.53Å; F311-C317 HydrophobicContact CG-CB 4.33Å; F311-C317 HydrophobicContact CZ-CB 3.19Å; F311-I319 HydrophobicContact CE1-CB 4.4Å; F311-I319 HydrophobicContact CE1-CD1 4.45Å; F311-I319 HydrophobicContact CZ-CB 3.76Å; F311-I319 HydrophobicContact CZ-CD1 4.2Å; F311-I319 HydrophobicContact CZ-CG2 4.07Å; F311-P347 HydrophobicContact CB-CG 4.46Å; F311-P347 VanDerWaalsContact O-CG 3.25Å; F311-P347 WeakPolarHBondContact O-CG 3.17Å; F311-L407 HydrophobicContact CB-CD2 3.69Å; F311-L419 HydrophobicContact CD2-CD1 3.84Å; F311-L419 HydrophobicContact CE2-CD1 3.8Å; F311-L419 HydrophobicContact CE2-CD2 4.38Å
312	T	81.7	Confident	85	Confident	80 Å²	80	47.3 Å²	47.3	49%	0.491	24%	0.242	S	C	.	.			trans	-109	129.9	174.6	-58.1	0	0	0	0	109.3	S310 L315	S310-T312 PolarHBondContact O-N 2.96Å; T312-L315 WeakPolarHBondContact O-CB 3.44Å; T312-L315 PolarHBondContact O-N 2.91Å
313	P	78.8	Confident	87.3	Confident	25 Å²	25	39.4 Å²	39.4	16%	0.162	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	145.1	173.6	-29.5	37.4	0	0	0	113.2	L407 Y409 A417	P313-L407 CarbonylContact C-O 3.45Å; P313-L407 WeakPolarHBondContact CA-O 3.28Å; P313-L407 HydrophobicContact CB-CD2 4.48Å; P313-L407 HydrophobicContact CB-CG 4.35Å; P313-L407 HydrophobicContact CG-CD2 3.88Å; P313-L407 HydrophobicContact CG-CG 4.17Å; P313-Y409 HydrophobicContact CB-CD2 3.68Å; P313-Y409 HydrophobicContact CB-CE1 4.23Å; P313-Y409 HydrophobicContact CB-CE2 3.16Å; P313-Y409 HydrophobicContact CB-CG 4.39Å; P313-Y409 HydrophobicContact CG-CE1 4.14Å; P313-Y409 HydrophobicContact CG-CE2 3.84Å; P313-A417 HydrophobicContact CB-CB 4.45Å; P313-A417 HydrophobicContact CG-CB 4.1Å
314	G	67.5	Low	89.1	Confident	3 Å²	3	34.9 Å²	34.9	3%	0.031	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.8	-57.4	-157.5	0	0	0	0	0	110.6	M290 S294 H406 L407	M290-G314 WeakPolarHBondContact O-CA 3.4Å; S294-G314 WeakPolarHBondContact CB-O 3.41Å; S294-G314 VanDerWaalsContact OG-C 3.27Å; S294-G314 WeakPolarHBondContact OG-CA 3.19Å; S294-G314 PolarHBondContact OG-O 3.26Å; G314-H406 PolarHBondContact O-CD2 2.83Å; G314-H406 PolarHBondContact O-NE2 3.04Å; G314-L407 CarbonylContact C-O 3.57Å; G314-L407 WeakPolarHBondContact CA-O 3.02Å; G314-L407 PolarHBondContact N-O 3.02Å
315	L	79.5	Confident	89.7	Confident	55 Å²	55	28.7 Å²	28.7	29%	0.288	15%	0.153	S	C	.	.			trans	-67.3	152.4	-158.8	-58.6	-176.2	0	0	0	114.8	T312 L407	T312-L315 WeakPolarHBondContact O-CB 3.44Å; T312-L315 PolarHBondContact O-N 2.91Å; L315-L407 PolarHBondContact O-N 2.83Å; L315-L407 VanDerWaalsContact O-N 3.1Å
316	Y	84.7	Confident	89.8	Confident	46 Å²	46	28.9 Å²	28.9	18%	0.18	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129	167.5	-71	-90.5	0	0	0	110.3	N404 L405 H406	Y316-N404 VanDerWaalsContact CB-OD1 3.23Å; Y316-N404 WeakPolarHBondContact CB-OD1 3.2Å; Y316-N404 WeakPolarHBondContact CD1-OD1 3.06Å; Y316-N404 VanDerWaalsContact CG-OD1 3.3Å; Y316-L405 CarbonylContact C-O 3.58Å; Y316-L405 WeakPolarHBondContact CA-O 3.06Å; Y316-H406 HydrophobicContact CD1-CB 3.76Å; Y316-H406 AromaticContact CD2-CD2 3.98Å; Y316-H406 HydrophobicContact CE1-CB 3.44Å; Y316-H406 VanDerWaalsContact CE1-CB 3.44Å; Y316-H406 AromaticContact CE1-CD2 3.8Å; Y316-H406 AromaticContact CE1-CG 3.66Å; Y316-H406 AromaticContact CE2-CD2 3.6Å; Y316-H406 AromaticContact CE2-NE2 3.93Å; Y316-H406 AromaticContact CZ-CD2 3.51Å; Y316-H406 AromaticContact CZ-CG 3.66Å; Y316-H406 AromaticContact CZ-NE2 3.96Å
317	C	89.5	Confident	89.8	Confident	4 Å²	4	25.9 Å²	25.9	3%	0.027	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.8	-174.6	-63.5	0	0	0	0	111.6	F311 N404 L405	F311-C317 HydrophobicContact CD1-CB 4.07Å; F311-C317 HydrophobicContact CD2-CB 4.1Å; F311-C317 HydrophobicContact CE1-CB 3.54Å; F311-C317 HydrophobicContact CE2-CB 3.53Å; F311-C317 HydrophobicContact CG-CB 4.33Å; F311-C317 HydrophobicContact CZ-CB 3.19Å; C317-N404 PolarHBondContact O-N 3.16Å; C317-L405 PolarHBondContact N-O 2.97Å; C317-L405 PolarHBondContact O-N 2.51Å
318	N	92.4	Very high	89.6	Confident	29 Å²	29	27.4 Å²	27.4	16%	0.155	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	141.5	167	-57.3	-32.5	0	0	0	108.7	F305 Q306 F402 F403 N404	F305-N318 HydrophobicContact CD1-CB 3.76Å; F305-N318 HydrophobicContact CE1-CB 4.1Å; Q306-N318 PolarHBondContact N-O 3.38Å; N318-F402 CarbonylContact C-O 3.54Å; N318-F402 VanDerWaalsContact CA-O 3.26Å; N318-F402 WeakPolarHBondContact CA-O 3.38Å; N318-F403 WeakPolarHBondContact OD1-CA 3.29Å; N318-N404 PolarHBondContact OD1-N 3.46Å
319	I	95	Very high	88.9	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	147.4	175.9	-177.7	164.5	0	0	0	110.9	V308 F311 D342 F379 F402 L405	V308-I319 HydrophobicContact CB-CD1 3.6Å; V308-I319 HydrophobicContact CG2-CD1 4.37Å; F311-I319 HydrophobicContact CE1-CB 4.4Å; F311-I319 HydrophobicContact CE1-CD1 4.45Å; F311-I319 HydrophobicContact CZ-CB 3.76Å; F311-I319 HydrophobicContact CZ-CD1 4.2Å; F311-I319 HydrophobicContact CZ-CG2 4.07Å; I319-D342 HydrophobicContact CD1-CB 4.14Å; I319-D342 HydrophobicContact CG1-CB 4.42Å; I319-F379 HydrophobicContact CD1-CE1 4.21Å; I319-F379 HydrophobicContact CD1-CE2 4.38Å; I319-F379 HydrophobicContact CD1-CZ 3.67Å; I319-F402 HydrophobicContact CG2-CB 3.93Å; I319-F402 HydrophobicContact CG2-CD2 4.02Å; I319-F402 HydrophobicContact CG2-CG 4.33Å; I319-F402 PolarHBondContact N-O 2.86Å; I319-F402 PolarHBondContact O-N 2.77Å; I319-L405 HydrophobicContact CG2-CD1 3.45Å; I319-L405 VanDerWaalsContact CG2-CD1 3.45Å
320	I	95.2	Very high	88	Confident	16 Å²	16	27.3 Å²	27.3	8%	0.082	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.8	165.4	-57	164.8	0	0	0	107.2	F305 D342 V400 A401 L434 L440 L441 I444	F305-I320 HydrophobicContact CB-CD1 4.12Å; F305-I320 HydrophobicContact CB-CG1 4.13Å; F305-I320 HydrophobicContact CD1-CD1 4.05Å; F305-I320 HydrophobicContact CD1-CG1 3.45Å; F305-I320 VanDerWaalsContact CD1-CG1 3.45Å; F305-I320 HydrophobicContact CD2-CD1 3.6Å; F305-I320 HydrophobicContact CD2-CG1 3.97Å; F305-I320 HydrophobicContact CE1-CD1 4.34Å; F305-I320 HydrophobicContact CE1-CG1 3.69Å; F305-I320 HydrophobicContact CE2-CD1 3.93Å; F305-I320 HydrophobicContact CE2-CG1 4.2Å; F305-I320 HydrophobicContact CG-CD1 3.65Å; F305-I320 HydrophobicContact CG-CG1 3.57Å; F305-I320 HydrophobicContact CZ-CD1 4.27Å; F305-I320 HydrophobicContact CZ-CG1 4.05Å; I320-D342 WeakPolarHBondContact O-CB 3.49Å; I320-V400 CarbonylContact C-O 3.52Å; I320-V400 WeakPolarHBondContact CA-O 3.34Å; I320-A401 HydrophobicContact CG1-CB 4.37Å; I320-L434 HydrophobicContact CB-CD1 4.49Å; I320-L434 HydrophobicContact CD1-CD1 4.2Å; I320-L434 HydrophobicContact CG1-CD1 4.14Å; I320-L434 HydrophobicContact CG2-CD1 3.53Å; I320-L440 HydrophobicContact CD1-CB 3.69Å; I320-L440 HydrophobicContact CD1-CD1 4.49Å; I320-L440 HydrophobicContact CD1-CD2 4.32Å; I320-L440 HydrophobicContact CD1-CG 4.39Å; I320-L440 WeakPolarHBondContact CD1-O 3.31Å; I320-L441 HydrophobicContact CG2-CD2 4.39Å; I320-I444 HydrophobicContact CB-CD1 4.19Å; I320-I444 HydrophobicContact CG2-CD1 3.77Å; I320-I444 HydrophobicContact CG2-CG2 4.13Å; I320-I444 WeakPolarHBondContact O-CD1 3.49Å
321	A	96.5	Very high	87	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	154.4	178.1	0	0	0	0	0	111.4	A340 T341 F379 Y399 V400 F402	A321-A340 HydrophobicContact CB-CB 3.78Å; A321-T341 CarbonylContact C-O 3.59Å; A321-T341 WeakPolarHBondContact CA-O 3.17Å; A321-T341 WeakPolarHBondContact CB-O 2.98Å; A321-F379 HydrophobicContact CB-CE2 4.31Å; A321-F379 HydrophobicContact CB-CZ 3.65Å; A321-Y399 WeakPolarHBondContact O-CA 3.44Å; A321-V400 PolarHBondContact N-O 2.98Å; A321-V400 PolarHBondContact O-N 3.06Å; A321-F402 HydrophobicContact CB-CD2 4.48Å; A321-F402 HydrophobicContact CB-CE2 4Å
322	K	95.3	Very high	86.3	Confident	1 Å²	1	34.6 Å²	34.6	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	126.4	168.8	-171.5	172.4	-176.8	168.2	0	109.5	A340 T341 A397 Q398 Y399 V448 F452 P453 D454	K322-A340 CarbonylContact O-C 3.48Å; K322-A340 WeakPolarHBondContact O-CA 3.32Å; K322-A340 WeakPolarHBondContact O-CB 3.47Å; K322-T341 HydrophobicContact CB-CG2 4.25Å; K322-T341 PolarHBondContact N-O 2.91Å; K322-T341 PolarHBondContact O-N 3.34Å; K322-A397 VanDerWaalsContact CE-CA 3.48Å; K322-A397 VanDerWaalsContact CE-CB 3.47Å; K322-Q398 CarbonylContact C-O 3.53Å; K322-Q398 WeakPolarHBondContact CA-O 3.4Å; K322-Y399 HydrophobicContact CB-CD1 4.12Å; K322-Y399 HydrophobicContact CB-CE1 3.94Å; K322-Y399 HydrophobicContact CD-CE1 4.21Å; K322-Y399 HydrophobicContact CD-CE2 4.49Å; K322-Y399 HydrophobicContact CG-CE1 4.29Å; K322-V448 HydrophobicContact CB-CG1 4.04Å; K322-V448 HydrophobicContact CD-CG1 3.51Å; K322-V448 HydrophobicContact CG-CG1 4.42Å; K322-F452 HydrophobicContact CD-CB 4.23Å; K322-F452 PolarHBondContact NZ-O 3.23Å; K322-P453 VanDerWaalsContact NZ-C 3.28Å; K322-P453 PolarHBondContact NZ-O 3.25Å; K322-D454 IonicContact NZ-OD1 2.74Å; K322-D454 PolarHBondContact NZ-OD1 3.06Å
323	V	94.9	Very high	86.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	127.8	177.6	177	0	0	0	0	109.6	V326 I338 L394 A397 Q398 V400	V323-V326 HydrophobicContact CG1-CG2 4.05Å; V323-I338 HydrophobicContact CG1-CG2 4.2Å; V323-I338 HydrophobicContact CG2-CG2 4.13Å; V323-L394 HydrophobicContact CG1-CB 4.43Å; V323-L394 HydrophobicContact CG2-CD1 4.21Å; V323-A397 WeakPolarHBondContact O-CA 3.35Å; V323-A397 PolarHBondContact O-N 3.31Å; V323-Q398 PolarHBondContact N-O 2.94Å; V323-V400 HydrophobicContact CG2-CB 4.22Å; V323-V400 HydrophobicContact CG2-CG2 3.54Å
324	I	93.2	Very high	86.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-47.9	175.1	-54.8	-53.3	0	0	0	110.1	R339 T341 M367 M371 L378 F396 F452	I324-R339 HydrophobicContact CB-CG 4.42Å; I324-R339 PolarHBondContact N-O 3.04Å; I324-T341 HydrophobicContact CD1-CG2 4.01Å; I324-T341 HydrophobicContact CG1-CG2 4.29Å; I324-M367 HydrophobicContact CG2-CG 4.14Å; I324-M367 VanDerWaalsContact O-SD 3.38Å; I324-M371 HydrophobicContact CG2-CG 3.55Å; I324-M371 HydrophobicContact CG2-SD 4.04Å; I324-L378 HydrophobicContact CG1-CD2 3.86Å; I324-F396 WeakPolarHBondContact O-CD2 3.27Å; I324-F452 HydrophobicContact CD1-CD1 3.46Å; I324-F452 VanDerWaalsContact CD1-CD1 3.46Å; I324-F452 HydrophobicContact CD1-CE1 3.65Å; I324-F452 HydrophobicContact CD1-CG 4.06Å; I324-F452 HydrophobicContact CD1-CZ 4.4Å; I324-F452 HydrophobicContact CG1-CD1 4.48Å; I324-F452 HydrophobicContact CG1-CE1 4.21Å
325	C	92.3	Very high	87.1	Confident	12 Å²	12	38.1 Å²	38.1	8%	0.081	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	163.6	172.4	62.1	0	0	0	0	111.6	R339 M367	C325-R339 PolarHBondContact N-O 3.45Å; C325-R339 PolarHBondContact O-N 3.47Å; C325-M367 HydrophobicContact CB-CE 3.68Å; C325-M367 HydrophobicContact CB-SD 3.71Å
326	V	93.3	Very high	87.7	Confident	44 Å²	44	35.5 Å²	35.5	27%	0.267	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	132.8	172.9	-176.2	0	0	0	0	108.9	V323 I337 I338 A391 L394	V323-V326 HydrophobicContact CG1-CG2 4.05Å; V326-I337 WeakPolarHBondContact CA-O 3.25Å; V326-I338 HydrophobicContact CG1-CG1 4.33Å; V326-I338 HydrophobicContact CG2-CB 4.38Å; V326-I338 HydrophobicContact CG2-CG1 4.08Å; V326-I338 HydrophobicContact CG2-CG2 4.12Å; V326-A391 HydrophobicContact CG1-CB 4.32Å; V326-L394 HydrophobicContact CG2-CB 4.05Å
327	F	91.2	Very high	88.1	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.035	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.2	-180	44.2	-85.6	0	0	0	110.9	I337 R339 A353 L355 Q359	F327-I337 HydrophobicContact CD2-CB 3.73Å; F327-I337 HydrophobicContact CD2-CD1 4.04Å; F327-I337 HydrophobicContact CD2-CG1 4.34Å; F327-I337 HydrophobicContact CD2-CG2 4.31Å; F327-I337 HydrophobicContact CE1-CB 4.42Å; F327-I337 HydrophobicContact CE1-CG2 4.21Å; F327-I337 HydrophobicContact CE2-CB 3.25Å; F327-I337 HydrophobicContact CE2-CD1 3.53Å; F327-I337 HydrophobicContact CE2-CG1 3.93Å; F327-I337 HydrophobicContact CE2-CG2 3.37Å; F327-I337 HydrophobicContact CG-CB 4.49Å; F327-I337 HydrophobicContact CZ-CB 3.62Å; F327-I337 HydrophobicContact CZ-CG2 3.26Å; F327-I337 PolarHBondContact N-O 3.03Å; F327-I337 PolarHBondContact O-N 3.46Å; F327-R339 HydrophobicContact CE1-CB 4.03Å; F327-A353 HydrophobicContact CE2-CB 4.39Å; F327-L355 HydrophobicContact CD1-CD1 4.25Å; F327-L355 HydrophobicContact CD1-CD2 4.08Å; F327-L355 HydrophobicContact CD2-CD2 3.5Å; F327-L355 VanDerWaalsContact CD2-CD2 3.5Å; F327-L355 HydrophobicContact CE1-CD1 3.96Å; F327-L355 HydrophobicContact CE1-CD2 3.72Å; F327-L355 HydrophobicContact CE2-CD2 3.01Å; F327-L355 HydrophobicContact CE2-CG 4.41Å; F327-L355 HydrophobicContact CG-CD2 4.01Å; F327-L355 HydrophobicContact CZ-CD1 4.22Å; F327-L355 HydrophobicContact CZ-CD2 3.19Å; F327-L355 HydrophobicContact CZ-CG 4.3Å; F327-Q359 HydrophobicContact CB-CB 4.31Å
328	P	89.7	Confident	88.4	Confident	79 Å²	79	33.5 Å²	33.5	51%	0.513	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	144.5	174.2	29.6	-34.1	0	0	0	110.4	Q359	P328-Q359 PolarHBondContact O-NE2 3.12Å
329	S	81	Confident	88.6	Confident	13 Å²	13	32.8 Å²	32.8	9%	0.091	19%	0.187	C	C	.	.			trans	-74.6	131.6	171.5	178.8	0	0	0	0	110.9	L331 F332 C335	S329-L331 VanDerWaalsContact C-N 3.29Å; S329-L331 PolarHBondContact OG-N 3.33Å; S329-F332 WeakPolarHBondContact CB-O 3.35Å; S329-F332 PolarHBondContact OG-N 2.86Å; S329-F332 VanDerWaalsContact OG-N 3.17Å; S329-C335 PolarHBondContact N-O 2.89Å
330	V	75.8	Confident	88.7	Confident	93 Å²	93	32.8 Å²	32.8	56%	0.564	19%	0.187	S	C	*	.	S	Bend	trans	-70	-30.1	172.7	-173	0	0	0	0	111.3
331	L	69.9	Low	88.7	Confident	140 Å²	140	32 Å²	32	73%	0.733	18%	0.183	S	C	*	.	S	Bend	trans	-85.1	-27.8	-177.2	-62.5	177.1	0	0	0	113.3	S329	S329-L331 VanDerWaalsContact C-N 3.29Å; S329-L331 PolarHBondContact OG-N 3.33Å
332	F	74.9	Confident	88.7	Confident	78 Å²	78	32.1 Å²	32.1	34%	0.342	18%	0.183	S	C	.	.			trans	-135.1	102.2	-171.3	-58.1	-67.1	0	0	0	110.9	S329 D334 C335 Y384	S329-F332 WeakPolarHBondContact CB-O 3.35Å; S329-F332 PolarHBondContact OG-N 2.86Å; S329-F332 VanDerWaalsContact OG-N 3.17Å; F332-D334 PolarHBondContact O-N 3.32Å; F332-D334 VanDerWaalsContact O-N 3.08Å; F332-C335 HydrophobicContact CB-CB 3.57Å; F332-C335 VanDerWaalsContact O-CB 3.29Å; F332-C335 WeakPolarHBondContact O-CB 3.4Å; F332-C335 PolarHBondContact O-N 2.87Å; F332-Y384 HydrophobicContact CB-CE1 4.09Å; F332-Y384 HydrophobicContact CD2-CE1 4.24Å; F332-Y384 HydrophobicContact CG-CE1 4.15Å
333	P	77.3	Confident	88.7	Confident	126 Å²	126	32.6 Å²	32.6	82%	0.818	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.6	-173.5	-27.4	34.5	0	0	0	116
334	D	81.8	Confident	88.7	Confident	55 Å²	55	33.1 Å²	33.1	29%	0.294	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	25	177.2	71.5	-30.7	0	0	0	112.9	R195 F332 Y384 G385 S388	R195-D334 IonicContact CZ-OD1 3.48Å; R195-D334 IonicContact CZ-OD2 3.81Å; R195-D334 IonicContact NH1-OD2 3.81Å; R195-D334 PolarHBondContact NH1-OD2 3.44Å; R195-D334 IonicContact NH2-OD1 2.78Å; R195-D334 PolarHBondContact NH2-OD1 3.41Å; R195-D334 IonicContact NH2-OD2 3.29Å; R195-D334 PolarHBondContact NH2-OD2 3.05Å; F332-D334 PolarHBondContact O-N 3.32Å; F332-D334 VanDerWaalsContact O-N 3.08Å; D334-Y384 WeakPolarHBondContact O-CA 3.3Å; D334-G385 PolarHBondContact O-N 2.78Å; D334-S388 VanDerWaalsContact O-CB 3.27Å; D334-S388 WeakPolarHBondContact O-CB 3.14Å
335	C	85.3	Confident	88.8	Confident	2 Å²	2	37 Å²	37	1%	0.014	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.3	174.8	-172.7	0	0	0	0	110.9	S329 F332 A383 Y384	S329-C335 PolarHBondContact N-O 2.89Å; F332-C335 HydrophobicContact CB-CB 3.57Å; F332-C335 VanDerWaalsContact O-CB 3.29Å; F332-C335 WeakPolarHBondContact O-CB 3.4Å; F332-C335 PolarHBondContact O-N 2.87Å; C335-A383 WeakPolarHBondContact CA-O 3.49Å; C335-Y384 HydrophobicContact CB-CD1 3.48Å; C335-Y384 VanDerWaalsContact CB-CD1 3.48Å; C335-Y384 HydrophobicContact CB-CE1 3.41Å; C335-Y384 VanDerWaalsContact CB-CE1 3.41Å; C335-Y384 WeakPolarHBondContact SG-CE1 3.27Å
336	S	92	Very high	89	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	136.9	163.5	-56.5	0	0	0	0	107.9	A383 S388 K392	S336-A383 PolarHBondContact N-O 2.94Å; S336-A383 PolarHBondContact O-N 3.14Å; S336-S388 PolarHBondContact N-OG 2.86Å; S336-S388 PolarHBondContact OG-O 3.15Å; S336-S388 PolarHBondContact OG-OG 3.26Å; S336-K392 WeakPolarHBondContact OG-CE 3.29Å
337	I	93.9	Very high	88.8	Confident	7 Å²	7	36.4 Å²	36.4	4%	0.036	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126	176.1	-56.4	168.5	0	0	0	107.1	V326 F327 A353 D380 V381 F382	V326-I337 WeakPolarHBondContact CA-O 3.25Å; F327-I337 HydrophobicContact CD2-CB 3.73Å; F327-I337 HydrophobicContact CD2-CD1 4.04Å; F327-I337 HydrophobicContact CD2-CG1 4.34Å; F327-I337 HydrophobicContact CD2-CG2 4.31Å; F327-I337 HydrophobicContact CE1-CB 4.42Å; F327-I337 HydrophobicContact CE1-CG2 4.21Å; F327-I337 HydrophobicContact CE2-CB 3.25Å; F327-I337 HydrophobicContact CE2-CD1 3.53Å; F327-I337 HydrophobicContact CE2-CG1 3.93Å; F327-I337 HydrophobicContact CE2-CG2 3.37Å; F327-I337 HydrophobicContact CG-CB 4.49Å; F327-I337 HydrophobicContact CZ-CB 3.62Å; F327-I337 HydrophobicContact CZ-CG2 3.26Å; F327-I337 PolarHBondContact N-O 3.03Å; F327-I337 PolarHBondContact O-N 3.46Å; I337-A353 HydrophobicContact CD1-CB 4.13Å; I337-D380 HydrophobicContact CG2-CB 3.69Å; I337-V381 WeakPolarHBondContact CA-O 3.34Å; I337-F382 HydrophobicContact CD1-CD1 4.11Å; I337-F382 HydrophobicContact CD1-CE1 3.65Å; I337-F382 HydrophobicContact CD1-CZ 4.37Å; I337-F382 HydrophobicContact CG1-CD1 3.79Å; I337-F382 HydrophobicContact CG1-CE1 3.82Å
338	I	96.8	Very high	88.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.9	177.8	-54.1	160.6	0	0	0	106.8	V323 V326 A340 D380 V381 A383 A391 L394 F402 I431	V323-I338 HydrophobicContact CG1-CG2 4.2Å; V323-I338 HydrophobicContact CG2-CG2 4.13Å; V326-I338 HydrophobicContact CG1-CG1 4.33Å; V326-I338 HydrophobicContact CG2-CB 4.38Å; V326-I338 HydrophobicContact CG2-CG1 4.08Å; V326-I338 HydrophobicContact CG2-CG2 4.12Å; I338-A340 HydrophobicContact CG2-CB 4.49Å; I338-D380 CarbonylContact O-C 3.59Å; I338-D380 WeakPolarHBondContact O-CA 3.4Å; I338-V381 HydrophobicContact CB-CB 4.26Å; I338-V381 PolarHBondContact N-O 2.89Å; I338-V381 PolarHBondContact O-N 2.83Å; I338-A383 HydrophobicContact CD1-CB 4.08Å; I338-A391 HydrophobicContact CD1-CB 3.67Å; I338-A391 HydrophobicContact CG1-CB 3.81Å; I338-L394 HydrophobicContact CD1-CD1 3.8Å; I338-L394 HydrophobicContact CG1-CD1 4.21Å; I338-L394 HydrophobicContact CG2-CD1 4.31Å; I338-F402 HydrophobicContact CD1-CE1 3.73Å; I338-F402 HydrophobicContact CD1-CZ 4.27Å; I338-F402 HydrophobicContact CG2-CZ 4.17Å; I338-I431 HydrophobicContact CD1-CD1 3.97Å
339	R	95.8	Very high	88.1	Confident	15 Å²	15	37.8 Å²	37.8	6%	0.057	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	123.8	170	-174.7	158.2	-68.2	177.1	5.7	109	I324 C325 F327 A353 M371 L378 F379 D380	I324-R339 HydrophobicContact CB-CG 4.42Å; I324-R339 PolarHBondContact N-O 3.04Å; C325-R339 PolarHBondContact N-O 3.45Å; C325-R339 PolarHBondContact O-N 3.47Å; F327-R339 HydrophobicContact CE1-CB 4.03Å; R339-A353 PolarHBondContact NH2-O 2.89Å; R339-M371 VanDerWaalsContact NH1-CE 3.33Å; R339-L378 HydrophobicContact CG-CB 4.33Å; R339-L378 HydrophobicContact CG-CD1 4.33Å; R339-F379 WeakPolarHBondContact CA-O 2.94Å; R339-D380 WeakPolarHBondContact CA-OD1 3.11Å; R339-D380 WeakPolarHBondContact CB-OD1 3.25Å; R339-D380 WeakPolarHBondContact CG-OD1 3.29Å; R339-D380 IonicContact CZ-OD1 3.06Å; R339-D380 IonicContact CZ-OD2 2.78Å; R339-D380 IonicContact NE-OD1 3.23Å; R339-D380 PolarHBondContact NE-OD1 3.4Å; R339-D380 IonicContact NE-OD2 3.09Å; R339-D380 IonicContact NH2-OD1 2.81Å; R339-D380 PolarHBondContact NH2-OD1 2.67Å; R339-D380 IonicContact NH2-OD2 3.23Å; R339-D380 PolarHBondContact NH2-OD2 2.92Å
340	A	96.8	Very high	88.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	171.9	-174.3	0	0	0	0	0	111.7	A321 K322 I338 L378 F379	A321-A340 HydrophobicContact CB-CB 3.78Å; K322-A340 CarbonylContact O-C 3.48Å; K322-A340 WeakPolarHBondContact O-CA 3.32Å; K322-A340 WeakPolarHBondContact O-CB 3.47Å; I338-A340 HydrophobicContact CG2-CB 4.49Å; A340-L378 WeakPolarHBondContact O-CA 3.28Å; A340-F379 HydrophobicContact CB-CE2 4.02Å; A340-F379 HydrophobicContact CB-CZ 4.21Å; A340-F379 PolarHBondContact N-O 3.06Å; A340-F379 PolarHBondContact O-N 3.38Å
341	T	96.2	Very high	88.8	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	144.9	175.3	-174.3	0	0	0	0	110.8	A321 K322 I324 G343 L377 V448 F452	A321-T341 CarbonylContact C-O 3.59Å; A321-T341 WeakPolarHBondContact CA-O 3.17Å; A321-T341 WeakPolarHBondContact CB-O 2.98Å; K322-T341 HydrophobicContact CB-CG2 4.25Å; K322-T341 PolarHBondContact N-O 2.91Å; K322-T341 PolarHBondContact O-N 3.34Å; I324-T341 HydrophobicContact CD1-CG2 4.01Å; I324-T341 HydrophobicContact CG1-CG2 4.29Å; T341-G343 PolarHBondContact OG1-N 2.75Å; T341-L377 VanDerWaalsContact CB-O 3.28Å; T341-L377 WeakPolarHBondContact CB-O 3.42Å; T341-L377 PolarHBondContact OG1-O 2.88Å; T341-V448 HydrophobicContact CG2-CG1 4.22Å; T341-F452 HydrophobicContact CG2-CD2 3.67Å; T341-F452 HydrophobicContact CG2-CE2 3.69Å; T341-F452 HydrophobicContact CG2-CG 4.23Å; T341-F452 HydrophobicContact CG2-CZ 4.24Å
342	D	95.7	Very high	89.7	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	20%	0.197	C	C	.	.			trans	-110.4	6.2	168.6	73.4	-14.1	0	0	0	112.6	L307 V308 I319 I320 T344 F379 I444 R447 V448	L307-D342 WeakPolarHBondContact CA-OD2 3.23Å; V308-D342 WeakPolarHBondContact CG1-OD1 3.11Å; V308-D342 PolarHBondContact N-OD2 2.99Å; I319-D342 HydrophobicContact CD1-CB 4.14Å; I319-D342 HydrophobicContact CG1-CB 4.42Å; I320-D342 WeakPolarHBondContact O-CB 3.49Å; D342-T344 WeakPolarHBondContact OD1-CB 3.18Å; D342-T344 PolarHBondContact OD1-N 2.75Å; D342-T344 PolarHBondContact OD1-OG1 3.24Å; D342-T344 PolarHBondContact OD2-OG1 3.39Å; D342-F379 HydrophobicContact CB-CE1 4.46Å; D342-I444 HydrophobicContact CB-CD1 4.29Å; D342-R447 PolarHBondContact O-NE 3.25Å; D342-V448 VanDerWaalsContact C-CG2 3.42Å
343	G	94.9	Very high	90.2	Very high	11 Å²	11	32.3 Å²	32.3	11%	0.113	19%	0.19	C	C	.	.	S	Bend	trans	87.1	-0.7	-176.8	0	0	0	0	0	114.9	T341	T341-G343 PolarHBondContact OG1-N 2.75Å
344	T	95.4	Very high	90.4	Very high	12 Å²	12	32.9 Å²	32.9	7%	0.074	19%	0.191	C	C	.	.	S	Bend	trans	-107.4	165.2	178.2	71.5	0	0	0	0	112.2	L307 V308 E309 D342 P346	L307-T344 HydrophobicContact CB-CG2 4.17Å; L307-T344 HydrophobicContact CD1-CG2 4.12Å; L307-T344 HydrophobicContact CD2-CG2 4.08Å; L307-T344 HydrophobicContact CG-CG2 4.34Å; V308-T344 VanDerWaalsContact CG1-OG1 3.31Å; V308-T344 WeakPolarHBondContact CG1-OG1 3.48Å; E309-T344 HydrophobicContact CG-CG2 4.33Å; E309-T344 PolarHBondContact N-OG1 2.93Å; D342-T344 WeakPolarHBondContact OD1-CB 3.18Å; D342-T344 PolarHBondContact OD1-N 2.75Å; D342-T344 PolarHBondContact OD1-OG1 3.24Å; D342-T344 PolarHBondContact OD2-OG1 3.39Å; T344-P346 WeakPolarHBondContact O-CD 2.95Å
345	V	95.7	Very high	90.3	Very high	80 Å²	80	31.5 Å²	31.5	49%	0.485	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-85.9	116.7	-179.7	178.3	0	0	0	0	109	E309 L377	E309-V345 WeakPolarHBondContact CA-O 3.37Å; E309-V345 VanDerWaalsContact CB-O 3.23Å; E309-V345 WeakPolarHBondContact CB-O 3.33Å; V345-L377 HydrophobicContact CG2-CD2 3.8Å
346	P	95.2	Very high	89.9	Confident	18 Å²	18	36.2 Å²	36.2	12%	0.117	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-62.3	153.8	178.9	-19.9	32.3	0	0	0	112.3	V308 T344 I350 N376 F379	V308-P346 HydrophobicContact CG1-CB 4.16Å; V308-P346 HydrophobicContact CG1-CG 3.95Å; V308-P346 HydrophobicContact CG2-CB 4.15Å; T344-P346 WeakPolarHBondContact O-CD 2.95Å; P346-I350 HydrophobicContact CB-CB 4.2Å; P346-I350 HydrophobicContact CB-CD1 4.21Å; P346-I350 HydrophobicContact CB-CG2 4.44Å; P346-N376 VanDerWaalsContact CD-O 3.24Å; P346-N376 WeakPolarHBondContact CD-O 3.39Å; P346-F379 HydrophobicContact CB-CB 4.36Å; P346-F379 HydrophobicContact CG-CB 3.93Å; P346-F379 HydrophobicContact CG-CD1 4.02Å; P346-F379 HydrophobicContact CG-CG 4.46Å
347	P	89.7	Confident	89.2	Confident	26 Å²	26	43 Å²	43	17%	0.169	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-51.6	143.6	175.1	-27.2	32.4	0	0	0	111.6	V308 F311 S349 I350	V308-P347 WeakPolarHBondContact O-CD 3.48Å; F311-P347 HydrophobicContact CB-CG 4.46Å; F311-P347 VanDerWaalsContact O-CG 3.25Å; F311-P347 WeakPolarHBondContact O-CG 3.17Å; P347-S349 PolarHBondContact O-N 2.75Å; P347-I350 HydrophobicContact CG-CD1 4.45Å; P347-I350 PolarHBondContact O-N 2.89Å
348	S	86.8	Confident	88.4	Confident	103 Å²	103	51 Å²	51	72%	0.72	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-4.5	-177.3	66.2	0	0	0	0	114.3	R351	S348-R351 VanDerWaalsContact O-CZ 3.22Å; S348-R351 PolarHBondContact O-NH1 3.17Å; S348-R351 PolarHBondContact O-NH2 3.39Å
349	S	80.1	Confident	87.4	Confident	13 Å²	13	53 Å²	53	9%	0.091	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-25.3	168.6	52.8	0	0	0	0	112.9	P347 M415 Q416 A417	P347-S349 PolarHBondContact O-N 2.75Å; S349-M415 WeakPolarHBondContact CA-O 3.34Å; S349-Q416 CarbonylContact O-C 3.5Å; S349-Q416 VanDerWaalsContact O-CA 3.23Å; S349-Q416 WeakPolarHBondContact O-CA 3.47Å; S349-A417 PolarHBondContact O-N 3.35Å
350	I	87.6	Confident	86.4	Confident	13 Å²	13	54.1 Å²	54.1	7%	0.067	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-76.3	132.3	179.4	-59.4	-173.8	0	0	0	109	V308 P346 P347 F379 L407	V308-I350 HydrophobicContact CG2-CD1 4.13Å; P346-I350 HydrophobicContact CB-CB 4.2Å; P346-I350 HydrophobicContact CB-CD1 4.21Å; P346-I350 HydrophobicContact CB-CG2 4.44Å; P347-I350 HydrophobicContact CG-CD1 4.45Å; P347-I350 PolarHBondContact O-N 2.89Å; I350-F379 HydrophobicContact CG2-CB 4.12Å; I350-L407 HydrophobicContact CD1-CD1 3.69Å; I350-L407 HydrophobicContact CD1-CD2 4.18Å; I350-L407 HydrophobicContact CG1-CD1 3.77Å; I350-L407 HydrophobicContact CG1-CD2 4.49Å
351	R	83.7	Confident	85	Confident	118 Å²	118	57 Å²	57	45%	0.445	32%	0.324	S	S	.	.			trans	-128.3	134.5	176.1	-71.1	-70.5	177.1	-77.8	-8.3	109.5	S348 Q416	S348-R351 VanDerWaalsContact O-CZ 3.22Å; S348-R351 PolarHBondContact O-NH1 3.17Å; S348-R351 PolarHBondContact O-NH2 3.39Å; R351-Q416 HydrophobicContact CG-CG 3.99Å
352	L	89.2	Confident	83.9	Confident	54 Å²	54	65 Å²	65	28%	0.283	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-62.3	139.8	169.8	-63.8	-179	0	0	0	110.1	L378 D380	L352-L378 HydrophobicContact CD1-CB 4.07Å; L352-L378 HydrophobicContact CD2-CB 3.96Å; L352-L378 WeakPolarHBondContact CD2-O 3.06Å; L352-D380 WeakPolarHBondContact CA-OD2 3.25Å
353	A	84.1	Confident	83.2	Confident	25 Å²	25	66.1 Å²	66.1	21%	0.207	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-62.6	137.3	165.1	0	0	0	0	0	109.3	F327 I337 R339 L355 D380 F382	F327-A353 HydrophobicContact CE2-CB 4.39Å; I337-A353 HydrophobicContact CD1-CB 4.13Å; R339-A353 PolarHBondContact NH2-O 2.89Å; A353-L355 PolarHBondContact O-N 3.46Å; A353-D380 WeakPolarHBondContact CB-OD2 3.32Å; A353-D380 PolarHBondContact N-OD2 3.48Å; A353-F382 HydrophobicContact CB-CZ 4.44Å
354	V	82	Confident	82.5	Confident	138 Å²	138	69.2 Å²	69.2	84%	0.836	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-69.8	128.2	168.6	-177.7	0	0	0	0	107.1
355	L	78.8	Confident	82	Confident	26 Å²	26	71.9 Å²	71.9	14%	0.136	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-99.8	134.5	178.7	-51.5	-175.1	0	0	0	108.8	F327 A353 L360 M371	F327-L355 HydrophobicContact CD1-CD1 4.25Å; F327-L355 HydrophobicContact CD1-CD2 4.08Å; F327-L355 HydrophobicContact CD2-CD2 3.5Å; F327-L355 VanDerWaalsContact CD2-CD2 3.5Å; F327-L355 HydrophobicContact CE1-CD1 3.96Å; F327-L355 HydrophobicContact CE1-CD2 3.72Å; F327-L355 HydrophobicContact CE2-CD2 3.01Å; F327-L355 HydrophobicContact CE2-CG 4.41Å; F327-L355 HydrophobicContact CG-CD2 4.01Å; F327-L355 HydrophobicContact CZ-CD1 4.22Å; F327-L355 HydrophobicContact CZ-CD2 3.19Å; F327-L355 HydrophobicContact CZ-CG 4.3Å; A353-L355 PolarHBondContact O-N 3.46Å; L355-L360 HydrophobicContact CB-CD1 3.85Å; L355-L360 HydrophobicContact CB-CG 4.07Å; L355-L360 HydrophobicContact CD1-CD1 4.17Å; L355-L360 HydrophobicContact CD1-CD2 3.77Å; L355-L360 HydrophobicContact CD1-CG 4.07Å; L355-M371 HydrophobicContact CD1-CE 3.84Å
356	E	78.5	Confident	81.4	Confident	101 Å²	101	73.6 Å²	73.6	47%	0.472	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-81.9	150.2	170.4	-63.2	-179.5	171	0	0	109.6	E358 Q359 L360	E356-E358 PolarHBondContact O-N 2.91Å; E356-E358 VanDerWaalsContact O-N 3.1Å; E356-Q359 HydrophobicContact CB-CG 4.47Å; E356-Q359 WeakPolarHBondContact O-CB 3.4Å; E356-Q359 PolarHBondContact O-N 3.48Å; E356-L360 PolarHBondContact O-N 3.02Å
357	D	76.4	Confident	81	Confident	142 Å²	142	73.4 Å²	73.4	76%	0.759	41%	0.414	S	S	*	.	H	α-helix	trans	-55.1	-33.2	-179.1	-68.5	-23.7	0	0	0	112	Q359 L360 G361	D357-Q359 VanDerWaalsContact C-N 3.29Å; D357-Q359 PolarHBondContact O-N 3.44Å; D357-L360 CarbonylContact O-C 3.6Å; D357-L360 PolarHBondContact O-N 3.26Å; D357-L360 VanDerWaalsContact O-N 3.11Å; D357-G361 WeakPolarHBondContact O-CA 3.45Å; D357-G361 PolarHBondContact O-N 3.37Å
358	E	76.5	Confident	80.9	Confident	175 Å²	175	75.4 Å²	75.4	82%	0.818	42%	0.422	S	S	*	.	H	α-helix	trans	-62.8	-32.8	176.4	-61.7	178.6	-177.6	0	0	112.9	E356 L360	E356-E358 PolarHBondContact O-N 2.91Å; E356-E358 VanDerWaalsContact O-N 3.1Å; E358-L360 VanDerWaalsContact C-N 3.33Å
359	Q	77.7	Confident	81	Confident	43 Å²	43	75 Å²	75	20%	0.201	41%	0.412	C	S	.	.	H	α-helix	trans	-76.1	-24.5	176.4	-61.1	175.3	-70.2	0	0	112	F327 P328 E356 D357	F327-Q359 HydrophobicContact CB-CB 4.31Å; P328-Q359 PolarHBondContact O-NE2 3.12Å; E356-Q359 HydrophobicContact CB-CG 4.47Å; E356-Q359 WeakPolarHBondContact O-CB 3.4Å; E356-Q359 PolarHBondContact O-N 3.48Å; D357-Q359 VanDerWaalsContact C-N 3.29Å; D357-Q359 PolarHBondContact O-N 3.44Å
360	L	74.5	Confident	81.4	Confident	38 Å²	38	75.2 Å²	75.2	20%	0.199	41%	0.412	C	S	.	.	H	α-helix	trans	-100.7	-7.7	-178.2	-73.4	171.2	0	0	0	113.8	L355 E356 D357 E358 N362 A363 M367 L368 M371	L355-L360 HydrophobicContact CB-CD1 3.85Å; L355-L360 HydrophobicContact CB-CG 4.07Å; L355-L360 HydrophobicContact CD1-CD1 4.17Å; L355-L360 HydrophobicContact CD1-CD2 3.77Å; L355-L360 HydrophobicContact CD1-CG 4.07Å; E356-L360 PolarHBondContact O-N 3.02Å; D357-L360 CarbonylContact O-C 3.6Å; D357-L360 PolarHBondContact O-N 3.26Å; D357-L360 VanDerWaalsContact O-N 3.11Å; E358-L360 VanDerWaalsContact C-N 3.33Å; L360-N362 PolarHBondContact O-N 3.47Å; L360-A363 HydrophobicContact CD2-CB 4.39Å; L360-A363 WeakPolarHBondContact O-CB 3.17Å; L360-A363 PolarHBondContact O-N 3.15Å; L360-M367 HydrophobicContact CD2-CE 4.26Å; L360-L368 HydrophobicContact CD1-CD2 4.35Å; L360-L368 HydrophobicContact CD2-CD2 3.97Å; L360-M371 HydrophobicContact CD2-CE 4.38Å
361	G	67.4	Low	81.5	Confident	59 Å²	59	75.5 Å²	75.5	61%	0.608	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-21.1	-159.1	0	0	0	0	0	118	D357	D357-G361 WeakPolarHBondContact O-CA 3.45Å; D357-G361 PolarHBondContact O-N 3.37Å
362	N	72.3	Confident	81.8	Confident	170 Å²	170	77.1 Å²	77.1	91%	0.909	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	16.9	175.6	-65.5	-39.6	0	0	0	113.5	L360	L360-N362 PolarHBondContact O-N 3.47Å
363	A	79.9	Confident	81.9	Confident	24 Å²	24	78.5 Å²	78.5	20%	0.198	44%	0.44	C	S	.	.			trans	-62.2	131.5	178	0	0	0	0	0	110.6	L360 A365 M367 L368	L360-A363 HydrophobicContact CD2-CB 4.39Å; L360-A363 WeakPolarHBondContact O-CB 3.17Å; L360-A363 PolarHBondContact O-N 3.15Å; A363-A365 PolarHBondContact O-N 3.42Å; A363-M367 HydrophobicContact CB-CE 3.35Å; A363-M367 HydrophobicContact CB-SD 4.45Å; A363-L368 HydrophobicContact CB-CD1 4.26Å; A363-L368 HydrophobicContact CB-CD2 3.75Å; A363-L368 HydrophobicContact CB-CG 3.92Å
364	P	81.6	Confident	82.3	Confident	75 Å²	75	79.3 Å²	79.3	49%	0.487	44%	0.439	S	S	.	.			trans	-56.7	136.7	171.8	-23.1	33.1	0	0	0	110.6	R366 M367 L368	P364-R366 PolarHBondContact O-N 3.11Å; P364-R366 VanDerWaalsContact O-N 3.15Å; P364-M367 HydrophobicContact CB-CB 4.31Å; P364-M367 WeakPolarHBondContact O-CA 3.42Å; P364-M367 WeakPolarHBondContact O-CB 3.34Å; P364-M367 PolarHBondContact O-N 3.18Å; P364-L368 PolarHBondContact O-N 3.33Å
365	A	84.5	Confident	82.9	Confident	69 Å²	69	75.7 Å²	75.7	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-51.4	-42.4	179.9	0	0	0	0	0	112.4	A363 M367 L368 D369	A363-A365 PolarHBondContact O-N 3.42Å; A365-M367 VanDerWaalsContact C-N 3.27Å; A365-M367 PolarHBondContact O-N 3.49Å; A365-L368 WeakPolarHBondContact O-CB 3.43Å; A365-L368 PolarHBondContact O-N 3.43Å; A365-D369 VanDerWaalsContact O-CG 3.29Å; A365-D369 PolarHBondContact O-N 2.99Å
366	R	82.7	Confident	83.6	Confident	115 Å²	115	78.8 Å²	78.8	43%	0.434	44%	0.437	S	S	.	.	H	α-helix	trans	-57.5	-36.9	175.4	-173.5	-178.6	-175.7	-172.4	3.8	113.4	P364 L370	P364-R366 PolarHBondContact O-N 3.11Å; P364-R366 VanDerWaalsContact O-N 3.15Å; R366-L370 HydrophobicContact CG-CD1 4.12Å; R366-L370 WeakPolarHBondContact O-CB 3.47Å; R366-L370 WeakPolarHBondContact O-CD1 3.39Å; R366-L370 WeakPolarHBondContact O-CG 3.4Å; R366-L370 PolarHBondContact O-N 3.34Å
367	M	86.5	Confident	84.4	Confident	15 Å²	15	74.5 Å²	74.5	7%	0.074	42%	0.417	C	S	.	.	H	α-helix	trans	-66.6	-43	177.1	-171	-169.6	92.3	0	0	110.3	I324 C325 L360 A363 P364 A365 L370 M371 F396	I324-M367 HydrophobicContact CG2-CG 4.14Å; I324-M367 VanDerWaalsContact O-SD 3.38Å; C325-M367 HydrophobicContact CB-CE 3.68Å; C325-M367 HydrophobicContact CB-SD 3.71Å; L360-M367 HydrophobicContact CD2-CE 4.26Å; A363-M367 HydrophobicContact CB-CE 3.35Å; A363-M367 HydrophobicContact CB-SD 4.45Å; P364-M367 HydrophobicContact CB-CB 4.31Å; P364-M367 WeakPolarHBondContact O-CA 3.42Å; P364-M367 WeakPolarHBondContact O-CB 3.34Å; P364-M367 PolarHBondContact O-N 3.18Å; A365-M367 VanDerWaalsContact C-N 3.27Å; A365-M367 PolarHBondContact O-N 3.49Å; M367-L370 PolarHBondContact O-N 3.1Å; M367-M371 HydrophobicContact CE-SD 3.8Å; M367-M371 HydrophobicContact CG-SD 4.18Å; M367-M371 WeakPolarHBondContact O-CB 3.4Å; M367-M371 WeakPolarHBondContact O-CG 3.37Å; M367-M371 PolarHBondContact O-N 3.35Å; M367-F396 HydrophobicContact CG-CD2 4.24Å; M367-F396 HydrophobicContact CG-CE2 4.16Å
368	L	88.6	Confident	85.4	Confident	67 Å²	67	68 Å²	68	35%	0.351	38%	0.383	S	S	.	.	H	α-helix	trans	-63.3	-47.2	176.5	-61.2	174.7	0	0	0	111.3	L360 A363 P364 A365 L370 M371 E372	L360-L368 HydrophobicContact CD1-CD2 4.35Å; L360-L368 HydrophobicContact CD2-CD2 3.97Å; A363-L368 HydrophobicContact CB-CD1 4.26Å; A363-L368 HydrophobicContact CB-CD2 3.75Å; A363-L368 HydrophobicContact CB-CG 3.92Å; P364-L368 PolarHBondContact O-N 3.33Å; A365-L368 WeakPolarHBondContact O-CB 3.43Å; A365-L368 PolarHBondContact O-N 3.43Å; L368-L370 VanDerWaalsContact C-N 3.32Å; L368-L370 PolarHBondContact O-N 2.92Å; L368-M371 WeakPolarHBondContact O-CB 3.33Å; L368-M371 PolarHBondContact O-N 2.89Å; L368-M371 VanDerWaalsContact O-N 3.11Å; L368-E372 PolarHBondContact O-N 3.46Å
369	D	88.5	Confident	86.3	Confident	94 Å²	94	59.7 Å²	59.7	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-58.6	-43.8	177.9	-64.1	-22.7	0	0	0	111.6	A365 E372 S373	A365-D369 VanDerWaalsContact O-CG 3.29Å; A365-D369 PolarHBondContact O-N 2.99Å; D369-E372 PolarHBondContact O-N 3.47Å; D369-S373 VanDerWaalsContact O-CB 3.23Å; D369-S373 WeakPolarHBondContact O-CB 3.46Å; D369-S373 PolarHBondContact O-N 3.16Å; D369-S373 PolarHBondContact O-OG 2.74Å
370	L	88.1	Confident	87.2	Confident	19 Å²	19	57.8 Å²	57.8	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-65.5	-39.9	176.8	-75.6	170.8	0	0	0	111.8	R366 M367 L368 H374 F396 Y451 F452	R366-L370 HydrophobicContact CG-CD1 4.12Å; R366-L370 WeakPolarHBondContact O-CB 3.47Å; R366-L370 WeakPolarHBondContact O-CD1 3.39Å; R366-L370 WeakPolarHBondContact O-CG 3.4Å; R366-L370 PolarHBondContact O-N 3.34Å; M367-L370 PolarHBondContact O-N 3.1Å; L368-L370 VanDerWaalsContact C-N 3.32Å; L368-L370 PolarHBondContact O-N 2.92Å; L370-H374 PolarHBondContact O-N 3.47Å; L370-H374 VanDerWaalsContact O-N 3.15Å; L370-F396 HydrophobicContact CD1-CZ 4.09Å; L370-Y451 VanDerWaalsContact CD2-O 3.27Å; L370-Y451 WeakPolarHBondContact CD2-O 3.28Å; L370-F452 HydrophobicContact CB-CD1 3.96Å; L370-F452 HydrophobicContact CB-CE1 3.82Å; L370-F452 HydrophobicContact CD1-CD1 4.11Å; L370-F452 HydrophobicContact CD2-CD1 4.07Å; L370-F452 HydrophobicContact CD2-CE1 4.48Å; L370-F452 HydrophobicContact CG-CD1 4.28Å
371	M	90.4	Very high	88.2	Confident	18 Å²	18	56 Å²	56	9%	0.089	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-40.4	177.6	-77.3	173.6	56.5	0	0	112.2	I324 R339 L355 L360 M367 L368 S375 L378	I324-M371 HydrophobicContact CG2-CG 3.55Å; I324-M371 HydrophobicContact CG2-SD 4.04Å; R339-M371 VanDerWaalsContact NH1-CE 3.33Å; L355-M371 HydrophobicContact CD1-CE 3.84Å; L360-M371 HydrophobicContact CD2-CE 4.38Å; M367-M371 HydrophobicContact CE-SD 3.8Å; M367-M371 HydrophobicContact CG-SD 4.18Å; M367-M371 WeakPolarHBondContact O-CB 3.4Å; M367-M371 WeakPolarHBondContact O-CG 3.37Å; M367-M371 PolarHBondContact O-N 3.35Å; L368-M371 WeakPolarHBondContact O-CB 3.33Å; L368-M371 PolarHBondContact O-N 2.89Å; L368-M371 VanDerWaalsContact O-N 3.11Å; M371-S375 WeakPolarHBondContact O-CA 3.46Å; M371-S375 WeakPolarHBondContact O-CB 3.42Å; M371-S375 PolarHBondContact O-N 2.85Å; M371-L378 HydrophobicContact CB-CD1 4.22Å; M371-L378 HydrophobicContact CG-CD1 4.16Å
372	E	90.3	Very high	89.4	Confident	153 Å²	153	54.2 Å²	54.2	72%	0.715	30%	0.301	S	S	*	.	H	α-helix	trans	-70.7	-50.7	178	-171.8	175.2	-178.3	0	0	111.1	L368 D369 H374 S375	L368-E372 PolarHBondContact O-N 3.46Å; D369-E372 PolarHBondContact O-N 3.47Å; E372-H374 VanDerWaalsContact C-N 3.28Å; E372-H374 PolarHBondContact O-N 3.08Å; E372-S375 PolarHBondContact O-OG 3.44Å
373	S	91.1	Very high	90.3	Very high	83 Å²	83	46.1 Å²	46.1	58%	0.58	26%	0.258	S	S	*	.	H	α-helix	trans	-65.8	-27.5	-174.1	-57.5	0	0	0	0	113.9	D369	D369-S373 VanDerWaalsContact O-CB 3.23Å; D369-S373 WeakPolarHBondContact O-CB 3.46Å; D369-S373 PolarHBondContact O-N 3.16Å; D369-S373 PolarHBondContact O-OG 2.74Å
374	H	93	Very high	90.6	Very high	41 Å²	41	46.1 Å²	46.1	19%	0.19	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	26.9	-174.5	-58.4	99	0	0	0	112.7	L370 E372 N376 L377 Y451 F452	L370-H374 PolarHBondContact O-N 3.47Å; L370-H374 VanDerWaalsContact O-N 3.15Å; E372-H374 VanDerWaalsContact C-N 3.28Å; E372-H374 PolarHBondContact O-N 3.08Å; H374-N376 PolarHBondContact O-N 3.38Å; H374-L377 HydrophobicContact CB-CD1 4.36Å; H374-L377 PolarHBondContact O-N 3.38Å; H374-Y451 AromaticContact CD2-CD1 3.73Å; H374-Y451 PolarHBondContact CE1-O 2.92Å; H374-Y451 AromaticContact NE2-CD1 3.67Å; H374-F452 HydrophobicContact CB-CE1 4.37Å; H374-F452 HydrophobicContact CB-CE2 3.84Å; H374-F452 HydrophobicContact CB-CZ 3.48Å; H374-F452 VanDerWaalsContact CB-CZ 3.48Å
375	S	92.7	Very high	90.6	Very high	62 Å²	62	43.3 Å²	43.3	43%	0.434	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-53.2	-27.8	-178.6	55.6	0	0	0	0	114.2	M371 E372 L377 L378	M371-S375 WeakPolarHBondContact O-CA 3.46Å; M371-S375 WeakPolarHBondContact O-CB 3.42Å; M371-S375 PolarHBondContact O-N 2.85Å; E372-S375 PolarHBondContact O-OG 3.44Å; S375-L377 VanDerWaalsContact C-N 3.28Å; S375-L377 PolarHBondContact O-N 2.79Å; S375-L378 PolarHBondContact O-N 2.68Å
376	N	94.1	Very high	90.6	Very high	92 Å²	92	43.1 Å²	43.1	49%	0.492	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-72.5	-13.4	176.8	66.8	-62.3	0	0	0	114.7	P346 H374	P346-N376 VanDerWaalsContact CD-O 3.24Å; P346-N376 WeakPolarHBondContact CD-O 3.39Å; H374-N376 PolarHBondContact O-N 3.38Å
377	L	96.2	Very high	90.8	Very high	10 Å²	10	38.4 Å²	38.4	5%	0.052	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-103	0.8	177.5	-58.2	178.9	0	0	0	112.5	T341 V345 H374 S375 Y451	T341-L377 VanDerWaalsContact CB-O 3.28Å; T341-L377 WeakPolarHBondContact CB-O 3.42Å; T341-L377 PolarHBondContact OG1-O 2.88Å; V345-L377 HydrophobicContact CG2-CD2 3.8Å; H374-L377 HydrophobicContact CB-CD1 4.36Å; H374-L377 PolarHBondContact O-N 3.38Å; S375-L377 VanDerWaalsContact C-N 3.28Å; S375-L377 PolarHBondContact O-N 2.79Å; L377-Y451 HydrophobicContact CD1-CD1 4.1Å; L377-Y451 HydrophobicContact CD1-CD2 3.82Å; L377-Y451 HydrophobicContact CD1-CE1 4.43Å; L377-Y451 HydrophobicContact CD1-CE2 4.17Å; L377-Y451 HydrophobicContact CD1-CG 3.78Å
378	L	96.1	Very high	91.1	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.037	21%	0.213	C	C	.	.			trans	-98.7	145.5	-174.9	-57.7	179.4	0	0	0	111.1	I324 R339 A340 L352 M371 S375 F452	I324-L378 HydrophobicContact CG1-CD2 3.86Å; R339-L378 HydrophobicContact CG-CB 4.33Å; R339-L378 HydrophobicContact CG-CD1 4.33Å; A340-L378 WeakPolarHBondContact O-CA 3.28Å; L352-L378 HydrophobicContact CD1-CB 4.07Å; L352-L378 HydrophobicContact CD2-CB 3.96Å; L352-L378 WeakPolarHBondContact CD2-O 3.06Å; M371-L378 HydrophobicContact CB-CD1 4.22Å; M371-L378 HydrophobicContact CG-CD1 4.16Å; S375-L378 PolarHBondContact O-N 2.68Å; L378-F452 HydrophobicContact CD2-CE1 4.13Å; L378-F452 HydrophobicContact CD2-CE2 4.38Å; L378-F452 HydrophobicContact CD2-CZ 3.57Å; L378-F452 HydrophobicContact CG-CZ 4.49Å
379	F	96.6	Very high	91.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	158	168.8	55.9	-91.7	0	0	0	110.6	V308 I319 A321 R339 A340 D342 P346 I350 V381 L419	V308-F379 HydrophobicContact CB-CD1 4.09Å; V308-F379 HydrophobicContact CB-CE1 3.9Å; V308-F379 HydrophobicContact CB-CZ 4.42Å; V308-F379 HydrophobicContact CG1-CD1 3.78Å; V308-F379 HydrophobicContact CG1-CE1 3.75Å; V308-F379 HydrophobicContact CG2-CD1 3.91Å; V308-F379 HydrophobicContact CG2-CE1 4.13Å; V308-F379 HydrophobicContact CG2-CG 4.09Å; I319-F379 HydrophobicContact CD1-CE1 4.21Å; I319-F379 HydrophobicContact CD1-CE2 4.38Å; I319-F379 HydrophobicContact CD1-CZ 3.67Å; A321-F379 HydrophobicContact CB-CE2 4.31Å; A321-F379 HydrophobicContact CB-CZ 3.65Å; R339-F379 WeakPolarHBondContact CA-O 2.94Å; A340-F379 HydrophobicContact CB-CE2 4.02Å; A340-F379 HydrophobicContact CB-CZ 4.21Å; A340-F379 PolarHBondContact N-O 3.06Å; A340-F379 PolarHBondContact O-N 3.38Å; D342-F379 HydrophobicContact CB-CE1 4.46Å; P346-F379 HydrophobicContact CB-CB 4.36Å; P346-F379 HydrophobicContact CG-CB 3.93Å; P346-F379 HydrophobicContact CG-CD1 4.02Å; P346-F379 HydrophobicContact CG-CG 4.46Å; I350-F379 HydrophobicContact CG2-CB 4.12Å; F379-V381 HydrophobicContact CD2-CG2 4.12Å; F379-V381 HydrophobicContact CE2-CG2 4.03Å; F379-L419 HydrophobicContact CD2-CD2 3.82Å; F379-L419 HydrophobicContact CE2-CD2 4.06Å
380	D	95.2	Very high	91.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.011	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.8	179.4	-75.1	-16.7	0	0	0	110.5	I337 I338 R339 L352 A353 F382	I337-D380 HydrophobicContact CG2-CB 3.69Å; I338-D380 CarbonylContact O-C 3.59Å; I338-D380 WeakPolarHBondContact O-CA 3.4Å; R339-D380 WeakPolarHBondContact CA-OD1 3.11Å; R339-D380 WeakPolarHBondContact CB-OD1 3.25Å; R339-D380 WeakPolarHBondContact CG-OD1 3.29Å; R339-D380 IonicContact CZ-OD1 3.06Å; R339-D380 IonicContact CZ-OD2 2.78Å; R339-D380 IonicContact NE-OD1 3.23Å; R339-D380 PolarHBondContact NE-OD1 3.4Å; R339-D380 IonicContact NE-OD2 3.09Å; R339-D380 IonicContact NH2-OD1 2.81Å; R339-D380 PolarHBondContact NH2-OD1 2.67Å; R339-D380 IonicContact NH2-OD2 3.23Å; R339-D380 PolarHBondContact NH2-OD2 2.92Å; L352-D380 WeakPolarHBondContact CA-OD2 3.25Å; A353-D380 WeakPolarHBondContact CB-OD2 3.32Å; A353-D380 PolarHBondContact N-OD2 3.48Å; D380-F382 HydrophobicContact CB-CE2 4.14Å
381	V	96.5	Very high	91.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	119	171	178.4	0	0	0	0	109.4	I337 I338 F379 A383 F402 L405 L419 M421	I337-V381 WeakPolarHBondContact CA-O 3.34Å; I338-V381 HydrophobicContact CB-CB 4.26Å; I338-V381 PolarHBondContact N-O 2.89Å; I338-V381 PolarHBondContact O-N 2.83Å; F379-V381 HydrophobicContact CD2-CG2 4.12Å; F379-V381 HydrophobicContact CE2-CG2 4.03Å; V381-A383 PolarHBondContact O-N 2.88Å; V381-F402 HydrophobicContact CB-CE1 4.4Å; V381-F402 HydrophobicContact CG1-CD1 4.23Å; V381-F402 HydrophobicContact CG1-CE1 4.13Å; V381-F402 HydrophobicContact CG2-CE1 4.3Å; V381-F402 HydrophobicContact CG2-CZ 4.43Å; V381-L405 HydrophobicContact CG1-CD2 3.63Å; V381-L405 HydrophobicContact CG2-CD1 4.11Å; V381-L419 CarbonylContact C-O 3.6Å; V381-L419 WeakPolarHBondContact CA-O 3.04Å; V381-L419 HydrophobicContact CG2-CD2 3.77Å; V381-L419 HydrophobicContact CG2-CG 4.18Å; V381-M421 HydrophobicContact CG1-CB 4.36Å
382	F	92.2	Very high	91.7	Very high	22 Å²	22	45.9 Å²	45.9	10%	0.096	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	99.6	175.9	-65.9	-99.3	0	0	0	109.4	I337 A353 D380 Y384 A418 L419 M421	I337-F382 HydrophobicContact CD1-CD1 4.11Å; I337-F382 HydrophobicContact CD1-CE1 3.65Å; I337-F382 HydrophobicContact CD1-CZ 4.37Å; I337-F382 HydrophobicContact CG1-CD1 3.79Å; I337-F382 HydrophobicContact CG1-CE1 3.82Å; A353-F382 HydrophobicContact CB-CZ 4.44Å; D380-F382 HydrophobicContact CB-CE2 4.14Å; F382-Y384 HydrophobicContact CB-CE2 3.79Å; F382-Y384 WeakPolarHBondContact O-CD2 3.34Å; F382-A418 HydrophobicContact CD2-CB 4.14Å; F382-A418 HydrophobicContact CE2-CB 4.2Å; F382-L419 PolarHBondContact N-O 2.54Å; F382-M421 PolarHBondContact O-N 2.97Å
383	A	91.6	Very high	91.9	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	119.9	-178.9	0	0	0	0	0	111.6	C335 S336 I338 V381 H387 S388 A391 M421 I431	C335-A383 WeakPolarHBondContact CA-O 3.49Å; S336-A383 PolarHBondContact N-O 2.94Å; S336-A383 PolarHBondContact O-N 3.14Å; I338-A383 HydrophobicContact CD1-CB 4.08Å; V381-A383 PolarHBondContact O-N 2.88Å; A383-H387 HydrophobicContact CB-CB 4.15Å; A383-S388 WeakPolarHBondContact O-CA 3.46Å; A383-S388 VanDerWaalsContact O-CB 3.24Å; A383-S388 WeakPolarHBondContact O-CB 3.34Å; A383-A391 HydrophobicContact CB-CB 4.17Å; A383-M421 HydrophobicContact CB-CB 4.34Å; A383-I431 HydrophobicContact CB-CD1 4.2Å
384	Y	85.4	Confident	92	Very high	24 Å²	24	38.8 Å²	38.8	9%	0.094	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	152.1	-173.8	-67.1	-74.8	0	0	0	113.7	F332 D334 C335 F382 S386 H387 T420 M421	F332-Y384 HydrophobicContact CB-CE1 4.09Å; F332-Y384 HydrophobicContact CD2-CE1 4.24Å; F332-Y384 HydrophobicContact CG-CE1 4.15Å; D334-Y384 WeakPolarHBondContact O-CA 3.3Å; C335-Y384 HydrophobicContact CB-CD1 3.48Å; C335-Y384 VanDerWaalsContact CB-CD1 3.48Å; C335-Y384 HydrophobicContact CB-CE1 3.41Å; C335-Y384 VanDerWaalsContact CB-CE1 3.41Å; C335-Y384 WeakPolarHBondContact SG-CE1 3.27Å; F382-Y384 HydrophobicContact CB-CE2 3.79Å; F382-Y384 WeakPolarHBondContact O-CD2 3.34Å; Y384-S386 PolarHBondContact O-N 3.05Å; Y384-H387 PolarHBondContact O-N 2.89Å; Y384-T420 HydrophobicContact CD2-CG2 3.68Å; Y384-T420 HydrophobicContact CE2-CG2 3.53Å; Y384-M421 PolarHBondContact N-O 3.02Å
385	G	83.2	Confident	91.9	Very high	17 Å²	17	45.6 Å²	45.6	18%	0.175	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	-128	172.2	0	0	0	0	0	113.2	D334 H387 S388 Q389	D334-G385 PolarHBondContact O-N 2.78Å; G385-H387 PolarHBondContact O-N 3.33Å; G385-S388 VanDerWaalsContact O-CB 3.27Å; G385-S388 WeakPolarHBondContact O-CB 3.24Å; G385-S388 PolarHBondContact O-N 2.74Å; G385-Q389 PolarHBondContact O-N 3.38Å
386	S	83.5	Confident	91.7	Very high	65 Å²	65	45 Å²	45	46%	0.455	22%	0.219	S	C	.	.	H	α-helix	trans	-59.1	-32.3	178.2	53.5	0	0	0	0	112.9	Y384 Q389 Y390	Y384-S386 PolarHBondContact O-N 3.05Å; S386-Q389 PolarHBondContact O-N 2.73Å; S386-Y390 PolarHBondContact O-N 3.4Å; S386-Y390 VanDerWaalsContact O-N 3.13Å
387	H	87.5	Confident	91.5	Very high	15 Å²	15	41.5 Å²	41.5	7%	0.069	20%	0.203	C	C	.	.	H	α-helix	trans	-72.1	-30.1	176.3	-59.5	-55.2	0	0	0	112.4	A383 Y384 G385 Q389 Y390 A391 M421 H422 G424 I431	A383-H387 HydrophobicContact CB-CB 4.15Å; Y384-H387 PolarHBondContact O-N 2.89Å; G385-H387 PolarHBondContact O-N 3.33Å; H387-Q389 VanDerWaalsContact C-N 3.29Å; H387-Q389 PolarHBondContact O-N 3.15Å; H387-Y390 PolarHBondContact O-N 2.87Å; H387-A391 WeakPolarHBondContact O-CB 3.2Å; H387-A391 PolarHBondContact O-N 2.88Å; H387-M421 HydrophobicContact CB-CG 3.93Å; H387-M421 VanDerWaalsContact CD2-CG 3.46Å; H387-M421 WeakPolarHBondContact CD2-CG 3.49Å; H387-H422 PolarHBondContact CD2-O 2.83Å; H387-G424 PolarHBondContact NE2-O 2.85Å; H387-I431 HydrophobicContact CB-CD1 3.97Å
388	S	92.5	Very high	91.3	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-59.7	-42.3	170.6	171.8	0	0	0	0	111	D334 S336 A383 G385 A391 K392	D334-S388 VanDerWaalsContact O-CB 3.27Å; D334-S388 WeakPolarHBondContact O-CB 3.14Å; S336-S388 PolarHBondContact N-OG 2.86Å; S336-S388 PolarHBondContact OG-O 3.15Å; S336-S388 PolarHBondContact OG-OG 3.26Å; A383-S388 WeakPolarHBondContact O-CA 3.46Å; A383-S388 VanDerWaalsContact O-CB 3.24Å; A383-S388 WeakPolarHBondContact O-CB 3.34Å; G385-S388 VanDerWaalsContact O-CB 3.27Å; G385-S388 WeakPolarHBondContact O-CB 3.24Å; G385-S388 PolarHBondContact O-N 2.74Å; S388-A391 PolarHBondContact O-N 2.69Å; S388-K392 WeakPolarHBondContact O-CG 3.35Å; S388-K392 PolarHBondContact O-N 2.93Å
389	Q	89.1	Confident	91.3	Very high	147 Å²	147	43.7 Å²	43.7	69%	0.687	21%	0.212	S	C	*	.	H	α-helix	trans	-66.2	-43.6	178.1	-64.4	178.5	-9.7	0	0	111.5	G385 S386 H387 K392	G385-Q389 PolarHBondContact O-N 3.38Å; S386-Q389 PolarHBondContact O-N 2.73Å; H387-Q389 VanDerWaalsContact C-N 3.29Å; H387-Q389 PolarHBondContact O-N 3.15Å; Q389-K392 PolarHBondContact O-N 2.88Å
390	Y	91.2	Very high	91.2	Very high	89 Å²	89	43.7 Å²	43.7	35%	0.349	21%	0.212	S	C	.	.	H	α-helix	trans	-64.5	-43	175.5	-173.2	-98.4	0	0	0	112.1	S386 H387 K392 S393 L394 I431	S386-Y390 PolarHBondContact O-N 3.4Å; S386-Y390 VanDerWaalsContact O-N 3.13Å; H387-Y390 PolarHBondContact O-N 2.87Å; Y390-K392 PolarHBondContact O-N 3.07Å; Y390-S393 WeakPolarHBondContact O-CB 3.1Å; Y390-S393 PolarHBondContact O-N 3.45Å; Y390-S393 PolarHBondContact O-OG 3.32Å; Y390-L394 HydrophobicContact CE1-CD2 4.07Å; Y390-I431 HydrophobicContact CD1-CB 3.69Å; Y390-I431 HydrophobicContact CD1-CD1 4.48Å; Y390-I431 HydrophobicContact CD1-CG2 3.83Å; Y390-I431 HydrophobicContact CE1-CB 3.78Å; Y390-I431 HydrophobicContact CE1-CG2 3.67Å; Y390-I431 VanDerWaalsContact CE1-O 3.28Å; Y390-I431 WeakPolarHBondContact CE1-O 3.42Å
391	A	94.7	Very high	91.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-54.9	-37.9	178.4	0	0	0	0	0	112.6	V326 I338 A383 H387 S388 S393 L394	V326-A391 HydrophobicContact CG1-CB 4.32Å; I338-A391 HydrophobicContact CD1-CB 3.67Å; I338-A391 HydrophobicContact CG1-CB 3.81Å; A383-A391 HydrophobicContact CB-CB 4.17Å; H387-A391 WeakPolarHBondContact O-CB 3.2Å; H387-A391 PolarHBondContact O-N 2.88Å; S388-A391 PolarHBondContact O-N 2.69Å; A391-S393 PolarHBondContact O-N 3.46Å; A391-S393 VanDerWaalsContact O-N 3.12Å; A391-L394 HydrophobicContact CB-CD1 4.5Å; A391-L394 VanDerWaalsContact O-CB 3.31Å; A391-L394 WeakPolarHBondContact O-CB 3.2Å; A391-L394 WeakPolarHBondContact O-CG 3.49Å; A391-L394 PolarHBondContact O-N 3.41Å
392	K	92.7	Very high	91.2	Very high	132 Å²	132	43.6 Å²	43.6	57%	0.574	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.4	177.2	-69.7	171.5	-174.2	-175	0	113.7	S336 S388 Q389 Y390	S336-K392 WeakPolarHBondContact OG-CE 3.29Å; S388-K392 WeakPolarHBondContact O-CG 3.35Å; S388-K392 PolarHBondContact O-N 2.93Å; Q389-K392 PolarHBondContact O-N 2.88Å; Y390-K392 PolarHBondContact O-N 3.07Å
393	S	94.1	Very high	91.1	Very high	71 Å²	71	43 Å²	43	50%	0.497	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.7	176.5	75	0	0	0	0	113.9	Y390 A391	Y390-S393 WeakPolarHBondContact O-CB 3.1Å; Y390-S393 PolarHBondContact O-N 3.45Å; Y390-S393 PolarHBondContact O-OG 3.32Å; A391-S393 PolarHBondContact O-N 3.46Å; A391-S393 VanDerWaalsContact O-N 3.12Å
394	L	95	Very high	90.9	Very high	15 Å²	15	43.5 Å²	43.5	8%	0.079	21%	0.212	C	C	.	.			trans	-69.2	144.7	177.4	-58.2	175.8	0	0	0	110.2	V323 V326 I338 Y390 A391 V400 I431 V433	V323-L394 HydrophobicContact CG1-CB 4.43Å; V323-L394 HydrophobicContact CG2-CD1 4.21Å; V326-L394 HydrophobicContact CG2-CB 4.05Å; I338-L394 HydrophobicContact CD1-CD1 3.8Å; I338-L394 HydrophobicContact CG1-CD1 4.21Å; I338-L394 HydrophobicContact CG2-CD1 4.31Å; Y390-L394 HydrophobicContact CE1-CD2 4.07Å; A391-L394 HydrophobicContact CB-CD1 4.5Å; A391-L394 VanDerWaalsContact O-CB 3.31Å; A391-L394 WeakPolarHBondContact O-CB 3.2Å; A391-L394 WeakPolarHBondContact O-CG 3.49Å; A391-L394 PolarHBondContact O-N 3.41Å; L394-V400 HydrophobicContact CD1-CG2 4.4Å; L394-V400 HydrophobicContact CD2-CG2 3.86Å; L394-I431 HydrophobicContact CD1-CG2 4.3Å; L394-V433 HydrophobicContact CD2-CG2 3.53Å
395	R	90.6	Very high	91.1	Very high	184 Å²	184	42.3 Å²	42.3	69%	0.694	21%	0.207	S	C	*	.			trans	-115.1	159.1	-178.1	-56.1	-178.5	-176.4	179.8	-0.6	110.4	Q398	R395-Q398 HydrophobicContact CB-CG 4.03Å; R395-Q398 WeakPolarHBondContact O-CB 3.49Å; R395-Q398 PolarHBondContact O-N 2.87Å
396	F	88.6	Confident	91.3	Very high	50 Å²	50	41.5 Å²	41.5	22%	0.219	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	143.2	169.4	177.4	-118.4	0	0	0	111.2	I324 M367 L370 Q398 E455	I324-F396 WeakPolarHBondContact O-CD2 3.27Å; M367-F396 HydrophobicContact CG-CD2 4.24Å; M367-F396 HydrophobicContact CG-CE2 4.16Å; L370-F396 HydrophobicContact CD1-CZ 4.09Å; F396-Q398 PolarHBondContact O-N 2.82Å; F396-E455 HydrophobicContact CD1-CG 4.24Å; F396-E455 HydrophobicContact CE1-CG 3.83Å; F396-E455 WeakPolarHBondContact CE1-OE1 3.3Å
397	A	88.8	Confident	91.4	Very high	18 Å²	18	38.4 Å²	38.4	15%	0.149	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	4.5	176.7	0	0	0	0	0	116.5	K322 V323	K322-A397 VanDerWaalsContact CE-CA 3.48Å; K322-A397 VanDerWaalsContact CE-CB 3.47Å; V323-A397 WeakPolarHBondContact O-CA 3.35Å; V323-A397 PolarHBondContact O-N 3.31Å
398	Q	92.5	Very high	90.5	Very high	51 Å²	51	39.4 Å²	39.4	24%	0.238	18%	0.182	C	C	.	.			trans	-70	137.8	172.9	-71.8	-173.8	-39	0	0	111.4	K322 V323 R395 F396 V400	K322-Q398 CarbonylContact C-O 3.53Å; K322-Q398 WeakPolarHBondContact CA-O 3.4Å; V323-Q398 PolarHBondContact N-O 2.94Å; R395-Q398 HydrophobicContact CB-CG 4.03Å; R395-Q398 WeakPolarHBondContact O-CB 3.49Å; R395-Q398 PolarHBondContact O-N 2.87Å; F396-Q398 PolarHBondContact O-N 2.82Å; Q398-V400 HydrophobicContact CB-CG2 4.5Å
399	Y	95.1	Very high	89.6	Confident	13 Å²	13	41.7 Å²	41.7	5%	0.051	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	131.8	168.1	-67.3	-87.6	0	0	0	109.9	A321 K322 L434 L441 I444 R445 D454	A321-Y399 WeakPolarHBondContact O-CA 3.44Å; K322-Y399 HydrophobicContact CB-CD1 4.12Å; K322-Y399 HydrophobicContact CB-CE1 3.94Å; K322-Y399 HydrophobicContact CD-CE1 4.21Å; K322-Y399 HydrophobicContact CD-CE2 4.49Å; K322-Y399 HydrophobicContact CG-CE1 4.29Å; Y399-L434 PolarHBondContact O-N 3.19Å; Y399-L441 HydrophobicContact CD1-CD2 3.86Å; Y399-L441 HydrophobicContact CD2-CD1 4.32Å; Y399-L441 HydrophobicContact CD2-CD2 4.23Å; Y399-L441 HydrophobicContact CG-CD1 4.43Å; Y399-L441 HydrophobicContact CG-CD2 3.56Å; Y399-I444 HydrophobicContact CD1-CD1 4.07Å; Y399-I444 HydrophobicContact CD1-CG1 4.49Å; Y399-I444 HydrophobicContact CD1-CG2 4.04Å; Y399-I444 HydrophobicContact CE1-CD1 4.23Å; Y399-I444 HydrophobicContact CE1-CG1 4.22Å; Y399-I444 HydrophobicContact CE1-CG2 4.07Å; Y399-R445 HydrophobicContact CE1-CG 4.33Å; Y399-R445 HydrophobicContact CE2-CG 4.32Å; Y399-D454 WeakPolarHBondContact CE2-OD1 3.16Å; Y399-D454 PolarHBondContact OH-OD1 3.02Å
400	V	96.1	Very high	88.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.2	-173.8	175.7	0	0	0	0	109.4	I320 A321 V323 L394 Q398 F402 I431 E432 V433	I320-V400 CarbonylContact C-O 3.52Å; I320-V400 WeakPolarHBondContact CA-O 3.34Å; A321-V400 PolarHBondContact N-O 2.98Å; A321-V400 PolarHBondContact O-N 3.06Å; V323-V400 HydrophobicContact CG2-CB 4.22Å; V323-V400 HydrophobicContact CG2-CG2 3.54Å; L394-V400 HydrophobicContact CD1-CG2 4.4Å; L394-V400 HydrophobicContact CD2-CG2 3.86Å; Q398-V400 HydrophobicContact CB-CG2 4.5Å; V400-F402 HydrophobicContact CB-CE2 3.89Å; V400-F402 HydrophobicContact CB-CZ 4.12Å; V400-F402 HydrophobicContact CG1-CD1 4.38Å; V400-F402 HydrophobicContact CG1-CD2 4.06Å; V400-F402 HydrophobicContact CG1-CE1 4.03Å; V400-F402 HydrophobicContact CG1-CE2 3.66Å; V400-F402 HydrophobicContact CG1-CG 4.39Å; V400-F402 HydrophobicContact CG1-CZ 3.66Å; V400-I431 HydrophobicContact CG1-CG2 3.27Å; V400-E432 CarbonylContact C-O 3.6Å; V400-E432 VanDerWaalsContact CA-O 3.31Å; V400-E432 WeakPolarHBondContact CA-O 3.24Å; V400-V433 HydrophobicContact CG2-CG2 4.26Å
401	A	94.4	Very high	86.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.1	166.2	0	0	0	0	0	109.3	F305 I320 F403 E432 L434	F305-A401 HydrophobicContact CE1-CB 3.68Å; F305-A401 HydrophobicContact CZ-CB 3.82Å; I320-A401 HydrophobicContact CG1-CB 4.37Å; A401-F403 HydrophobicContact CB-CD2 4.35Å; A401-F403 HydrophobicContact CB-CE2 3.56Å; A401-F403 HydrophobicContact CB-CZ 3.92Å; A401-E432 HydrophobicContact CB-CB 4.44Å; A401-E432 PolarHBondContact N-O 3.4Å; A401-E432 PolarHBondContact O-N 3.49Å; A401-L434 HydrophobicContact CB-CD1 4.26Å; A401-L434 HydrophobicContact CB-CD2 3.92Å; A401-L434 HydrophobicContact CB-CG 4.13Å
402	F	95.4	Very high	84.2	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.6	172.2	-58.8	-93.9	0	0	0	108.6	N318 I319 A321 I338 V381 V400 L405 M421 I431	N318-F402 CarbonylContact C-O 3.54Å; N318-F402 VanDerWaalsContact CA-O 3.26Å; N318-F402 WeakPolarHBondContact CA-O 3.38Å; I319-F402 HydrophobicContact CG2-CB 3.93Å; I319-F402 HydrophobicContact CG2-CD2 4.02Å; I319-F402 HydrophobicContact CG2-CG 4.33Å; I319-F402 PolarHBondContact N-O 2.86Å; I319-F402 PolarHBondContact O-N 2.77Å; A321-F402 HydrophobicContact CB-CD2 4.48Å; A321-F402 HydrophobicContact CB-CE2 4Å; I338-F402 HydrophobicContact CD1-CE1 3.73Å; I338-F402 HydrophobicContact CD1-CZ 4.27Å; I338-F402 HydrophobicContact CG2-CZ 4.17Å; V381-F402 HydrophobicContact CB-CE1 4.4Å; V381-F402 HydrophobicContact CG1-CD1 4.23Å; V381-F402 HydrophobicContact CG1-CE1 4.13Å; V381-F402 HydrophobicContact CG2-CE1 4.3Å; V381-F402 HydrophobicContact CG2-CZ 4.43Å; V400-F402 HydrophobicContact CB-CE2 3.89Å; V400-F402 HydrophobicContact CB-CZ 4.12Å; V400-F402 HydrophobicContact CG1-CD1 4.38Å; V400-F402 HydrophobicContact CG1-CD2 4.06Å; V400-F402 HydrophobicContact CG1-CE1 4.03Å; V400-F402 HydrophobicContact CG1-CE2 3.66Å; V400-F402 HydrophobicContact CG1-CG 4.39Å; V400-F402 HydrophobicContact CG1-CZ 3.66Å; F402-L405 HydrophobicContact CB-CD1 3.45Å; F402-L405 VanDerWaalsContact CB-CD1 3.45Å; F402-L405 HydrophobicContact CB-CD2 4.16Å; F402-L405 HydrophobicContact CB-CG 3.61Å; F402-L405 HydrophobicContact CD1-CD1 4.29Å; F402-L405 HydrophobicContact CD1-CD2 4.3Å; F402-L405 HydrophobicContact CG-CD1 3.87Å; F402-L405 HydrophobicContact CG-CG 4.35Å; F402-M421 HydrophobicContact CB-CE 4.18Å; F402-M421 HydrophobicContact CD1-CE 4.25Å; F402-I431 HydrophobicContact CD1-CD1 4.47Å; F402-I431 HydrophobicContact CD1-CG1 4.08Å; F402-I431 HydrophobicContact CD1-CG2 4.26Å; F402-I431 HydrophobicContact CE1-CD1 4.33Å; F402-I431 HydrophobicContact CE1-CG1 4.35Å; F402-I431 HydrophobicContact CE1-CG2 4.08Å
403	F	90.6	Very high	82.6	Confident	10 Å²	10	36.7 Å²	36.7	4%	0.044	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.5	-180	-64	-93.4	0	0	0	109.9	F305 N318 A401 M421 R429 R430 E432	F305-F403 HydrophobicContact CE1-CE1 4.04Å; F305-F403 HydrophobicContact CE1-CZ 4.1Å; F305-F403 AromaticContact CZ-CE1 3.73Å; F305-F403 HydrophobicContact CZ-CE1 3.73Å; F305-F403 AromaticContact CZ-CZ 3.68Å; F305-F403 HydrophobicContact CZ-CZ 3.68Å; N318-F403 WeakPolarHBondContact OD1-CA 3.29Å; A401-F403 HydrophobicContact CB-CD2 4.35Å; A401-F403 HydrophobicContact CB-CE2 3.56Å; A401-F403 HydrophobicContact CB-CZ 3.92Å; F403-M421 WeakPolarHBondContact O-CE 3.4Å; F403-R429 WeakPolarHBondContact O-CA 3.01Å; F403-R430 HydrophobicContact CB-CG 3.98Å; F403-R430 HydrophobicContact CD2-CG 3.43Å; F403-R430 VanDerWaalsContact CD2-CG 3.43Å; F403-R430 HydrophobicContact CE2-CG 4.16Å; F403-R430 HydrophobicContact CG-CG 3.92Å; F403-R430 PolarHBondContact N-O 2.78Å; F403-E432 HydrophobicContact CE2-CB 3.97Å
404	N	87.3	Confident	80.8	Confident	9 Å²	9	36.9 Å²	36.9	5%	0.048	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.3	48.8	173.3	-165.2	7.4	0	0	0	112.7	Y316 C317 N318 N427 R429	Y316-N404 VanDerWaalsContact CB-OD1 3.23Å; Y316-N404 WeakPolarHBondContact CB-OD1 3.2Å; Y316-N404 WeakPolarHBondContact CD1-OD1 3.06Å; Y316-N404 VanDerWaalsContact CG-OD1 3.3Å; C317-N404 PolarHBondContact O-N 3.16Å; N318-N404 PolarHBondContact OD1-N 3.46Å; N404-N427 WeakPolarHBondContact ND2-CB 3.36Å; N404-N427 PolarHBondContact ND2-O 3.07Å; N404-R429 HydrophobicContact CB-CG 3.72Å
405	L	91	Very high	79.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.1	170.8	-75.5	-179.6	0	0	0	110.9	Y316 C317 I319 V381 F402 L419 M421	Y316-L405 CarbonylContact C-O 3.58Å; Y316-L405 WeakPolarHBondContact CA-O 3.06Å; C317-L405 PolarHBondContact N-O 2.97Å; C317-L405 PolarHBondContact O-N 2.51Å; I319-L405 HydrophobicContact CG2-CD1 3.45Å; I319-L405 VanDerWaalsContact CG2-CD1 3.45Å; V381-L405 HydrophobicContact CG1-CD2 3.63Å; V381-L405 HydrophobicContact CG2-CD1 4.11Å; F402-L405 HydrophobicContact CB-CD1 3.45Å; F402-L405 VanDerWaalsContact CB-CD1 3.45Å; F402-L405 HydrophobicContact CB-CD2 4.16Å; F402-L405 HydrophobicContact CB-CG 3.61Å; F402-L405 HydrophobicContact CD1-CD1 4.29Å; F402-L405 HydrophobicContact CD1-CD2 4.3Å; F402-L405 HydrophobicContact CG-CD1 3.87Å; F402-L405 HydrophobicContact CG-CG 4.35Å; L405-L419 HydrophobicContact CB-CD1 3.77Å; L405-L419 HydrophobicContact CB-CG 4.3Å; L405-L419 HydrophobicContact CD1-CD1 4.08Å; L405-L419 HydrophobicContact CD1-CD2 3.77Å; L405-L419 HydrophobicContact CD1-CG 3.86Å; L405-L419 HydrophobicContact CG-CD1 4.48Å; L405-M421 HydrophobicContact CD2-CB 3.82Å; L405-M421 HydrophobicContact CD2-CE 3.49Å; L405-M421 VanDerWaalsContact CD2-CE 3.49Å; L405-M421 HydrophobicContact CD2-SD 4.24Å; L405-M421 HydrophobicContact CG-CE 4.1Å
406	H	85.7	Confident	78.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	117.3	178.5	-171.7	-146.8	0	0	0	111	D291 G314 Y316 H408 L419 T420 H422	D291-H406 IonicContact OD1-CE1 3.76Å; D291-H406 PolarHBondContact OD1-CE1 2.87Å; D291-H406 IonicContact OD1-NE2 3.83Å; G314-H406 PolarHBondContact O-CD2 2.83Å; G314-H406 PolarHBondContact O-NE2 3.04Å; Y316-H406 HydrophobicContact CD1-CB 3.76Å; Y316-H406 AromaticContact CD2-CD2 3.98Å; Y316-H406 HydrophobicContact CE1-CB 3.44Å; Y316-H406 VanDerWaalsContact CE1-CB 3.44Å; Y316-H406 AromaticContact CE1-CD2 3.8Å; Y316-H406 AromaticContact CE1-CG 3.66Å; Y316-H406 AromaticContact CE2-CD2 3.6Å; Y316-H406 AromaticContact CE2-NE2 3.93Å; Y316-H406 AromaticContact CZ-CD2 3.51Å; Y316-H406 AromaticContact CZ-CG 3.66Å; Y316-H406 AromaticContact CZ-NE2 3.96Å; H406-H408 VanDerWaalsContact CE1-CB 3.44Å; H406-H408 WeakPolarHBondContact CE1-CB 3.21Å; H406-H408 AromaticContact CE1-CG 3.99Å; H406-H408 AromaticContact ND1-CD2 3.55Å; H406-H408 AromaticContact ND1-CG 3.84Å; H406-L419 CarbonylContact O-C 3.51Å; H406-L419 WeakPolarHBondContact O-CA 3.34Å; H406-T420 PolarHBondContact N-O 2.92Å; H406-T420 PolarHBondContact O-N 2.81Å; H406-H422 AromaticContact CG-NE2 3.69Å; H406-H422 AromaticContact ND1-CE1 3.94Å; H406-H422 AromaticContact ND1-NE2 3.11Å; H406-H422 PolarHBondContact ND1-NE2 3.45Å; H406-H422 VanDerWaalsContact ND1-NE2 3.11Å
407	L	85.8	Confident	77.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.6	167.4	-177.1	60.9	0	0	0	108.8	F311 P313 G314 L315 I350 A417 A418 L419	F311-L407 HydrophobicContact CB-CD2 3.69Å; P313-L407 CarbonylContact C-O 3.45Å; P313-L407 WeakPolarHBondContact CA-O 3.28Å; P313-L407 HydrophobicContact CB-CD2 4.48Å; P313-L407 HydrophobicContact CB-CG 4.35Å; P313-L407 HydrophobicContact CG-CD2 3.88Å; P313-L407 HydrophobicContact CG-CG 4.17Å; G314-L407 CarbonylContact C-O 3.57Å; G314-L407 WeakPolarHBondContact CA-O 3.02Å; G314-L407 PolarHBondContact N-O 3.02Å; L315-L407 PolarHBondContact O-N 2.83Å; L315-L407 VanDerWaalsContact O-N 3.1Å; I350-L407 HydrophobicContact CD1-CD1 3.69Å; I350-L407 HydrophobicContact CD1-CD2 4.18Å; I350-L407 HydrophobicContact CG1-CD1 3.77Å; I350-L407 HydrophobicContact CG1-CD2 4.49Å; L407-A417 HydrophobicContact CD1-CB 3.57Å; L407-A417 HydrophobicContact CG-CB 4.04Å; L407-A418 WeakPolarHBondContact CA-O 3.43Å; L407-L419 HydrophobicContact CB-CD1 4.1Å; L407-L419 HydrophobicContact CD1-CB 4.36Å; L407-L419 HydrophobicContact CD1-CD1 4.41Å
408	H	69.5	Low	77.7	Confident	35 Å²	35	34.5 Å²	34.5	16%	0.162	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	150.5	-178.4	68.9	92.2	0	0	0	113	H406 A417 A418 T420	H406-H408 VanDerWaalsContact CE1-CB 3.44Å; H406-H408 WeakPolarHBondContact CE1-CB 3.21Å; H406-H408 AromaticContact CE1-CG 3.99Å; H406-H408 AromaticContact ND1-CD2 3.55Å; H406-H408 AromaticContact ND1-CG 3.84Å; H408-A417 CarbonylContact O-C 3.55Å; H408-A417 WeakPolarHBondContact O-CA 3.21Å; H408-A417 WeakPolarHBondContact O-CB 3.37Å; H408-A418 PolarHBondContact CD2-O 3.36Å; H408-A418 PolarHBondContact N-O 3.29Å; H408-A418 PolarHBondContact O-N 3.15Å; H408-T420 PolarHBondContact CD2-OG1 3.36Å; H408-T420 PolarHBondContact NE2-OG1 2.85Å
409	Y	73.2	Confident	77.7	Confident	51 Å²	51	32.1 Å²	32.1	20%	0.2	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	145.7	176.4	-71.2	-74.5	0	0	0	112.3	M290 P313 P414 Q416 A417	M290-Y409 HydrophobicContact CB-CD2 4.4Å; M290-Y409 HydrophobicContact CE-CD2 3.54Å; M290-Y409 HydrophobicContact CE-CE2 3.03Å; M290-Y409 HydrophobicContact CG-CD2 4.48Å; M290-Y409 HydrophobicContact SD-CD2 3.41Å; M290-Y409 WeakPolarHBondContact SD-CD2 3.36Å; M290-Y409 HydrophobicContact SD-CE2 3.64Å; M290-Y409 HydrophobicContact SD-CG 4.32Å; P313-Y409 HydrophobicContact CB-CD2 3.68Å; P313-Y409 HydrophobicContact CB-CE1 4.23Å; P313-Y409 HydrophobicContact CB-CE2 3.16Å; P313-Y409 HydrophobicContact CB-CG 4.39Å; P313-Y409 HydrophobicContact CG-CE1 4.14Å; P313-Y409 HydrophobicContact CG-CE2 3.84Å; Y409-P414 WeakPolarHBondContact CD1-O 3.31Å; Y409-P414 VanDerWaalsContact CE1-O 3.27Å; Y409-P414 WeakPolarHBondContact CE1-O 3.36Å; Y409-Q416 CarbonylContact C-O 3.32Å; Y409-Q416 WeakPolarHBondContact CA-O 3.46Å; Y409-A417 HydrophobicContact CD1-CB 4.3Å
410	K	63.6	Low	77.4	Confident	53 Å²	53	31.5 Å²	31.5	23%	0.23	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	131.4	171.1	-58.8	178.8	-172.7	172.2	0	108.8	Y412 Q413 P414 Q416 A418	K410-Y412 PolarHBondContact O-N 2.78Å; K410-Q413 HydrophobicContact CB-CB 4.26Å; K410-Q413 CarbonylContact O-C 3.58Å; K410-Q413 PolarHBondContact O-N 3.27Å; K410-Q413 VanDerWaalsContact O-N 3.16Å; K410-P414 WeakPolarHBondContact O-CA 3.36Å; K410-Q416 HydrophobicContact CD-CB 4.03Å; K410-Q416 PolarHBondContact N-O 3.48Å; K410-Q416 VanDerWaalsContact NZ-OE1 3.17Å; K410-A418 HydrophobicContact CG-CB 4.41Å
411	L	48.1	Very low	77	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.021	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-41.7	-177.7	-172.3	72.7	0	0	0	113.1	Y151 D191 S192 R283 L284 W287 Q413	Y151-L411 HydrophobicContact CE1-CD2 4.04Å; Y151-L411 WeakPolarHBondContact OH-CD2 3.34Å; D191-L411 HydrophobicContact CB-CD2 4.42Å; S192-L411 VanDerWaalsContact CB-CB 3.4Å; S192-L411 WeakPolarHBondContact OG-CB 3.42Å; S192-L411 PolarHBondContact OG-N 2.81Å; R283-L411 HydrophobicContact CG-CD1 4.16Å; R283-L411 PolarHBondContact NE-O 2.81Å; R283-L411 VanDerWaalsContact NE-O 3.16Å; R283-L411 PolarHBondContact NH2-O 2.88Å; L284-L411 HydrophobicContact CD2-CD1 4.03Å; L284-L411 HydrophobicContact CD2-CD2 4.31Å; W287-L411 HydrophobicContact CB-CD1 3.96Å; W287-L411 HydrophobicContact CD2-CD1 4.29Å; W287-L411 HydrophobicContact CG-CD1 3.91Å; L411-Q413 PolarHBondContact O-N 3.17Å
412	Y	49	Very low	76.3	Confident	121 Å²	121	32 Å²	32	48%	0.475	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-11.4	178.6	-57.1	-67.8	0	0	0	114	Y151 P153 R283 K410	Y151-Y412 HydrophobicContact CE1-CE1 4.25Å; P153-Y412 WeakPolarHBondContact CB-OH 3.35Å; P153-Y412 WeakPolarHBondContact CG-OH 3.42Å; R283-Y412 VanDerWaalsContact NH2-CA 3.32Å; K410-Y412 PolarHBondContact O-N 2.78Å
413	Q	59.4	Low	75.4	Confident	86 Å²	86	32.9 Å²	32.9	40%	0.402	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	72.5	-179.8	-67.1	170.1	-21.8	0	0	107.3	K410 L411 M415 Q416	K410-Q413 HydrophobicContact CB-CB 4.26Å; K410-Q413 CarbonylContact O-C 3.58Å; K410-Q413 PolarHBondContact O-N 3.27Å; K410-Q413 VanDerWaalsContact O-N 3.16Å; L411-Q413 PolarHBondContact O-N 3.17Å; Q413-M415 PolarHBondContact O-N 3.35Å; Q413-Q416 HydrophobicContact CB-CB 3.84Å; Q413-Q416 HydrophobicContact CB-CG 3.89Å; Q413-Q416 WeakPolarHBondContact O-CA 3.26Å; Q413-Q416 WeakPolarHBondContact O-CB 3.47Å; Q413-Q416 PolarHBondContact O-N 2.92Å; Q413-Q416 VanDerWaalsContact O-O 3.13Å
414	P	56.8	Low	74.4	Confident	74 Å²	74	33.8 Å²	33.8	48%	0.481	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	-9.2	-171.7	25.6	-34.9	0	0	0	113.9	Y409 K410	Y409-P414 WeakPolarHBondContact CD1-O 3.31Å; Y409-P414 VanDerWaalsContact CE1-O 3.27Å; Y409-P414 WeakPolarHBondContact CE1-O 3.36Å; K410-P414 WeakPolarHBondContact O-CA 3.36Å
415	M	65.9	Low	73.7	Confident	160 Å²	160	39.7 Å²	39.7	79%	0.788	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	-6.2	171.4	-61.2	-61.5	170	0	0	113.2	S349 Q413	S349-M415 WeakPolarHBondContact CA-O 3.34Å; Q413-M415 PolarHBondContact O-N 3.35Å
416	Q	72.2	Confident	72.6	Confident	47 Å²	47	42 Å²	42	22%	0.22	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.2	177.6	-63	-169	23.1	0	0	110.6	S349 R351 Y409 K410 Q413	S349-Q416 CarbonylContact O-C 3.5Å; S349-Q416 VanDerWaalsContact O-CA 3.23Å; S349-Q416 WeakPolarHBondContact O-CA 3.47Å; R351-Q416 HydrophobicContact CG-CG 3.99Å; Y409-Q416 CarbonylContact C-O 3.32Å; Y409-Q416 WeakPolarHBondContact CA-O 3.46Å; K410-Q416 HydrophobicContact CD-CB 4.03Å; K410-Q416 PolarHBondContact N-O 3.48Å; K410-Q416 VanDerWaalsContact NZ-OE1 3.17Å; Q413-Q416 HydrophobicContact CB-CB 3.84Å; Q413-Q416 HydrophobicContact CB-CG 3.89Å; Q413-Q416 WeakPolarHBondContact O-CA 3.26Å; Q413-Q416 WeakPolarHBondContact O-CB 3.47Å; Q413-Q416 PolarHBondContact O-N 2.92Å; Q413-Q416 VanDerWaalsContact O-O 3.13Å
417	A	76.1	Confident	71.9	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	151.1	174.8	0	0	0	0	0	110.9	P313 S349 L407 H408 Y409	P313-A417 HydrophobicContact CB-CB 4.45Å; P313-A417 HydrophobicContact CG-CB 4.1Å; S349-A417 PolarHBondContact O-N 3.35Å; L407-A417 HydrophobicContact CD1-CB 3.57Å; L407-A417 HydrophobicContact CG-CB 4.04Å; H408-A417 CarbonylContact O-C 3.55Å; H408-A417 WeakPolarHBondContact O-CA 3.21Å; H408-A417 WeakPolarHBondContact O-CB 3.37Å; Y409-A417 HydrophobicContact CD1-CB 4.3Å
418	A	83.9	Confident	71.5	Confident	9 Å²	9	48.3 Å²	48.3	7%	0.074	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.5	173.1	0	0	0	0	0	109	F382 L407 H408 K410	F382-A418 HydrophobicContact CD2-CB 4.14Å; F382-A418 HydrophobicContact CE2-CB 4.2Å; L407-A418 WeakPolarHBondContact CA-O 3.43Å; H408-A418 PolarHBondContact CD2-O 3.36Å; H408-A418 PolarHBondContact N-O 3.29Å; H408-A418 PolarHBondContact O-N 3.15Å; K410-A418 HydrophobicContact CG-CB 4.41Å
419	L	91.8	Very high	72.2	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	113.1	173.4	-171.1	60.6	0	0	0	108.3	F311 F379 V381 F382 L405 H406 L407	F311-L419 HydrophobicContact CD2-CD1 3.84Å; F311-L419 HydrophobicContact CE2-CD1 3.8Å; F311-L419 HydrophobicContact CE2-CD2 4.38Å; F379-L419 HydrophobicContact CD2-CD2 3.82Å; F379-L419 HydrophobicContact CE2-CD2 4.06Å; V381-L419 CarbonylContact C-O 3.6Å; V381-L419 WeakPolarHBondContact CA-O 3.04Å; V381-L419 HydrophobicContact CG2-CD2 3.77Å; V381-L419 HydrophobicContact CG2-CG 4.18Å; F382-L419 PolarHBondContact N-O 2.54Å; L405-L419 HydrophobicContact CB-CD1 3.77Å; L405-L419 HydrophobicContact CB-CG 4.3Å; L405-L419 HydrophobicContact CD1-CD1 4.08Å; L405-L419 HydrophobicContact CD1-CD2 3.77Å; L405-L419 HydrophobicContact CD1-CG 3.86Å; L405-L419 HydrophobicContact CG-CD1 4.48Å; H406-L419 CarbonylContact O-C 3.51Å; H406-L419 WeakPolarHBondContact O-CA 3.34Å; L407-L419 HydrophobicContact CB-CD1 4.1Å; L407-L419 HydrophobicContact CD1-CB 4.36Å; L407-L419 HydrophobicContact CD1-CD1 4.41Å
420	T	89.2	Confident	73	Confident	1 Å²	1	50 Å²	50	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.4	-164.9	-68.8	0	0	0	0	111.4	Y384 H406 H408	Y384-T420 HydrophobicContact CD2-CG2 3.68Å; Y384-T420 HydrophobicContact CE2-CG2 3.53Å; H406-T420 PolarHBondContact N-O 2.92Å; H406-T420 PolarHBondContact O-N 2.81Å; H408-T420 PolarHBondContact CD2-OG1 3.36Å; H408-T420 PolarHBondContact NE2-OG1 2.85Å
421	M	88.7	Confident	74.4	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	97.3	163.4	-174.8	69.1	76.8	0	0	108.6	V381 F382 A383 Y384 H387 F402 F403 L405 R429 R430 I431	V381-M421 HydrophobicContact CG1-CB 4.36Å; F382-M421 PolarHBondContact O-N 2.97Å; A383-M421 HydrophobicContact CB-CB 4.34Å; Y384-M421 PolarHBondContact N-O 3.02Å; H387-M421 HydrophobicContact CB-CG 3.93Å; H387-M421 VanDerWaalsContact CD2-CG 3.46Å; H387-M421 WeakPolarHBondContact CD2-CG 3.49Å; F402-M421 HydrophobicContact CB-CE 4.18Å; F402-M421 HydrophobicContact CD1-CE 4.25Å; F403-M421 WeakPolarHBondContact O-CE 3.4Å; L405-M421 HydrophobicContact CD2-CB 3.82Å; L405-M421 HydrophobicContact CD2-CE 3.49Å; L405-M421 VanDerWaalsContact CD2-CE 3.49Å; L405-M421 HydrophobicContact CD2-SD 4.24Å; L405-M421 HydrophobicContact CG-CE 4.1Å; M421-R429 HydrophobicContact SD-CB 4.09Å; M421-R429 HydrophobicContact SD-CG 4.29Å; M421-R430 WeakPolarHBondContact CE-O 3.38Å; M421-I431 HydrophobicContact CE-CG1 3.89Å; M421-I431 HydrophobicContact CG-CG1 4.44Å
422	H	79.5	Confident	76.5	Confident	11 Å²	11	51.9 Å²	51.9	5%	0.051	28%	0.279	C	S	.	.			trans	-60.7	156.9	177.5	-66.4	-68.3	0	0	0	112.1	H387 H406	H387-H422 PolarHBondContact CD2-O 2.83Å; H406-H422 AromaticContact CG-NE2 3.69Å; H406-H422 AromaticContact ND1-CE1 3.94Å; H406-H422 AromaticContact ND1-NE2 3.11Å; H406-H422 PolarHBondContact ND1-NE2 3.45Å; H406-H422 VanDerWaalsContact ND1-NE2 3.11Å
423	S	75.3	Confident	78.7	Confident	17 Å²	17	48.4 Å²	48.4	12%	0.119	27%	0.27	C	S	.	.	S	Bend	trans	-65	154.4	179.8	79.3	0	0	0	0	112.9	D197 R429	D197-S423 PolarHBondContact OD2-OG 3.23Å; S423-R429 PolarHBondContact O-NH1 3.29Å
424	G	69.7	Low	80.3	Confident	29 Å²	29	45.1 Å²	45.1	30%	0.299	26%	0.255	S	S	.	.	S	Bend	trans	79.8	175.5	179.8	0	0	0	0	0	114.3	H387	H387-G424 PolarHBondContact NE2-O 2.85Å
425	N	73.4	Confident	81.9	Confident	134 Å²	134	49.3 Å²	49.3	72%	0.717	27%	0.266	S	S	*	.			trans	-110.4	14.6	-174.3	63	-9.8	0	0	0	113.3	G428	N425-G428 PolarHBondContact O-N 3.21Å
426	A	67.1	Low	82.8	Confident	48 Å²	48	45.6 Å²	45.6	40%	0.397	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-56.3	145.3	177.5	0	0	0	0	0	110.7	G428 R429	A426-G428 PolarHBondContact O-N 2.97Å; A426-R429 WeakPolarHBondContact O-CB 3.41Å; A426-R429 VanDerWaalsContact O-CG 3.28Å; A426-R429 WeakPolarHBondContact O-CG 3.37Å; A426-R429 PolarHBondContact O-N 3.35Å; A426-R429 PolarHBondContact O-NE 3.1Å
427	N	72.8	Confident	83.4	Confident	94 Å²	94	49.8 Å²	49.8	50%	0.503	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	54.6	32.2	-179.9	-55.5	-18.4	0	0	0	113.2	N404 R429	N404-N427 WeakPolarHBondContact ND2-CB 3.36Å; N404-N427 PolarHBondContact ND2-O 3.07Å; N427-R429 VanDerWaalsContact C-N 3.3Å; N427-R429 PolarHBondContact O-N 3.34Å
428	G	76.6	Confident	83.9	Confident	39 Å²	39	51 Å²	51	40%	0.402	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	76.1	9.5	176.1	0	0	0	0	0	115.7	N425 A426 R430	N425-G428 PolarHBondContact O-N 3.21Å; A426-G428 PolarHBondContact O-N 2.97Å; G428-R430 PolarHBondContact O-N 3.47Å; G428-R430 PolarHBondContact O-NH1 2.73Å
429	R	84.7	Confident	84	Confident	27 Å²	27	58.5 Å²	58.5	10%	0.102	32%	0.315	C	S	.	.			trans	-55.3	121.2	178.8	-76.2	175.4	-131.6	150	-0.1	111.6	F403 N404 M421 S423 A426 N427	F403-R429 WeakPolarHBondContact O-CA 3.01Å; N404-R429 HydrophobicContact CB-CG 3.72Å; M421-R429 HydrophobicContact SD-CB 4.09Å; M421-R429 HydrophobicContact SD-CG 4.29Å; S423-R429 PolarHBondContact O-NH1 3.29Å; A426-R429 WeakPolarHBondContact O-CB 3.41Å; A426-R429 VanDerWaalsContact O-CG 3.28Å; A426-R429 WeakPolarHBondContact O-CG 3.37Å; A426-R429 PolarHBondContact O-N 3.35Å; A426-R429 PolarHBondContact O-NE 3.1Å; N427-R429 VanDerWaalsContact C-N 3.3Å; N427-R429 PolarHBondContact O-N 3.34Å
430	R	89.3	Confident	83.8	Confident	94 Å²	94	60.3 Å²	60.3	36%	0.355	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	162.2	176.8	66.5	-167	-176.5	-81.1	4.4	111.1	F403 M421 G428 E432	F403-R430 HydrophobicContact CB-CG 3.98Å; F403-R430 HydrophobicContact CD2-CG 3.43Å; F403-R430 VanDerWaalsContact CD2-CG 3.43Å; F403-R430 HydrophobicContact CE2-CG 4.16Å; F403-R430 HydrophobicContact CG-CG 3.92Å; F403-R430 PolarHBondContact N-O 2.78Å; M421-R430 WeakPolarHBondContact CE-O 3.38Å; G428-R430 PolarHBondContact O-N 3.47Å; G428-R430 PolarHBondContact O-NH1 2.73Å; R430-E432 IonicContact NE-OE2 3.67Å
431	I	93.9	Very high	83.8	Confident	12 Å²	12	60.2 Å²	60.2	6%	0.062	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.6	169.8	-55.7	178.1	0	0	0	105.9	I338 A383 H387 Y390 L394 V400 F402 M421	I338-I431 HydrophobicContact CD1-CD1 3.97Å; A383-I431 HydrophobicContact CB-CD1 4.2Å; H387-I431 HydrophobicContact CB-CD1 3.97Å; Y390-I431 HydrophobicContact CD1-CB 3.69Å; Y390-I431 HydrophobicContact CD1-CD1 4.48Å; Y390-I431 HydrophobicContact CD1-CG2 3.83Å; Y390-I431 HydrophobicContact CE1-CB 3.78Å; Y390-I431 HydrophobicContact CE1-CG2 3.67Å; Y390-I431 VanDerWaalsContact CE1-O 3.28Å; Y390-I431 WeakPolarHBondContact CE1-O 3.42Å; L394-I431 HydrophobicContact CD1-CG2 4.3Å; V400-I431 HydrophobicContact CG1-CG2 3.27Å; F402-I431 HydrophobicContact CD1-CD1 4.47Å; F402-I431 HydrophobicContact CD1-CG1 4.08Å; F402-I431 HydrophobicContact CD1-CG2 4.26Å; F402-I431 HydrophobicContact CE1-CD1 4.33Å; F402-I431 HydrophobicContact CE1-CG1 4.35Å; F402-I431 HydrophobicContact CE1-CG2 4.08Å; M421-I431 HydrophobicContact CE-CG1 3.89Å; M421-I431 HydrophobicContact CG-CG1 4.44Å
432	E	92.2	Very high	83.7	Confident	85 Å²	85	66.4 Å²	66.4	40%	0.397	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	121.3	-177.3	-172.8	174.8	160.7	0	0	110.7	V400 A401 F403 R430 L434	V400-E432 CarbonylContact C-O 3.6Å; V400-E432 VanDerWaalsContact CA-O 3.31Å; V400-E432 WeakPolarHBondContact CA-O 3.24Å; A401-E432 HydrophobicContact CB-CB 4.44Å; A401-E432 PolarHBondContact N-O 3.4Å; A401-E432 PolarHBondContact O-N 3.49Å; F403-E432 HydrophobicContact CE2-CB 3.97Å; R430-E432 IonicContact NE-OE2 3.67Å; E432-L434 PolarHBondContact O-N 2.78Å
433	V	94.9	Very high	84	Confident	48 Å²	48	72.2 Å²	72.2	29%	0.291	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	122.5	171.7	178.3	0	0	0	0	109.2	L394 V400	L394-V433 HydrophobicContact CD2-CG2 3.53Å; V400-V433 HydrophobicContact CG2-CG2 4.26Å
434	L	92.6	Very high	84.7	Confident	17 Å²	17	71.5 Å²	71.5	9%	0.089	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-81.7	135.4	178.8	-62.9	-179.1	0	0	0	110.7	I320 Y399 A401 E432 L440 L441	I320-L434 HydrophobicContact CB-CD1 4.49Å; I320-L434 HydrophobicContact CD1-CD1 4.2Å; I320-L434 HydrophobicContact CG1-CD1 4.14Å; I320-L434 HydrophobicContact CG2-CD1 3.53Å; Y399-L434 PolarHBondContact O-N 3.19Å; A401-L434 HydrophobicContact CB-CD1 4.26Å; A401-L434 HydrophobicContact CB-CD2 3.92Å; A401-L434 HydrophobicContact CB-CG 4.13Å; E432-L434 PolarHBondContact O-N 2.78Å; L434-L440 HydrophobicContact CD1-CB 4.18Å; L434-L440 HydrophobicContact CD2-CD1 4.09Å; L434-L441 HydrophobicContact CB-CD1 4.49Å; L434-L441 HydrophobicContact CB-CD2 3.97Å; L434-L441 HydrophobicContact CB-CG 4.4Å; L434-L441 HydrophobicContact CD1-CD2 3.55Å; L434-L441 HydrophobicContact CD1-CG 4.4Å; L434-L441 HydrophobicContact CG-CD2 4.43Å
435	K	89.4	Confident	85.6	Confident	161 Å²	161	73.2 Å²	73.2	70%	0.7	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-69.8	149.5	173.3	-63.9	-179.2	-178	175.9	0	110.4	N437 S438 L441	K435-N437 WeakPolarHBondContact CB-OD1 3.45Å; K435-N437 PolarHBondContact O-N 3.16Å; K435-S438 VanDerWaalsContact O-CB 3.26Å; K435-S438 WeakPolarHBondContact O-CB 3.28Å; K435-S438 PolarHBondContact O-N 2.77Å; K435-L441 VanDerWaalsContact O-CD1 3.23Å; K435-L441 WeakPolarHBondContact O-CD1 3.28Å
436	S	85	Confident	86.3	Confident	82 Å²	82	74.4 Å²	74.4	57%	0.573	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.5	-177.6	54.3	0	0	0	0	114.6	R445	S436-R445 VanDerWaalsContact O-CZ 3.26Å; S436-R445 PolarHBondContact O-NH1 3.05Å; S436-R445 PolarHBondContact O-NH2 3.03Å
437	N	85.6	Confident	87.4	Confident	135 Å²	135	75.6 Å²	75.6	72%	0.722	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	10.3	177.6	68.4	-25.4	0	0	0	114.2	K435	K435-N437 WeakPolarHBondContact CB-OD1 3.45Å; K435-N437 PolarHBondContact O-N 3.16Å
438	S	87	Confident	88.2	Confident	26 Å²	26	71.1 Å²	71.1	18%	0.182	34%	0.344	C	S	.	.			trans	-70.1	131.5	177.8	-178	0	0	0	0	111.1	K435 L440 L441	K435-S438 VanDerWaalsContact O-CB 3.26Å; K435-S438 WeakPolarHBondContact O-CB 3.28Å; K435-S438 PolarHBondContact O-N 2.77Å; S438-L440 PolarHBondContact O-N 2.75Å; S438-L440 WeakPolarHBondContact OG-CB 3.34Å; S438-L440 PolarHBondContact OG-N 3.43Å; S438-L441 WeakPolarHBondContact O-CB 3.32Å; S438-L441 PolarHBondContact O-N 3.43Å
439	Y	86.2	Confident	88.6	Confident	167 Å²	167	74 Å²	74	66%	0.655	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.3	175.4	74.3	-86.5	0	0	0	112.2	L441 E442	Y439-L441 PolarHBondContact O-N 2.73Å; Y439-E442 WeakPolarHBondContact O-CG 3.29Å; Y439-E442 PolarHBondContact O-N 2.74Å; Y439-E442 VanDerWaalsContact O-N 3.14Å
440	L	86.1	Confident	88.4	Confident	39 Å²	39	76.6 Å²	76.6	20%	0.204	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-17.4	175.5	-66.1	177.5	0	0	0	113.4	F305 I320 L434 S438	F305-L440 HydrophobicContact CD2-CD2 3.92Å; F305-L440 HydrophobicContact CE2-CD1 3.7Å; F305-L440 HydrophobicContact CE2-CD2 3.68Å; F305-L440 HydrophobicContact CE2-CG 4.3Å; F305-L440 HydrophobicContact CZ-CD1 4.15Å; I320-L440 HydrophobicContact CD1-CB 3.69Å; I320-L440 HydrophobicContact CD1-CD1 4.49Å; I320-L440 HydrophobicContact CD1-CD2 4.32Å; I320-L440 HydrophobicContact CD1-CG 4.39Å; I320-L440 WeakPolarHBondContact CD1-O 3.31Å; L434-L440 HydrophobicContact CD1-CB 4.18Å; L434-L440 HydrophobicContact CD2-CD1 4.09Å; S438-L440 PolarHBondContact O-N 2.75Å; S438-L440 WeakPolarHBondContact OG-CB 3.34Å; S438-L440 PolarHBondContact OG-N 3.43Å
441	L	89.2	Confident	88.1	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-85.9	-12.7	-179.9	-61.3	-175.7	0	0	0	114.1	I320 Y399 L434 K435 S438 Y439 E443 I444 R445	I320-L441 HydrophobicContact CG2-CD2 4.39Å; Y399-L441 HydrophobicContact CD1-CD2 3.86Å; Y399-L441 HydrophobicContact CD2-CD1 4.32Å; Y399-L441 HydrophobicContact CD2-CD2 4.23Å; Y399-L441 HydrophobicContact CG-CD1 4.43Å; Y399-L441 HydrophobicContact CG-CD2 3.56Å; L434-L441 HydrophobicContact CB-CD1 4.49Å; L434-L441 HydrophobicContact CB-CD2 3.97Å; L434-L441 HydrophobicContact CB-CG 4.4Å; L434-L441 HydrophobicContact CD1-CD2 3.55Å; L434-L441 HydrophobicContact CD1-CG 4.4Å; L434-L441 HydrophobicContact CG-CD2 4.43Å; K435-L441 VanDerWaalsContact O-CD1 3.23Å; K435-L441 WeakPolarHBondContact O-CD1 3.28Å; S438-L441 WeakPolarHBondContact O-CB 3.32Å; S438-L441 PolarHBondContact O-N 3.43Å; Y439-L441 PolarHBondContact O-N 2.73Å; L441-E443 PolarHBondContact O-N 3.1Å; L441-I444 HydrophobicContact CD2-CG2 4.1Å; L441-I444 WeakPolarHBondContact O-CG2 3.43Å; L441-R445 HydrophobicContact CB-CG 4.31Å; L441-R445 VanDerWaalsContact O-CB 3.25Å; L441-R445 WeakPolarHBondContact O-CB 3.39Å; L441-R445 VanDerWaalsContact O-CG 3.26Å; L441-R445 WeakPolarHBondContact O-CG 3.07Å; L441-R445 PolarHBondContact O-N 3.13Å
442	E	87.1	Confident	87.6	Confident	130 Å²	130	76.3 Å²	76.3	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-59.3	-49.5	-171.8	-72	179.8	-173.5	0	0	112.1	Y439 Q446	Y439-E442 WeakPolarHBondContact O-CG 3.29Å; Y439-E442 PolarHBondContact O-N 2.74Å; Y439-E442 VanDerWaalsContact O-N 3.14Å; E442-Q446 WeakPolarHBondContact O-CG 3.19Å
443	E	85.5	Confident	86.8	Confident	133 Å²	133	74.6 Å²	74.6	62%	0.621	37%	0.365	S	S	*	.	H	α-helix	trans	-75.9	-42.3	-176.9	-60.5	-171	174	0	0	113.1	L441 Q446 R447	L441-E443 PolarHBondContact O-N 3.1Å; E443-Q446 PolarHBondContact O-N 3.36Å; E443-R447 PolarHBondContact O-N 2.91Å; E443-R447 IonicContact OE2-NH1 3.69Å
444	I	90.5	Very high	85.8	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-68.5	-37.4	-178	-173.6	174	0	0	0	111.8	I320 D342 Y399 L441 Q446 R447 V448	I320-I444 HydrophobicContact CB-CD1 4.19Å; I320-I444 HydrophobicContact CG2-CD1 3.77Å; I320-I444 HydrophobicContact CG2-CG2 4.13Å; I320-I444 WeakPolarHBondContact O-CD1 3.49Å; D342-I444 HydrophobicContact CB-CD1 4.29Å; Y399-I444 HydrophobicContact CD1-CD1 4.07Å; Y399-I444 HydrophobicContact CD1-CG1 4.49Å; Y399-I444 HydrophobicContact CD1-CG2 4.04Å; Y399-I444 HydrophobicContact CE1-CD1 4.23Å; Y399-I444 HydrophobicContact CE1-CG1 4.22Å; Y399-I444 HydrophobicContact CE1-CG2 4.07Å; L441-I444 HydrophobicContact CD2-CG2 4.1Å; L441-I444 WeakPolarHBondContact O-CG2 3.43Å; I444-Q446 VanDerWaalsContact C-N 3.3Å; I444-Q446 PolarHBondContact O-N 3.13Å; I444-R447 PolarHBondContact O-N 3.04Å; I444-R447 VanDerWaalsContact O-N 3.16Å; I444-V448 HydrophobicContact CD1-CG2 4.27Å; I444-V448 HydrophobicContact CG1-CG2 3.6Å; I444-V448 WeakPolarHBondContact O-CB 3.21Å; I444-V448 WeakPolarHBondContact O-CG2 3.23Å; I444-V448 PolarHBondContact O-N 2.71Å
445	R	89.6	Confident	84.4	Confident	65 Å²	65	78.7 Å²	78.7	25%	0.245	38%	0.382	C	S	.	.	H	α-helix	trans	-59.7	-44.1	176.8	-81.8	175.9	167.6	152.8	-1.9	111.2	Y399 S436 L441 R447 V448 Q449 D454	Y399-R445 HydrophobicContact CE1-CG 4.33Å; Y399-R445 HydrophobicContact CE2-CG 4.32Å; S436-R445 VanDerWaalsContact O-CZ 3.26Å; S436-R445 PolarHBondContact O-NH1 3.05Å; S436-R445 PolarHBondContact O-NH2 3.03Å; L441-R445 HydrophobicContact CB-CG 4.31Å; L441-R445 VanDerWaalsContact O-CB 3.25Å; L441-R445 WeakPolarHBondContact O-CB 3.39Å; L441-R445 VanDerWaalsContact O-CG 3.26Å; L441-R445 WeakPolarHBondContact O-CG 3.07Å; L441-R445 PolarHBondContact O-N 3.13Å; R445-R447 PolarHBondContact O-N 3.31Å; R445-V448 PolarHBondContact O-N 2.87Å; R445-Q449 WeakPolarHBondContact O-CB 2.8Å; R445-Q449 PolarHBondContact O-N 3.2Å; R445-D454 IonicContact NE-OD2 3.91Å
446	Q	87.6	Confident	82.5	Confident	158 Å²	158	75.8 Å²	75.8	74%	0.738	39%	0.388	S	S	*	.	H	α-helix	trans	-58.4	-38.3	178.1	-68.7	177.1	17.6	0	0	112.1	E442 E443 I444	E442-Q446 WeakPolarHBondContact O-CG 3.19Å; E443-Q446 PolarHBondContact O-N 3.36Å; I444-Q446 VanDerWaalsContact C-N 3.3Å; I444-Q446 PolarHBondContact O-N 3.13Å
447	R	90.4	Very high	80.2	Confident	73 Å²	73	84.3 Å²	84.3	28%	0.275	42%	0.419	S	S	.	.	H	α-helix	trans	-76.7	-42.6	178.4	-66.4	-172.4	-65.9	-94.6	3	113.3	L307 D342 E443 I444 R445 S450 Y451	L307-R447 VanDerWaalsContact CD2-CZ 3.5Å; D342-R447 PolarHBondContact O-NE 3.25Å; E443-R447 PolarHBondContact O-N 2.91Å; E443-R447 IonicContact OE2-NH1 3.69Å; I444-R447 PolarHBondContact O-N 3.04Å; I444-R447 VanDerWaalsContact O-N 3.16Å; R445-R447 PolarHBondContact O-N 3.31Å; R447-S450 PolarHBondContact O-OG 3.17Å; R447-Y451 WeakPolarHBondContact O-CD2 3.27Å; R447-Y451 WeakPolarHBondContact O-CE2 3.42Å
448	V	90.1	Very high	79.9	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-85.3	-34.2	-170.3	174.7	0	0	0	0	111.8	K322 T341 D342 I444 R445 S450 Y451 F452	K322-V448 HydrophobicContact CB-CG1 4.04Å; K322-V448 HydrophobicContact CD-CG1 3.51Å; K322-V448 HydrophobicContact CG-CG1 4.42Å; T341-V448 HydrophobicContact CG2-CG1 4.22Å; D342-V448 VanDerWaalsContact C-CG2 3.42Å; I444-V448 HydrophobicContact CD1-CG2 4.27Å; I444-V448 HydrophobicContact CG1-CG2 3.6Å; I444-V448 WeakPolarHBondContact O-CB 3.21Å; I444-V448 WeakPolarHBondContact O-CG2 3.23Å; I444-V448 PolarHBondContact O-N 2.71Å; R445-V448 PolarHBondContact O-N 2.87Å; V448-S450 PolarHBondContact O-N 2.6Å; V448-S450 VanDerWaalsContact O-N 3.17Å; V448-Y451 PolarHBondContact O-N 3.29Å; V448-F452 HydrophobicContact CG1-CB 3.82Å; V448-F452 HydrophobicContact CG1-CD2 4.22Å; V448-F452 HydrophobicContact CG1-CG 4.45Å; V448-F452 CarbonylContact O-C 3.57Å; V448-F452 PolarHBondContact O-N 2.73Å
449	Q	84	Confident	79.6	Confident	99 Å²	99	84.7 Å²	84.7	46%	0.463	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-24	-170	-170.3	159.4	18.1	0	0	113.8	R445 Y451	R445-Q449 WeakPolarHBondContact O-CB 2.8Å; R445-Q449 PolarHBondContact O-N 3.2Å; Q449-Y451 VanDerWaalsContact C-N 3.31Å
450	S	79.9	Confident	79.2	Confident	83 Å²	83	80.2 Å²	80.2	58%	0.58	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-26.6	172.9	50.7	0	0	0	0	113.8	R447 V448	R447-S450 PolarHBondContact O-OG 3.17Å; V448-S450 PolarHBondContact O-N 2.6Å; V448-S450 VanDerWaalsContact O-N 3.17Å
451	Y	83.6	Confident	78.8	Confident	98 Å²	98	82.6 Å²	82.6	38%	0.384	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-41.8	-174.5	-51.5	-67.2	0	0	0	111.9	L370 H374 L377 R447 V448 Q449	L370-Y451 VanDerWaalsContact CD2-O 3.27Å; L370-Y451 WeakPolarHBondContact CD2-O 3.28Å; H374-Y451 AromaticContact CD2-CD1 3.73Å; H374-Y451 PolarHBondContact CE1-O 2.92Å; H374-Y451 AromaticContact NE2-CD1 3.67Å; L377-Y451 HydrophobicContact CD1-CD1 4.1Å; L377-Y451 HydrophobicContact CD1-CD2 3.82Å; L377-Y451 HydrophobicContact CD1-CE1 4.43Å; L377-Y451 HydrophobicContact CD1-CE2 4.17Å; L377-Y451 HydrophobicContact CD1-CG 3.78Å; R447-Y451 WeakPolarHBondContact O-CD2 3.27Å; R447-Y451 WeakPolarHBondContact O-CE2 3.42Å; V448-Y451 PolarHBondContact O-N 3.29Å; Q449-Y451 VanDerWaalsContact C-N 3.31Å
452	F	83	Confident	78.1	Confident	1 Å²	1	87.8 Å²	87.8	0%	0.004	44%	0.44	C	S	.	.	S	Bend	trans	-125.7	83.9	178.7	-57.1	-93.3	0	0	0	108	K322 I324 T341 L370 H374 L378 V448	K322-F452 HydrophobicContact CD-CB 4.23Å; K322-F452 PolarHBondContact NZ-O 3.23Å; I324-F452 HydrophobicContact CD1-CD1 3.46Å; I324-F452 VanDerWaalsContact CD1-CD1 3.46Å; I324-F452 HydrophobicContact CD1-CE1 3.65Å; I324-F452 HydrophobicContact CD1-CG 4.06Å; I324-F452 HydrophobicContact CD1-CZ 4.4Å; I324-F452 HydrophobicContact CG1-CD1 4.48Å; I324-F452 HydrophobicContact CG1-CE1 4.21Å; T341-F452 HydrophobicContact CG2-CD2 3.67Å; T341-F452 HydrophobicContact CG2-CE2 3.69Å; T341-F452 HydrophobicContact CG2-CG 4.23Å; T341-F452 HydrophobicContact CG2-CZ 4.24Å; L370-F452 HydrophobicContact CB-CD1 3.96Å; L370-F452 HydrophobicContact CB-CE1 3.82Å; L370-F452 HydrophobicContact CD1-CD1 4.11Å; L370-F452 HydrophobicContact CD2-CD1 4.07Å; L370-F452 HydrophobicContact CD2-CE1 4.48Å; L370-F452 HydrophobicContact CG-CD1 4.28Å; H374-F452 HydrophobicContact CB-CE1 4.37Å; H374-F452 HydrophobicContact CB-CE2 3.84Å; H374-F452 HydrophobicContact CB-CZ 3.48Å; H374-F452 VanDerWaalsContact CB-CZ 3.48Å; L378-F452 HydrophobicContact CD2-CE1 4.13Å; L378-F452 HydrophobicContact CD2-CE2 4.38Å; L378-F452 HydrophobicContact CD2-CZ 3.57Å; L378-F452 HydrophobicContact CG-CZ 4.49Å; V448-F452 HydrophobicContact CG1-CB 3.82Å; V448-F452 HydrophobicContact CG1-CD2 4.22Å; V448-F452 HydrophobicContact CG1-CG 4.45Å; V448-F452 CarbonylContact O-C 3.57Å; V448-F452 PolarHBondContact O-N 2.73Å
453	P	76.4	Confident	77.5	Confident	50 Å²	50	84.9 Å²	84.9	33%	0.325	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-56.7	146.9	176.4	23.3	-34	0	0	0	110.8	K322	K322-P453 VanDerWaalsContact NZ-C 3.28Å; K322-P453 PolarHBondContact NZ-O 3.25Å
454	D	72.7	Confident	77	Confident	50 Å²	50	81.5 Å²	81.5	27%	0.267	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-61.2	140.3	168	-67.9	-11.9	0	0	0	107.9	K322 Y399 R445 A456	K322-D454 IonicContact NZ-OD1 2.74Å; K322-D454 PolarHBondContact NZ-OD1 3.06Å; Y399-D454 WeakPolarHBondContact CE2-OD1 3.16Å; Y399-D454 PolarHBondContact OH-OD1 3.02Å; R445-D454 IonicContact NE-OD2 3.91Å; D454-A456 PolarHBondContact O-N 2.67Å
455	E	64.5	Low	75.9	Confident	101 Å²	101	87.6 Å²	87.6	47%	0.472	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-61.1	133.8	169.4	-67.2	-163.6	142.1	0	0	107.5	F396 E457	F396-E455 HydrophobicContact CD1-CG 4.24Å; F396-E455 HydrophobicContact CE1-CG 3.83Å; F396-E455 WeakPolarHBondContact CE1-OE1 3.3Å; E455-E457 PolarHBondContact O-N 3.16Å
456	A	49.1	Very low	74.8	Confident	99 Å²	99	89.5 Å²	89.5	82%	0.818	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-60.6	121.2	164.5	0	0	0	0	0	106.1	D454	D454-A456 PolarHBondContact O-N 2.67Å
457	E	36.4	Very low	73.6	Confident	262 Å²	262	83.3 Å²	83.3	100%	1.224	44%	0.438	S	S	*	.			trans	-49.4	0	175.4	-77.6	-175	159.6	0	0	112.7	E455	E455-E457 PolarHBondContact O-N 3.16Å

Retrieved 457 of 457 residues in 494.4 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).