A0A3Q0KN34_SCHMA Loading...

Ras-associating domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KN34, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 331 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23.9	Very low	32.5	Very low	229 Å²	229	121.2 Å²	121.2	100%	1.128	64%	0.644	S	S	*	*				0	108.9	0	-174.2	167.6	124.3	0	0	106.9
2	I	26	Very low	33.5	Very low	139 Å²	139	117.9 Å²	117.9	71%	0.713	63%	0.627	S	S	*	*			trans	48.4	84	169.7	-44.1	176.4	0	0	0	116.5
3	I	27.1	Very low	34.7	Very low	137 Å²	137	116 Å²	116	70%	0.703	62%	0.617	S	S	*	*			trans	-104.8	0.3	156.5	-56.9	174.4	0	0	0	110.3	A5 L7	I3-A5 VanDerWaalsContact C-N 3.31Å; I3-A5 PolarHBondContact O-N 3.29Å; I3-L7 HydrophobicContact CG2-CD1 4.49Å
4	C	30.5	Very low	35.4	Very low	102 Å²	102	113.5 Å²	113.5	69%	0.689	60%	0.603	S	S	*	*	H	α-helix	trans	-69	-19.6	-175.1	-66.5	0	0	0	0	115.2	K8	C4-K8 VanDerWaalsContact O-CB 3.23Å; C4-K8 WeakPolarHBondContact O-CB 3.25Å; C4-K8 PolarHBondContact O-N 3.04Å
5	A	28.1	Very low	36	Very low	67 Å²	67	110.4 Å²	110.4	55%	0.554	59%	0.585	S	S	*	*	H	α-helix	trans	-77.4	-43.9	-174	0	0	0	0	0	112.9	I3 K8 H9	I3-A5 VanDerWaalsContact C-N 3.31Å; I3-A5 PolarHBondContact O-N 3.29Å; A5-K8 PolarHBondContact O-N 3.29Å; A5-H9 PolarHBondContact O-N 3.13Å; A5-H9 VanDerWaalsContact O-N 3.13Å
6	S	29.6	Very low	36.8	Very low	91 Å²	91	108.4 Å²	108.4	64%	0.636	58%	0.575	S	S	*	*	H	α-helix	trans	-68.9	-42.3	-179.3	-55.5	0	0	0	0	111.7	K8 H9 E10	S6-K8 VanDerWaalsContact C-N 3.3Å; S6-K8 PolarHBondContact O-N 3.46Å; S6-H9 PolarHBondContact O-N 3.1Å; S6-E10 WeakPolarHBondContact O-CB 3.44Å; S6-E10 PolarHBondContact O-N 3.25Å
7	L	32.9	Very low	37.6	Very low	91 Å²	91	109.9 Å²	109.9	48%	0.476	58%	0.578	S	S	.	*	H	α-helix	trans	-62	-36.6	174	-107.4	145.4	0	0	0	112.3	I3 M11	I3-L7 HydrophobicContact CG2-CD1 4.49Å; L7-M11 VanDerWaalsContact O-CB 3.29Å; L7-M11 WeakPolarHBondContact O-CB 3.31Å; L7-M11 PolarHBondContact O-N 3.04Å
8	K	38.7	Very low	38	Very low	153 Å²	153	107.7 Å²	107.7	67%	0.665	56%	0.561	S	S	*	*	H	α-helix	trans	-66	-40.5	176.1	-170.2	178.1	-175.2	-179.3	0	111.8	C4 A5 S6 N12	C4-K8 VanDerWaalsContact O-CB 3.23Å; C4-K8 WeakPolarHBondContact O-CB 3.25Å; C4-K8 PolarHBondContact O-N 3.04Å; A5-K8 PolarHBondContact O-N 3.29Å; S6-K8 VanDerWaalsContact C-N 3.3Å; S6-K8 PolarHBondContact O-N 3.46Å; K8-N12 WeakPolarHBondContact O-CB 3.34Å; K8-N12 PolarHBondContact O-N 2.89Å
9	H	38	Very low	38.1	Very low	127 Å²	127	109 Å²	109	59%	0.588	56%	0.558	S	S	*	*	H	α-helix	trans	-71.4	-39.4	179.8	-167	34.7	0	0	0	112	A5 S6 N12 N13	A5-H9 PolarHBondContact O-N 3.13Å; A5-H9 VanDerWaalsContact O-N 3.13Å; S6-H9 PolarHBondContact O-N 3.1Å; H9-N12 PolarHBondContact O-N 2.96Å; H9-N13 WeakPolarHBondContact O-CB 3.27Å; H9-N13 PolarHBondContact O-N 3.33Å
10	E	40.7	Very low	38.3	Very low	141 Å²	141	109.9 Å²	109.9	66%	0.659	56%	0.564	S	S	*	*	H	α-helix	trans	-69.9	-44.7	179.2	-149.7	167.5	-155.5	0	0	111.4	S6 N12 N13 L14	S6-E10 WeakPolarHBondContact O-CB 3.44Å; S6-E10 PolarHBondContact O-N 3.25Å; E10-N12 VanDerWaalsContact C-N 3.34Å; E10-N12 PolarHBondContact O-N 3.09Å; E10-N13 PolarHBondContact O-N 3.01Å; E10-L14 WeakPolarHBondContact O-CB 3.47Å; E10-L14 PolarHBondContact O-N 2.92Å
11	M	41.5	Very low	38.7	Very low	56 Å²	56	111.1 Å²	111.1	28%	0.276	57%	0.567	S	S	.	*	H	α-helix	trans	-59.7	-42.1	170.8	-97.2	178.3	63	0	0	112.1	L7 L14 M15 L142 L255	L7-M11 VanDerWaalsContact O-CB 3.29Å; L7-M11 WeakPolarHBondContact O-CB 3.31Å; L7-M11 PolarHBondContact O-N 3.04Å; M11-L14 PolarHBondContact O-N 3.25Å; M11-M15 WeakPolarHBondContact O-CB 3.46Å; M11-M15 WeakPolarHBondContact O-CG 3.08Å; M11-M15 PolarHBondContact O-N 3.08Å; M11-L142 HydrophobicContact CE-CD1 4.17Å; M11-L255 HydrophobicContact CE-CD2 4.18Å
12	N	45.4	Very low	39.3	Very low	82 Å²	82	102.3 Å²	102.3	44%	0.439	52%	0.522	S	S	.	.	H	α-helix	trans	-73.4	-31.6	-175.5	-152.1	-4.4	0	0	0	112	K8 H9 E10 N16	K8-N12 WeakPolarHBondContact O-CB 3.34Å; K8-N12 PolarHBondContact O-N 2.89Å; H9-N12 PolarHBondContact O-N 2.96Å; E10-N12 VanDerWaalsContact C-N 3.34Å; E10-N12 PolarHBondContact O-N 3.09Å; N12-N16 WeakPolarHBondContact O-CB 3.36Å; N12-N16 PolarHBondContact O-N 3.13Å; N12-N16 PolarHBondContact O-ND2 2.96Å; N12-N16 PolarHBondContact OD1-ND2 3.38Å
13	N	48.7	Very low	40	Very low	93 Å²	93	102.2 Å²	102.2	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-69.4	-44.4	169.9	-87.8	-20.2	0	0	0	111.7	H9 E10 N16 Q17	H9-N13 WeakPolarHBondContact O-CB 3.27Å; H9-N13 PolarHBondContact O-N 3.33Å; E10-N13 PolarHBondContact O-N 3.01Å; N13-N16 PolarHBondContact O-N 2.99Å; N13-Q17 WeakPolarHBondContact O-CB 3.33Å; N13-Q17 PolarHBondContact O-N 3.1Å
14	L	45	Very low	40.6	Very low	81 Å²	81	98.9 Å²	98.9	42%	0.424	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-45.4	178.2	-148.9	80.8	0	0	0	111	E10 M11 N16 Q17 Y18 I242	E10-L14 WeakPolarHBondContact O-CB 3.47Å; E10-L14 PolarHBondContact O-N 2.92Å; M11-L14 PolarHBondContact O-N 3.25Å; L14-N16 PolarHBondContact O-N 3.33Å; L14-Q17 PolarHBondContact O-N 3.24Å; L14-Y18 HydrophobicContact CG-CE2 4.37Å; L14-Y18 VanDerWaalsContact O-CD2 3.25Å; L14-Y18 WeakPolarHBondContact O-CD2 3.45Å; L14-Y18 PolarHBondContact O-N 3.48Å; L14-I242 HydrophobicContact CD2-CD1 4.01Å; L14-I242 HydrophobicContact CG-CD1 4.34Å
15	M	44.2	Very low	41	Very low	67 Å²	67	101.2 Å²	101.2	33%	0.33	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-39.5	177.5	-76.1	-90.3	-66.9	0	0	112.8	M11 R19 L255 Q256	M11-M15 WeakPolarHBondContact O-CB 3.46Å; M11-M15 WeakPolarHBondContact O-CG 3.08Å; M11-M15 PolarHBondContact O-N 3.08Å; M15-R19 WeakPolarHBondContact O-CA 3.24Å; M15-R19 VanDerWaalsContact O-CB 3.31Å; M15-R19 WeakPolarHBondContact O-CB 3.44Å; M15-R19 PolarHBondContact O-N 3.06Å; M15-L255 WeakPolarHBondContact CE-O 3.46Å; M15-Q256 VanDerWaalsContact CE-CA 3.48Å; M15-Q256 HydrophobicContact CE-CB 4.44Å; M15-Q256 HydrophobicContact CE-CG 4.37Å
16	N	48.6	Very low	41.4	Very low	78 Å²	78	100.2 Å²	100.2	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-70.9	-31.4	176.5	-81.6	-44.6	0	0	0	112.7	N12 N13 L14	N12-N16 WeakPolarHBondContact O-CB 3.36Å; N12-N16 PolarHBondContact O-N 3.13Å; N12-N16 PolarHBondContact O-ND2 2.96Å; N12-N16 PolarHBondContact OD1-ND2 3.38Å; N13-N16 PolarHBondContact O-N 2.99Å; L14-N16 PolarHBondContact O-N 3.33Å
17	Q	50.5	Low	41.8	Very low	134 Å²	134	101.9 Å²	101.9	63%	0.626	48%	0.484	S	S	*	.	H	α-helix	trans	-65.5	-38.1	177.3	-175.6	173.1	-21.3	0	0	112.2	N13 L14	N13-Q17 WeakPolarHBondContact O-CB 3.33Å; N13-Q17 PolarHBondContact O-N 3.1Å; L14-Q17 PolarHBondContact O-N 3.24Å
18	Y	43.8	Very low	42.1	Very low	70 Å²	70	102 Å²	102	28%	0.275	49%	0.485	S	S	.	.	H	α-helix	trans	-101.2	-2.3	-178.3	-63	-74.8	0	0	0	114.4	L14 N20 Q21 F22 I242	L14-Y18 HydrophobicContact CG-CE2 4.37Å; L14-Y18 VanDerWaalsContact O-CD2 3.25Å; L14-Y18 WeakPolarHBondContact O-CD2 3.45Å; L14-Y18 PolarHBondContact O-N 3.48Å; Y18-N20 PolarHBondContact O-N 3.03Å; Y18-N20 VanDerWaalsContact O-N 3.11Å; Y18-Q21 PolarHBondContact O-N 3.35Å; Y18-Q21 VanDerWaalsContact O-N 3.12Å; Y18-F22 PolarHBondContact O-N 3.15Å; Y18-I242 HydrophobicContact CD2-CD1 3.53Å; Y18-I242 HydrophobicContact CE2-CD1 3.77Å; Y18-I242 HydrophobicContact CG-CD1 4.18Å
19	R	41.6	Very low	42.2	Very low	133 Å²	133	98.2 Å²	98.2	50%	0.502	47%	0.471	S	S	.	.	H	α-helix	trans	-51.8	-39.4	-178	-165.1	174.5	-177.1	166.9	2.8	113.1	M15 K23	M15-R19 WeakPolarHBondContact O-CA 3.24Å; M15-R19 VanDerWaalsContact O-CB 3.31Å; M15-R19 WeakPolarHBondContact O-CB 3.44Å; M15-R19 PolarHBondContact O-N 3.06Å; R19-K23 VanDerWaalsContact O-CB 3.22Å; R19-K23 WeakPolarHBondContact O-CB 3.5Å; R19-K23 PolarHBondContact O-N 3.04Å; R19-K23 VanDerWaalsContact O-N 3.13Å
20	N	40.7	Very low	42	Very low	126 Å²	126	97.5 Å²	97.5	67%	0.674	46%	0.464	S	S	*	.	H	α-helix	trans	-77.5	-36.2	-176.7	-67	-26.1	0	0	0	112.7	Y18 S24	Y18-N20 PolarHBondContact O-N 3.03Å; Y18-N20 VanDerWaalsContact O-N 3.11Å; N20-S24 PolarHBondContact O-N 2.71Å
21	Q	47.4	Very low	42	Very low	137 Å²	137	93.3 Å²	93.3	64%	0.64	45%	0.45	S	S	*	.	H	α-helix	trans	-68.7	-45.5	176.9	-74.3	-175.2	-12.8	0	0	111	Y18 K23 S24 Y25	Y18-Q21 PolarHBondContact O-N 3.35Å; Y18-Q21 VanDerWaalsContact O-N 3.12Å; Q21-K23 PolarHBondContact O-N 3.48Å; Q21-S24 PolarHBondContact O-N 3.49Å; Q21-Y25 PolarHBondContact O-N 3.07Å; Q21-Y25 VanDerWaalsContact O-N 3.09Å
22	F	36	Very low	41.8	Very low	43 Å²	43	96.4 Å²	96.4	19%	0.189	47%	0.468	C	S	.	.	H	α-helix	trans	-65	-36.7	176.8	-105.9	-88.7	0	0	0	113.2	Y18 S24 Y25 L26 E246 A252	Y18-F22 PolarHBondContact O-N 3.15Å; F22-S24 VanDerWaalsContact C-N 3.34Å; F22-Y25 PolarHBondContact O-N 3.3Å; F22-L26 PolarHBondContact O-N 3.46Å; F22-E246 HydrophobicContact CE2-CG 4.44Å; F22-E246 HydrophobicContact CZ-CG 4.04Å; F22-A252 HydrophobicContact CE1-CB 4.26Å
23	K	40.7	Very low	41.5	Very low	137 Å²	137	97.2 Å²	97.2	60%	0.596	48%	0.476	S	S	*	.	H	α-helix	trans	-66.6	-37.3	178.2	-156.2	-178.8	-170.5	-167.4	0	111.9	R19 Q21 Q27	R19-K23 VanDerWaalsContact O-CB 3.22Å; R19-K23 WeakPolarHBondContact O-CB 3.5Å; R19-K23 PolarHBondContact O-N 3.04Å; R19-K23 VanDerWaalsContact O-N 3.13Å; Q21-K23 PolarHBondContact O-N 3.48Å; K23-Q27 WeakPolarHBondContact O-CB 3.45Å; K23-Q27 PolarHBondContact O-N 3.1Å; K23-Q27 VanDerWaalsContact O-N 3.12Å
24	S	40.7	Very low	40.8	Very low	68 Å²	68	98.8 Å²	98.8	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-66.4	-39.6	173.6	-168.5	0	0	0	0	112	N20 Q21 F22 Q27 N28	N20-S24 PolarHBondContact O-N 2.71Å; Q21-S24 PolarHBondContact O-N 3.49Å; F22-S24 VanDerWaalsContact C-N 3.34Å; S24-Q27 PolarHBondContact O-N 3.11Å; S24-N28 PolarHBondContact O-N 3.43Å; S24-N28 VanDerWaalsContact O-N 3.15Å
25	Y	37.4	Very low	40.4	Very low	151 Å²	151	102.2 Å²	102.2	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-69.4	-44.4	-178.5	-155.4	-99	0	0	0	112.3	Q21 F22 Q27 N28 I29	Q21-Y25 PolarHBondContact O-N 3.07Å; Q21-Y25 VanDerWaalsContact O-N 3.09Å; F22-Y25 PolarHBondContact O-N 3.3Å; Y25-Q27 VanDerWaalsContact C-N 3.32Å; Y25-Q27 PolarHBondContact O-N 2.84Å; Y25-N28 PolarHBondContact O-N 3.06Å; Y25-I29 HydrophobicContact CD1-CD1 3.77Å; Y25-I29 HydrophobicContact CE1-CD1 3.83Å; Y25-I29 WeakPolarHBondContact O-CG1 3.39Å; Y25-I29 PolarHBondContact O-N 3.37Å
26	L	36.4	Very low	39.9	Very low	45 Å²	45	106.4 Å²	106.4	24%	0.236	52%	0.521	C	S	.	.	H	α-helix	trans	-62.1	-40.4	173.2	-76.7	168.5	0	0	0	111.5	F22 N28 I29 Y30	F22-L26 PolarHBondContact O-N 3.46Å; L26-N28 VanDerWaalsContact C-N 3.27Å; L26-N28 PolarHBondContact O-N 3.27Å; L26-I29 PolarHBondContact O-N 3.03Å; L26-Y30 HydrophobicContact CD2-CE2 4.49Å; L26-Y30 VanDerWaalsContact O-CD2 3.24Å; L26-Y30 WeakPolarHBondContact O-CD2 3.49Å; L26-Y30 PolarHBondContact O-N 3.41Å
27	Q	38.8	Very low	39.1	Very low	127 Å²	127	107.4 Å²	107.4	59%	0.593	53%	0.53	S	S	*	.	H	α-helix	trans	-64	-32.1	179.1	-170	152.6	7.8	0	0	112.9	K23 S24 Y25 S31	K23-Q27 WeakPolarHBondContact O-CB 3.45Å; K23-Q27 PolarHBondContact O-N 3.1Å; K23-Q27 VanDerWaalsContact O-N 3.12Å; S24-Q27 PolarHBondContact O-N 3.11Å; Y25-Q27 VanDerWaalsContact C-N 3.32Å; Y25-Q27 PolarHBondContact O-N 2.84Å; Q27-S31 WeakPolarHBondContact O-CB 3.39Å; Q27-S31 PolarHBondContact O-N 3.14Å; Q27-S31 VanDerWaalsContact O-N 3.11Å; Q27-S31 PolarHBondContact O-OG 3.12Å
28	N	39.4	Very low	38.2	Very low	94 Å²	94	110.5 Å²	110.5	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-70.3	-44.1	173.9	-74.3	-9.1	0	0	0	112.1	S24 Y25 L26 Y30 S31 D32	S24-N28 PolarHBondContact O-N 3.43Å; S24-N28 VanDerWaalsContact O-N 3.15Å; Y25-N28 PolarHBondContact O-N 3.06Å; L26-N28 VanDerWaalsContact C-N 3.27Å; L26-N28 PolarHBondContact O-N 3.27Å; N28-Y30 VanDerWaalsContact C-N 3.27Å; N28-Y30 PolarHBondContact O-N 3.19Å; N28-S31 PolarHBondContact O-N 2.93Å; N28-D32 PolarHBondContact O-N 2.99Å; N28-D32 VanDerWaalsContact O-N 3.1Å
29	I	40.1	Very low	37.7	Very low	72 Å²	72	113.7 Å²	113.7	37%	0.369	56%	0.562	S	S	.	*	H	α-helix	trans	-61.1	-37.1	177.5	-63.2	167.9	0	0	0	111.7	Y25 L26 T33	Y25-I29 HydrophobicContact CD1-CD1 3.77Å; Y25-I29 HydrophobicContact CE1-CD1 3.83Å; Y25-I29 WeakPolarHBondContact O-CG1 3.39Å; Y25-I29 PolarHBondContact O-N 3.37Å; L26-I29 PolarHBondContact O-N 3.03Å; I29-T33 PolarHBondContact O-N 3.07Å; I29-T33 PolarHBondContact O-OG1 2.96Å
30	Y	34	Very low	37.3	Very low	113 Å²	113	112 Å²	112	44%	0.443	57%	0.57	S	S	.	*	H	α-helix	trans	-77.2	-21.6	176.7	-82.4	-75.7	0	0	0	113.9	L26 N28 T33	L26-Y30 HydrophobicContact CD2-CE2 4.49Å; L26-Y30 VanDerWaalsContact O-CD2 3.24Å; L26-Y30 WeakPolarHBondContact O-CD2 3.49Å; L26-Y30 PolarHBondContact O-N 3.41Å; N28-Y30 VanDerWaalsContact C-N 3.27Å; N28-Y30 PolarHBondContact O-N 3.19Å; Y30-T33 WeakPolarHBondContact CA-OG1 3.35Å; Y30-T33 PolarHBondContact O-OG1 3.23Å
31	S	41.1	Very low	37.1	Very low	52 Å²	52	114.7 Å²	114.7	36%	0.364	58%	0.579	S	S	.	*	H	α-helix	trans	-79.3	-34.9	176.1	-57.2	0	0	0	0	111.2	Q27 N28 H35	Q27-S31 WeakPolarHBondContact O-CB 3.39Å; Q27-S31 PolarHBondContact O-N 3.14Å; Q27-S31 VanDerWaalsContact O-N 3.11Å; Q27-S31 PolarHBondContact O-OG 3.12Å; N28-S31 PolarHBondContact O-N 2.93Å; S31-H35 PolarHBondContact O-CD2 2.66Å
32	D	36.4	Very low	36.6	Very low	122 Å²	122	114.8 Å²	114.8	65%	0.652	58%	0.584	S	S	*	*	H	α-helix	trans	-73.6	-27	178.2	-69.1	-20.2	0	0	0	112.9	N28	N28-D32 PolarHBondContact O-N 2.99Å; N28-D32 VanDerWaalsContact O-N 3.1Å
33	T	39.6	Very low	36.9	Very low	98 Å²	98	120.4 Å²	120.4	60%	0.601	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-12.4	177.8	36.6	0	0	0	0	114.5	I29 Y30	I29-T33 PolarHBondContact O-N 3.07Å; I29-T33 PolarHBondContact O-OG1 2.96Å; Y30-T33 WeakPolarHBondContact CA-OG1 3.35Å; Y30-T33 PolarHBondContact O-OG1 3.23Å
34	L	35.4	Very low	36.7	Very low	127 Å²	127	120.9 Å²	120.9	67%	0.665	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-10.4	179.4	-97.7	164.2	0	0	0	114.1
35	H	36.3	Very low	36.8	Very low	152 Å²	152	127 Å²	127	70%	0.704	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-6.9	-179.4	-80.3	-48.2	0	0	0	115.3	S31	S31-H35 PolarHBondContact O-CD2 2.66Å
36	D	32.5	Very low	36.7	Very low	156 Å²	156	126.7 Å²	126.7	83%	0.834	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	9.4	-179.5	-93.3	-15.2	0	0	0	115.4
37	T	31.8	Very low	37	Very low	98 Å²	98	132.3 Å²	132.3	60%	0.601	69%	0.685	S	S	*	*			trans	-108.8	65.8	166.7	29.8	0	0	0	0	111	I39	T37-I39 PolarHBondContact O-N 3.15Å
38	K	31.7	Very low	37.1	Very low	200 Å²	200	130.3 Å²	130.3	87%	0.87	69%	0.685	S	S	*	*			trans	-70.5	88.3	148.1	-78.3	-168.9	-179.6	-178.4	0	107.4	S40	K38-S40 PolarHBondContact O-N 3.34Å; K38-S40 VanDerWaalsContact O-N 3.09Å
39	I	33.6	Very low	36.9	Very low	136 Å²	136	132.7 Å²	132.7	70%	0.697	70%	0.698	S	S	*	*			trans	-61.5	108.7	156.4	-71.9	160.7	0	0	0	105.1	T37 E41	T37-I39 PolarHBondContact O-N 3.15Å; I39-E41 HydrophobicContact CG2-CG 4.46Å; I39-E41 PolarHBondContact O-N 3.27Å
40	S	34.7	Very low	37.2	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	73%	0.725	S	S	*	*			trans	-63.1	103.7	163.9	54.3	0	0	0	0	106.9	K38 D42	K38-S40 PolarHBondContact O-N 3.34Å; K38-S40 VanDerWaalsContact O-N 3.09Å; S40-D42 PolarHBondContact O-N 3.41Å
41	E	35	Very low	37.4	Very low	184 Å²	184	135 Å²	135	86%	0.86	74%	0.735	S	S	*	*			trans	-71.8	77.6	162.5	-68.9	179.4	174.2	0	0	107.7	I39	I39-E41 HydrophobicContact CG2-CG 4.46Å; I39-E41 PolarHBondContact O-N 3.27Å
42	D	36.7	Very low	37.6	Very low	139 Å²	139	139.5 Å²	139.5	74%	0.743	76%	0.755	S	S	*	*			trans	-132.1	95.8	166.2	-98.1	-27.6	0	0	0	106.6	S40	S40-D42 PolarHBondContact O-N 3.41Å
43	D	42	Very low	38.1	Very low	161 Å²	161	140.4 Å²	140.4	86%	0.861	76%	0.76	S	S	*	*			trans	-179.1	85.5	137.4	-87.8	-22	0	0	0	110.2
44	N	36.8	Very low	38.4	Very low	147 Å²	147	142.2 Å²	142.2	79%	0.786	77%	0.766	S	S	*	*				52.8	95.4	118.5	-147.1	16.6	0	0	0	119.3
45	E	42.9	Very low	38.9	Very low	196 Å²	196	144.5 Å²	144.5	92%	0.916	77%	0.773	S	S	*	*			trans	-135.4	94.6	143.1	-76.1	-162.8	178.4	0	0	110.4	N47	E45-N47 PolarHBondContact O-N 3.09Å
46	D	35.6	Very low	39	Very low	144 Å²	144	143.9 Å²	143.9	77%	0.77	78%	0.775	S	S	*	*			trans	13.9	102.5	132.8	-142.1	3.3	0	0	0	116.2
47	N	43.8	Very low	39.5	Very low	164 Å²	164	143.9 Å²	143.9	88%	0.877	78%	0.775	S	S	*	*			trans	-146.1	119	146.5	-114.3	-17.2	0	0	0	110.6	E45	E45-N47 PolarHBondContact O-N 3.09Å
48	S	39.6	Very low	39.5	Very low	84 Å²	84	142.2 Å²	142.2	59%	0.587	78%	0.777	S	S	*	*			trans	-67.8	158.5	-178.7	51.1	0	0	0	0	114.2
49	D	35.1	Very low	40	Very low	145 Å²	145	141 Å²	141	78%	0.775	78%	0.779	S	S	*	*			trans	73.7	99.4	152.2	-60.4	-19.6	0	0	0	118.3
50	T	46.2	Very low	39.9	Very low	154 Å²	154	142.7 Å²	142.7	95%	0.945	79%	0.789	S	S	*	*				-166.7	145.1	106.4	12.5	0	0	0	0	111.7
51	A	39.6	Very low	40	Very low	78 Å²	78	142.6 Å²	142.6	65%	0.645	79%	0.794	S	S	*	*			trans	-90.2	170.9	-167.2	0	0	0	0	0	113.5
52	D	43.8	Very low	40	Very low	148 Å²	148	142.7 Å²	142.7	79%	0.791	80%	0.795	S	S	*	*			trans	98.9	135.1	147.9	-56.3	-29.5	0	0	0	120
53	D	47.7	Very low	39.7	Very low	140 Å²	140	145.9 Å²	145.9	75%	0.749	80%	0.802	S	S	*	*			trans	98.2	84.4	156.9	-59.8	-12.1	0	0	0	119.8
54	D	45.4	Very low	39.2	Very low	137 Å²	137	143.2 Å²	143.2	73%	0.733	80%	0.802	S	S	*	*				58.7	127.8	107.8	-66.4	-16.5	0	0	0	123.1
55	E	46.3	Very low	39	Very low	175 Å²	175	141.7 Å²	141.7	82%	0.818	80%	0.803	S	S	*	*			trans	68	111.2	140.3	-61.3	-165.7	-175.9	0	0	119.8
56	D	37.9	Very low	38.9	Very low	138 Å²	138	137.5 Å²	137.5	74%	0.738	79%	0.793	S	S	*	*				79.2	108.6	92.4	-159.4	21.5	0	0	0	113.4
57	D	43.1	Very low	38.9	Very low	156 Å²	156	138.1 Å²	138.1	83%	0.834	80%	0.796	S	S	*	*				-176.9	120.5	128.8	-102.6	-27.5	0	0	0	110.8
58	G	31.9	Very low	38.4	Very low	63 Å²	63	136.5 Å²	136.5	65%	0.649	79%	0.787	S	S	*	*			trans	-82	148	172.6	0	0	0	0	0	113.1
59	I	43	Very low	38.2	Very low	175 Å²	175	140.5 Å²	140.5	90%	0.897	80%	0.802	S	S	*	*			trans	-149.9	118.1	149.7	34.1	171.5	0	0	0	110.6
60	N	31.4	Very low	38	Very low	172 Å²	172	139.6 Å²	139.6	92%	0.92	80%	0.802	S	S	*	*			trans	-80.5	129.6	161	-84.3	-40.3	0	0	0	109.7
61	A	36.4	Very low	37.6	Very low	95 Å²	95	139.7 Å²	139.7	79%	0.785	80%	0.796	S	S	*	*			trans	171.1	139.5	151.4	0	0	0	0	0	106.7
62	E	34.4	Very low	37	Very low	186 Å²	186	143 Å²	143	87%	0.869	80%	0.803	S	S	*	*			cis	-163	151.6	9.4	-145.4	176.2	160.2	0	0	107.5
63	K	31.7	Very low	36.6	Very low	206 Å²	206	141.8 Å²	141.8	90%	0.896	80%	0.801	S	S	*	*			trans	-48.1	132.7	171.9	-145.4	179.7	-174.2	-175.2	0	113.7
64	A	30.1	Very low	35.7	Very low	104 Å²	104	142.4 Å²	142.4	86%	0.86	80%	0.803	S	S	*	*			trans	-157.5	115.4	144.5	0	0	0	0	0	110.1
65	S	32.8	Very low	34.9	Very low	115 Å²	115	141.3 Å²	141.3	80%	0.804	81%	0.806	S	S	*	*			trans	-100.8	171	166.8	98.1	0	0	0	0	109.3
66	P	41.7	Very low	34.3	Very low	109 Å²	109	140.2 Å²	140.2	71%	0.708	81%	0.805	S	S	*	*			trans	-101.2	156	-138	38.8	-36.4	0	0	0	114.1
67	D	35.4	Very low	34	Very low	157 Å²	157	139.9 Å²	139.9	84%	0.84	81%	0.808	S	S	*	*			trans	-133.6	130.3	166.8	-78.8	-29.2	0	0	0	112
68	D	32.6	Very low	33.6	Very low	129 Å²	129	141.2 Å²	141.2	69%	0.69	81%	0.809	S	S	*	*			trans	48.5	102.4	144.8	-74.9	-22.3	0	0	0	121.3
69	N	36.2	Very low	33.6	Very low	168 Å²	168	143.4 Å²	143.4	90%	0.898	81%	0.813	S	S	*	*				-138.1	90.2	129	-89.3	-34	0	0	0	109.4	L71	N69-L71 PolarHBondContact O-N 3.31Å
70	T	31.1	Very low	33.2	Very low	126 Å²	126	138.7 Å²	138.7	77%	0.773	79%	0.79	S	S	*	*			trans	-50.1	109.1	155.9	34.3	0	0	0	0	111
71	L	37	Very low	33.6	Very low	156 Å²	156	134.7 Å²	134.7	82%	0.817	77%	0.773	S	S	*	*			trans	-144.7	117.8	153.2	-132.8	127.5	0	0	0	109.5	N69 T73	N69-L71 PolarHBondContact O-N 3.31Å; L71-T73 PolarHBondContact O-N 3.32Å; L71-T73 VanDerWaalsContact O-N 3.1Å; L71-T73 PolarHBondContact O-OG1 3.43Å
72	D	27.5	Very low	33.7	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	77%	0.77	S	S	*	*			trans	-45.3	107	-176.3	-63.8	-55.9	0	0	0	113.3
73	T	35.9	Very low	34.1	Very low	124 Å²	124	135.8 Å²	135.8	76%	0.761	76%	0.76	S	S	*	*			trans	-120.6	47.3	163.1	17.2	0	0	0	0	109.1	L71 S75	L71-T73 PolarHBondContact O-N 3.32Å; L71-T73 VanDerWaalsContact O-N 3.1Å; L71-T73 PolarHBondContact O-OG1 3.43Å; T73-S75 PolarHBondContact O-N 3.44Å
74	L	27.1	Very low	34.3	Very low	152 Å²	152	131.5 Å²	131.5	80%	0.796	75%	0.746	S	S	*	*			trans	-85.4	92.8	167.8	-79.6	163.3	0	0	0	108.5
75	S	29.9	Very low	34.5	Very low	114 Å²	114	134.9 Å²	134.9	80%	0.797	74%	0.744	S	S	*	*			trans	159.6	50.3	145.1	-67.8	0	0	0	0	111.3	T73 T77	T73-S75 PolarHBondContact O-N 3.44Å; S75-T77 PolarHBondContact O-N 3.01Å
76	I	33.3	Very low	34.6	Very low	153 Å²	153	137.2 Å²	137.2	79%	0.785	74%	0.742	S	S	*	*			trans	-83.9	99.1	156.9	-65.6	173.7	0	0	0	105.1	Q78	I76-Q78 PolarHBondContact O-N 3.2Å
77	T	32.3	Very low	33.9	Very low	131 Å²	131	138.7 Å²	138.7	80%	0.804	74%	0.738	S	S	*	*			trans	-52.4	111.5	166.8	29.1	0	0	0	0	108	S75 C79	S75-T77 PolarHBondContact O-N 3.01Å; T77-C79 PolarHBondContact O-N 3.25Å
78	Q	33.7	Very low	33.4	Very low	183 Å²	183	138.5 Å²	138.5	86%	0.855	74%	0.737	S	S	*	*			trans	-46.3	102.5	174.6	-171	171.6	3.4	0	0	109.4	I76 D80	I76-Q78 PolarHBondContact O-N 3.2Å; Q78-D80 PolarHBondContact O-N 3.44Å
79	C	32.3	Very low	33	Very low	110 Å²	110	142.7 Å²	142.7	74%	0.743	75%	0.745	S	S	*	*			trans	-68.9	116.9	172.2	-145.5	0	0	0	0	106.5	T77 P81	T77-C79 PolarHBondContact O-N 3.25Å; C79-P81 VanDerWaalsContact O-CD 3.25Å; C79-P81 WeakPolarHBondContact O-CD 3.41Å
80	D	34	Very low	32.5	Very low	76 Å²	76	143.5 Å²	143.5	41%	0.406	74%	0.74	S	S	.	*			trans	-70.9	110.4	-174.9	-171	0.2	0	0	0	109.8	Q78 E82 K83	Q78-D80 PolarHBondContact O-N 3.44Å; D80-E82 PolarHBondContact O-N 3.43Å; D80-E82 VanDerWaalsContact O-N 3.13Å; D80-E82 PolarHBondContact OD1-N 3.09Å; D80-K83 PolarHBondContact O-N 2.95Å
81	P	39.8	Very low	32.4	Very low	88 Å²	88	144.6 Å²	144.6	57%	0.571	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-61.4	-22.3	-176	25	-33.3	0	0	0	112.6	C79 K83 L84	C79-P81 VanDerWaalsContact O-CD 3.25Å; C79-P81 WeakPolarHBondContact O-CD 3.41Å; P81-K83 PolarHBondContact O-N 3.29Å; P81-L84 PolarHBondContact O-N 3.24Å; P81-L84 VanDerWaalsContact O-N 3.1Å
82	E	38.1	Very low	31.9	Very low	152 Å²	152	142.2 Å²	142.2	71%	0.71	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-67.6	-18.3	176.6	-65.5	-172.4	174.2	0	0	113	D80	D80-E82 PolarHBondContact O-N 3.43Å; D80-E82 VanDerWaalsContact O-N 3.13Å; D80-E82 PolarHBondContact OD1-N 3.09Å
83	K	43.3	Very low	31.7	Very low	152 Å²	152	140.3 Å²	140.3	66%	0.661	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-83.1	-19.2	172.6	-72.6	-175.9	179.8	174.4	0	113.7	D80 P81	D80-K83 PolarHBondContact O-N 2.95Å; P81-K83 PolarHBondContact O-N 3.29Å
84	L	35.5	Very low	31.4	Very low	115 Å²	115	138.7 Å²	138.7	60%	0.602	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-30.1	174.8	-91.8	100	0	0	0	112.2	P81 Q86 F87	P81-L84 PolarHBondContact O-N 3.24Å; P81-L84 VanDerWaalsContact O-N 3.1Å; L84-Q86 PolarHBondContact O-N 3.09Å; L84-Q86 VanDerWaalsContact O-N 3.13Å; L84-F87 WeakPolarHBondContact O-CB 3.35Å; L84-F87 PolarHBondContact O-N 2.68Å; L84-F87 VanDerWaalsContact O-N 3.08Å
85	E	34.5	Very low	31.3	Very low	175 Å²	175	138.7 Å²	138.7	82%	0.818	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-16.2	178.1	-72.3	-165.8	159	0	0	113.7	F87	E85-F87 VanDerWaalsContact C-N 3.33Å
86	Q	34.5	Very low	31.5	Very low	165 Å²	165	140.1 Å²	140.1	77%	0.771	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-6.1	176.7	-144.5	164.3	32.8	0	0	113.5	L84 N88	L84-Q86 PolarHBondContact O-N 3.09Å; L84-Q86 VanDerWaalsContact O-N 3.13Å; Q86-N88 PolarHBondContact O-N 2.97Å
87	F	28.2	Very low	31.2	Very low	140 Å²	140	139.5 Å²	139.5	61%	0.614	72%	0.717	S	S	*	*			trans	-73.1	90.5	167.7	-89.1	-93.8	0	0	0	109.7	L84 E85 Y89 L275	L84-F87 WeakPolarHBondContact O-CB 3.35Å; L84-F87 PolarHBondContact O-N 2.68Å; L84-F87 VanDerWaalsContact O-N 3.08Å; E85-F87 VanDerWaalsContact C-N 3.33Å; F87-Y89 PolarHBondContact O-N 3.03Å; F87-L275 HydrophobicContact CE1-CD2 3.87Å; F87-L275 HydrophobicContact CZ-CD1 4.38Å; F87-L275 HydrophobicContact CZ-CD2 4.31Å
88	N	25.3	Very low	31.1	Very low	152 Å²	152	137.6 Å²	137.6	81%	0.813	71%	0.709	S	S	*	*			trans	-64.2	103.2	166.3	-85	-66.2	0	0	0	109.2	Q86 K90	Q86-N88 PolarHBondContact O-N 2.97Å; N88-K90 PolarHBondContact O-N 3.06Å
89	Y	24	Very low	30.9	Very low	218 Å²	218	134.4 Å²	134.4	86%	0.855	71%	0.708	S	S	*	*			trans	-60.4	106.5	171.6	-161.3	-94.7	0	0	0	109	F87 E91	F87-Y89 PolarHBondContact O-N 3.03Å; Y89-E91 HydrophobicContact CE1-CB 4.41Å
90	K	25.8	Very low	30.7	Very low	184 Å²	184	137.3 Å²	137.3	80%	0.8	72%	0.715	S	S	*	*			trans	-99	93	171.1	-163.8	177.6	-175.7	-178.6	0	108.2	N88 T92	N88-K90 PolarHBondContact O-N 3.06Å; K90-T92 PolarHBondContact O-N 3.48Å; K90-T92 PolarHBondContact O-OG1 3.4Å; K90-T92 VanDerWaalsContact O-OG1 3.12Å
91	E	28.2	Very low	30.5	Very low	149 Å²	149	137 Å²	137	70%	0.696	72%	0.722	S	S	*	*			trans	-50.6	108.1	169.4	-173	-179.7	-175.5	0	0	108.8	Y89 T93	Y89-E91 HydrophobicContact CE1-CB 4.41Å; E91-T93 HydrophobicContact CG-CG2 4.21Å
92	T	26.4	Very low	30.6	Very low	107 Å²	107	137.6 Å²	137.6	66%	0.656	72%	0.717	S	S	*	*			trans	-100.7	85	176.6	-51.6	0	0	0	0	106.7	K90 S94	K90-T92 PolarHBondContact O-N 3.48Å; K90-T92 PolarHBondContact O-OG1 3.4Å; K90-T92 VanDerWaalsContact O-OG1 3.12Å; T92-S94 PolarHBondContact O-N 3.23Å; T92-S94 PolarHBondContact O-OG 3.43Å
93	T	23.8	Very low	31	Very low	107 Å²	107	138.6 Å²	138.6	66%	0.656	73%	0.726	S	S	*	*			trans	-59.1	100.5	169.9	49.6	0	0	0	0	108.3	E91	E91-T93 HydrophobicContact CG-CG2 4.21Å
94	S	30.4	Very low	31.4	Very low	89 Å²	89	135 Å²	135	62%	0.622	72%	0.719	S	S	*	*			trans	-95.6	111.7	173.3	-52.5	0	0	0	0	106.5	T92 I96	T92-S94 PolarHBondContact O-N 3.23Å; T92-S94 PolarHBondContact O-OG 3.43Å; S94-I96 WeakPolarHBondContact O-CG1 3.41Å; S94-I96 PolarHBondContact O-N 3.22Å
95	D	24.8	Very low	32.1	Very low	152 Å²	152	137 Å²	137	81%	0.813	72%	0.719	S	S	*	*			trans	-56.9	98.3	178.8	-70.6	-39.3	0	0	0	110.9	T97	D95-T97 PolarHBondContact O-N 3.11Å
96	I	33.2	Very low	33.3	Very low	145 Å²	145	136.4 Å²	136.4	74%	0.744	71%	0.709	S	S	*	*			trans	-80.3	78.7	171.7	-46.2	176.6	0	0	0	107.9	S94 S98	S94-I96 WeakPolarHBondContact O-CG1 3.41Å; S94-I96 PolarHBondContact O-N 3.22Å; I96-S98 VanDerWaalsContact C-N 3.32Å; I96-S98 PolarHBondContact O-N 3.01Å
97	T	27	Very low	34.7	Very low	139 Å²	139	131.6 Å²	131.6	85%	0.853	69%	0.688	S	S	*	*			trans	-87	78	152.2	-15	0	0	0	0	107.3	D95	D95-T97 PolarHBondContact O-N 3.11Å
98	S	29.8	Very low	36.5	Very low	91 Å²	91	129 Å²	129	64%	0.636	68%	0.684	S	S	*	*			trans	-148	33.8	172.1	93.4	0	0	0	0	115.2	I96	I96-S98 VanDerWaalsContact C-N 3.32Å; I96-S98 PolarHBondContact O-N 3.01Å
99	S	30.2	Very low	38.5	Very low	117 Å²	117	124.7 Å²	124.7	82%	0.818	66%	0.656	S	S	*	*	S	Bend	trans	-97.6	0.8	168.6	45.6	0	0	0	0	113.5
100	L	28.5	Very low	40.9	Very low	170 Å²	170	118.5 Å²	118.5	89%	0.89	64%	0.638	S	S	*	*	S	Bend	trans	-150.3	49.3	-174.8	-143.8	87.7	0	0	0	115.1
101	A	30.1	Very low	43.2	Very low	69 Å²	69	110.2 Å²	110.2	57%	0.57	60%	0.602	S	S	*	*			trans	-161.2	139.2	162.6	0	0	0	0	0	111.2
102	F	40.8	Very low	45.4	Very low	102 Å²	102	104.4 Å²	104.4	45%	0.447	58%	0.579	S	S	.	*			trans	104	61.4	168.7	-46.6	-43.9	0	0	0	118.4	S104 R105	F102-S104 PolarHBondContact O-N 3.28Å; F102-S104 VanDerWaalsContact O-N 3.13Å; F102-R105 HydrophobicContact CB-CB 3.87Å; F102-R105 HydrophobicContact CB-CG 4.3Å; F102-R105 HydrophobicContact CD1-CB 3.75Å; F102-R105 HydrophobicContact CD1-CG 3.26Å; F102-R105 HydrophobicContact CD2-CB 4.33Å; F102-R105 HydrophobicContact CE1-CG 3.8Å; F102-R105 HydrophobicContact CG-CB 3.66Å; F102-R105 HydrophobicContact CG-CG 3.75Å
103	L	47.7	Very low	47.4	Very low	172 Å²	172	99.8 Å²	99.8	90%	0.901	55%	0.551	S	S	*	*	S	Bend	trans	-66.2	7.6	151.3	-79.2	157.7	0	0	0	113.9
104	S	50	Low	49.9	Very low	76 Å²	76	98.3 Å²	98.3	53%	0.531	54%	0.537	S	S	.	.	S	Bend	trans	-157.5	3.4	-172.8	50.9	0	0	0	0	117.6	F102	F102-S104 PolarHBondContact O-N 3.28Å; F102-S104 VanDerWaalsContact O-N 3.13Å
105	R	51	Low	51.8	Low	157 Å²	157	95.2 Å²	95.2	59%	0.592	51%	0.512	S	S	*	.			trans	-95.8	135.5	178.9	-71.5	-167.8	-169.6	166.4	7.3	112.1	F102 P133	F102-R105 HydrophobicContact CB-CB 3.87Å; F102-R105 HydrophobicContact CB-CG 4.3Å; F102-R105 HydrophobicContact CD1-CB 3.75Å; F102-R105 HydrophobicContact CD1-CG 3.26Å; F102-R105 HydrophobicContact CD2-CB 4.33Å; F102-R105 HydrophobicContact CE1-CG 3.8Å; F102-R105 HydrophobicContact CG-CB 3.66Å; F102-R105 HydrophobicContact CG-CG 3.75Å; R105-P133 WeakPolarHBondContact O-CD 3.04Å
106	R	59.4	Low	54.1	Low	164 Å²	164	92.3 Å²	92.3	62%	0.619	50%	0.496	S	S	*	.			trans	-68	129.6	169.9	-57.8	179.9	159.9	172.9	-6.4	108.3	I131 Y132 D135	R106-I131 CarbonylContact C-O 3.52Å; R106-I131 WeakPolarHBondContact CA-O 3.38Å; R106-Y132 HydrophobicContact CB-CD1 3.91Å; R106-Y132 HydrophobicContact CB-CE1 4.18Å; R106-Y132 HydrophobicContact CG-CD1 3.6Å; R106-Y132 HydrophobicContact CG-CE1 4.19Å; R106-D135 IonicContact CZ-OD2 3.81Å; R106-D135 IonicContact NE-OD2 3.95Å; R106-D135 IonicContact NH2-OD2 2.98Å; R106-D135 PolarHBondContact NH2-OD2 3.31Å
107	I	64.4	Low	55.9	Low	64 Å²	64	85.8 Å²	85.8	33%	0.328	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.9	179	-59.6	173.5	0	0	0	107.5	R109 G130 I131	I107-R109 HydrophobicContact CG2-CG 4.35Å; I107-G130 CarbonylContact O-C 3.58Å; I107-G130 VanDerWaalsContact O-CA 3.31Å; I107-G130 WeakPolarHBondContact O-CA 3.49Å; I107-I131 HydrophobicContact CB-CB 4.33Å; I107-I131 PolarHBondContact N-O 3.12Å; I107-I131 PolarHBondContact O-N 3.2Å
108	T	66.6	Low	58	Low	85 Å²	85	83.6 Å²	83.6	52%	0.521	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.7	174.9	-51.8	0	0	0	0	109.5	L128 E129	T108-L128 HydrophobicContact CG2-CD1 3.54Å; T108-L128 HydrophobicContact CG2-CG 4.23Å; T108-E129 CarbonylContact C-O 3.59Å; T108-E129 WeakPolarHBondContact CA-O 3.25Å; T108-E129 VanDerWaalsContact CG2-O 3.31Å; T108-E129 WeakPolarHBondContact CG2-O 3.47Å
109	R	67.3	Low	60	Low	61 Å²	61	82.1 Å²	82.1	23%	0.23	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.2	178.4	-57.4	-175.3	-177.9	122.4	3.8	109.4	I107 Y111 L128 E129	I107-R109 HydrophobicContact CG2-CG 4.35Å; R109-Y111 HydrophobicContact CB-CE2 3.73Å; R109-Y111 VanDerWaalsContact CD-OH 3.29Å; R109-Y111 WeakPolarHBondContact CD-OH 3.09Å; R109-L128 CarbonylContact O-C 3.47Å; R109-L128 WeakPolarHBondContact O-CA 3.13Å; R109-E129 HydrophobicContact CB-CB 4.31Å; R109-E129 PolarHBondContact N-O 3.34Å; R109-E129 PolarHBondContact O-N 2.94Å
110	N	73	Confident	61.9	Low	88 Å²	88	80.2 Å²	80.2	47%	0.471	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122.6	179.4	-176.3	47.4	0	0	0	109.9	R127 L128	N110-R127 CarbonylContact C-O 3.57Å; N110-R127 WeakPolarHBondContact CA-O 3.44Å; N110-R127 PolarHBondContact OD1-O 2.9Å; N110-L128 HydrophobicContact CB-CD1 3.95Å
111	Y	74.4	Confident	63.7	Low	11 Å²	11	72.5 Å²	72.5	4%	0.043	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140	177	-50.6	-87.7	0	0	0	108	R109 S126 R127 E129 W250 L266	R109-Y111 HydrophobicContact CB-CE2 3.73Å; R109-Y111 VanDerWaalsContact CD-OH 3.29Å; R109-Y111 WeakPolarHBondContact CD-OH 3.09Å; Y111-S126 CarbonylContact O-C 3.53Å; Y111-S126 WeakPolarHBondContact O-CA 3.27Å; Y111-S126 WeakPolarHBondContact O-CB 3.47Å; Y111-R127 HydrophobicContact CD2-CB 4.34Å; Y111-R127 HydrophobicContact CD2-CG 4.24Å; Y111-R127 PolarHBondContact N-O 2.77Å; Y111-R127 PolarHBondContact O-N 2.79Å; Y111-E129 HydrophobicContact CE2-CG 4.13Å; Y111-W250 AromaticContact CD1-CH2 3.71Å; Y111-W250 HydrophobicContact CD1-CH2 3.71Å; Y111-W250 AromaticContact CD1-CZ2 3.76Å; Y111-W250 HydrophobicContact CD1-CZ2 3.76Å; Y111-W250 HydrophobicContact CE1-CH2 4.3Å; Y111-W250 HydrophobicContact CG-CZ2 4.43Å; Y111-L266 HydrophobicContact CD1-CB 4.45Å; Y111-L266 HydrophobicContact CD2-CD1 4.37Å; Y111-L266 HydrophobicContact CE1-CB 3.97Å; Y111-L266 HydrophobicContact CE2-CD1 4.18Å
112	A	74.6	Confident	65.6	Low	27 Å²	27	75.5 Å²	75.5	22%	0.223	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	156.6	176.2	0	0	0	0	0	109.7	V125 W250 Y280	A112-V125 CarbonylContact C-O 3.43Å; A112-V125 WeakPolarHBondContact CA-O 3.43Å; A112-W250 PolarHBondContact O-NE1 3.38Å; A112-Y280 HydrophobicContact CB-CD1 4.46Å; A112-Y280 HydrophobicContact CB-CE1 3.85Å; A112-Y280 PolarHBondContact O-OH 3.4Å
113	S	69.6	Low	66.7	Low	10 Å²	10	70.7 Å²	70.7	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	153.1	165.3	-153	0	0	0	0	109.8	A124 V125 D248	S113-A124 CarbonylContact O-C 3.38Å; S113-A124 WeakPolarHBondContact O-CA 3.22Å; S113-V125 PolarHBondContact N-O 3.29Å; S113-V125 PolarHBondContact O-N 2.9Å; S113-D248 PolarHBondContact OG-OD1 3.43Å; S113-D248 PolarHBondContact OG-OD2 2.8Å
114	E	75.8	Confident	67.9	Low	76 Å²	76	63.6 Å²	63.6	36%	0.355	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	132.9	173.3	-174.7	-178.1	173.9	0	0	109.3	R122 I123 A124	E114-R122 WeakPolarHBondContact OE1-CD 3.25Å; E114-R122 IonicContact OE1-CZ 3.71Å; E114-R122 IonicContact OE1-NE 2.71Å; E114-R122 IonicContact OE1-NH1 2.77Å; E114-R122 PolarHBondContact OE1-NH1 2.99Å; E114-I123 CarbonylContact C-O 3.57Å; E114-I123 VanDerWaalsContact CA-O 3.27Å; E114-I123 WeakPolarHBondContact CA-O 3.43Å; E114-A124 HydrophobicContact CG-CB 4.47Å
115	F	69.2	Low	68.5	Low	24 Å²	24	60 Å²	60	11%	0.105	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	160.4	174.9	58.9	-87.3	0	0	0	110.8	L117 I123 V125 I241 L245 D248 A251	F115-L117 HydrophobicContact CD2-CD2 4.12Å; F115-L117 HydrophobicContact CE2-CD2 3.92Å; F115-I123 HydrophobicContact CD1-CB 4.25Å; F115-I123 HydrophobicContact CD1-CG2 4.49Å; F115-I123 HydrophobicContact CD2-CB 3.98Å; F115-I123 HydrophobicContact CD2-CG1 4.19Å; F115-I123 HydrophobicContact CE1-CB 3.9Å; F115-I123 HydrophobicContact CE1-CG2 3.71Å; F115-I123 HydrophobicContact CE2-CB 3.61Å; F115-I123 HydrophobicContact CE2-CG1 3.7Å; F115-I123 HydrophobicContact CE2-CG2 3.99Å; F115-I123 HydrophobicContact CG-CB 4.3Å; F115-I123 HydrophobicContact CZ-CB 3.58Å; F115-I123 HydrophobicContact CZ-CG1 4.07Å; F115-I123 HydrophobicContact CZ-CG2 3.44Å; F115-I123 VanDerWaalsContact CZ-CG2 3.44Å; F115-I123 PolarHBondContact N-O 2.87Å; F115-I123 PolarHBondContact O-N 3.12Å; F115-V125 HydrophobicContact CE1-CG2 4.19Å; F115-I241 HydrophobicContact CE2-CG2 4.26Å; F115-I241 HydrophobicContact CZ-CG2 3.79Å; F115-L245 HydrophobicContact CE1-CD2 4.03Å; F115-L245 HydrophobicContact CZ-CD2 4Å; F115-L245 HydrophobicContact CZ-CG 4.39Å; F115-D248 HydrophobicContact CB-CB 4.49Å; F115-D248 HydrophobicContact CD1-CB 4.23Å; F115-A251 HydrophobicContact CD1-CB 4.13Å; F115-A251 HydrophobicContact CE1-CB 3.87Å
116	I	74.4	Confident	69.5	Low	90 Å²	90	54.2 Å²	54.2	46%	0.462	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.2	-176.8	-47	-171.7	0	0	0	108.1	R122	I116-R122 HydrophobicContact CD1-CG 4.28Å; I116-R122 HydrophobicContact CG1-CG 4.1Å; I116-R122 HydrophobicContact CG2-CG 4.46Å
117	L	70.1	Confident	70.2	Confident	9 Å²	9	46.4 Å²	46.4	5%	0.047	25%	0.247	C	C	.	.			trans	-77.6	161.1	175.4	-61.2	-172.8	0	0	0	111.2	F115 D119 D120 T121 I123 Y244	F115-L117 HydrophobicContact CD2-CD2 4.12Å; F115-L117 HydrophobicContact CE2-CD2 3.92Å; L117-D119 WeakPolarHBondContact CB-OD1 3.28Å; L117-D119 PolarHBondContact O-N 2.9Å; L117-D120 PolarHBondContact O-N 3.39Å; L117-T121 WeakPolarHBondContact CB-O 3.41Å; L117-T121 HydrophobicContact CD1-CG2 4.27Å; L117-T121 PolarHBondContact N-O 3.28Å; L117-I123 HydrophobicContact CD1-CD1 4.18Å; L117-I123 HydrophobicContact CD1-CG1 4.1Å; L117-I123 HydrophobicContact CD2-CG1 4.35Å; L117-I123 HydrophobicContact CG-CG1 3.96Å; L117-Y244 HydrophobicContact CD2-CD1 4.11Å; L117-Y244 HydrophobicContact CD2-CD2 3.38Å; L117-Y244 HydrophobicContact CD2-CE2 4.1Å; L117-Y244 HydrophobicContact CD2-CG 3.38Å
118	P	70.6	Confident	70.4	Confident	93 Å²	93	46.5 Å²	46.5	60%	0.604	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.2	179	-27.1	36.7	0	0	0	115.4	D120 Y244	P118-D120 VanDerWaalsContact C-N 3.27Å; P118-Y244 VanDerWaalsContact CD-CE1 3.44Å; P118-Y244 HydrophobicContact CG-CE1 3.61Å
119	D	72.2	Confident	70.5	Confident	59 Å²	59	42.5 Å²	42.5	32%	0.316	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	14	174.9	70.2	-18.3	0	0	0	113.5	L117 T121 L239	L117-D119 WeakPolarHBondContact CB-OD1 3.28Å; L117-D119 PolarHBondContact O-N 2.9Å; D119-T121 PolarHBondContact O-N 2.82Å; D119-T121 WeakPolarHBondContact OD1-CB 3.41Å; D119-T121 PolarHBondContact OD1-N 2.59Å; D119-T121 PolarHBondContact OD1-OG1 3.46Å; D119-T121 VanDerWaalsContact OD1-OG1 3.05Å; D119-T121 PolarHBondContact OD2-OG1 2.93Å; D119-L239 HydrophobicContact CB-CD1 3.64Å
120	D	71.3	Confident	70.4	Confident	78 Å²	78	39.8 Å²	39.8	42%	0.417	21%	0.214	S	C	.	.	S	Bend	trans	62	17.2	-172	-75.9	-32.7	0	0	0	114.5	L117 P118 R122 K149	L117-D120 PolarHBondContact O-N 3.39Å; P118-D120 VanDerWaalsContact C-N 3.27Å; D120-R122 PolarHBondContact O-N 2.85Å; D120-K149 HydrophobicContact CB-CB 4.12Å; D120-K149 HydrophobicContact CB-CD 3.65Å; D120-K149 HydrophobicContact CB-CG 4.43Å; D120-K149 WeakPolarHBondContact OD2-CD 3.37Å; D120-K149 WeakPolarHBondContact OD2-CE 3.29Å; D120-K149 IonicContact OD2-NZ 2.66Å; D120-K149 PolarHBondContact OD2-NZ 3.13Å
121	T	64.7	Low	70.1	Confident	7 Å²	7	37.1 Å²	37.1	4%	0.043	20%	0.199	C	C	.	.			trans	-75.6	120.3	171.5	-64.1	0	0	0	0	109.9	L117 D119 I123 V146 G147	L117-T121 WeakPolarHBondContact CB-O 3.41Å; L117-T121 HydrophobicContact CD1-CG2 4.27Å; L117-T121 PolarHBondContact N-O 3.28Å; D119-T121 PolarHBondContact O-N 2.82Å; D119-T121 WeakPolarHBondContact OD1-CB 3.41Å; D119-T121 PolarHBondContact OD1-N 2.59Å; D119-T121 PolarHBondContact OD1-OG1 3.46Å; D119-T121 VanDerWaalsContact OD1-OG1 3.05Å; D119-T121 PolarHBondContact OD2-OG1 2.93Å; T121-I123 HydrophobicContact CG2-CD1 3.85Å; T121-V146 HydrophobicContact CG2-CG1 3.48Å; T121-V146 VanDerWaalsContact CG2-CG1 3.48Å; T121-G147 CarbonylContact C-O 3.55Å
122	R	71.4	Confident	70	Confident	133 Å²	133	38.9 Å²	38.9	50%	0.502	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	132.1	173.9	-69.2	-177.4	171.2	-126.7	2.1	110.5	E114 I116 D120 V146 G147	E114-R122 WeakPolarHBondContact OE1-CD 3.25Å; E114-R122 IonicContact OE1-CZ 3.71Å; E114-R122 IonicContact OE1-NE 2.71Å; E114-R122 IonicContact OE1-NH1 2.77Å; E114-R122 PolarHBondContact OE1-NH1 2.99Å; I116-R122 HydrophobicContact CD1-CG 4.28Å; I116-R122 HydrophobicContact CG1-CG 4.1Å; I116-R122 HydrophobicContact CG2-CG 4.46Å; D120-R122 PolarHBondContact O-N 2.85Å; R122-V146 CarbonylContact O-C 3.55Å; R122-V146 WeakPolarHBondContact O-CA 3.34Å; R122-G147 PolarHBondContact N-O 3.05Å; R122-G147 PolarHBondContact O-N 3.49Å
123	I	64.1	Low	69.4	Low	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.7	175.1	-51.3	-62.9	0	0	0	107.8	E114 F115 L117 T121 L144 S145 V146 I241	E114-I123 CarbonylContact C-O 3.57Å; E114-I123 VanDerWaalsContact CA-O 3.27Å; E114-I123 WeakPolarHBondContact CA-O 3.43Å; F115-I123 HydrophobicContact CD1-CB 4.25Å; F115-I123 HydrophobicContact CD1-CG2 4.49Å; F115-I123 HydrophobicContact CD2-CB 3.98Å; F115-I123 HydrophobicContact CD2-CG1 4.19Å; F115-I123 HydrophobicContact CE1-CB 3.9Å; F115-I123 HydrophobicContact CE1-CG2 3.71Å; F115-I123 HydrophobicContact CE2-CB 3.61Å; F115-I123 HydrophobicContact CE2-CG1 3.7Å; F115-I123 HydrophobicContact CE2-CG2 3.99Å; F115-I123 HydrophobicContact CG-CB 4.3Å; F115-I123 HydrophobicContact CZ-CB 3.58Å; F115-I123 HydrophobicContact CZ-CG1 4.07Å; F115-I123 HydrophobicContact CZ-CG2 3.44Å; F115-I123 VanDerWaalsContact CZ-CG2 3.44Å; F115-I123 PolarHBondContact N-O 2.87Å; F115-I123 PolarHBondContact O-N 3.12Å; L117-I123 HydrophobicContact CD1-CD1 4.18Å; L117-I123 HydrophobicContact CD1-CG1 4.1Å; L117-I123 HydrophobicContact CD2-CG1 4.35Å; L117-I123 HydrophobicContact CG-CG1 3.96Å; T121-I123 HydrophobicContact CG2-CD1 3.85Å; I123-L144 HydrophobicContact CG2-CD1 3.56Å; I123-S145 CarbonylContact C-O 3.54Å; I123-S145 WeakPolarHBondContact CA-O 3.21Å; I123-V146 HydrophobicContact CD1-CB 4.11Å; I123-V146 HydrophobicContact CD1-CG1 3.74Å; I123-V146 HydrophobicContact CD1-CG2 3.73Å; I123-I241 HydrophobicContact CD1-CD1 3.81Å; I123-I241 HydrophobicContact CD1-CG1 3.86Å; I123-I241 HydrophobicContact CG1-CG1 4.34Å; I123-I241 HydrophobicContact CG2-CG2 4.02Å
124	A	72.3	Confident	69.3	Low	24 Å²	24	46 Å²	46	20%	0.198	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	130	173.7	0	0	0	0	0	110.2	S113 E114 L144 S145	S113-A124 CarbonylContact O-C 3.38Å; S113-A124 WeakPolarHBondContact O-CA 3.22Å; E114-A124 HydrophobicContact CG-CB 4.47Å; A124-L144 CarbonylContact O-C 3.42Å; A124-L144 WeakPolarHBondContact O-CA 3.2Å; A124-S145 PolarHBondContact N-O 2.67Å; A124-S145 PolarHBondContact O-N 3.32Å
125	V	63.2	Low	69.3	Low	1 Å²	1	46.6 Å²	46.6	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	137.8	176.5	-178.5	0	0	0	0	108	A112 S113 F115 S143 L144 A251 I254 L255	A112-V125 CarbonylContact C-O 3.43Å; A112-V125 WeakPolarHBondContact CA-O 3.43Å; S113-V125 PolarHBondContact N-O 3.29Å; S113-V125 PolarHBondContact O-N 2.9Å; F115-V125 HydrophobicContact CE1-CG2 4.19Å; V125-S143 CarbonylContact C-O 3.6Å; V125-S143 WeakPolarHBondContact CA-O 3.27Å; V125-L144 HydrophobicContact CG2-CD1 3.74Å; V125-A251 HydrophobicContact CG2-CB 4.21Å; V125-I254 HydrophobicContact CG1-CB 4.21Å; V125-I254 HydrophobicContact CG1-CG2 3.63Å; V125-L255 HydrophobicContact CG1-CD1 4.31Å; V125-L255 HydrophobicContact CG1-CD2 3.74Å; V125-L255 HydrophobicContact CG1-CG 3.74Å; V125-L255 HydrophobicContact CG2-CD1 4.19Å
126	S	72.2	Confident	69.4	Low	35 Å²	35	52.9 Å²	52.9	25%	0.245	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	152.5	168.1	60	0	0	0	0	112.8	Y111 L142 S143	Y111-S126 CarbonylContact O-C 3.53Å; Y111-S126 WeakPolarHBondContact O-CA 3.27Å; Y111-S126 WeakPolarHBondContact O-CB 3.47Å; S126-L142 CarbonylContact O-C 3.57Å; S126-L142 WeakPolarHBondContact O-CA 3.17Å; S126-S143 PolarHBondContact N-O 3.36Å; S126-S143 PolarHBondContact O-N 2.73Å; S126-S143 WeakPolarHBondContact OG-CB 3.37Å
127	R	72.6	Confident	69	Low	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	118.9	177.5	175.8	-158	-171.9	97.2	1.9	109.1	N110 Y111 E129 V140 I141 L142 I254 C257 N259	N110-R127 CarbonylContact C-O 3.57Å; N110-R127 WeakPolarHBondContact CA-O 3.44Å; N110-R127 PolarHBondContact OD1-O 2.9Å; Y111-R127 HydrophobicContact CD2-CB 4.34Å; Y111-R127 HydrophobicContact CD2-CG 4.24Å; Y111-R127 PolarHBondContact N-O 2.77Å; Y111-R127 PolarHBondContact O-N 2.79Å; R127-E129 HydrophobicContact CG-CG 4.14Å; R127-E129 IonicContact CZ-OE1 2.72Å; R127-E129 IonicContact NE-OE1 3.11Å; R127-E129 PolarHBondContact NE-OE1 2.77Å; R127-E129 IonicContact NH2-OE1 3.8Å; R127-E129 PolarHBondContact NH2-OE1 3.05Å; R127-V140 HydrophobicContact CG-CG1 4Å; R127-I141 CarbonylContact C-O 3.6Å; R127-I141 VanDerWaalsContact CA-O 3.27Å; R127-I141 WeakPolarHBondContact CA-O 3.4Å; R127-L142 HydrophobicContact CB-CD2 3.74Å; R127-L142 HydrophobicContact CG-CD2 3.92Å; R127-I254 HydrophobicContact CB-CG2 3.52Å; R127-I254 PolarHBondContact NH1-O 3.42Å; R127-I254 VanDerWaalsContact NH1-O 3.1Å; R127-C257 PolarHBondContact NH1-O 3.41Å; R127-C257 PolarHBondContact NH2-O 3.22Å; R127-N259 PolarHBondContact NH2-O 2.71Å
128	L	68.6	Low	69.1	Low	65 Å²	65	57.4 Å²	57.4	34%	0.34	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	116.7	171.7	-175.6	69.6	0	0	0	109	T108 R109 N110 V140 I141	T108-L128 HydrophobicContact CG2-CD1 3.54Å; T108-L128 HydrophobicContact CG2-CG 4.23Å; R109-L128 CarbonylContact O-C 3.47Å; R109-L128 WeakPolarHBondContact O-CA 3.13Å; N110-L128 HydrophobicContact CB-CD1 3.95Å; L128-V140 CarbonylContact O-C 3.44Å; L128-V140 WeakPolarHBondContact O-CA 3.31Å; L128-I141 HydrophobicContact CB-CB 4.31Å; L128-I141 HydrophobicContact CD2-CD1 4.43Å; L128-I141 PolarHBondContact N-O 3.5Å; L128-I141 PolarHBondContact O-N 3.31Å
129	E	70	Confident	69	Low	2 Å²	2	57.1 Å²	57.1	1%	0.009	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.7	171.1	-55.4	-170.3	149	0	0	110.3	T108 R109 Y111 R127 Q139 V140 A263	T108-E129 CarbonylContact C-O 3.59Å; T108-E129 WeakPolarHBondContact CA-O 3.25Å; T108-E129 VanDerWaalsContact CG2-O 3.31Å; T108-E129 WeakPolarHBondContact CG2-O 3.47Å; R109-E129 HydrophobicContact CB-CB 4.31Å; R109-E129 PolarHBondContact N-O 3.34Å; R109-E129 PolarHBondContact O-N 2.94Å; Y111-E129 HydrophobicContact CE2-CG 4.13Å; R127-E129 HydrophobicContact CG-CG 4.14Å; R127-E129 IonicContact CZ-OE1 2.72Å; R127-E129 IonicContact NE-OE1 3.11Å; R127-E129 PolarHBondContact NE-OE1 2.77Å; R127-E129 IonicContact NH2-OE1 3.8Å; R127-E129 PolarHBondContact NH2-OE1 3.05Å; E129-Q139 CarbonylContact C-O 3.52Å; E129-Q139 VanDerWaalsContact CA-O 3.27Å; E129-Q139 WeakPolarHBondContact CA-O 3.46Å; E129-V140 HydrophobicContact CG-CG1 4.44Å; E129-V140 HydrophobicContact CG-CG2 4.2Å; E129-A263 WeakPolarHBondContact OE2-CB 3.42Å
130	G	65.3	Low	68.8	Low	3 Å²	3	56.6 Å²	56.6	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	120.9	172.6	0	0	0	0	0	109.9	I107 E138 Q139	I107-G130 CarbonylContact O-C 3.58Å; I107-G130 VanDerWaalsContact O-CA 3.31Å; I107-G130 WeakPolarHBondContact O-CA 3.49Å; G130-E138 CarbonylContact O-C 3.55Å; G130-E138 WeakPolarHBondContact O-CA 3.45Å; G130-Q139 PolarHBondContact N-O 3.12Å; G130-Q139 PolarHBondContact O-N 2.97Å
131	I	65.9	Low	68.8	Low	32 Å²	32	56.1 Å²	56.1	16%	0.164	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.6	173.4	-56.7	170.1	0	0	0	106.9	R106 I107 P133 E138	R106-I131 CarbonylContact C-O 3.52Å; R106-I131 WeakPolarHBondContact CA-O 3.38Å; I107-I131 HydrophobicContact CB-CB 4.33Å; I107-I131 PolarHBondContact N-O 3.12Å; I107-I131 PolarHBondContact O-N 3.2Å; I131-P133 HydrophobicContact CG2-CG 4.34Å; I131-P133 WeakPolarHBondContact O-CD 3.11Å; I131-E138 HydrophobicContact CG1-CG 4.36Å; I131-E138 HydrophobicContact CG2-CG 4.21Å
132	Y	72	Confident	69.1	Low	49 Å²	49	58.5 Å²	58.5	19%	0.192	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	83.2	-177.4	-55.2	-87.4	0	0	0	109	R106 M134 D135 N136 N137 Q139	R106-Y132 HydrophobicContact CB-CD1 3.91Å; R106-Y132 HydrophobicContact CB-CE1 4.18Å; R106-Y132 HydrophobicContact CG-CD1 3.6Å; R106-Y132 HydrophobicContact CG-CE1 4.19Å; Y132-M134 VanDerWaalsContact C-N 3.28Å; Y132-M134 PolarHBondContact O-N 2.99Å; Y132-D135 CarbonylContact O-C 3.45Å; Y132-D135 PolarHBondContact O-N 3.05Å; Y132-N136 PolarHBondContact O-N 3Å; Y132-N136 VanDerWaalsContact O-N 3.12Å; Y132-N137 WeakPolarHBondContact CA-O 3.4Å; Y132-N137 WeakPolarHBondContact CB-O 3.36Å; Y132-N137 WeakPolarHBondContact CD2-O 3.22Å; Y132-N137 PolarHBondContact N-O 3.13Å; Y132-N137 PolarHBondContact O-N 3.34Å; Y132-Q139 HydrophobicContact CE2-CB 4.27Å
133	P	62.5	Low	69.1	Low	57 Å²	57	54.6 Å²	54.6	37%	0.37	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-59.4	-37	-172.2	-23.9	33.1	0	0	0	113.4	R105 I131 D135 N136	R105-P133 WeakPolarHBondContact O-CD 3.04Å; I131-P133 HydrophobicContact CG2-CG 4.34Å; I131-P133 WeakPolarHBondContact O-CD 3.11Å; P133-D135 VanDerWaalsContact C-N 3.28Å; P133-D135 PolarHBondContact O-N 3.32Å; P133-N136 PolarHBondContact O-N 3.22Å
134	M	67.1	Low	69.7	Low	128 Å²	128	57.8 Å²	57.8	63%	0.631	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-65.6	-31.8	178.3	-70.8	-58.3	-50.5	0	0	113.3	Y132 N136	Y132-M134 VanDerWaalsContact C-N 3.28Å; Y132-M134 PolarHBondContact O-N 2.99Å; M134-N136 VanDerWaalsContact C-N 3.34Å
135	D	76	Confident	69.7	Low	89 Å²	89	59.9 Å²	59.9	48%	0.476	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-96.3	2.5	-176.9	-57.1	-44.6	0	0	0	110.6	R106 Y132 P133 N137	R106-D135 IonicContact CZ-OD2 3.81Å; R106-D135 IonicContact NE-OD2 3.95Å; R106-D135 IonicContact NH2-OD2 2.98Å; R106-D135 PolarHBondContact NH2-OD2 3.31Å; Y132-D135 CarbonylContact O-C 3.45Å; Y132-D135 PolarHBondContact O-N 3.05Å; P133-D135 VanDerWaalsContact C-N 3.28Å; P133-D135 PolarHBondContact O-N 3.32Å; D135-N137 HydrophobicContact CB-CB 4.09Å; D135-N137 PolarHBondContact O-N 2.93Å; D135-N137 VanDerWaalsContact O-N 3.11Å
136	N	70.6	Confident	70	Confident	156 Å²	156	63.6 Å²	63.6	83%	0.834	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.5	42.6	-168	-167.7	43.3	0	0	0	112.3	Y132 P133 M134	Y132-N136 PolarHBondContact O-N 3Å; Y132-N136 VanDerWaalsContact O-N 3.12Å; P133-N136 PolarHBondContact O-N 3.22Å; M134-N136 VanDerWaalsContact C-N 3.34Å
137	N	66.3	Low	69.3	Low	83 Å²	83	63.5 Å²	63.5	44%	0.444	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.9	-171	-173.8	20.7	0	0	0	110.1	Y132 D135	Y132-N137 WeakPolarHBondContact CA-O 3.4Å; Y132-N137 WeakPolarHBondContact CB-O 3.36Å; Y132-N137 WeakPolarHBondContact CD2-O 3.22Å; Y132-N137 PolarHBondContact N-O 3.13Å; Y132-N137 PolarHBondContact O-N 3.34Å; D135-N137 HydrophobicContact CB-CB 4.09Å; D135-N137 PolarHBondContact O-N 2.93Å; D135-N137 VanDerWaalsContact O-N 3.11Å
138	E	72.5	Confident	68.4	Low	111 Å²	111	67.4 Å²	67.4	52%	0.519	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.3	172.9	-62.2	-174.1	167.3	0	0	108.4	G130 I131 S260	G130-E138 CarbonylContact O-C 3.55Å; G130-E138 WeakPolarHBondContact O-CA 3.45Å; I131-E138 HydrophobicContact CG1-CG 4.36Å; I131-E138 HydrophobicContact CG2-CG 4.21Å; E138-S260 WeakPolarHBondContact OE2-CB 3.16Å; E138-S260 PolarHBondContact OE2-OG 2.72Å
139	Q	68.4	Low	67.6	Low	88 Å²	88	70.3 Å²	70.3	41%	0.411	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.5	-177.6	179.7	172.8	51.8	0	0	108.9	E129 G130 Y132 I141	E129-Q139 CarbonylContact C-O 3.52Å; E129-Q139 VanDerWaalsContact CA-O 3.27Å; E129-Q139 WeakPolarHBondContact CA-O 3.46Å; G130-Q139 PolarHBondContact N-O 3.12Å; G130-Q139 PolarHBondContact O-N 2.97Å; Y132-Q139 HydrophobicContact CE2-CB 4.27Å; Q139-I141 HydrophobicContact CG-CD1 4.24Å; Q139-I141 HydrophobicContact CG-CG1 3.94Å
140	V	69	Low	66.4	Low	47 Å²	47	78 Å²	78	29%	0.285	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.8	168.3	-177.3	0	0	0	0	107.6	R127 L128 E129	R127-V140 HydrophobicContact CG-CG1 4Å; L128-V140 CarbonylContact O-C 3.44Å; L128-V140 WeakPolarHBondContact O-CA 3.31Å; E129-V140 HydrophobicContact CG-CG1 4.44Å; E129-V140 HydrophobicContact CG-CG2 4.2Å
141	I	70	Confident	65.4	Low	69 Å²	69	82.9 Å²	82.9	35%	0.354	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	115.5	175.8	-58.6	173.5	0	0	0	107.6	R127 L128 Q139	R127-I141 CarbonylContact C-O 3.6Å; R127-I141 VanDerWaalsContact CA-O 3.27Å; R127-I141 WeakPolarHBondContact CA-O 3.4Å; L128-I141 HydrophobicContact CB-CB 4.31Å; L128-I141 HydrophobicContact CD2-CD1 4.43Å; L128-I141 PolarHBondContact N-O 3.5Å; L128-I141 PolarHBondContact O-N 3.31Å; Q139-I141 HydrophobicContact CG-CD1 4.24Å; Q139-I141 HydrophobicContact CG-CG1 3.94Å
142	L	70.9	Confident	63.9	Low	57 Å²	57	90.2 Å²	90.2	30%	0.298	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.7	171.5	-70.9	160.6	0	0	0	109.3	M11 S126 R127 I254	M11-L142 HydrophobicContact CE-CD1 4.17Å; S126-L142 CarbonylContact O-C 3.57Å; S126-L142 WeakPolarHBondContact O-CA 3.17Å; R127-L142 HydrophobicContact CB-CD2 3.74Å; R127-L142 HydrophobicContact CG-CD2 3.92Å; L142-I254 HydrophobicContact CD2-CG2 4.21Å; L142-I254 WeakPolarHBondContact CD2-O 3.37Å
143	S	72.3	Confident	62.3	Low	50 Å²	50	95 Å²	95	35%	0.35	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	130.7	176.1	-52.9	0	0	0	0	110	V125 S126	V125-S143 CarbonylContact C-O 3.6Å; V125-S143 WeakPolarHBondContact CA-O 3.27Å; S126-S143 PolarHBondContact N-O 3.36Å; S126-S143 PolarHBondContact O-N 2.73Å; S126-S143 WeakPolarHBondContact OG-CB 3.37Å
144	L	75.3	Confident	60.8	Low	67 Å²	67	95.9 Å²	95.9	35%	0.351	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.1	171.3	179.4	70.6	0	0	0	107.6	I123 A124 V125 I241	I123-L144 HydrophobicContact CG2-CD1 3.56Å; A124-L144 CarbonylContact O-C 3.42Å; A124-L144 WeakPolarHBondContact O-CA 3.2Å; V125-L144 HydrophobicContact CG2-CD1 3.74Å; L144-I241 HydrophobicContact CD2-CD1 4.15Å
145	S	73.1	Confident	59.1	Low	68 Å²	68	97.3 Å²	97.3	48%	0.476	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.1	178.8	-55.2	0	0	0	0	109.6	I123 A124	I123-S145 CarbonylContact C-O 3.54Å; I123-S145 WeakPolarHBondContact CA-O 3.21Å; A124-S145 PolarHBondContact N-O 2.67Å; A124-S145 PolarHBondContact O-N 3.32Å
146	V	70.5	Confident	57	Low	79 Å²	79	101.8 Å²	101.8	48%	0.479	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.9	-179	-177.8	0	0	0	0	108.3	T121 R122 I123 I241	T121-V146 HydrophobicContact CG2-CG1 3.48Å; T121-V146 VanDerWaalsContact CG2-CG1 3.48Å; R122-V146 CarbonylContact O-C 3.55Å; R122-V146 WeakPolarHBondContact O-CA 3.34Å; I123-V146 HydrophobicContact CD1-CB 4.11Å; I123-V146 HydrophobicContact CD1-CG1 3.74Å; I123-V146 HydrophobicContact CD1-CG2 3.73Å; V146-I241 HydrophobicContact CG2-CD1 3.94Å
147	G	56.5	Low	55.2	Low	33 Å²	33	99.6 Å²	99.6	34%	0.34	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	105.1	175.3	0	0	0	0	0	110	T121 R122	T121-G147 CarbonylContact C-O 3.55Å; R122-G147 PolarHBondContact N-O 3.05Å; R122-G147 PolarHBondContact O-N 3.49Å
148	H	53.1	Low	53.4	Low	82 Å²	82	101.1 Å²	101.1	38%	0.38	54%	0.538	S	S	.	.			trans	-86.7	139.1	176.1	-162.7	-34.3	0	0	0	110.1	Y150 I151	H148-Y150 AromaticContact CE1-CD2 3.47Å; H148-Y150 VanDerWaalsContact CE1-CD2 3.47Å; H148-Y150 WeakPolarHBondContact CE1-CD2 3.38Å; H148-Y150 AromaticContact ND1-CD2 3.71Å; H148-Y150 PolarHBondContact ND1-N 3.26Å; H148-Y150 PolarHBondContact O-N 3.46Å; H148-I151 HydrophobicContact CB-CD1 4.16Å; H148-I151 HydrophobicContact CB-CG1 3.88Å; H148-I151 PolarHBondContact O-N 2.89Å
149	K	52.3	Low	51.4	Low	126 Å²	126	103.7 Å²	103.7	55%	0.548	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-48	-25.9	173.8	-171.4	174.2	-176.5	174.3	0	114.9	D120	D120-K149 HydrophobicContact CB-CB 4.12Å; D120-K149 HydrophobicContact CB-CD 3.65Å; D120-K149 HydrophobicContact CB-CG 4.43Å; D120-K149 WeakPolarHBondContact OD2-CD 3.37Å; D120-K149 WeakPolarHBondContact OD2-CE 3.29Å; D120-K149 IonicContact OD2-NZ 2.66Å; D120-K149 PolarHBondContact OD2-NZ 3.13Å
150	Y	45.6	Very low	49.6	Very low	165 Å²	165	105.7 Å²	105.7	65%	0.647	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	15.6	-178.8	-56.6	-67.7	0	0	0	114.9	H148 Y152	H148-Y150 AromaticContact CE1-CD2 3.47Å; H148-Y150 VanDerWaalsContact CE1-CD2 3.47Å; H148-Y150 WeakPolarHBondContact CE1-CD2 3.38Å; H148-Y150 AromaticContact ND1-CD2 3.71Å; H148-Y150 PolarHBondContact ND1-N 3.26Å; H148-Y150 PolarHBondContact O-N 3.46Å; Y150-Y152 PolarHBondContact O-N 3.03Å
151	I	43.9	Very low	47.7	Very low	105 Å²	105	110.3 Å²	110.3	54%	0.538	59%	0.591	S	S	.	*			trans	-73.1	82.5	164.5	-53.4	178.3	0	0	0	107	H148 I153	H148-I151 HydrophobicContact CB-CD1 4.16Å; H148-I151 HydrophobicContact CB-CG1 3.88Å; H148-I151 PolarHBondContact O-N 2.89Å; I151-I153 VanDerWaalsContact C-N 3.25Å; I151-I153 HydrophobicContact CG2-CG1 4.33Å; I151-I153 PolarHBondContact O-N 2.8Å
152	Y	34.6	Very low	45.9	Very low	185 Å²	185	116.2 Å²	116.2	73%	0.725	62%	0.617	S	S	*	*			trans	-58.4	97.5	160	-100.9	-92	0	0	0	106.6	Y150 G154 Q155	Y150-Y152 PolarHBondContact O-N 3.03Å; Y152-G154 PolarHBondContact O-N 2.86Å; Y152-Q155 HydrophobicContact CD1-CB 4.35Å
153	I	37.6	Very low	44	Very low	151 Å²	151	118.9 Å²	118.9	77%	0.774	64%	0.638	S	S	*	*			trans	-64.7	86.6	163.5	-61.2	169.4	0	0	0	105.4	I151 Q155	I151-I153 VanDerWaalsContact C-N 3.25Å; I151-I153 HydrophobicContact CG2-CG1 4.33Å; I151-I153 PolarHBondContact O-N 2.8Å; I153-Q155 VanDerWaalsContact C-N 3.26Å; I153-Q155 PolarHBondContact O-N 2.81Å
154	G	31.6	Very low	42	Very low	74 Å²	74	121.9 Å²	121.9	76%	0.763	66%	0.659	S	S	*	*			trans	27.4	53.8	165.6	0	0	0	0	0	116.3	Y152 Q156	Y152-G154 PolarHBondContact O-N 2.86Å; G154-Q156 PolarHBondContact O-N 2.95Å
155	Q	31.5	Very low	40.1	Very low	158 Å²	158	124.1 Å²	124.1	74%	0.738	68%	0.677	S	S	*	*			trans	-78.7	111.6	155	-86.6	-170.8	-6.4	0	0	105.3	Y152 I153 S157	Y152-Q155 HydrophobicContact CD1-CB 4.35Å; I153-Q155 VanDerWaalsContact C-N 3.26Å; I153-Q155 PolarHBondContact O-N 2.81Å; Q155-S157 PolarHBondContact O-N 2.84Å
156	Q	31.7	Very low	38.1	Very low	183 Å²	183	126.6 Å²	126.6	86%	0.855	69%	0.69	S	S	*	*			trans	-28.2	112	172.3	-68.6	171.5	19.5	0	0	109.9	G154 T158	G154-Q156 PolarHBondContact O-N 2.95Å; Q156-T158 PolarHBondContact O-N 2.82Å
157	S	31.9	Very low	36.1	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	70%	0.703	S	S	*	*			trans	-51	109.5	163.6	48	0	0	0	0	106.7	Q155 N159	Q155-S157 PolarHBondContact O-N 2.84Å; S157-N159 PolarHBondContact O-N 3.49Å
158	T	29.9	Very low	35	Very low	115 Å²	115	133.5 Å²	133.5	71%	0.706	73%	0.726	S	S	*	*			trans	-52.7	107.4	171.6	46.9	0	0	0	0	107.8	Q156 I160	Q156-T158 PolarHBondContact O-N 2.82Å; T158-I160 VanDerWaalsContact C-N 3.26Å; T158-I160 PolarHBondContact O-N 2.74Å
159	N	30	Very low	33.7	Very low	165 Å²	165	138 Å²	138	88%	0.882	75%	0.747	S	S	*	*			trans	-65.1	96.4	158.9	-101.5	-50.1	0	0	0	106.4	S157	S157-N159 PolarHBondContact O-N 3.49Å
160	I	31.3	Very low	32.8	Very low	131 Å²	131	138.3 Å²	138.3	67%	0.672	76%	0.76	S	S	*	*			trans	-93.8	129.5	158.4	-68.5	173.8	0	0	0	105.6	T158	T158-I160 VanDerWaalsContact C-N 3.26Å; T158-I160 PolarHBondContact O-N 2.74Å
161	D	28.6	Very low	32	Very low	144 Å²	144	137.3 Å²	137.3	77%	0.77	77%	0.766	S	S	*	*			trans	89.6	76.8	174.4	-57.3	-23.1	0	0	0	118.9
162	Q	32.3	Very low	31.4	Very low	192 Å²	192	138.7 Å²	138.7	90%	0.897	78%	0.781	S	S	*	*				-159.8	128.8	119.2	-117.5	179.4	-10.2	0	0	112.5
163	P	30.8	Very low	31.3	Very low	114 Å²	114	136.1 Å²	136.1	74%	0.74	79%	0.785	S	S	*	*			trans	-86.7	120.9	177.9	31.4	-29.6	0	0	0	113.1
164	S	29.6	Very low	30.7	Very low	112 Å²	112	136.2 Å²	136.2	78%	0.783	79%	0.787	S	S	*	*			trans	72.4	163.3	144.9	-50.7	0	0	0	0	119.5
165	P	36.5	Very low	30.7	Very low	114 Å²	114	138.1 Å²	138.1	74%	0.74	79%	0.789	S	S	*	*				-130.9	176.8	-50.1	35.7	-19.8	0	0	0	111.3
166	T	30.4	Very low	30.4	Very low	121 Å²	121	139.4 Å²	139.4	74%	0.742	79%	0.792	S	S	*	*			trans	138.7	106.5	144.4	-52.3	0	0	0	0	113.9
167	T	29.3	Very low	30.1	Very low	124 Å²	124	138 Å²	138	76%	0.761	79%	0.791	S	S	*	*			trans	29.4	123.5	146	11.8	0	0	0	0	121.1
168	T	32.8	Very low	30	Very low	133 Å²	133	142.8 Å²	142.8	82%	0.816	80%	0.798	S	S	*	*				177.4	138.1	100.8	-62.7	0	0	0	0	110.5
169	Q	26.7	Very low	29.9	Very low	177 Å²	177	146.4 Å²	146.4	83%	0.827	81%	0.807	S	S	*	*			trans	-55.2	145.2	175.1	-71.2	171.3	-2.9	0	0	113.3
170	T	31.4	Very low	29.7	Very low	132 Å²	132	145 Å²	145	81%	0.81	80%	0.804	S	S	*	*				-177	121.4	125.3	27.7	0	0	0	0	111.9
171	N	30.5	Very low	29.5	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	81%	0.805	S	S	*	*			trans	26.5	134.6	154.3	-60.1	-21.8	0	0	0	122.6	T173	N171-T173 PolarHBondContact O-N 2.99Å
172	P	31.2	Very low	29.6	Very low	133 Å²	133	144 Å²	144	86%	0.864	81%	0.807	S	S	*	*			trans	-85.6	112.4	173.5	33.8	-28.5	0	0	0	111.1
173	T	31.1	Very low	29.2	Very low	131 Å²	131	142.1 Å²	142.1	80%	0.804	80%	0.803	S	S	*	*			trans	-94.5	117.5	167.2	-22.6	0	0	0	0	109.1	N171 S175	N171-T173 PolarHBondContact O-N 2.99Å; T173-S175 PolarHBondContact O-N 2.95Å
174	N	26.1	Very low	29.1	Very low	154 Å²	154	141.4 Å²	141.4	82%	0.824	80%	0.801	S	S	*	*			trans	-45.8	118.6	169.5	-79.1	-34.7	0	0	0	111.7
175	S	31	Very low	29.1	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	81%	0.805	S	S	*	*			trans	-128.2	85.4	161.4	54.7	0	0	0	0	109.5	T173	T173-S175 PolarHBondContact O-N 2.95Å
176	F	25.1	Very low	28.7	Very low	184 Å²	184	145 Å²	145	81%	0.807	81%	0.809	S	S	*	*			trans	-71.6	143.5	160.2	-99.7	-99.2	0	0	0	109
177	N	26.7	Very low	28.6	Very low	154 Å²	154	149.4 Å²	149.4	82%	0.824	82%	0.818	S	S	*	*			trans	92.1	91.7	171.7	-52.5	-31.3	0	0	0	116.6
178	K	29.4	Very low	28.6	Very low	211 Å²	211	151.9 Å²	151.9	92%	0.917	83%	0.825	S	S	*	*			trans	-122.4	123.7	145.1	-96.4	-173.1	177.1	-176.1	0	110.4
179	Q	26.6	Very low	28.4	Very low	191 Å²	191	153.7 Å²	153.7	89%	0.893	83%	0.83	S	S	*	*			trans	-58.1	138.6	180	-70.4	159.3	-43.3	0	0	112.1	S181	Q179-S181 PolarHBondContact O-N 2.8Å
180	V	27.2	Very low	28.7	Very low	136 Å²	136	148.8 Å²	148.8	82%	0.824	83%	0.827	S	S	*	*			trans	-79.9	104.4	157.4	177.4	0	0	0	0	106.6
181	S	27.2	Very low	28.6	Very low	99 Å²	99	147.2 Å²	147.2	69%	0.692	82%	0.822	S	S	*	*			trans	-87.8	109.4	172	-158.7	0	0	0	0	107.9	Q179	Q179-S181 PolarHBondContact O-N 2.8Å
182	L	28.8	Very low	28.6	Very low	154 Å²	154	146.5 Å²	146.5	81%	0.806	82%	0.818	S	S	*	*			trans	-80.6	116.2	167.7	-74.1	166.1	0	0	0	107.9	S184	L182-S184 PolarHBondContact O-N 3.28Å
183	N	25	Very low	28.5	Very low	152 Å²	152	147.5 Å²	147.5	81%	0.813	81%	0.811	S	S	*	*			trans	-72.9	102	171.6	-74.8	-16	0	0	0	109.2
184	S	29.3	Very low	28.4	Very low	100 Å²	100	150.2 Å²	150.2	70%	0.699	81%	0.814	S	S	*	*			trans	-79.4	113.2	159.1	51.1	0	0	0	0	109	L182 E186	L182-S184 PolarHBondContact O-N 3.28Å; S184-E186 PolarHBondContact O-N 2.72Å; S184-E186 VanDerWaalsContact O-N 3.12Å
185	S	28	Very low	28.5	Very low	126 Å²	126	146.8 Å²	146.8	88%	0.881	82%	0.815	S	S	*	*			trans	-72.9	95.4	167	-70.5	0	0	0	0	109.7
186	E	29.8	Very low	28.2	Very low	175 Å²	175	149.4 Å²	149.4	82%	0.818	82%	0.816	S	S	*	*			trans	-91.8	130.6	162.7	-86.6	-176.4	143.2	0	0	110.7	S184 L188	S184-E186 PolarHBondContact O-N 2.72Å; S184-E186 VanDerWaalsContact O-N 3.12Å; E186-L188 PolarHBondContact O-N 2.85Å
187	K	27.4	Very low	28.5	Very low	213 Å²	213	146.6 Å²	146.6	93%	0.926	81%	0.809	S	S	*	*			trans	-56.5	122	174.6	-70.8	170.1	173.6	175.1	0	110.6
188	L	30	Very low	28.6	Very low	176 Å²	176	146.8 Å²	146.8	92%	0.921	81%	0.81	S	S	*	*			trans	-104.5	110.2	163.6	-77.9	168.7	0	0	0	109.7	E186	E186-L188 PolarHBondContact O-N 2.85Å
189	N	28.8	Very low	28.7	Very low	172 Å²	172	146.2 Å²	146.2	92%	0.92	81%	0.807	S	S	*	*			trans	-100	124	161.9	-120.5	0.4	0	0	0	107
190	G	31.2	Very low	29.1	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	80%	0.797	S	S	*	*			trans	149.4	70.2	170.7	0	0	0	0	0	117
191	S	31.1	Very low	29.1	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	79%	0.791	S	S	*	*			trans	35.1	112.4	136.6	-150.4	0	0	0	0	120.4
192	N	29.9	Very low	29.2	Very low	128 Å²	128	143 Å²	143	68%	0.684	80%	0.796	S	S	*	*				175.8	118.2	101.9	-90.6	-23.1	0	0	0	113.1
193	H	28.7	Very low	29.2	Very low	155 Å²	155	142.3 Å²	142.3	72%	0.718	79%	0.794	S	S	*	*			trans	63.5	125.1	135.5	-62.4	-36.5	0	0	0	124
194	Q	29	Very low	29.5	Very low	188 Å²	188	143.4 Å²	143.4	88%	0.879	79%	0.793	S	S	*	*			trans	101	107.1	134.9	-117.6	114.9	9.9	0	0	117.8
195	G	28.1	Very low	29.5	Very low	81 Å²	81	144.2 Å²	144.2	84%	0.835	80%	0.795	S	S	*	*			trans	168	72.7	168.6	0	0	0	0	0	112.2
196	M	26	Very low	29.5	Very low	169 Å²	169	145.9 Å²	145.9	83%	0.833	79%	0.792	S	S	*	*			trans	-67.8	153.9	178.3	-93.3	-170.7	84.9	0	0	113.5
197	I	29.6	Very low	29.6	Very low	126 Å²	126	145.8 Å²	145.8	65%	0.646	79%	0.792	S	S	*	*			trans	84.4	98.3	151.3	-59.1	144.9	0	0	0	117.3
198	N	30.6	Very low	29.9	Very low	158 Å²	158	144.9 Å²	144.9	85%	0.845	79%	0.791	S	S	*	*				-176.9	129.2	110	-88.6	-34.8	0	0	0	111.7
199	K	29.6	Very low	30.1	Very low	198 Å²	198	143 Å²	143	86%	0.861	79%	0.786	S	S	*	*			trans	-140.4	171.3	173.2	-137	-163.4	-179.5	-178.6	0	104.7
200	P	36.9	Very low	30.1	Very low	105 Å²	105	142.5 Å²	142.5	68%	0.682	78%	0.784	S	S	*	*				-127.6	-179.7	-64.1	30.7	-12.1	0	0	0	111.1
201	S	26.9	Very low	30.4	Very low	100 Å²	100	146.5 Å²	146.5	70%	0.699	79%	0.786	S	S	*	*				173.1	132.8	129.8	50	0	0	0	0	111.8
202	L	29.7	Very low	30.3	Very low	153 Å²	153	149.2 Å²	149.2	80%	0.801	79%	0.793	S	S	*	*			trans	-145	106.2	131.8	-148.9	91.7	0	0	0	107
203	N	28.8	Very low	30.7	Very low	141 Å²	141	151.8 Å²	151.8	75%	0.754	80%	0.801	S	S	*	*			trans	-77.6	135	167.2	-69.6	-31.8	0	0	0	107.7
204	H	30.4	Very low	30.8	Very low	174 Å²	174	148.8 Å²	148.8	81%	0.806	80%	0.797	S	S	*	*			trans	-110.3	119.9	153	-101.1	-69.5	0	0	0	108.9
205	T	30	Very low	30.9	Very low	118 Å²	118	147.1 Å²	147.1	72%	0.724	79%	0.793	S	S	*	*			trans	-63.9	136.2	-178.6	-57.8	0	0	0	0	111.8	E207	T205-E207 HydrophobicContact CG2-CG 4.36Å
206	I	27.9	Very low	31.2	Very low	161 Å²	161	149.2 Å²	149.2	83%	0.826	80%	0.795	S	S	*	*			trans	-93.7	116.3	164.1	-64.2	168.2	0	0	0	106.5
207	E	30.3	Very low	31.4	Very low	173 Å²	173	147.4 Å²	147.4	81%	0.808	79%	0.789	S	S	*	*			trans	-145.9	113.3	153.9	-78	-167.9	169.2	0	0	106.6	T205	T205-E207 HydrophobicContact CG2-CG 4.36Å
208	E	34.9	Very low	31.5	Very low	194 Å²	194	149.2 Å²	149.2	91%	0.907	80%	0.797	S	S	*	*			trans	-171.7	142.6	131.9	-100.5	175.3	-160	0	0	109.7
209	T	34	Very low	31.4	Very low	135 Å²	135	148.7 Å²	148.7	83%	0.828	79%	0.794	S	S	*	*			trans	-90.2	150.7	-155.6	44.3	0	0	0	0	114
210	N	28	Very low	31.6	Very low	163 Å²	163	145 Å²	145	87%	0.872	79%	0.793	S	S	*	*			trans	-36.7	129.6	166.7	-70.3	-49.1	0	0	0	115.2
211	I	39.2	Very low	31.1	Very low	157 Å²	157	143.5 Å²	143.5	81%	0.805	79%	0.789	S	S	*	*			trans	-137.1	115.9	139.2	-60.3	-177.9	0	0	0	107.5
212	D	28.7	Very low	31.3	Very low	157 Å²	157	148 Å²	148	84%	0.84	80%	0.799	S	S	*	*			trans	-78.4	114.7	166.8	-180	23.9	0	0	0	107.6
213	E	38	Very low	31.4	Very low	182 Å²	182	147.5 Å²	147.5	85%	0.85	79%	0.792	S	S	*	*			trans	-142.2	112.2	164.9	-127.3	177.1	-164.2	0	0	110
214	S	30.7	Very low	31.6	Very low	92 Å²	92	148.1 Å²	148.1	64%	0.643	80%	0.796	S	S	*	*			trans	-65.4	154.4	175.7	52.5	0	0	0	0	114.1
215	L	30.8	Very low	31.8	Very low	152 Å²	152	145.4 Å²	145.4	80%	0.796	79%	0.786	S	S	*	*			trans	85.9	92.1	158.2	-62	160.3	0	0	0	118.2
216	S	33.7	Very low	31.9	Very low	125 Å²	125	147.3 Å²	147.3	87%	0.874	79%	0.792	S	S	*	*			trans	-134.7	107	135.5	61.1	0	0	0	0	110.5
217	D	30.1	Very low	32.2	Very low	132 Å²	132	148.4 Å²	148.4	71%	0.706	79%	0.794	S	S	*	*			trans	-74	158	162.2	-77.1	-45.3	0	0	0	111.2
218	M	33.5	Very low	32.5	Very low	163 Å²	163	142.6 Å²	142.6	80%	0.803	77%	0.772	S	S	*	*			trans	77.6	119.4	168.8	-45.2	-87.3	78	0	0	114.9
219	D	28.3	Very low	32.4	Very low	147 Å²	147	141.6 Å²	141.6	79%	0.786	77%	0.768	S	S	*	*			cis	-145.9	121.8	8.5	-94	-37.9	0	0	0	106.5
220	S	32.2	Very low	32.7	Very low	121 Å²	121	140 Å²	140	85%	0.846	76%	0.758	S	S	*	*			trans	-91.8	127.5	176.4	-156	0	0	0	0	110.2	H222	S220-H222 PolarHBondContact O-N 2.89Å
221	A	27.9	Very low	32.9	Very low	73 Å²	73	135.8 Å²	135.8	60%	0.603	74%	0.741	S	S	*	*			trans	-53	117.8	177.4	0	0	0	0	0	112.3	H223	A221-H223 PolarHBondContact O-N 3Å
222	H	30.4	Very low	32.6	Very low	195 Å²	195	133 Å²	133	90%	0.903	73%	0.727	S	S	*	*			trans	-73.9	83.8	150.2	-92.1	-78.7	0	0	0	107.7	S220 D224	S220-H222 PolarHBondContact O-N 2.89Å; H222-D224 PolarHBondContact O-N 2.98Å
223	H	32.3	Very low	32.8	Very low	142 Å²	142	128.8 Å²	128.8	66%	0.657	71%	0.71	S	S	*	*			trans	-70.8	106.7	160.9	-108.8	-66.6	0	0	0	107.5	A221 L225	A221-H223 PolarHBondContact O-N 3Å; H223-L225 HydrophobicContact CB-CD1 4.03Å; H223-L225 HydrophobicContact CB-CG 4.04Å; H223-L225 PolarHBondContact O-N 3.11Å
224	D	31.6	Very low	32.7	Very low	155 Å²	155	127.5 Å²	127.5	83%	0.829	70%	0.698	S	S	*	*			trans	-59.3	89.8	154.7	-84.4	-35.1	0	0	0	107.7	H222	H222-D224 PolarHBondContact O-N 2.98Å
225	L	34.7	Very low	32.9	Very low	116 Å²	116	129.8 Å²	129.8	61%	0.607	70%	0.702	S	S	*	*			trans	-119.9	70.2	168.7	-74	172.6	0	0	0	107.3	H223	H223-L225 HydrophobicContact CB-CD1 4.03Å; H223-L225 HydrophobicContact CB-CG 4.04Å; H223-L225 PolarHBondContact O-N 3.11Å
226	N	32.6	Very low	33	Very low	158 Å²	158	128.3 Å²	128.3	85%	0.845	70%	0.699	S	S	*	*			trans	-113.6	18.3	173.2	-102.3	2.8	0	0	0	112.9
227	E	33.9	Very low	33.4	Very low	184 Å²	184	131.9 Å²	131.9	86%	0.86	69%	0.693	S	S	*	*	S	Bend	trans	-115.8	10.1	-179.9	-68.2	-165.6	161	0	0	114.9
228	S	36.3	Very low	34.2	Very low	51 Å²	51	128.2 Å²	128.2	36%	0.357	69%	0.687	S	S	.	*	S	Bend	trans	-120.4	-8.1	-171.5	41.5	0	0	0	0	116.6	I232	S228-I232 WeakPolarHBondContact O-CD1 3.39Å; S228-I232 VanDerWaalsContact O-CG1 3.27Å; S228-I232 WeakPolarHBondContact O-CG1 3.38Å; S228-I232 PolarHBondContact O-N 3.26Å
229	E	33.1	Very low	35	Very low	173 Å²	173	123.5 Å²	123.5	81%	0.808	67%	0.665	S	S	*	*	H	α-helix	trans	-76.2	-31.4	179.3	-68.3	-164.5	154.1	0	0	113.2	S231	E229-S231 PolarHBondContact O-N 3.29Å
230	T	39.7	Very low	36.2	Very low	101 Å²	101	120.9 Å²	120.9	62%	0.62	65%	0.648	S	S	*	*	H	α-helix	trans	-72.8	-29.1	178.8	-19.3	0	0	0	0	112.5	S233 Y234	T230-S233 PolarHBondContact O-OG 2.97Å; T230-Y234 VanDerWaalsContact O-CD2 3.31Å; T230-Y234 WeakPolarHBondContact O-CD2 3.27Å
231	S	32.5	Very low	37.5	Very low	76 Å²	76	117.3 Å²	117.3	53%	0.531	62%	0.618	S	S	.	*	H	α-helix	trans	-82.4	-24	-179	-58.1	0	0	0	0	112.8	E229	E229-S231 PolarHBondContact O-N 3.29Å
232	I	32.7	Very low	39.2	Very low	99 Å²	99	115.3 Å²	115.3	51%	0.508	60%	0.598	S	S	.	*	H	α-helix	trans	-84.4	-24.2	-178.9	-66	169.8	0	0	0	111.9	S228 Y234 I235 T236	S228-I232 WeakPolarHBondContact O-CD1 3.39Å; S228-I232 VanDerWaalsContact O-CG1 3.27Å; S228-I232 WeakPolarHBondContact O-CG1 3.38Å; S228-I232 PolarHBondContact O-N 3.26Å; I232-Y234 VanDerWaalsContact C-N 3.27Å; I232-Y234 PolarHBondContact O-N 3.32Å; I232-I235 PolarHBondContact O-N 3.04Å; I232-I235 VanDerWaalsContact O-N 3.14Å; I232-T236 PolarHBondContact O-N 3.47Å; I232-T236 PolarHBondContact O-OG1 3.5Å
233	S	33.5	Very low	40.8	Very low	67 Å²	67	110 Å²	110	47%	0.469	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-27.5	176.6	66.6	0	0	0	0	113.2	T230 I235	T230-S233 PolarHBondContact O-OG 2.97Å; S233-I235 VanDerWaalsContact C-N 3.32Å
234	Y	36.1	Very low	42.2	Very low	155 Å²	155	105 Å²	105	61%	0.608	55%	0.551	S	S	*	*	H	α-helix	trans	-75.4	-19.9	174.2	-73.3	-81.5	0	0	0	113.3	T230 I232	T230-Y234 VanDerWaalsContact O-CD2 3.31Å; T230-Y234 WeakPolarHBondContact O-CD2 3.27Å; I232-Y234 VanDerWaalsContact C-N 3.27Å; I232-Y234 PolarHBondContact O-N 3.32Å
235	I	34.8	Very low	43.7	Very low	140 Å²	140	98.6 Å²	98.6	72%	0.718	52%	0.517	S	S	*	.	H	α-helix	trans	-87.8	-24.3	-178.4	-60	172.2	0	0	0	111	I232 S233	I232-I235 PolarHBondContact O-N 3.04Å; I232-I235 VanDerWaalsContact O-N 3.14Å; S233-I235 VanDerWaalsContact C-N 3.32Å
236	T	34.1	Very low	45	Very low	121 Å²	121	99.2 Å²	99.2	74%	0.742	52%	0.517	S	S	*	.	H	α-helix	trans	-84.4	-20.5	-179.6	12.6	0	0	0	0	114	I232	I232-T236 PolarHBondContact O-N 3.47Å; I232-T236 PolarHBondContact O-OG1 3.5Å
237	R	42	Very low	46.5	Very low	200 Å²	200	98 Å²	98	76%	0.755	51%	0.51	S	S	*	.	S	Bend	trans	-101.6	104.7	163.2	-100.2	177.7	172.5	163.8	-3.2	107.1	L239	R237-L239 PolarHBondContact O-N 3.2Å
238	G	45.6	Very low	47.9	Very low	55 Å²	55	90.5 Å²	90.5	57%	0.567	48%	0.476	S	S	*	.			trans	-49	132.9	177.8	0	0	0	0	0	111.1	Q240	G238-Q240 VanDerWaalsContact O-CG 3.25Å; G238-Q240 WeakPolarHBondContact O-CG 3.44Å; G238-Q240 PolarHBondContact O-N 2.8Å
239	L	50.7	Low	49.1	Very low	65 Å²	65	91.5 Å²	91.5	34%	0.34	48%	0.477	S	S	.	.			trans	-47.3	110.6	-176.8	-64.5	165.9	0	0	0	110.2	D119 R237 Y244	D119-L239 HydrophobicContact CB-CD1 3.64Å; R237-L239 PolarHBondContact O-N 3.2Å; L239-Y244 HydrophobicContact CB-CE2 4.37Å; L239-Y244 HydrophobicContact CD2-CE2 3.85Å; L239-Y244 WeakPolarHBondContact CD2-OH 3.45Å
240	Q	54.4	Low	50.7	Low	92 Å²	92	84.4 Å²	84.4	43%	0.43	44%	0.443	S	S	.	.			trans	-94.9	132.6	177.8	-54.1	-166	-0.4	0	0	108.8	G238 I242 D243 Y244	G238-Q240 VanDerWaalsContact O-CG 3.25Å; G238-Q240 WeakPolarHBondContact O-CG 3.44Å; G238-Q240 PolarHBondContact O-N 2.8Å; Q240-I242 HydrophobicContact CB-CG2 3.83Å; Q240-I242 PolarHBondContact O-N 2.99Å; Q240-D243 WeakPolarHBondContact CB-OD2 3.41Å; Q240-D243 WeakPolarHBondContact O-CB 3.38Å; Q240-D243 PolarHBondContact O-N 3.33Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.17Å
241	I	59.1	Low	51.8	Low	45 Å²	45	79.6 Å²	79.6	23%	0.231	41%	0.414	C	S	.	.	H	α-helix	trans	-52.6	-31.5	177.5	-62.4	169.5	0	0	0	111.2	F115 I123 L144 V146 D243 Y244 L245	F115-I241 HydrophobicContact CE2-CG2 4.26Å; F115-I241 HydrophobicContact CZ-CG2 3.79Å; I123-I241 HydrophobicContact CD1-CD1 3.81Å; I123-I241 HydrophobicContact CD1-CG1 3.86Å; I123-I241 HydrophobicContact CG1-CG1 4.34Å; I123-I241 HydrophobicContact CG2-CG2 4.02Å; L144-I241 HydrophobicContact CD2-CD1 4.15Å; V146-I241 HydrophobicContact CG2-CD1 3.94Å; I241-D243 VanDerWaalsContact C-N 3.31Å; I241-D243 PolarHBondContact O-N 3.1Å; I241-Y244 PolarHBondContact O-N 3.27Å; I241-L245 HydrophobicContact CG2-CG 4.43Å; I241-L245 PolarHBondContact O-N 3.34Å; I241-L245 VanDerWaalsContact O-N 3.11Å
242	I	63.5	Low	53.4	Low	32 Å²	32	76.5 Å²	76.5	16%	0.164	39%	0.392	C	S	.	.	H	α-helix	trans	-64.8	-33.4	179.8	-161.6	162.6	0	0	0	113.3	L14 Y18 Q240 Y244 L245	L14-I242 HydrophobicContact CD2-CD1 4.01Å; L14-I242 HydrophobicContact CG-CD1 4.34Å; Y18-I242 HydrophobicContact CD2-CD1 3.53Å; Y18-I242 HydrophobicContact CE2-CD1 3.77Å; Y18-I242 HydrophobicContact CG-CD1 4.18Å; Q240-I242 HydrophobicContact CB-CG2 3.83Å; Q240-I242 PolarHBondContact O-N 2.99Å; I242-Y244 PolarHBondContact O-N 3.17Å; I242-L245 PolarHBondContact O-N 3.09Å
243	D	63.2	Low	54.9	Low	83 Å²	83	72.1 Å²	72.1	44%	0.444	37%	0.37	S	S	.	.	H	α-helix	trans	-68.2	-18.4	180	-56.8	-28.6	0	0	0	111.3	Q240 I241	Q240-D243 WeakPolarHBondContact CB-OD2 3.41Å; Q240-D243 WeakPolarHBondContact O-CB 3.38Å; Q240-D243 PolarHBondContact O-N 3.33Å; I241-D243 VanDerWaalsContact C-N 3.31Å; I241-D243 PolarHBondContact O-N 3.1Å
244	Y	62.8	Low	56.5	Low	36 Å²	36	68.9 Å²	68.9	14%	0.141	35%	0.348	C	S	.	.	H	α-helix	trans	-110.5	-5	-179.4	-62	-82.3	0	0	0	113.2	L117 P118 L239 Q240 I241 I242 E246 D247	L117-Y244 HydrophobicContact CD2-CD1 4.11Å; L117-Y244 HydrophobicContact CD2-CD2 3.38Å; L117-Y244 HydrophobicContact CD2-CE2 4.1Å; L117-Y244 HydrophobicContact CD2-CG 3.38Å; P118-Y244 VanDerWaalsContact CD-CE1 3.44Å; P118-Y244 HydrophobicContact CG-CE1 3.61Å; L239-Y244 HydrophobicContact CB-CE2 4.37Å; L239-Y244 HydrophobicContact CD2-CE2 3.85Å; L239-Y244 WeakPolarHBondContact CD2-OH 3.45Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.17Å; I241-Y244 PolarHBondContact O-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.17Å; Y244-E246 PolarHBondContact O-N 2.6Å; Y244-D247 PolarHBondContact O-N 3.41Å
245	L	63	Low	57.9	Low	22 Å²	22	62.5 Å²	62.5	12%	0.115	32%	0.324	C	S	.	.	H	α-helix	trans	-69.3	-22.5	170.9	-83.1	171.4	0	0	0	111.5	F115 I241 I242 D247 D248 A251 A252 L255	F115-L245 HydrophobicContact CE1-CD2 4.03Å; F115-L245 HydrophobicContact CZ-CD2 4Å; F115-L245 HydrophobicContact CZ-CG 4.39Å; I241-L245 HydrophobicContact CG2-CG 4.43Å; I241-L245 PolarHBondContact O-N 3.34Å; I241-L245 VanDerWaalsContact O-N 3.11Å; I242-L245 PolarHBondContact O-N 3.09Å; L245-D247 PolarHBondContact O-N 2.76Å; L245-D248 CarbonylContact O-C 3.51Å; L245-D248 PolarHBondContact O-N 2.78Å; L245-D248 VanDerWaalsContact O-O 3.13Å; L245-A251 HydrophobicContact CD2-CB 3.7Å; L245-A252 HydrophobicContact CB-CB 4.49Å; L245-L255 HydrophobicContact CD1-CD1 3.59Å; L245-L255 HydrophobicContact CD2-CD1 3.63Å; L245-L255 HydrophobicContact CG-CD1 4.3Å
246	E	62.2	Low	59.3	Low	129 Å²	129	58.6 Å²	58.6	60%	0.603	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-28	172.7	-60.6	-171.3	-178.7	0	0	112	F22 Y244	F22-E246 HydrophobicContact CE2-CG 4.44Å; F22-E246 HydrophobicContact CZ-CG 4.04Å; Y244-E246 PolarHBondContact O-N 2.6Å
247	D	63.8	Low	60.5	Low	132 Å²	132	53 Å²	53	71%	0.706	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-21.7	178.2	-62	-31.8	0	0	0	113	Y244 L245	Y244-D247 PolarHBondContact O-N 3.41Å; L245-D247 PolarHBondContact O-N 2.76Å
248	D	62.8	Low	61.2	Low	27 Å²	27	48 Å²	48	14%	0.144	26%	0.256	C	S	.	.			trans	-120.4	84.3	175.3	-174.1	-12.2	0	0	0	110.7	S113 F115 L245 W250 A251 A252	S113-D248 PolarHBondContact OG-OD1 3.43Å; S113-D248 PolarHBondContact OG-OD2 2.8Å; F115-D248 HydrophobicContact CB-CB 4.49Å; F115-D248 HydrophobicContact CD1-CB 4.23Å; L245-D248 CarbonylContact O-C 3.51Å; L245-D248 PolarHBondContact O-N 2.78Å; L245-D248 VanDerWaalsContact O-O 3.13Å; D248-W250 PolarHBondContact O-N 2.79Å; D248-W250 VanDerWaalsContact O-N 3.09Å; D248-W250 WeakPolarHBondContact OD1-CB 3.49Å; D248-W250 PolarHBondContact OD1-N 3.36Å; D248-W250 VanDerWaalsContact OD1-N 3.09Å; D248-A251 HydrophobicContact CB-CB 3.9Å; D248-A251 VanDerWaalsContact CG-CB 3.45Å; D248-A251 WeakPolarHBondContact O-CB 3.33Å; D248-A251 PolarHBondContact O-N 2.8Å; D248-A251 PolarHBondContact OD1-N 2.77Å; D248-A251 WeakPolarHBondContact OD2-CB 3.49Å; D248-A252 PolarHBondContact O-N 2.81Å
249	L	62	Low	61.5	Low	72 Å²	72	49.5 Å²	49.5	38%	0.377	25%	0.252	S	S	.	.	H	α-helix	trans	-55.1	-30.2	179.3	-154.4	78	0	0	0	112.4	T253	L249-T253 WeakPolarHBondContact O-CB 3.45Å; L249-T253 PolarHBondContact O-N 2.79Å; L249-T253 PolarHBondContact O-OG1 2.75Å
250	W	65.9	Low	61.5	Low	24 Å²	24	47.3 Å²	47.3	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-73.1	-45.4	178.4	-179.3	-120.1	0	0	0	111.3	Y111 A112 D248 A252 T253 I254 L266 L269 E270 C273	Y111-W250 AromaticContact CD1-CH2 3.71Å; Y111-W250 HydrophobicContact CD1-CH2 3.71Å; Y111-W250 AromaticContact CD1-CZ2 3.76Å; Y111-W250 HydrophobicContact CD1-CZ2 3.76Å; Y111-W250 HydrophobicContact CE1-CH2 4.3Å; Y111-W250 HydrophobicContact CG-CZ2 4.43Å; A112-W250 PolarHBondContact O-NE1 3.38Å; D248-W250 PolarHBondContact O-N 2.79Å; D248-W250 VanDerWaalsContact O-N 3.09Å; D248-W250 WeakPolarHBondContact OD1-CB 3.49Å; D248-W250 PolarHBondContact OD1-N 3.36Å; D248-W250 VanDerWaalsContact OD1-N 3.09Å; W250-A252 PolarHBondContact O-N 3.03Å; W250-T253 PolarHBondContact O-N 2.95Å; W250-I254 HydrophobicContact CD2-CD1 4.17Å; W250-I254 HydrophobicContact CD2-CG1 4.39Å; W250-I254 HydrophobicContact CG-CD1 4.29Å; W250-I254 HydrophobicContact CZ2-CD1 4.09Å; W250-I254 HydrophobicContact CZ2-CG1 4.33Å; W250-I254 VanDerWaalsContact O-CG1 3.28Å; W250-I254 WeakPolarHBondContact O-CG1 3.29Å; W250-I254 PolarHBondContact O-N 3.43Å; W250-L266 HydrophobicContact CH2-CD2 4.28Å; W250-L266 VanDerWaalsContact CH2-O 3.27Å; W250-L266 WeakPolarHBondContact CH2-O 3.31Å; W250-L266 HydrophobicContact CZ3-CD2 4.15Å; W250-L266 WeakPolarHBondContact CZ3-O 3.4Å; W250-L269 HydrophobicContact CE3-CB 4.15Å; W250-L269 HydrophobicContact CZ3-CB 3.9Å; W250-E270 HydrophobicContact CH2-CB 3.72Å; W250-E270 HydrophobicContact CH2-CG 4.31Å; W250-E270 HydrophobicContact CZ2-CB 4.41Å; W250-E270 HydrophobicContact CZ3-CB 4.12Å; W250-C273 HydrophobicContact CB-CB 4.26Å
251	A	63.5	Low	61.4	Low	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-44.2	172.5	0	0	0	0	0	112.1	F115 V125 L245 D248 T253 I254 L255	F115-A251 HydrophobicContact CD1-CB 4.13Å; F115-A251 HydrophobicContact CE1-CB 3.87Å; V125-A251 HydrophobicContact CG2-CB 4.21Å; L245-A251 HydrophobicContact CD2-CB 3.7Å; D248-A251 HydrophobicContact CB-CB 3.9Å; D248-A251 VanDerWaalsContact CG-CB 3.45Å; D248-A251 WeakPolarHBondContact O-CB 3.33Å; D248-A251 PolarHBondContact O-N 2.8Å; D248-A251 PolarHBondContact OD1-N 2.77Å; D248-A251 WeakPolarHBondContact OD2-CB 3.49Å; A251-T253 VanDerWaalsContact C-N 3.35Å; A251-T253 PolarHBondContact O-N 3.24Å; A251-I254 PolarHBondContact O-N 3.03Å; A251-L255 WeakPolarHBondContact O-CG 3.27Å; A251-L255 PolarHBondContact O-N 3.05Å; A251-L255 VanDerWaalsContact O-N 3.13Å
252	A	65.9	Low	61	Low	10 Å²	10	47.4 Å²	47.4	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-59.3	-45.7	176.5	0	0	0	0	0	111.7	F22 L245 D248 W250 I254 L255 Q256	F22-A252 HydrophobicContact CE1-CB 4.26Å; L245-A252 HydrophobicContact CB-CB 4.49Å; D248-A252 PolarHBondContact O-N 2.81Å; W250-A252 PolarHBondContact O-N 3.03Å; A252-I254 PolarHBondContact O-N 3.39Å; A252-L255 PolarHBondContact O-N 3.39Å; A252-Q256 WeakPolarHBondContact O-CB 3.31Å; A252-Q256 PolarHBondContact O-N 3.4Å
253	T	64.6	Low	60.4	Low	7 Å²	7	46.1 Å²	46.1	4%	0.043	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-42.7	179.5	-55.5	0	0	0	0	111.9	L249 W250 A251 L255 Q256 C257 L266 L269	L249-T253 WeakPolarHBondContact O-CB 3.45Å; L249-T253 PolarHBondContact O-N 2.79Å; L249-T253 PolarHBondContact O-OG1 2.75Å; W250-T253 PolarHBondContact O-N 2.95Å; A251-T253 VanDerWaalsContact C-N 3.35Å; A251-T253 PolarHBondContact O-N 3.24Å; T253-L255 PolarHBondContact O-N 3.17Å; T253-Q256 PolarHBondContact O-N 2.97Å; T253-C257 PolarHBondContact O-N 2.96Å; T253-C257 PolarHBondContact O-SG 3.06Å; T253-C257 VanDerWaalsContact O-SG 3.33Å; T253-L266 HydrophobicContact CG2-CD2 3.56Å; T253-L266 HydrophobicContact CG2-CG 4.34Å; T253-L269 HydrophobicContact CG2-CD1 3.3Å
254	I	66.2	Low	59.8	Low	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-56.3	-43.5	176.7	-74.1	171.6	0	0	0	110.6	V125 R127 L142 W250 A251 A252 L266	V125-I254 HydrophobicContact CG1-CB 4.21Å; V125-I254 HydrophobicContact CG1-CG2 3.63Å; R127-I254 HydrophobicContact CB-CG2 3.52Å; R127-I254 PolarHBondContact NH1-O 3.42Å; R127-I254 VanDerWaalsContact NH1-O 3.1Å; L142-I254 HydrophobicContact CD2-CG2 4.21Å; L142-I254 WeakPolarHBondContact CD2-O 3.37Å; W250-I254 HydrophobicContact CD2-CD1 4.17Å; W250-I254 HydrophobicContact CD2-CG1 4.39Å; W250-I254 HydrophobicContact CG-CD1 4.29Å; W250-I254 HydrophobicContact CZ2-CD1 4.09Å; W250-I254 HydrophobicContact CZ2-CG1 4.33Å; W250-I254 VanDerWaalsContact O-CG1 3.28Å; W250-I254 WeakPolarHBondContact O-CG1 3.29Å; W250-I254 PolarHBondContact O-N 3.43Å; A251-I254 PolarHBondContact O-N 3.03Å; A252-I254 PolarHBondContact O-N 3.39Å; I254-L266 HydrophobicContact CG1-CD2 4.12Å
255	L	66.2	Low	59.2	Low	20 Å²	20	46.2 Å²	46.2	11%	0.105	26%	0.26	C	S	.	.	H	α-helix	trans	-74.4	-34.6	-179.7	-70.2	169.9	0	0	0	113.1	M11 M15 V125 L245 A251 A252 T253 C257	M11-L255 HydrophobicContact CE-CD2 4.18Å; M15-L255 WeakPolarHBondContact CE-O 3.46Å; V125-L255 HydrophobicContact CG1-CD1 4.31Å; V125-L255 HydrophobicContact CG1-CD2 3.74Å; V125-L255 HydrophobicContact CG1-CG 3.74Å; V125-L255 HydrophobicContact CG2-CD1 4.19Å; L245-L255 HydrophobicContact CD1-CD1 3.59Å; L245-L255 HydrophobicContact CD2-CD1 3.63Å; L245-L255 HydrophobicContact CG-CD1 4.3Å; A251-L255 WeakPolarHBondContact O-CG 3.27Å; A251-L255 PolarHBondContact O-N 3.05Å; A251-L255 VanDerWaalsContact O-N 3.13Å; A252-L255 PolarHBondContact O-N 3.39Å; T253-L255 PolarHBondContact O-N 3.17Å; L255-C257 PolarHBondContact O-N 2.9Å
256	Q	63.6	Low	58.8	Low	58 Å²	58	45.2 Å²	45.2	27%	0.271	25%	0.254	S	S	.	.	H	α-helix	trans	-71.2	-32.3	-174.3	-166.7	173.8	27.9	0	0	113.3	M15 A252 T253 D258	M15-Q256 VanDerWaalsContact CE-CA 3.48Å; M15-Q256 HydrophobicContact CE-CB 4.44Å; M15-Q256 HydrophobicContact CE-CG 4.37Å; A252-Q256 WeakPolarHBondContact O-CB 3.31Å; A252-Q256 PolarHBondContact O-N 3.4Å; T253-Q256 PolarHBondContact O-N 2.97Å; Q256-D258 PolarHBondContact O-N 3.4Å
257	C	59.4	Low	58.4	Low	4 Å²	4	45.1 Å²	45.1	3%	0.027	25%	0.248	C	C	.	.			trans	-75.1	110.5	-175.7	-66.9	0	0	0	0	109.3	R127 T253 L255 N262 L266	R127-C257 PolarHBondContact NH1-O 3.41Å; R127-C257 PolarHBondContact NH2-O 3.22Å; T253-C257 PolarHBondContact O-N 2.96Å; T253-C257 PolarHBondContact O-SG 3.06Å; T253-C257 VanDerWaalsContact O-SG 3.33Å; L255-C257 PolarHBondContact O-N 2.9Å; C257-N262 HydrophobicContact CB-CB 3.63Å; C257-N262 WeakPolarHBondContact SG-CB 3.12Å; C257-L266 HydrophobicContact CB-CD1 4.1Å
258	D	57.7	Low	57.9	Low	94 Å²	94	45.5 Å²	45.5	50%	0.503	25%	0.246	S	C	.	.			trans	-89.8	-20.7	179.2	53.1	-5.2	0	0	0	112.8	Q256	Q256-D258 PolarHBondContact O-N 3.4Å
259	N	50.2	Low	57.4	Low	88 Å²	88	45.5 Å²	45.5	47%	0.471	25%	0.246	S	C	.	.	S	Bend	trans	-120.5	150.6	-176.1	-69.8	-26.6	0	0	0	113.2	R127 S261 N262	R127-N259 PolarHBondContact NH2-O 2.71Å; N259-S261 WeakPolarHBondContact CB-OG 3.44Å; N259-S261 PolarHBondContact O-N 3.4Å; N259-N262 PolarHBondContact O-N 2.8Å; N259-N262 VanDerWaalsContact O-N 3.17Å
260	S	51.3	Low	57	Low	19 Å²	19	44.8 Å²	44.8	13%	0.133	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-58.6	-22.3	174.3	60.3	0	0	0	0	113.5	E138 N262 A263	E138-S260 WeakPolarHBondContact OE2-CB 3.16Å; E138-S260 PolarHBondContact OE2-OG 2.72Å; S260-N262 PolarHBondContact O-N 2.82Å; S260-A263 WeakPolarHBondContact O-CB 3.23Å; S260-A263 PolarHBondContact O-N 2.78Å; S260-A263 VanDerWaalsContact O-N 3.09Å
261	S	51.8	Low	56.2	Low	92 Å²	92	47.6 Å²	47.6	64%	0.643	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-63.8	-20.6	176.1	50.1	0	0	0	0	112.9	N259 A263	N259-S261 WeakPolarHBondContact CB-OG 3.44Å; N259-S261 PolarHBondContact O-N 3.4Å; S261-A263 PolarHBondContact O-N 2.76Å
262	N	51.4	Low	55.2	Low	47 Å²	47	50.7 Å²	50.7	25%	0.251	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-82.6	3.7	175.1	-68	-29.7	0	0	0	113.7	C257 N259 S260 G264 L265 L266	C257-N262 HydrophobicContact CB-CB 3.63Å; C257-N262 WeakPolarHBondContact SG-CB 3.12Å; N259-N262 PolarHBondContact O-N 2.8Å; N259-N262 VanDerWaalsContact O-N 3.17Å; S260-N262 PolarHBondContact O-N 2.82Å; N262-G264 PolarHBondContact O-N 2.7Å; N262-G264 VanDerWaalsContact O-N 3.17Å; N262-L265 WeakPolarHBondContact O-CB 3.41Å; N262-L265 PolarHBondContact O-N 2.93Å; N262-L266 PolarHBondContact O-N 3.04Å
263	A	52	Low	54.2	Low	4 Å²	4	52.8 Å²	52.8	3%	0.033	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-19.2	176.5	0	0	0	0	0	113.9	E129 S260 S261 R267	E129-A263 WeakPolarHBondContact OE2-CB 3.42Å; S260-A263 WeakPolarHBondContact O-CB 3.23Å; S260-A263 PolarHBondContact O-N 2.78Å; S260-A263 VanDerWaalsContact O-N 3.09Å; S261-A263 PolarHBondContact O-N 2.76Å; A263-R267 WeakPolarHBondContact O-CB 3.34Å; A263-R267 PolarHBondContact O-N 3.22Å
264	G	50.6	Low	53.1	Low	42 Å²	42	59.9 Å²	59.9	43%	0.433	34%	0.34	S	S	.	.	H	α-helix	trans	-70.5	-44.8	168.5	0	0	0	0	0	111.9	N262 R267 Q268	N262-G264 PolarHBondContact O-N 2.7Å; N262-G264 VanDerWaalsContact O-N 3.17Å; G264-R267 PolarHBondContact O-N 2.78Å; G264-Q268 PolarHBondContact O-N 2.52Å
265	L	50.4	Low	51.9	Low	80 Å²	80	66.1 Å²	66.1	42%	0.419	37%	0.373	S	S	.	.	H	α-helix	trans	-68.5	-44.7	-179	-148.2	119	0	0	0	111.7	N262 R267 Q268 L269	N262-L265 WeakPolarHBondContact O-CB 3.41Å; N262-L265 PolarHBondContact O-N 2.93Å; L265-R267 PolarHBondContact O-N 3.13Å; L265-Q268 PolarHBondContact O-N 3.21Å; L265-L269 HydrophobicContact CD2-CD1 3.95Å; L265-L269 PolarHBondContact O-N 3.12Å
266	L	53.7	Low	50.4	Low	0 Å²	0	71.9 Å²	71.9	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-61.2	-31.5	172.6	-76.8	165.7	0	0	0	112.2	Y111 W250 T253 I254 C257 N262 E270	Y111-L266 HydrophobicContact CD1-CB 4.45Å; Y111-L266 HydrophobicContact CD2-CD1 4.37Å; Y111-L266 HydrophobicContact CE1-CB 3.97Å; Y111-L266 HydrophobicContact CE2-CD1 4.18Å; W250-L266 HydrophobicContact CH2-CD2 4.28Å; W250-L266 VanDerWaalsContact CH2-O 3.27Å; W250-L266 WeakPolarHBondContact CH2-O 3.31Å; W250-L266 HydrophobicContact CZ3-CD2 4.15Å; W250-L266 WeakPolarHBondContact CZ3-O 3.4Å; T253-L266 HydrophobicContact CG2-CD2 3.56Å; T253-L266 HydrophobicContact CG2-CG 4.34Å; I254-L266 HydrophobicContact CG1-CD2 4.12Å; C257-L266 HydrophobicContact CB-CD1 4.1Å; N262-L266 PolarHBondContact O-N 3.04Å; L266-E270 WeakPolarHBondContact O-CB 3.49Å; L266-E270 PolarHBondContact O-N 3.13Å
267	R	53.7	Low	49.2	Very low	127 Å²	127	74.1 Å²	74.1	48%	0.479	42%	0.418	S	S	.	.	H	α-helix	trans	-78	-35.9	178.9	-165.8	-172.4	-48.1	-153	7.4	112.7	A263 G264 L265 A271	A263-R267 WeakPolarHBondContact O-CB 3.34Å; A263-R267 PolarHBondContact O-N 3.22Å; G264-R267 PolarHBondContact O-N 2.78Å; L265-R267 PolarHBondContact O-N 3.13Å; R267-A271 PolarHBondContact O-N 2.76Å
268	Q	52.8	Low	48.1	Very low	141 Å²	141	81 Å²	81	66%	0.659	45%	0.45	S	S	*	.	H	α-helix	trans	-64.9	-41.7	170.9	-88.9	174.9	-30.5	0	0	111.3	G264 L265 A271 G272	G264-Q268 PolarHBondContact O-N 2.52Å; L265-Q268 PolarHBondContact O-N 3.21Å; Q268-A271 WeakPolarHBondContact O-CB 3.41Å; Q268-A271 PolarHBondContact O-N 3.39Å; Q268-G272 PolarHBondContact O-N 3.33Å
269	L	52.8	Low	47	Very low	26 Å²	26	79.9 Å²	79.9	14%	0.136	45%	0.454	C	S	.	.	H	α-helix	trans	-72.5	-30.7	177.5	-73.8	162.2	0	0	0	112.8	W250 T253 L265 A271 G272 C273	W250-L269 HydrophobicContact CE3-CB 4.15Å; W250-L269 HydrophobicContact CZ3-CB 3.9Å; T253-L269 HydrophobicContact CG2-CD1 3.3Å; L265-L269 HydrophobicContact CD2-CD1 3.95Å; L265-L269 PolarHBondContact O-N 3.12Å; L269-A271 PolarHBondContact O-N 2.74Å; L269-G272 PolarHBondContact O-N 2.73Å; L269-G272 VanDerWaalsContact O-N 3.12Å; L269-C273 WeakPolarHBondContact O-CB 3.44Å; L269-C273 PolarHBondContact O-N 3.24Å; L269-C273 PolarHBondContact O-SG 2.86Å
270	E	53.2	Low	46.2	Very low	58 Å²	58	81.6 Å²	81.6	27%	0.271	46%	0.455	S	S	.	.	H	α-helix	trans	-59.3	-33.2	170.7	-172.3	-179.8	-180	0	0	111.7	W250 L266 R274	W250-E270 HydrophobicContact CH2-CB 3.72Å; W250-E270 HydrophobicContact CH2-CG 4.31Å; W250-E270 HydrophobicContact CZ2-CB 4.41Å; W250-E270 HydrophobicContact CZ3-CB 4.12Å; L266-E270 WeakPolarHBondContact O-CB 3.49Å; L266-E270 PolarHBondContact O-N 3.13Å; E270-R274 WeakPolarHBondContact O-CB 3.38Å; E270-R274 IonicContact OE1-CZ 3.43Å; E270-R274 IonicContact OE1-NH1 2.67Å; E270-R274 PolarHBondContact OE1-NH1 3.4Å; E270-R274 IonicContact OE1-NH2 3.55Å
271	A	49.1	Very low	45.2	Very low	83 Å²	83	89.7 Å²	89.7	69%	0.686	49%	0.487	S	S	*	.	H	α-helix	trans	-75.2	-32.6	176.2	0	0	0	0	0	112.6	R267 Q268 L269	R267-A271 PolarHBondContact O-N 2.76Å; Q268-A271 WeakPolarHBondContact O-CB 3.41Å; Q268-A271 PolarHBondContact O-N 3.39Å; L269-A271 PolarHBondContact O-N 2.74Å
272	G	43.7	Very low	44	Very low	64 Å²	64	92.2 Å²	92.2	66%	0.66	49%	0.491	S	S	*	.	H	α-helix	trans	-80.5	-32.2	177.8	0	0	0	0	0	114.5	Q268 L269	Q268-G272 PolarHBondContact O-N 3.33Å; L269-G272 PolarHBondContact O-N 2.73Å; L269-G272 VanDerWaalsContact O-N 3.12Å
273	C	44.2	Very low	42.9	Very low	55 Å²	55	98 Å²	98	37%	0.372	52%	0.516	S	S	.	.	S	Bend	trans	-94.5	-2.8	-174.6	-62	0	0	0	0	114.1	W250 L269 L275	W250-C273 HydrophobicContact CB-CB 4.26Å; L269-C273 WeakPolarHBondContact O-CB 3.44Å; L269-C273 PolarHBondContact O-N 3.24Å; L269-C273 PolarHBondContact O-SG 2.86Å; C273-L275 PolarHBondContact O-N 3.18Å
274	R	41.5	Very low	41.7	Very low	156 Å²	156	107.2 Å²	107.2	59%	0.589	55%	0.55	S	S	*	*			trans	-80.2	76.7	-177.6	-119.4	-172.6	176	119.4	7.1	112.1	E270	E270-R274 WeakPolarHBondContact O-CB 3.38Å; E270-R274 IonicContact OE1-CZ 3.43Å; E270-R274 IonicContact OE1-NH1 2.67Å; E270-R274 PolarHBondContact OE1-NH1 3.4Å; E270-R274 IonicContact OE1-NH2 3.55Å
275	L	41.8	Very low	40.6	Very low	131 Å²	131	110.6 Å²	110.6	69%	0.686	56%	0.562	S	S	*	*	S	Bend	trans	-83.5	-22.5	168.3	-80.7	166.8	0	0	0	113.5	F87 C273	F87-L275 HydrophobicContact CE1-CD2 3.87Å; F87-L275 HydrophobicContact CZ-CD1 4.38Å; F87-L275 HydrophobicContact CZ-CD2 4.31Å; C273-L275 PolarHBondContact O-N 3.18Å
276	Q	33.6	Very low	39.6	Very low	140 Å²	140	113.5 Å²	113.5	65%	0.654	57%	0.574	S	S	*	*			trans	-149	116.1	174.4	-67.8	-169.5	2.3	0	0	113.6	E278	Q276-E278 PolarHBondContact O-N 2.77Å
277	P	39.3	Very low	38.3	Very low	105 Å²	105	119.2 Å²	119.2	68%	0.682	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-10.3	173.8	25.2	-30.9	0	0	0	114.1
278	E	36.2	Very low	37.2	Very low	150 Å²	150	118.8 Å²	118.8	70%	0.701	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-6.4	-179.3	-65.2	-158.6	158.3	0	0	115.3	Q276 Y280 K281	Q276-E278 PolarHBondContact O-N 2.77Å; E278-Y280 PolarHBondContact O-N 3.42Å; E278-K281 PolarHBondContact O-N 2.74Å
279	A	34.9	Very low	36.4	Very low	69 Å²	69	121.4 Å²	121.4	57%	0.57	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-11.7	178.8	0	0	0	0	0	113.3
280	Y	32.1	Very low	35.2	Very low	125 Å²	125	124.4 Å²	124.4	49%	0.49	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.9	51	177.4	-59.4	-80.9	0	0	0	112.8	A112 E278 M282	A112-Y280 HydrophobicContact CB-CD1 4.46Å; A112-Y280 HydrophobicContact CB-CE1 3.85Å; A112-Y280 PolarHBondContact O-OH 3.4Å; E278-Y280 PolarHBondContact O-N 3.42Å; Y280-M282 PolarHBondContact O-N 2.9Å
281	K	30.6	Very low	34.2	Very low	188 Å²	188	132.5 Å²	132.5	82%	0.817	68%	0.68	S	S	*	*			trans	-85.6	50.2	155.7	-110.1	-177.2	-174.4	169.3	0	110.3	E278 E283	E278-K281 PolarHBondContact O-N 2.74Å; K281-E283 VanDerWaalsContact C-N 3.31Å; K281-E283 PolarHBondContact O-N 3.23Å
282	M	27	Very low	33.3	Very low	145 Å²	145	135.8 Å²	135.8	71%	0.714	68%	0.682	S	S	*	*			trans	-73.9	100.4	160.1	-142.6	171.6	-175.2	0	0	105.1	Y280 R284	Y280-M282 PolarHBondContact O-N 2.9Å; M282-R284 VanDerWaalsContact C-N 3.27Å; M282-R284 PolarHBondContact O-N 3.42Å
283	E	28.1	Very low	32.8	Very low	169 Å²	169	138 Å²	138	79%	0.79	68%	0.683	S	S	*	*			trans	-44	95	172.9	-175.2	-179	179.1	0	0	108.6	K281 V285	K281-E283 VanDerWaalsContact C-N 3.31Å; K281-E283 PolarHBondContact O-N 3.23Å; E283-V285 HydrophobicContact CG-CG2 4.26Å; E283-V285 PolarHBondContact O-N 3.27Å
284	R	26.8	Very low	32.2	Very low	198 Å²	198	139.8 Å²	139.8	75%	0.747	69%	0.691	S	S	*	*			trans	-66.3	90.9	164.3	-86.4	-175.7	161.5	129.1	-2.7	104.8	M282 Q286	M282-R284 VanDerWaalsContact C-N 3.27Å; M282-R284 PolarHBondContact O-N 3.42Å; R284-Q286 HydrophobicContact CB-CB 4.29Å; R284-Q286 PolarHBondContact O-N 3.18Å
285	V	27.8	Very low	32	Very low	113 Å²	113	137.5 Å²	137.5	69%	0.685	69%	0.69	S	S	*	*			trans	-62.6	67.8	140.5	-174.8	0	0	0	0	105.8	E283 T287	E283-V285 HydrophobicContact CG-CG2 4.26Å; E283-V285 PolarHBondContact O-N 3.27Å; V285-T287 PolarHBondContact O-N 3.12Å
286	Q	28	Very low	31.7	Very low	141 Å²	141	138 Å²	138	66%	0.659	69%	0.693	S	S	*	*			trans	-66.7	95.6	158.9	-163.9	171.5	34.7	0	0	102.2	R284 V288	R284-Q286 HydrophobicContact CB-CB 4.29Å; R284-Q286 PolarHBondContact O-N 3.18Å; Q286-V288 PolarHBondContact O-N 3.11Å
287	T	27.9	Very low	31.8	Very low	119 Å²	119	139.1 Å²	139.1	73%	0.73	70%	0.696	S	S	*	*			trans	-52.2	102.4	154.4	23.4	0	0	0	0	104.4	V285 K289	V285-T287 PolarHBondContact O-N 3.12Å; T287-K289 PolarHBondContact O-N 3.04Å
288	V	30.7	Very low	32	Very low	119 Å²	119	138.9 Å²	138.9	72%	0.721	69%	0.694	S	S	*	*			trans	-62.5	83.1	167.5	-179.4	0	0	0	0	104.4	Q286 S290	Q286-V288 PolarHBondContact O-N 3.11Å; V288-S290 PolarHBondContact O-N 2.89Å
289	K	34.1	Very low	32.4	Very low	195 Å²	195	137.4 Å²	137.4	85%	0.848	70%	0.701	S	S	*	*			trans	-67	88.5	148.7	-93.6	-174.3	174.9	175.9	0	103.7	T287 R291	T287-K289 PolarHBondContact O-N 3.04Å; K289-R291 PolarHBondContact O-N 2.79Å
290	S	27.9	Very low	32.8	Very low	90 Å²	90	140.6 Å²	140.6	63%	0.629	70%	0.702	S	S	*	*			trans	-46.2	91.3	156.4	177.5	0	0	0	0	107	V288 E292	V288-S290 PolarHBondContact O-N 2.89Å; S290-E292 PolarHBondContact O-N 3.08Å; S290-E292 PolarHBondContact OG-N 3.2Å
291	R	32.5	Very low	33.5	Very low	227 Å²	227	140.5 Å²	140.5	86%	0.857	72%	0.717	S	S	*	*			trans	-86.1	85.5	143.2	-90.4	-174.6	163.4	175.4	-4.7	103.4	K289 T293	K289-R291 PolarHBondContact O-N 2.79Å; R291-T293 PolarHBondContact O-N 3.15Å
292	E	29.8	Very low	34.1	Very low	153 Å²	153	136.9 Å²	136.9	72%	0.715	71%	0.71	S	S	*	*			trans	-50.1	84	146.9	-165.6	-175.4	-176.3	0	0	106.8	S290 V294	S290-E292 PolarHBondContact O-N 3.08Å; S290-E292 PolarHBondContact OG-N 3.2Å; E292-V294 HydrophobicContact CG-CG2 3.65Å; E292-V294 PolarHBondContact O-N 2.93Å
293	T	33.1	Very low	34.8	Very low	111 Å²	111	135.4 Å²	135.4	68%	0.681	71%	0.709	S	S	*	*			trans	-67.6	90.2	149.6	28	0	0	0	0	104.1	R291 I295	R291-T293 PolarHBondContact O-N 3.15Å; T293-I295 PolarHBondContact O-N 2.77Å
294	V	33.1	Very low	35.7	Very low	91 Å²	91	138 Å²	138	55%	0.552	71%	0.712	S	S	*	*			trans	-56	89.6	153.3	-177.8	0	0	0	0	104.8	E292 D296	E292-V294 HydrophobicContact CG-CG2 3.65Å; E292-V294 PolarHBondContact O-N 2.93Å; V294-D296 PolarHBondContact O-N 2.98Å; V294-D296 VanDerWaalsContact O-N 3.16Å
295	I	35.9	Very low	36.4	Very low	109 Å²	109	134.2 Å²	134.2	56%	0.559	71%	0.711	S	S	*	*			trans	-75.2	95.2	159.7	-59.7	175.2	0	0	0	102.3	T293 F297	T293-I295 PolarHBondContact O-N 2.77Å; I295-F297 HydrophobicContact CB-CD2 4.47Å; I295-F297 HydrophobicContact CB-CE2 4.15Å; I295-F297 HydrophobicContact CG2-CD1 4.5Å; I295-F297 HydrophobicContact CG2-CD2 4.11Å; I295-F297 HydrophobicContact CG2-CE1 4.31Å; I295-F297 HydrophobicContact CG2-CE2 3.91Å; I295-F297 HydrophobicContact CG2-CG 4.41Å; I295-F297 HydrophobicContact CG2-CZ 4.02Å; I295-F297 WeakPolarHBondContact O-CD2 3.39Å; I295-F297 PolarHBondContact O-N 2.84Å
296	D	35.4	Very low	37.2	Very low	140 Å²	140	135.9 Å²	135.9	75%	0.749	71%	0.714	S	S	*	*			trans	-58.8	96.8	162	-98.1	-22.6	0	0	0	106.2	V294 P298	V294-D296 PolarHBondContact O-N 2.98Å; V294-D296 VanDerWaalsContact O-N 3.16Å; D296-P298 VanDerWaalsContact O-CD 3.25Å; D296-P298 WeakPolarHBondContact O-CD 3.25Å
297	F	37.3	Very low	37.9	Very low	164 Å²	164	132 Å²	132	72%	0.719	71%	0.713	S	S	*	*			trans	-67.9	116.8	161.5	-72.5	-83.7	0	0	0	105.4	I295 S299	I295-F297 HydrophobicContact CB-CD2 4.47Å; I295-F297 HydrophobicContact CB-CE2 4.15Å; I295-F297 HydrophobicContact CG2-CD1 4.5Å; I295-F297 HydrophobicContact CG2-CD2 4.11Å; I295-F297 HydrophobicContact CG2-CE1 4.31Å; I295-F297 HydrophobicContact CG2-CE2 3.91Å; I295-F297 HydrophobicContact CG2-CG 4.41Å; I295-F297 HydrophobicContact CG2-CZ 4.02Å; I295-F297 WeakPolarHBondContact O-CD2 3.39Å; I295-F297 PolarHBondContact O-N 2.84Å; F297-S299 PolarHBondContact O-N 2.79Å
298	P	42.5	Very low	38.4	Very low	100 Å²	100	134.1 Å²	134.1	65%	0.649	72%	0.718	S	S	*	*			trans	-55.1	120.1	165	23.2	-30.6	0	0	0	106.3	D296 K300	D296-P298 VanDerWaalsContact O-CD 3.25Å; D296-P298 WeakPolarHBondContact O-CD 3.25Å; P298-K300 PolarHBondContact O-N 2.99Å
299	S	44.3	Very low	38.9	Very low	120 Å²	120	133.2 Å²	133.2	84%	0.839	72%	0.717	S	S	*	*	S	Bend	trans	-65.4	16.8	-177.8	54.5	0	0	0	0	113.8	F297	F297-S299 PolarHBondContact O-N 2.79Å
300	K	43.7	Very low	39.1	Very low	136 Å²	136	136.3 Å²	136.3	59%	0.591	72%	0.724	S	S	*	*	S	Bend	trans	-117.4	113.5	174.4	-64.4	-174.8	179.5	-175.3	0	108	P298 T302	P298-K300 PolarHBondContact O-N 2.99Å; K300-T302 PolarHBondContact O-N 3.48Å
301	P	46.6	Very low	39.8	Very low	123 Å²	123	136.8 Å²	136.8	80%	0.799	73%	0.727	S	S	*	*			trans	-58.3	109.4	172.5	23.4	-31.2	0	0	0	108.7	V303	P301-V303 PolarHBondContact O-N 3.24Å; P301-V303 VanDerWaalsContact O-N 3.08Å
302	T	43.5	Very low	40.2	Very low	111 Å²	111	132.9 Å²	132.9	68%	0.681	73%	0.729	S	S	*	*			trans	-80.1	91.7	174.8	-55.3	0	0	0	0	107.6	K300 R304	K300-T302 PolarHBondContact O-N 3.48Å; T302-R304 HydrophobicContact CG2-CG 4.42Å; T302-R304 PolarHBondContact O-N 3.46Å; T302-R304 VanDerWaalsContact O-N 3.15Å
303	V	42.8	Very low	41	Very low	114 Å²	114	130.6 Å²	130.6	69%	0.691	73%	0.73	S	S	*	*			trans	-72.7	102.5	170.4	-178.3	0	0	0	0	107.5	P301 T305	P301-V303 PolarHBondContact O-N 3.24Å; P301-V303 VanDerWaalsContact O-N 3.08Å; V303-T305 PolarHBondContact O-N 2.98Å
304	R	45.1	Very low	41.5	Very low	223 Å²	223	133.1 Å²	133.1	84%	0.842	74%	0.739	S	S	*	*			trans	-79.3	93.4	164.9	-71	-174.7	-179.2	165.7	0.6	107.7	T302 I306	T302-R304 HydrophobicContact CG2-CG 4.42Å; T302-R304 PolarHBondContact O-N 3.46Å; T302-R304 VanDerWaalsContact O-N 3.15Å; R304-I306 PolarHBondContact O-N 3.1Å
305	T	43.3	Very low	42.2	Very low	120 Å²	120	134.9 Å²	134.9	74%	0.736	75%	0.75	S	S	*	*			trans	-72.5	109	170.6	-42.9	0	0	0	0	107.9	V303 G307	V303-T305 PolarHBondContact O-N 2.98Å; T305-G307 VanDerWaalsContact C-N 3.31Å; T305-G307 PolarHBondContact O-N 2.99Å
306	I	44.2	Very low	42.3	Very low	147 Å²	147	138.2 Å²	138.2	75%	0.754	77%	0.769	S	S	*	*			trans	-72.8	94.3	170	-50.1	176.3	0	0	0	105.7	R304 L308	R304-I306 PolarHBondContact O-N 3.1Å; I306-L308 VanDerWaalsContact C-N 3.31Å; I306-L308 HydrophobicContact CG2-CG 4.4Å; I306-L308 PolarHBondContact O-N 3.07Å
307	G	42.6	Very low	42.9	Very low	61 Å²	61	135.8 Å²	135.8	63%	0.629	76%	0.763	S	S	*	*			trans	-69.2	83.6	-179.8	0	0	0	0	0	111.4	T305 S309	T305-G307 VanDerWaalsContact C-N 3.31Å; T305-G307 PolarHBondContact O-N 2.99Å; G307-S309 PolarHBondContact O-N 3.21Å; G307-S309 VanDerWaalsContact O-N 3.07Å
308	L	38	Very low	43.5	Very low	162 Å²	162	135.6 Å²	135.6	85%	0.848	77%	0.768	S	S	*	*			trans	-80.5	62	164.2	-64.3	177	0	0	0	109.4	I306	I306-L308 VanDerWaalsContact C-N 3.31Å; I306-L308 HydrophobicContact CG2-CG 4.4Å; I306-L308 PolarHBondContact O-N 3.07Å
309	S	41.8	Very low	43.5	Very low	100 Å²	100	137 Å²	137	70%	0.699	77%	0.77	S	S	*	*			trans	-99	100.6	173.2	-57.1	0	0	0	0	108.4	G307 S311	G307-S309 PolarHBondContact O-N 3.21Å; G307-S309 VanDerWaalsContact O-N 3.07Å; S309-S311 PolarHBondContact O-N 3.16Å; S309-S311 VanDerWaalsContact O-N 3.1Å
310	R	38.2	Very low	43.7	Very low	260 Å²	260	137.8 Å²	137.8	98%	0.981	77%	0.77	S	S	*	*			trans	-75	93.3	173.2	-161.2	-177	-135.8	-126.7	4.6	108.3
311	S	42.6	Very low	43.9	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	78%	0.776	S	S	*	*			trans	-125.9	123	167.6	44.8	0	0	0	0	109.7	S309 S313	S309-S311 PolarHBondContact O-N 3.16Å; S309-S311 VanDerWaalsContact O-N 3.1Å; S311-S313 PolarHBondContact O-N 3.27Å
312	T	41.1	Very low	44	Very low	146 Å²	146	139.1 Å²	139.1	90%	0.896	78%	0.78	S	S	*	*			trans	-55.4	107.4	-179.2	49.3	0	0	0	0	112.4
313	S	45.9	Very low	44.1	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	79%	0.785	S	S	*	*			trans	-157.5	125.2	153.5	69.9	0	0	0	0	111.3	S311 T315	S311-S313 PolarHBondContact O-N 3.27Å; S313-T315 PolarHBondContact O-N 3.43Å; S313-T315 VanDerWaalsContact O-N 3.13Å
314	D	42.8	Very low	44.2	Very low	165 Å²	165	137.4 Å²	137.4	88%	0.882	78%	0.782	S	S	*	*			trans	-66.4	99.5	176.2	-60.1	-56.1	0	0	0	110.9
315	T	48.3	Very low	44.2	Very low	127 Å²	127	131.9 Å²	131.9	78%	0.779	77%	0.773	S	S	*	*			trans	176.8	117.7	144.5	44.5	0	0	0	0	108.1	S313 S317	S313-T315 PolarHBondContact O-N 3.43Å; S313-T315 VanDerWaalsContact O-N 3.13Å; T315-S317 PolarHBondContact O-N 3.47Å
316	D	38.6	Very low	44.2	Very low	180 Å²	180	133.3 Å²	133.3	96%	0.963	78%	0.776	S	S	*	*			trans	-61.5	101.1	174.9	-85.1	-36.9	0	0	0	111.1
317	S	47.9	Very low	44.2	Very low	88 Å²	88	135 Å²	135	62%	0.615	78%	0.778	S	S	*	*			trans	-145.4	114.6	157.1	-167.5	0	0	0	0	108.9	T315 D319	T315-S317 PolarHBondContact O-N 3.47Å; S317-D319 PolarHBondContact O-N 3.02Å; S317-D319 VanDerWaalsContact O-N 3.09Å
318	I	49.1	Very low	44.3	Very low	160 Å²	160	139.3 Å²	139.3	82%	0.821	79%	0.787	S	S	*	*			trans	-79.2	89.6	173.7	-57.5	169.4	0	0	0	106.6	T320	I318-T320 PolarHBondContact O-N 3.02Å
319	D	44.3	Very low	44.3	Very low	129 Å²	129	135 Å²	135	69%	0.69	78%	0.782	S	S	*	*			trans	-79	98.7	172.7	-84.8	-11.5	0	0	0	110	S317 T321	S317-D319 PolarHBondContact O-N 3.02Å; S317-D319 VanDerWaalsContact O-N 3.09Å; D319-T321 PolarHBondContact O-N 3.46Å; D319-T321 VanDerWaalsContact O-N 3.12Å
320	T	48.1	Very low	44.4	Very low	137 Å²	137	139.4 Å²	139.4	84%	0.84	79%	0.791	S	S	*	*			trans	-72.3	91.6	162.5	21.5	0	0	0	0	109.7	I318	I318-T320 PolarHBondContact O-N 3.02Å
321	T	48	Very low	44.4	Very low	117 Å²	117	137.1 Å²	137.1	72%	0.718	81%	0.806	S	S	*	*			trans	-81.9	117.1	171	50.3	0	0	0	0	110.7	D319 T323	D319-T321 PolarHBondContact O-N 3.46Å; D319-T321 VanDerWaalsContact O-N 3.12Å; T321-T323 PolarHBondContact O-N 3.09Å
322	L	47	Very low	44.5	Very low	171 Å²	171	139 Å²	139	90%	0.895	81%	0.812	S	S	*	*			trans	-87.5	96.4	174.3	-163.9	136.1	0	0	0	108.8	G324	L322-G324 PolarHBondContact O-N 3.13Å
323	T	46.5	Very low	44.7	Very low	127 Å²	127	138.6 Å²	138.6	78%	0.779	81%	0.807	S	S	*	*			trans	-83.2	102.5	173.2	37.1	0	0	0	0	109.9	T321	T321-T323 PolarHBondContact O-N 3.09Å
324	G	44.1	Very low	44.6	Very low	61 Å²	61	140.5 Å²	140.5	63%	0.629	81%	0.812	S	S	*	*			trans	-71.8	130.2	162.8	0	0	0	0	0	109.7	L322	L322-G324 PolarHBondContact O-N 3.13Å
325	V	46.8	Very low	44.7	Very low	108 Å²	108	139.1 Å²	139.1	66%	0.655	81%	0.808	S	S	*	*			trans	-91.8	104.5	169.5	-177.3	0	0	0	0	106.9	F327	V325-F327 HydrophobicContact CG1-CD2 4.39Å; V325-F327 PolarHBondContact O-N 3.21Å
326	D	42.9	Very low	44.5	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	81%	0.809	S	S	*	*			trans	-66.7	123.4	167.1	-74.1	-32.8	0	0	0	108.4
327	F	44.7	Very low	44.9	Very low	182 Å²	182	137.1 Å²	137.1	80%	0.798	80%	0.799	S	S	*	*			trans	-102.6	102.1	168.8	-118.9	-90.8	0	0	0	105.9	V325 G329	V325-F327 HydrophobicContact CG1-CD2 4.39Å; V325-F327 PolarHBondContact O-N 3.21Å; F327-G329 PolarHBondContact O-N 3.12Å
328	D	44.7	Very low	44.7	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	81%	0.812	S	S	*	*			trans	-65	98.7	168.8	-72	-37	0	0	0	108.6	E330	D328-E330 PolarHBondContact O-N 3.35Å
329	G	37.6	Very low	44.4	Very low	72 Å²	72	139.2 Å²	139.2	74%	0.742	81%	0.812	S	S	*	*			trans	-86.5	92.4	164.1	0	0	0	0	0	108.9	F327	F327-G329 PolarHBondContact O-N 3.12Å
330	E	42.8	Very low	44.4	Very low	193 Å²	193	140 Å²	140	90%	0.902	82%	0.822	S	S	*	*			trans	-61	137.1	160.2	-83.4	-176.5	148.2	0	0	109.9	D328	D328-E330 PolarHBondContact O-N 3.35Å
331	T	39.5	Very low	44	Very low	211 Å²	211	140.3 Å²	140.3	100%	1.294	82%	0.82	S	S	*	*			trans	-57.4	0	177.9	42.5	0	0	0	0	115.9

Retrieved 331 of 331 residues in 211.2 ms (Link to these results)

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