A0A096NFV4_PAPAN Loading...

Abhydrolase domain containing 16B

AlphaFold DB (A0A2K6AMF7), UniProt , Accession A0A096NFV4, Species PAPAN (Papio anubis, Olive baboon), Gene ABHD16B, Length 469 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	42.7	Very low	39.1	Very low	218 Å²	218	106.3 Å²	106.3	100%	1.074	58%	0.584	S	S	*	*				0	123.3	0	-77.7	170.8	70.3	0	0	108.6
2	C	31	Very low	39.8	Very low	75 Å²	75	107.3 Å²	107.3	51%	0.507	58%	0.581	S	S	.	*			trans	-72.3	136.7	-174.6	-169.8	0	0	0	0	111.1	I4 C5 F6	C2-I4 PolarHBondContact O-N 2.91Å; C2-I4 VanDerWaalsContact O-N 3.09Å; C2-C5 WeakPolarHBondContact O-CA 3.38Å; C2-C5 WeakPolarHBondContact O-CB 3.28Å; C2-C5 PolarHBondContact O-N 3.47Å; C2-F6 PolarHBondContact O-N 2.71Å
3	V	32.1	Very low	40.9	Very low	114 Å²	114	104.7 Å²	104.7	69%	0.691	57%	0.571	S	S	*	*	H	α-helix	trans	-51.8	-34	-179.9	175.1	0	0	0	0	111.9	F6 V7	V3-F6 PolarHBondContact O-N 2.93Å; V3-V7 WeakPolarHBondContact O-CG2 3.42Å; V3-V7 PolarHBondContact O-N 2.88Å
4	I	37.8	Very low	41.8	Very low	108 Å²	108	104.1 Å²	104.1	55%	0.554	56%	0.561	S	S	*	*	H	α-helix	trans	-68.1	-35.8	177.5	-61	171.2	0	0	0	111.8	C2 K8	C2-I4 PolarHBondContact O-N 2.91Å; C2-I4 VanDerWaalsContact O-N 3.09Å; I4-K8 HydrophobicContact CG2-CD 4.45Å; I4-K8 WeakPolarHBondContact O-CB 3.4Å; I4-K8 WeakPolarHBondContact O-CG 3.36Å; I4-K8 PolarHBondContact O-N 3.48Å
5	C	30.1	Very low	42.4	Very low	77 Å²	77	105.9 Å²	105.9	52%	0.52	56%	0.561	S	S	.	*	H	α-helix	trans	-72.7	-34.5	176.7	-60.7	0	0	0	0	111.6	C2 A9	C2-C5 WeakPolarHBondContact O-CA 3.38Å; C2-C5 WeakPolarHBondContact O-CB 3.28Å; C2-C5 PolarHBondContact O-N 3.47Å; C5-A9 VanDerWaalsContact O-CB 3.31Å; C5-A9 WeakPolarHBondContact O-CB 3.17Å; C5-A9 PolarHBondContact O-N 3.27Å
6	F	37	Very low	43.2	Very low	124 Å²	124	105.3 Å²	105.3	54%	0.544	56%	0.557	S	S	.	*	H	α-helix	trans	-67.6	-45.6	174.4	-176.4	-99.9	0	0	0	111.7	C2 V3 K8 A9 L10	C2-F6 PolarHBondContact O-N 2.71Å; V3-F6 PolarHBondContact O-N 2.93Å; F6-K8 PolarHBondContact O-N 3.28Å; F6-A9 PolarHBondContact O-N 3.06Å; F6-L10 HydrophobicContact CE1-CD1 4.1Å; F6-L10 HydrophobicContact CZ-CD1 4Å; F6-L10 WeakPolarHBondContact O-CB 3.41Å; F6-L10 PolarHBondContact O-N 3.41Å
7	V	39.8	Very low	43.7	Very low	79 Å²	79	104.6 Å²	104.6	48%	0.479	55%	0.546	S	S	.	.	H	α-helix	trans	-63.8	-40.8	176.1	174.1	0	0	0	0	111.3	V3 L10 V11	V3-V7 WeakPolarHBondContact O-CG2 3.42Å; V3-V7 PolarHBondContact O-N 2.88Å; V7-L10 PolarHBondContact O-N 3.13Å; V7-V11 HydrophobicContact CG1-CG2 4.37Å; V7-V11 WeakPolarHBondContact O-CB 3.46Å; V7-V11 VanDerWaalsContact O-CG2 3.23Å; V7-V11 WeakPolarHBondContact O-CG2 3.38Å; V7-V11 PolarHBondContact O-N 2.93Å
8	K	38	Very low	44.2	Very low	148 Å²	148	102.9 Å²	102.9	64%	0.643	54%	0.537	S	S	*	.	H	α-helix	trans	-64.2	-40.8	174.1	-80.2	-179	176.4	179.7	0	112.4	I4 F6 V11 H12	I4-K8 HydrophobicContact CG2-CD 4.45Å; I4-K8 WeakPolarHBondContact O-CB 3.4Å; I4-K8 WeakPolarHBondContact O-CG 3.36Å; I4-K8 PolarHBondContact O-N 3.48Å; F6-K8 PolarHBondContact O-N 3.28Å; K8-V11 PolarHBondContact O-N 3.38Å; K8-H12 VanDerWaalsContact O-CB 3.31Å; K8-H12 WeakPolarHBondContact O-CB 3.43Å; K8-H12 PolarHBondContact O-N 3.28Å
9	A	41.2	Very low	44.3	Very low	52 Å²	52	102.6 Å²	102.6	43%	0.43	54%	0.54	S	S	.	.	H	α-helix	trans	-64	-43.6	175.1	0	0	0	0	0	111.3	C5 F6 H12 V13	C5-A9 VanDerWaalsContact O-CB 3.31Å; C5-A9 WeakPolarHBondContact O-CB 3.17Å; C5-A9 PolarHBondContact O-N 3.27Å; F6-A9 PolarHBondContact O-N 3.06Å; A9-H12 PolarHBondContact O-N 3.32Å; A9-V13 WeakPolarHBondContact O-CB 3.34Å; A9-V13 VanDerWaalsContact O-CG2 3.23Å; A9-V13 WeakPolarHBondContact O-CG2 3.42Å; A9-V13 PolarHBondContact O-N 3.27Å
10	L	43.7	Very low	44.3	Very low	82 Å²	82	99.5 Å²	99.5	43%	0.429	53%	0.529	S	S	.	.	H	α-helix	trans	-61.7	-46.9	176.4	-145.1	93.3	0	0	0	111.1	F6 V7 H12 V13 F14	F6-L10 HydrophobicContact CE1-CD1 4.1Å; F6-L10 HydrophobicContact CZ-CD1 4Å; F6-L10 WeakPolarHBondContact O-CB 3.41Å; F6-L10 PolarHBondContact O-N 3.41Å; V7-L10 PolarHBondContact O-N 3.13Å; L10-H12 VanDerWaalsContact C-N 3.29Å; L10-H12 PolarHBondContact O-N 3.04Å; L10-V13 PolarHBondContact O-N 3.23Å; L10-F14 HydrophobicContact CD2-CD2 4.24Å; L10-F14 HydrophobicContact CD2-CE2 3.98Å; L10-F14 HydrophobicContact CG-CD2 4.15Å; L10-F14 HydrophobicContact CG-CE2 4.17Å; L10-F14 WeakPolarHBondContact O-CB 3.33Å; L10-F14 VanDerWaalsContact O-CD2 3.32Å; L10-F14 WeakPolarHBondContact O-CD2 3.45Å; L10-F14 PolarHBondContact O-N 3.44Å
11	V	56.6	Low	44.1	Very low	92 Å²	92	100.2 Å²	100.2	56%	0.558	54%	0.543	S	S	*	.	H	α-helix	trans	-62.1	-37	175.9	169.8	0	0	0	0	111.2	V7 K8 K15	V7-V11 HydrophobicContact CG1-CG2 4.37Å; V7-V11 WeakPolarHBondContact O-CB 3.46Å; V7-V11 VanDerWaalsContact O-CG2 3.23Å; V7-V11 WeakPolarHBondContact O-CG2 3.38Å; V7-V11 PolarHBondContact O-N 2.93Å; K8-V11 PolarHBondContact O-N 3.38Å; V11-K15 WeakPolarHBondContact O-CB 3.3Å; V11-K15 PolarHBondContact O-N 3.29Å
12	H	47.3	Very low	44.4	Very low	118 Å²	118	93.9 Å²	93.9	55%	0.546	51%	0.507	S	S	.	.	H	α-helix	trans	-70.4	-41.4	177.9	-147.5	49.7	0	0	0	111.9	K8 A9 L10 K15 I16	K8-H12 VanDerWaalsContact O-CB 3.31Å; K8-H12 WeakPolarHBondContact O-CB 3.43Å; K8-H12 PolarHBondContact O-N 3.28Å; A9-H12 PolarHBondContact O-N 3.32Å; L10-H12 VanDerWaalsContact C-N 3.29Å; L10-H12 PolarHBondContact O-N 3.04Å; H12-K15 PolarHBondContact O-N 3.21Å; H12-I16 WeakPolarHBondContact O-CB 3.45Å; H12-I16 WeakPolarHBondContact O-CD1 3.29Å; H12-I16 VanDerWaalsContact O-CG1 3.22Å; H12-I16 WeakPolarHBondContact O-CG1 3.42Å; H12-I16 PolarHBondContact O-N 2.86Å
13	V	54.4	Low	45.2	Very low	74 Å²	74	95.9 Å²	95.9	45%	0.448	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-48.8	173.4	170.7	0	0	0	0	110.5	A9 L10 K15 I16 Y17	A9-V13 WeakPolarHBondContact O-CB 3.34Å; A9-V13 VanDerWaalsContact O-CG2 3.23Å; A9-V13 WeakPolarHBondContact O-CG2 3.42Å; A9-V13 PolarHBondContact O-N 3.27Å; L10-V13 PolarHBondContact O-N 3.23Å; V13-K15 VanDerWaalsContact C-N 3.31Å; V13-K15 PolarHBondContact O-N 2.88Å; V13-I16 PolarHBondContact O-N 3.35Å; V13-Y17 HydrophobicContact CG1-CD2 3.55Å; V13-Y17 HydrophobicContact CG1-CE2 3.48Å; V13-Y17 VanDerWaalsContact CG1-CE2 3.48Å; V13-Y17 WeakPolarHBondContact O-CD2 3.39Å; V13-Y17 PolarHBondContact O-N 2.77Å
14	F	52.8	Low	46.2	Very low	97 Å²	97	93 Å²	93	43%	0.425	49%	0.494	S	S	.	.	H	α-helix	trans	-59.9	-40.3	173.8	-93.5	-81.6	0	0	0	112.1	L10 Y17 L18 A122	L10-F14 HydrophobicContact CD2-CD2 4.24Å; L10-F14 HydrophobicContact CD2-CE2 3.98Å; L10-F14 HydrophobicContact CG-CD2 4.15Å; L10-F14 HydrophobicContact CG-CE2 4.17Å; L10-F14 WeakPolarHBondContact O-CB 3.33Å; L10-F14 VanDerWaalsContact O-CD2 3.32Å; L10-F14 WeakPolarHBondContact O-CD2 3.45Å; L10-F14 PolarHBondContact O-N 3.44Å; F14-Y17 PolarHBondContact O-N 3.33Å; F14-L18 VanDerWaalsContact O-CB 3.25Å; F14-L18 WeakPolarHBondContact O-CB 3.38Å; F14-L18 WeakPolarHBondContact O-CD1 3.49Å; F14-L18 WeakPolarHBondContact O-CG 3.35Å; F14-L18 PolarHBondContact O-N 3.42Å; F14-A122 HydrophobicContact CD1-CB 4.45Å; F14-A122 HydrophobicContact CE1-CB 3.83Å
15	K	51.3	Low	47.4	Very low	131 Å²	131	92.5 Å²	92.5	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-63.5	-46.4	177.1	-172	177.6	-179.8	-179.2	0	111.1	V11 H12 V13 L18 T19	V11-K15 WeakPolarHBondContact O-CB 3.3Å; V11-K15 PolarHBondContact O-N 3.29Å; H12-K15 PolarHBondContact O-N 3.21Å; V13-K15 VanDerWaalsContact C-N 3.31Å; V13-K15 PolarHBondContact O-N 2.88Å; K15-L18 PolarHBondContact O-N 3.29Å; K15-T19 WeakPolarHBondContact O-CB 3.27Å; K15-T19 WeakPolarHBondContact O-CG2 3.44Å; K15-T19 PolarHBondContact O-N 3.42Å; K15-T19 PolarHBondContact O-OG1 3.48Å
16	I	55.8	Low	49.6	Very low	95 Å²	95	89 Å²	89	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-59.8	-47.2	176.9	-69.7	163.7	0	0	0	110.4	H12 V13 L18 T19 A20	H12-I16 WeakPolarHBondContact O-CB 3.45Å; H12-I16 WeakPolarHBondContact O-CD1 3.29Å; H12-I16 VanDerWaalsContact O-CG1 3.22Å; H12-I16 WeakPolarHBondContact O-CG1 3.42Å; H12-I16 PolarHBondContact O-N 2.86Å; V13-I16 PolarHBondContact O-N 3.35Å; I16-L18 PolarHBondContact O-N 3.44Å; I16-T19 WeakPolarHBondContact CA-OG1 3.48Å; I16-T19 PolarHBondContact O-N 3.37Å; I16-T19 PolarHBondContact O-OG1 2.93Å; I16-A20 PolarHBondContact O-N 3.23Å; I16-A20 VanDerWaalsContact O-N 3.07Å
17	Y	51.7	Low	51.4	Low	95 Å²	95	93.6 Å²	93.6	37%	0.373	49%	0.486	S	S	.	.	H	α-helix	trans	-67.8	-33.6	179	-78.6	-60.8	0	0	0	113.7	V13 F14 Y22 P125	V13-Y17 HydrophobicContact CG1-CD2 3.55Å; V13-Y17 HydrophobicContact CG1-CE2 3.48Å; V13-Y17 VanDerWaalsContact CG1-CE2 3.48Å; V13-Y17 WeakPolarHBondContact O-CD2 3.39Å; V13-Y17 PolarHBondContact O-N 2.77Å; F14-Y17 PolarHBondContact O-N 3.33Å; Y17-Y22 HydrophobicContact CD1-CE2 4.45Å; Y17-P125 HydrophobicContact CD1-CB 4.35Å; Y17-P125 HydrophobicContact CD1-CG 3.26Å; Y17-P125 HydrophobicContact CE1-CB 3.79Å; Y17-P125 HydrophobicContact CE1-CG 3.17Å; Y17-P125 HydrophobicContact CG-CG 4.35Å
18	L	51.3	Low	53.3	Low	73 Å²	73	93.5 Å²	93.5	38%	0.382	50%	0.501	S	S	.	.	H	α-helix	trans	-75.6	-24.8	175.3	-71.2	168.1	0	0	0	113.2	F14 K15 I16 L118 R121	F14-L18 VanDerWaalsContact O-CB 3.25Å; F14-L18 WeakPolarHBondContact O-CB 3.38Å; F14-L18 WeakPolarHBondContact O-CD1 3.49Å; F14-L18 WeakPolarHBondContact O-CG 3.35Å; F14-L18 PolarHBondContact O-N 3.42Å; K15-L18 PolarHBondContact O-N 3.29Å; I16-L18 PolarHBondContact O-N 3.44Å; L18-L118 HydrophobicContact CD1-CD1 4.24Å; L18-L118 HydrophobicContact CD2-CD1 3.57Å; L18-R121 HydrophobicContact CD2-CB 4.36Å
19	T	46.3	Very low	55.6	Low	98 Å²	98	91.2 Å²	91.2	60%	0.601	49%	0.488	S	S	*	.	H	α-helix	trans	-88.9	-15.4	176.6	50.1	0	0	0	0	114.3	K15 I16 S21	K15-T19 WeakPolarHBondContact O-CB 3.27Å; K15-T19 WeakPolarHBondContact O-CG2 3.44Å; K15-T19 PolarHBondContact O-N 3.42Å; K15-T19 PolarHBondContact O-OG1 3.48Å; I16-T19 WeakPolarHBondContact CA-OG1 3.48Å; I16-T19 PolarHBondContact O-N 3.37Å; I16-T19 PolarHBondContact O-OG1 2.93Å; T19-S21 PolarHBondContact O-N 2.88Å
20	A	45.2	Very low	58	Low	39 Å²	39	93.2 Å²	93.2	32%	0.322	50%	0.497	S	S	.	.	S	Bend	trans	-73	120.6	176.5	0	0	0	0	0	110.2	I16 Y22	I16-A20 PolarHBondContact O-N 3.23Å; I16-A20 VanDerWaalsContact O-N 3.07Å; A20-Y22 VanDerWaalsContact C-N 3.29Å; A20-Y22 HydrophobicContact CB-CD2 3.7Å; A20-Y22 HydrophobicContact CB-CE2 3.2Å; A20-Y22 WeakPolarHBondContact O-CD2 3.09Å; A20-Y22 PolarHBondContact O-N 3.02Å
21	S	40.8	Very low	60.5	Low	116 Å²	116	92.6 Å²	92.6	81%	0.811	50%	0.497	S	S	*	.			trans	-79.9	78	178.8	-60.1	0	0	0	0	109.6	T19 T23	T19-S21 PolarHBondContact O-N 2.88Å; S21-T23 PolarHBondContact O-N 2.94Å
22	Y	48.7	Very low	62.4	Low	84 Å²	84	90.1 Å²	90.1	33%	0.329	49%	0.486	S	S	.	.			trans	-81.1	103.1	172.4	-65.3	-76	0	0	0	108.9	Y17 A20 Y24 L124 P125 Q128	Y17-Y22 HydrophobicContact CD1-CE2 4.45Å; A20-Y22 VanDerWaalsContact C-N 3.29Å; A20-Y22 HydrophobicContact CB-CD2 3.7Å; A20-Y22 HydrophobicContact CB-CE2 3.2Å; A20-Y22 WeakPolarHBondContact O-CD2 3.09Å; A20-Y22 PolarHBondContact O-N 3.02Å; Y22-Y24 PolarHBondContact O-N 2.98Å; Y22-L124 HydrophobicContact CD2-CD2 4.14Å; Y22-L124 HydrophobicContact CD2-CG 4.35Å; Y22-L124 HydrophobicContact CG-CD2 3.96Å; Y22-L124 HydrophobicContact CG-CG 4.14Å; Y22-P125 HydrophobicContact CE2-CG 4.12Å; Y22-Q128 VanDerWaalsContact CD1-OE1 3.23Å
23	T	47	Very low	64.8	Low	118 Å²	118	85 Å²	85	72%	0.724	46%	0.462	S	S	*	.			trans	-78.8	106.5	172.7	36.8	0	0	0	0	109.2	S21 T25	S21-T23 PolarHBondContact O-N 2.94Å; T23-T25 PolarHBondContact O-N 3.48Å
24	Y	52.6	Low	66.8	Low	52 Å²	52	86 Å²	86	20%	0.204	46%	0.457	C	S	.	.			trans	-69.6	101.7	171.5	-146.7	-90.3	0	0	0	108.1	Y22 F26 L124 R142 D154 E185 G209	Y22-Y24 PolarHBondContact O-N 2.98Å; Y24-F26 HydrophobicContact CD1-CB 3.37Å; Y24-F26 HydrophobicContact CD1-CG 4.4Å; Y24-F26 HydrophobicContact CE1-CB 3.61Å; Y24-F26 HydrophobicContact CE1-CG 4.27Å; Y24-F26 PolarHBondContact O-N 2.92Å; Y24-L124 HydrophobicContact CD2-CD1 3.51Å; Y24-L124 HydrophobicContact CE2-CD1 3.78Å; Y24-R142 VanDerWaalsContact CZ-NH2 3.28Å; Y24-R142 PolarHBondContact OH-NH2 2.97Å; Y24-D154 PolarHBondContact OH-OD2 2.79Å; Y24-E185 PolarHBondContact OH-OE1 3.44Å; Y24-G209 PolarHBondContact OH-N 2.98Å
25	T	63.7	Low	68.7	Low	98 Å²	98	84.1 Å²	84.1	60%	0.601	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-64.5	-1.6	-175.9	36.2	0	0	0	0	114.1	T23 R27 G28	T23-T25 PolarHBondContact O-N 3.48Å; T25-R27 VanDerWaalsContact C-N 3.29Å; T25-R27 PolarHBondContact O-N 3.21Å; T25-G28 PolarHBondContact O-N 3.43Å
26	F	76.6	Confident	70.6	Confident	4 Å²	4	80.5 Å²	80.5	2%	0.018	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-59	-33.8	-177.9	-172	-107.3	0	0	0	114	Y24 G28 W29 K144 E152 D154 G209	Y24-F26 HydrophobicContact CD1-CB 3.37Å; Y24-F26 HydrophobicContact CD1-CG 4.4Å; Y24-F26 HydrophobicContact CE1-CB 3.61Å; Y24-F26 HydrophobicContact CE1-CG 4.27Å; Y24-F26 PolarHBondContact O-N 2.92Å; F26-G28 PolarHBondContact O-N 3.15Å; F26-W29 HydrophobicContact CD2-CB 4.33Å; F26-W29 WeakPolarHBondContact O-CB 3.42Å; F26-W29 PolarHBondContact O-N 3.18Å; F26-K144 HydrophobicContact CE1-CD 4.45Å; F26-K144 HydrophobicContact CE1-CG 4.26Å; F26-K144 HydrophobicContact CE2-CB 3.8Å; F26-K144 HydrophobicContact CE2-CG 4.14Å; F26-K144 HydrophobicContact CZ-CB 3.82Å; F26-K144 HydrophobicContact CZ-CD 4.24Å; F26-K144 HydrophobicContact CZ-CG 3.64Å; F26-K144 WeakPolarHBondContact O-CE 3.34Å; F26-K144 PolarHBondContact O-NZ 2.8Å; F26-E152 HydrophobicContact CE1-CB 3.9Å; F26-E152 HydrophobicContact CZ-CB 4.46Å; F26-D154 HydrophobicContact CD2-CB 4.12Å; F26-D154 HydrophobicContact CE1-CB 4.26Å; F26-D154 HydrophobicContact CE2-CB 3.52Å; F26-D154 WeakPolarHBondContact CE2-OD1 3.36Å; F26-D154 HydrophobicContact CZ-CB 3.6Å; F26-G209 WeakPolarHBondContact CD1-O 3.34Å; F26-G209 WeakPolarHBondContact CE1-O 3.36Å
27	R	74	Confident	72.1	Confident	221 Å²	221	78.9 Å²	78.9	83%	0.834	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-57	-37.3	-179.5	-127.2	-176.2	-172.2	-172	2	112.5	T25 K144	T25-R27 VanDerWaalsContact C-N 3.29Å; T25-R27 PolarHBondContact O-N 3.21Å; R27-K144 PolarHBondContact O-NZ 2.96Å; R27-K144 VanDerWaalsContact O-NZ 3.16Å
28	G	79.9	Confident	73.2	Confident	76 Å²	76	76.2 Å²	76.2	78%	0.784	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-88.2	-2.9	176.3	0	0	0	0	0	114.7	T25 F26	T25-G28 PolarHBondContact O-N 3.43Å; F26-G28 PolarHBondContact O-N 3.15Å
29	W	85.9	Confident	73.8	Confident	100 Å²	100	80 Å²	80	38%	0.379	43%	0.43	S	S	.	.	S	Bend	trans	-68	136	-179.3	-159.3	-90.3	0	0	0	110.7	F26 R142 K144	F26-W29 HydrophobicContact CD2-CB 4.33Å; F26-W29 WeakPolarHBondContact O-CB 3.42Å; F26-W29 PolarHBondContact O-N 3.18Å; W29-R142 HydrophobicContact CZ2-CB 4.13Å; W29-K144 WeakPolarHBondContact O-CE 3.49Å; W29-K144 PolarHBondContact O-NZ 3.36Å
30	P	93.1	Very high	74.3	Confident	95 Å²	95	79.8 Å²	79.8	62%	0.617	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-64.6	142.1	-178.6	26.4	-34.9	0	0	0	111.4	A32	P30-A32 PolarHBondContact O-N 3.09Å
31	V	96	Very high	74.6	Confident	69 Å²	69	81.9 Å²	81.9	42%	0.418	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	123.5	172.1	175.5	0	0	0	0	108.7	R34 K144 V146	V31-R34 HydrophobicContact CG1-CG 3.74Å; V31-K144 HydrophobicContact CG2-CD 3.86Å; V31-K144 HydrophobicContact CG2-CG 4.44Å; V31-V146 HydrophobicContact CB-CG2 4.41Å; V31-V146 HydrophobicContact CG1-CG2 3.7Å; V31-V146 HydrophobicContact CG2-CG2 3.75Å
32	A	95.5	Very high	74.6	Confident	39 Å²	39	79.7 Å²	79.7	32%	0.322	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-28.6	-179.2	0	0	0	0	0	112.9	P30 A143 K144	P30-A32 PolarHBondContact O-N 3.09Å; A32-A143 HydrophobicContact CB-CB 3.81Å; A32-K144 PolarHBondContact N-O 3.47Å
33	F	97.2	Very high	74.2	Confident	12 Å²	12	78.3 Å²	78.3	5%	0.053	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	149.3	-178.3	-172.4	-100.8	0	0	0	110.9	D37 V38 L145 V146 V225 Q228 Y229 H232 R233	F33-D37 WeakPolarHBondContact CA-OD2 3.35Å; F33-D37 HydrophobicContact CD2-CB 4.24Å; F33-D37 HydrophobicContact CE2-CB 3.92Å; F33-D37 HydrophobicContact CZ-CB 4.35Å; F33-V38 HydrophobicContact CZ-CG2 3.88Å; F33-L145 HydrophobicContact CB-CD2 3.85Å; F33-L145 CarbonylContact O-C 3.49Å; F33-L145 WeakPolarHBondContact O-CA 3.36Å; F33-V146 PolarHBondContact O-N 2.89Å; F33-V225 HydrophobicContact CD1-CG2 3.81Å; F33-V225 HydrophobicContact CE1-CG2 4.15Å; F33-Q228 HydrophobicContact CE1-CB 3.72Å; F33-Q228 HydrophobicContact CZ-CB 4.05Å; F33-Y229 HydrophobicContact CB-CD2 3.5Å; F33-Y229 HydrophobicContact CB-CE2 4.04Å; F33-Y229 HydrophobicContact CB-CG 4.45Å; F33-Y229 HydrophobicContact CD1-CD2 4.18Å; F33-Y229 HydrophobicContact CD2-CD2 4.29Å; F33-Y229 AromaticContact CG-CD2 3.76Å; F33-Y229 HydrophobicContact CG-CD2 3.76Å; F33-H232 HydrophobicContact CE2-CB 4.38Å; F33-H232 HydrophobicContact CZ-CB 4.32Å; F33-R233 HydrophobicContact CD2-CB 3.92Å; F33-R233 HydrophobicContact CD2-CG 4.39Å; F33-R233 HydrophobicContact CE2-CB 4.2Å
34	R	97.1	Very high	73.7	Confident	93 Å²	93	78.8 Å²	78.8	35%	0.351	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	151	177.2	-50.8	174.4	58.1	83.1	0.5	110.4	V31 D36 D37 V146	V31-R34 HydrophobicContact CG1-CG 3.74Å; R34-D36 WeakPolarHBondContact CB-OD1 3.45Å; R34-D36 IonicContact CZ-OD1 2.91Å; R34-D36 IonicContact NE-OD1 3.47Å; R34-D36 PolarHBondContact NE-OD1 2.92Å; R34-D36 VanDerWaalsContact NE-OD1 3.1Å; R34-D36 PolarHBondContact O-N 3.22Å; R34-D36 VanDerWaalsContact O-N 3.09Å; R34-D37 PolarHBondContact N-OD2 2.85Å; R34-D37 WeakPolarHBondContact O-CB 3.37Å; R34-D37 PolarHBondContact O-N 2.93Å; R34-D37 VanDerWaalsContact O-N 3.11Å; R34-V146 HydrophobicContact CB-CB 4.47Å; R34-V146 HydrophobicContact CG-CB 4.22Å
35	W	93.4	Very high	73	Confident	58 Å²	58	79.2 Å²	79.2	22%	0.22	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.4	177	76.7	-80.6	0	0	0	114	V146 A147 C148 V225 Q228	W35-V146 PolarHBondContact N-O 3.28Å; W35-A147 VanDerWaalsContact CD1-C 3.48Å; W35-C148 HydrophobicContact CB-CB 4.41Å; W35-C148 VanDerWaalsContact CD1-CA 3.42Å; W35-C148 HydrophobicContact CD2-CB 3.48Å; W35-C148 VanDerWaalsContact CD2-CB 3.48Å; W35-C148 HydrophobicContact CE3-CB 3.85Å; W35-C148 HydrophobicContact CG-CB 3.72Å; W35-C148 HydrophobicContact CZ2-CB 4.23Å; W35-C148 HydrophobicContact CZ3-CB 4.36Å; W35-V225 HydrophobicContact CB-CB 4.28Å; W35-V225 HydrophobicContact CB-CG2 4.25Å; W35-Q228 PolarHBondContact O-OE1 3.17Å; W35-Q228 VanDerWaalsContact O-OE1 3.13Å
36	D	91	Very high	71.7	Confident	55 Å²	55	80 Å²	80	29%	0.294	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-6.7	-179	54.3	-18	0	0	0	114.3	R34 V38 R39 A40	R34-D36 WeakPolarHBondContact CB-OD1 3.45Å; R34-D36 IonicContact CZ-OD1 2.91Å; R34-D36 IonicContact NE-OD1 3.47Å; R34-D36 PolarHBondContact NE-OD1 2.92Å; R34-D36 VanDerWaalsContact NE-OD1 3.1Å; R34-D36 PolarHBondContact O-N 3.22Å; R34-D36 VanDerWaalsContact O-N 3.09Å; D36-V38 VanDerWaalsContact C-N 3.25Å; D36-V38 PolarHBondContact O-N 3.16Å; D36-R39 PolarHBondContact O-N 3.09Å; D36-R39 VanDerWaalsContact O-N 3.13Å; D36-A40 PolarHBondContact O-N 3.24Å
37	D	86.1	Confident	70	Confident	62 Å²	62	86.2 Å²	86.2	33%	0.332	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-34.4	-178.2	-73.4	-15.4	0	0	0	112.3	F33 R34 R39 A40 A41	F33-D37 WeakPolarHBondContact CA-OD2 3.35Å; F33-D37 HydrophobicContact CD2-CB 4.24Å; F33-D37 HydrophobicContact CE2-CB 3.92Å; F33-D37 HydrophobicContact CZ-CB 4.35Å; R34-D37 PolarHBondContact N-OD2 2.85Å; R34-D37 WeakPolarHBondContact O-CB 3.37Å; R34-D37 PolarHBondContact O-N 2.93Å; R34-D37 VanDerWaalsContact O-N 3.11Å; D37-R39 VanDerWaalsContact C-N 3.35Å; D37-R39 PolarHBondContact O-N 3.25Å; D37-A40 PolarHBondContact O-N 3.14Å; D37-A41 PolarHBondContact O-N 3.01Å
38	V	75.3	Confident	68.3	Low	38 Å²	38	87.2 Å²	87.2	23%	0.23	52%	0.523	C	S	.	.	H	α-helix	trans	-67.5	-35.5	-179.8	-174.1	0	0	0	0	111.8	F33 D36 H232	F33-V38 HydrophobicContact CZ-CG2 3.88Å; D36-V38 VanDerWaalsContact C-N 3.25Å; D36-V38 PolarHBondContact O-N 3.16Å; V38-H232 HydrophobicContact CG2-CB 4.25Å; V38-H232 VanDerWaalsContact CG2-CD2 3.4Å; V38-H232 WeakPolarHBondContact CG2-CD2 3.28Å
39	R	64.6	Low	66.5	Low	154 Å²	154	85.5 Å²	85.5	58%	0.581	50%	0.502	S	S	*	.	H	α-helix	trans	-74.9	-34.9	179.9	-67.8	-177	178.8	177.6	1.9	111.9	D36 D37 A41	D36-R39 PolarHBondContact O-N 3.09Å; D36-R39 VanDerWaalsContact O-N 3.13Å; D37-R39 VanDerWaalsContact C-N 3.35Å; D37-R39 PolarHBondContact O-N 3.25Å; R39-A41 PolarHBondContact O-N 3.12Å
40	A	55.7	Low	64.3	Low	93 Å²	93	85 Å²	85	77%	0.769	51%	0.505	S	S	*	.	H	α-helix	trans	-67.7	-25.1	178	0	0	0	0	0	112.9	D36 D37 G42	D36-A40 PolarHBondContact O-N 3.24Å; D37-A40 PolarHBondContact O-N 3.14Å; A40-G42 VanDerWaalsContact C-N 3.34Å; A40-G42 PolarHBondContact O-N 3.31Å
41	A	52.5	Low	61.9	Low	83 Å²	83	84 Å²	84	69%	0.686	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	4.5	-177.1	0	0	0	0	0	115.3	D37 R39 G43	D37-A41 PolarHBondContact O-N 3.01Å; R39-A41 PolarHBondContact O-N 3.12Å; A41-G43 PolarHBondContact O-N 3.35Å; A41-G43 VanDerWaalsContact O-N 3.16Å
42	G	40.6	Very low	59.2	Low	70 Å²	70	82.3 Å²	82.3	72%	0.722	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	13	174	0	0	0	0	0	115.8	A40 S44	A40-G42 VanDerWaalsContact C-N 3.34Å; A40-G42 PolarHBondContact O-N 3.31Å; G42-S44 PolarHBondContact O-N 3.18Å
43	G	39.8	Very low	56.3	Low	55 Å²	55	84 Å²	84	57%	0.567	50%	0.503	S	S	*	.			trans	-72.7	109	-179.5	0	0	0	0	0	112.5	A41 S45	A41-G43 PolarHBondContact O-N 3.35Å; A41-G43 VanDerWaalsContact O-N 3.16Å; G43-S45 PolarHBondContact O-N 2.99Å
44	S	37.5	Very low	53.5	Low	127 Å²	127	85 Å²	85	89%	0.888	51%	0.513	S	S	*	.			trans	-63.7	96.4	159	170.7	0	0	0	0	108.5	G42	G42-S44 PolarHBondContact O-N 3.18Å
45	S	38.3	Very low	50.8	Low	61 Å²	61	80.9 Å²	80.9	43%	0.427	50%	0.499	S	S	.	.			trans	-90.5	117.7	173.1	172.5	0	0	0	0	109.5	G43 H47	G43-S45 PolarHBondContact O-N 2.99Å; S45-H47 PolarHBondContact O-N 3.45Å; S45-H47 PolarHBondContact OG-N 3.49Å; S45-H47 VanDerWaalsContact OG-N 3.12Å; S45-H47 PolarHBondContact OG-O 3.19Å
46	S	36.6	Very low	48.3	Very low	115 Å²	115	79.1 Å²	79.1	80%	0.804	50%	0.497	S	S	*	.	S	Bend	trans	-66.9	-9.5	167	50.8	0	0	0	0	113	R48	S46-R48 PolarHBondContact O-N 3.04Å
47	H	41	Very low	45.9	Very low	135 Å²	135	78.4 Å²	78.4	63%	0.625	50%	0.498	S	S	*	.	S	Bend	trans	-88.9	94.4	167	-60	-69.1	0	0	0	108.8	S45 A49	S45-H47 PolarHBondContact O-N 3.45Å; S45-H47 PolarHBondContact OG-N 3.49Å; S45-H47 VanDerWaalsContact OG-N 3.12Å; S45-H47 PolarHBondContact OG-O 3.19Å; H47-A49 PolarHBondContact O-N 2.94Å
48	R	38.3	Very low	43.9	Very low	241 Å²	241	76.4 Å²	76.4	91%	0.909	49%	0.493	S	S	*	.			trans	-67.4	84.2	167.9	-84	-175.9	176.3	176.5	0.8	109	S46 L50	S46-R48 PolarHBondContact O-N 3.04Å; R48-L50 PolarHBondContact O-N 3.4Å
49	A	41.3	Very low	42.5	Very low	41 Å²	41	75.8 Å²	75.8	34%	0.339	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-55.2	127.2	155.5	0	0	0	0	0	107	H47 T51 Y260	H47-A49 PolarHBondContact O-N 2.94Å; A49-T51 PolarHBondContact O-N 2.81Å; A49-T51 VanDerWaalsContact O-N 3.12Å; A49-Y260 HydrophobicContact CB-CE1 3.82Å
50	L	39.7	Very low	41.1	Very low	88 Å²	88	75.4 Å²	75.4	46%	0.461	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-52.7	124.2	174.4	-76.6	157.1	0	0	0	107.3	R48 A54 A55 T259	R48-L50 PolarHBondContact O-N 3.4Å; L50-A54 HydrophobicContact CB-CB 4.05Å; L50-A54 HydrophobicContact CD2-CB 3.68Å; L50-A54 HydrophobicContact CG-CB 4.5Å; L50-A55 HydrophobicContact CB-CB 4.33Å; L50-T259 HydrophobicContact CB-CG2 4.44Å
51	T	41.5	Very low	40	Very low	74 Å²	74	76.4 Å²	76.4	45%	0.454	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-53.8	150.5	176.7	58	0	0	0	0	109.1	A49 A53 A54 A55	A49-T51 PolarHBondContact O-N 2.81Å; A49-T51 VanDerWaalsContact O-N 3.12Å; T51-A53 CarbonylContact O-C 3.43Å; T51-A53 PolarHBondContact O-N 3.22Å; T51-A54 CarbonylContact O-C 3.48Å; T51-A54 WeakPolarHBondContact O-CA 3.26Å; T51-A54 WeakPolarHBondContact O-CB 3.37Å; T51-A54 PolarHBondContact O-N 3.1Å; T51-A54 PolarHBondContact OG1-N 2.96Å; T51-A55 PolarHBondContact O-N 3.39Å
52	C	41.3	Very low	39.4	Very low	35 Å²	35	73.8 Å²	73.8	24%	0.236	45%	0.454	C	S	.	.	H	α-helix	trans	-51.5	-29.6	-179.6	-51.6	0	0	0	0	112.9	A56	C52-A56 WeakPolarHBondContact O-CB 3.38Å; C52-A56 PolarHBondContact O-N 3.45Å
53	A	34.6	Very low	39.3	Very low	74 Å²	74	73.3 Å²	73.3	61%	0.612	43%	0.43	S	S	*	.	H	α-helix	trans	-68.4	-39.1	171.6	0	0	0	0	0	113.3	T51 A57	T51-A53 CarbonylContact O-C 3.43Å; T51-A53 PolarHBondContact O-N 3.22Å; A53-A57 WeakPolarHBondContact O-CB 3.45Å; A53-A57 PolarHBondContact O-N 3.15Å
54	A	37.4	Very low	38.8	Very low	33 Å²	33	76.3 Å²	76.3	27%	0.273	43%	0.433	S	S	.	.	H	α-helix	trans	-76	-32.6	175.4	0	0	0	0	0	112.9	L50 T51 A57 G58	L50-A54 HydrophobicContact CB-CB 4.05Å; L50-A54 HydrophobicContact CD2-CB 3.68Å; L50-A54 HydrophobicContact CG-CB 4.5Å; T51-A54 CarbonylContact O-C 3.48Å; T51-A54 WeakPolarHBondContact O-CA 3.26Å; T51-A54 WeakPolarHBondContact O-CB 3.37Å; T51-A54 PolarHBondContact O-N 3.1Å; T51-A54 PolarHBondContact OG1-N 2.96Å; A54-A57 CarbonylContact O-C 3.13Å; A54-A57 PolarHBondContact O-N 3.05Å; A54-G58 PolarHBondContact O-N 2.88Å
55	A	40	Very low	38.8	Very low	6 Å²	6	77.3 Å²	77.3	5%	0.05	42%	0.424	C	S	.	.	H	α-helix	trans	-74.1	-39.8	173.5	0	0	0	0	0	111.8	L50 T51 G58 V59 W255	L50-A55 HydrophobicContact CB-CB 4.33Å; T51-A55 PolarHBondContact O-N 3.39Å; A55-G58 PolarHBondContact O-N 3.01Å; A55-V59 WeakPolarHBondContact O-CG2 3.41Å; A55-V59 PolarHBondContact O-N 3.32Å; A55-V59 VanDerWaalsContact O-N 3.07Å; A55-W255 HydrophobicContact CB-CZ2 3.75Å
56	A	41.2	Very low	38.6	Very low	21 Å²	21	76.2 Å²	76.2	17%	0.174	42%	0.418	C	S	.	.	H	α-helix	trans	-59.9	-49.1	165.6	0	0	0	0	0	109.9	C52 G58 V59 W60	C52-A56 WeakPolarHBondContact O-CB 3.38Å; C52-A56 PolarHBondContact O-N 3.45Å; A56-G58 PolarHBondContact O-N 2.87Å; A56-V59 WeakPolarHBondContact O-CB 3.37Å; A56-V59 PolarHBondContact O-N 3.49Å; A56-W60 PolarHBondContact O-N 3.27Å
57	A	39.9	Very low	38.5	Very low	40 Å²	40	76.6 Å²	76.6	33%	0.331	41%	0.411	S	S	.	.	H	α-helix	trans	-58.9	-33.6	176.1	0	0	0	0	0	112.4	A53 A54 W60 L61	A53-A57 WeakPolarHBondContact O-CB 3.45Å; A53-A57 PolarHBondContact O-N 3.15Å; A54-A57 CarbonylContact O-C 3.13Å; A54-A57 PolarHBondContact O-N 3.05Å; A57-W60 CarbonylContact O-C 3.55Å; A57-W60 PolarHBondContact O-N 3.43Å; A57-L61 WeakPolarHBondContact O-CA 3.45Å; A57-L61 WeakPolarHBondContact O-CB 3.31Å; A57-L61 WeakPolarHBondContact O-CD1 3.43Å; A57-L61 WeakPolarHBondContact O-CG 3.36Å; A57-L61 PolarHBondContact O-N 3.03Å
58	G	44.2	Very low	38.3	Very low	21 Å²	21	73 Å²	73	22%	0.216	41%	0.41	C	S	.	.	H	α-helix	trans	-64.9	-42.1	172.6	0	0	0	0	0	112.7	A54 A55 A56 W60 L61 L62	A54-G58 PolarHBondContact O-N 2.88Å; A55-G58 PolarHBondContact O-N 3.01Å; A56-G58 PolarHBondContact O-N 2.87Å; G58-W60 VanDerWaalsContact C-N 3.34Å; G58-L61 PolarHBondContact O-N 2.96Å; G58-L62 WeakPolarHBondContact O-CB 3.44Å; G58-L62 WeakPolarHBondContact O-CD1 3.38Å; G58-L62 VanDerWaalsContact O-CG 3.25Å; G58-L62 WeakPolarHBondContact O-CG 3.38Å; G58-L62 PolarHBondContact O-N 3.11Å
59	V	47.3	Very low	37.9	Very low	24 Å²	24	65.1 Å²	65.1	15%	0.145	40%	0.404	C	S	.	.	H	α-helix	trans	-65.4	-36.9	172.5	176	0	0	0	0	111.4	A55 A56 R63	A55-V59 WeakPolarHBondContact O-CG2 3.41Å; A55-V59 PolarHBondContact O-N 3.32Å; A55-V59 VanDerWaalsContact O-N 3.07Å; A56-V59 WeakPolarHBondContact O-CB 3.37Å; A56-V59 PolarHBondContact O-N 3.49Å; V59-R63 WeakPolarHBondContact O-CB 3.43Å; V59-R63 PolarHBondContact O-N 3.49Å
60	W	34.1	Very low	37.6	Very low	146 Å²	146	70.8 Å²	70.8	55%	0.553	43%	0.429	S	S	*	.	H	α-helix	trans	-75.6	-34.5	175.9	-73.2	104	0	0	0	113.5	A56 A57 G58 R63 D64	A56-W60 PolarHBondContact O-N 3.27Å; A57-W60 CarbonylContact O-C 3.55Å; A57-W60 PolarHBondContact O-N 3.43Å; G58-W60 VanDerWaalsContact C-N 3.34Å; W60-R63 VanDerWaalsContact O-CB 3.31Å; W60-R63 WeakPolarHBondContact O-CB 3.35Å; W60-R63 PolarHBondContact O-N 3.1Å; W60-D64 PolarHBondContact O-N 3.48Å; W60-D64 VanDerWaalsContact O-N 3.1Å
61	L	32.8	Very low	37.1	Very low	114 Å²	114	69.8 Å²	69.8	60%	0.597	43%	0.433	S	S	*	.	H	α-helix	trans	-69.4	-41.8	176.5	-82	160.5	0	0	0	110.7	A57 G58 R63 D64 E65	A57-L61 WeakPolarHBondContact O-CA 3.45Å; A57-L61 WeakPolarHBondContact O-CB 3.31Å; A57-L61 WeakPolarHBondContact O-CD1 3.43Å; A57-L61 WeakPolarHBondContact O-CG 3.36Å; A57-L61 PolarHBondContact O-N 3.03Å; G58-L61 PolarHBondContact O-N 2.96Å; L61-R63 VanDerWaalsContact C-N 3.27Å; L61-R63 PolarHBondContact O-N 3Å; L61-D64 PolarHBondContact O-N 3.19Å; L61-E65 PolarHBondContact O-N 3.46Å
62	L	39.6	Very low	36.7	Very low	29 Å²	29	75.6 Å²	75.6	15%	0.152	46%	0.46	C	S	.	.	H	α-helix	trans	-65.9	-30.8	172.1	-68	167.5	0	0	0	111.7	G58 D64 A66 M258 N302 E305	G58-L62 WeakPolarHBondContact O-CB 3.44Å; G58-L62 WeakPolarHBondContact O-CD1 3.38Å; G58-L62 VanDerWaalsContact O-CG 3.25Å; G58-L62 WeakPolarHBondContact O-CG 3.38Å; G58-L62 PolarHBondContact O-N 3.11Å; L62-D64 VanDerWaalsContact C-N 3.35Å; L62-A66 VanDerWaalsContact O-CB 3.25Å; L62-A66 WeakPolarHBondContact O-CB 3.32Å; L62-A66 PolarHBondContact O-N 2.82Å; L62-M258 HydrophobicContact CD1-SD 4.39Å; L62-N302 WeakPolarHBondContact CB-ND2 3.37Å; L62-N302 WeakPolarHBondContact CD1-ND2 3.38Å; L62-E305 HydrophobicContact CD2-CB 4.31Å
63	R	38.3	Very low	36.3	Very low	59 Å²	59	77.4 Å²	77.4	22%	0.223	49%	0.485	C	S	.	.	H	α-helix	trans	-64.6	-36.7	171.6	-177.8	-175.8	176.6	159.5	5.9	112.2	V59 W60 L61 L67 E297	V59-R63 WeakPolarHBondContact O-CB 3.43Å; V59-R63 PolarHBondContact O-N 3.49Å; W60-R63 VanDerWaalsContact O-CB 3.31Å; W60-R63 WeakPolarHBondContact O-CB 3.35Å; W60-R63 PolarHBondContact O-N 3.1Å; L61-R63 VanDerWaalsContact C-N 3.27Å; L61-R63 PolarHBondContact O-N 3Å; R63-L67 WeakPolarHBondContact O-CD1 3.47Å; R63-L67 WeakPolarHBondContact O-CG 3.38Å; R63-L67 PolarHBondContact O-N 3.12Å; R63-E297 PolarHBondContact NH1-O 3.41Å; R63-E297 VanDerWaalsContact NH1-O 3.16Å; R63-E297 PolarHBondContact NH2-O 3.09Å
64	D	30.1	Very low	36.1	Very low	118 Å²	118	83.1 Å²	83.1	63%	0.631	49%	0.491	S	S	*	.	H	α-helix	trans	-73.7	-36.9	176.5	-90.4	-9.4	0	0	0	112.7	W60 L61 L62 L67	W60-D64 PolarHBondContact O-N 3.48Å; W60-D64 VanDerWaalsContact O-N 3.1Å; L61-D64 PolarHBondContact O-N 3.19Å; L62-D64 VanDerWaalsContact C-N 3.35Å; D64-L67 PolarHBondContact O-N 2.86Å
65	E	36.4	Very low	35.7	Very low	149 Å²	149	86.6 Å²	86.6	70%	0.696	51%	0.511	S	S	*	.	H	α-helix	trans	-69.6	-39.5	172.7	-74.1	-148	152.3	0	0	112.8	L61 L67 G68	L61-E65 PolarHBondContact O-N 3.46Å; E65-L67 PolarHBondContact O-N 3.38Å; E65-G68 CarbonylContact O-C 3.59Å; E65-G68 WeakPolarHBondContact O-CA 3.25Å; E65-G68 PolarHBondContact O-N 3.42Å
66	A	34.3	Very low	35.4	Very low	37 Å²	37	92.4 Å²	92.4	31%	0.306	55%	0.548	S	S	.	.	H	α-helix	trans	-65.5	-21	176.9	0	0	0	0	0	113.3	L62 G68	L62-A66 VanDerWaalsContact O-CB 3.25Å; L62-A66 WeakPolarHBondContact O-CB 3.32Å; L62-A66 PolarHBondContact O-N 2.82Å; A66-G68 VanDerWaalsContact C-N 3.33Å
67	L	35	Very low	35.3	Very low	123 Å²	123	102.2 Å²	102.2	64%	0.644	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-1.3	170.9	-72.8	167.2	0	0	0	113	R63 D64 E65	R63-L67 WeakPolarHBondContact O-CD1 3.47Å; R63-L67 WeakPolarHBondContact O-CG 3.38Å; R63-L67 PolarHBondContact O-N 3.12Å; D64-L67 PolarHBondContact O-N 2.86Å; E65-L67 PolarHBondContact O-N 3.38Å
68	G	36.4	Very low	35.4	Very low	59 Å²	59	103.3 Å²	103.3	61%	0.608	60%	0.596	S	S	*	*			trans	-134.6	43.7	-168.3	0	0	0	0	0	115.4	E65 A66	E65-G68 CarbonylContact O-C 3.59Å; E65-G68 WeakPolarHBondContact O-CA 3.25Å; E65-G68 PolarHBondContact O-N 3.42Å; A66-G68 VanDerWaalsContact C-N 3.33Å
69	G	29.5	Very low	35.4	Very low	76 Å²	76	109.6 Å²	109.6	78%	0.784	63%	0.63	S	S	*	*			trans	-103.2	65.9	177.3	0	0	0	0	0	115.2
70	D	35.7	Very low	35.7	Very low	160 Å²	160	117.1 Å²	117.1	86%	0.856	66%	0.655	S	S	*	*			trans	-179.7	107.6	142.2	-131.2	-5.9	0	0	0	110.3
71	A	30.2	Very low	37	Very low	68 Å²	68	113 Å²	113	56%	0.562	65%	0.649	S	S	*	*			trans	-175.9	71.2	158.1	0	0	0	0	0	113	G73	A71-G73 VanDerWaalsContact C-N 3.32Å; A71-G73 PolarHBondContact O-N 2.94Å
72	L	33.4	Very low	38.1	Very low	195 Å²	195	115.7 Å²	115.7	100%	1.021	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	92.9	146.8	-99.6	156.5	0	0	0	107.1
73	G	32.4	Very low	39.2	Very low	74 Å²	74	117.1 Å²	117.1	76%	0.763	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	132.8	41.3	171.5	0	0	0	0	0	117.5	A71	A71-G73 VanDerWaalsContact C-N 3.32Å; A71-G73 PolarHBondContact O-N 2.94Å
74	R	30.6	Very low	40.3	Very low	193 Å²	193	119.9 Å²	119.9	73%	0.728	69%	0.69	S	S	*	*			trans	-108.1	134.1	167.8	-100.1	-178.2	172.6	160.7	-0.8	112.1
75	P	28.5	Very low	41.9	Very low	106 Å²	106	117.4 Å²	117.4	69%	0.688	68%	0.681	S	S	*	*			trans	-68.1	162.3	175	31.3	-33.1	0	0	0	110.2	R77	P75-R77 PolarHBondContact O-N 3.47Å
76	P	32.8	Very low	43.5	Very low	129 Å²	129	115 Å²	115	84%	0.838	67%	0.672	S	S	*	*			trans	-55.8	129.4	-172.8	21.4	-32.4	0	0	0	111.2	G78	P76-G78 PolarHBondContact O-N 3.28Å; P76-G78 VanDerWaalsContact O-N 3.08Å
77	R	40.1	Very low	45.4	Very low	227 Å²	227	119.1 Å²	119.1	86%	0.857	69%	0.688	S	S	*	*			trans	-61.5	110.8	179.9	-82.7	179.5	172.5	164.5	-1.3	109.4	P75	P75-R77 PolarHBondContact O-N 3.47Å
78	G	42.6	Very low	47	Very low	62 Å²	62	117.3 Å²	117.3	64%	0.639	68%	0.677	S	S	*	*			trans	-57.5	145.6	166.7	0	0	0	0	0	111.3	P76 R80	P76-G78 PolarHBondContact O-N 3.28Å; P76-G78 VanDerWaalsContact O-N 3.08Å; G78-R80 PolarHBondContact O-N 3.48Å
79	V	44.2	Very low	48.7	Very low	154 Å²	154	119.5 Å²	119.5	93%	0.933	67%	0.671	S	S	*	*			trans	-56.8	103.1	178.9	-174.7	0	0	0	0	109.2
80	R	52.5	Low	51	Low	182 Å²	182	121.4 Å²	121.4	69%	0.687	66%	0.663	S	S	*	*			trans	-70	136.8	173.9	-82	-180	170.4	-175.2	-5.2	109.3	G78	G78-R80 PolarHBondContact O-N 3.48Å
81	S	61.6	Low	53.1	Low	60 Å²	60	124.3 Å²	124.3	42%	0.42	66%	0.662	S	S	.	*			trans	-68.1	142.3	178.5	74	0	0	0	0	111.1	A83 Q84 C85	S81-A83 PolarHBondContact O-N 3.13Å; S81-A83 VanDerWaalsContact O-N 3.14Å; S81-Q84 PolarHBondContact O-N 3.33Å; S81-Q84 WeakPolarHBondContact OG-CG 3.49Å; S81-C85 PolarHBondContact O-N 2.93Å
82	Q	56.6	Low	55.6	Low	170 Å²	170	124.4 Å²	124.4	79%	0.794	65%	0.65	S	S	*	*	H	α-helix	trans	-53.5	-34.4	179.5	-81.9	176	-17.1	0	0	113	Q84 C85 L86	Q82-Q84 PolarHBondContact O-N 2.99Å; Q82-C85 WeakPolarHBondContact O-CB 3.46Å; Q82-C85 PolarHBondContact O-N 2.94Å; Q82-L86 PolarHBondContact O-N 3.34Å
83	A	61.2	Low	58.1	Low	58 Å²	58	118.8 Å²	118.8	48%	0.479	62%	0.621	S	S	.	*	H	α-helix	trans	-65	-36.8	177.6	0	0	0	0	0	113.2	S81 C85 L86 L87	S81-A83 PolarHBondContact O-N 3.13Å; S81-A83 VanDerWaalsContact O-N 3.14Å; A83-C85 VanDerWaalsContact C-N 3.32Å; A83-L86 PolarHBondContact O-N 3.4Å; A83-L87 WeakPolarHBondContact O-CB 3.39Å; A83-L87 WeakPolarHBondContact O-CG 3.33Å; A83-L87 PolarHBondContact O-N 2.74Å
84	Q	61.9	Low	60.8	Low	118 Å²	118	119.4 Å²	119.4	55%	0.551	61%	0.611	S	S	*	*	H	α-helix	trans	-70	-32.4	175.1	-71.9	175.2	-5.3	0	0	111.6	S81 Q82 Q88	S81-Q84 PolarHBondContact O-N 3.33Å; S81-Q84 WeakPolarHBondContact OG-CG 3.49Å; Q82-Q84 PolarHBondContact O-N 2.99Å; Q84-Q88 WeakPolarHBondContact O-CB 3.48Å; Q84-Q88 PolarHBondContact O-N 2.95Å; Q84-Q88 VanDerWaalsContact O-N 3.12Å
85	C	64.9	Low	63.5	Low	65 Å²	65	111.4 Å²	111.4	44%	0.439	59%	0.589	S	S	.	*	H	α-helix	trans	-68.2	-44.8	174.1	-165.3	0	0	0	0	111.6	S81 Q82 A83 Q88 Q89	S81-C85 PolarHBondContact O-N 2.93Å; Q82-C85 WeakPolarHBondContact O-CB 3.46Å; Q82-C85 PolarHBondContact O-N 2.94Å; A83-C85 VanDerWaalsContact C-N 3.32Å; C85-Q88 PolarHBondContact O-N 3.43Å; C85-Q89 WeakPolarHBondContact O-CG 3.38Å; C85-Q89 PolarHBondContact O-N 3.39Å
86	L	69.8	Low	66.3	Low	100 Å²	100	109.9 Å²	109.9	52%	0.524	57%	0.573	S	S	.	*	H	α-helix	trans	-62.7	-44.7	176	-82.4	157.4	0	0	0	112.9	Q82 A83 Q88 Q89 L90	Q82-L86 PolarHBondContact O-N 3.34Å; A83-L86 PolarHBondContact O-N 3.4Å; L86-Q88 VanDerWaalsContact C-N 3.28Å; L86-Q88 PolarHBondContact O-N 3Å; L86-Q89 PolarHBondContact O-N 3Å; L86-L90 WeakPolarHBondContact O-CG 3.48Å; L86-L90 PolarHBondContact O-N 3.14Å
87	L	73	Confident	69.1	Low	122 Å²	122	108.8 Å²	108.8	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-61.9	-38	175.5	-82.6	162	0	0	0	112	A83 R91	A83-L87 WeakPolarHBondContact O-CB 3.39Å; A83-L87 WeakPolarHBondContact O-CG 3.33Å; A83-L87 PolarHBondContact O-N 2.74Å; L87-R91 WeakPolarHBondContact O-CB 3.38Å; L87-R91 PolarHBondContact O-N 3.09Å; L87-R91 VanDerWaalsContact O-N 3.1Å
88	Q	70.2	Confident	71.6	Confident	86 Å²	86	100 Å²	100	40%	0.402	54%	0.535	S	S	.	.	H	α-helix	trans	-67.1	-43.1	175.5	-170.8	177	-15.2	0	0	111.4	Q84 C85 L86 L90 R91 E92	Q84-Q88 WeakPolarHBondContact O-CB 3.48Å; Q84-Q88 PolarHBondContact O-N 2.95Å; Q84-Q88 VanDerWaalsContact O-N 3.12Å; C85-Q88 PolarHBondContact O-N 3.43Å; L86-Q88 VanDerWaalsContact C-N 3.28Å; L86-Q88 PolarHBondContact O-N 3Å; Q88-L90 PolarHBondContact O-N 3.27Å; Q88-R91 PolarHBondContact O-N 3.39Å; Q88-E92 WeakPolarHBondContact CG-OE1 3.46Å; Q88-E92 PolarHBondContact NE2-OE1 3.12Å; Q88-E92 WeakPolarHBondContact O-CG 3.43Å; Q88-E92 PolarHBondContact O-N 2.86Å
89	Q	70.3	Confident	73.9	Confident	104 Å²	104	97 Å²	97	49%	0.486	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-45.6	175.5	-75.2	177.7	-29.6	0	0	112.4	C85 L86 R91 E92 L93	C85-Q89 WeakPolarHBondContact O-CG 3.38Å; C85-Q89 PolarHBondContact O-N 3.39Å; L86-Q89 PolarHBondContact O-N 3Å; Q89-R91 VanDerWaalsContact C-N 3.31Å; Q89-R91 PolarHBondContact O-N 2.73Å; Q89-E92 PolarHBondContact O-N 2.87Å; Q89-L93 PolarHBondContact O-N 3.34Å
90	L	78.8	Confident	76.3	Confident	117 Å²	117	95.8 Å²	95.8	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-63.5	-36.9	177.1	-72.9	171.7	0	0	0	112.4	L86 Q88 E92 L93	L86-L90 WeakPolarHBondContact O-CG 3.48Å; L86-L90 PolarHBondContact O-N 3.14Å; Q88-L90 PolarHBondContact O-N 3.27Å; L90-E92 VanDerWaalsContact C-N 3.34Å; L90-L93 WeakPolarHBondContact O-CB 3.41Å
91	R	78.7	Confident	78.3	Confident	221 Å²	221	89.8 Å²	89.8	83%	0.834	47%	0.473	S	S	*	.	H	α-helix	trans	-69.8	-31.1	177.8	-169.9	176.4	179.9	176.3	0.5	112.6	L87 Q88 Q89	L87-R91 WeakPolarHBondContact O-CB 3.38Å; L87-R91 PolarHBondContact O-N 3.09Å; L87-R91 VanDerWaalsContact O-N 3.1Å; Q88-R91 PolarHBondContact O-N 3.39Å; Q89-R91 VanDerWaalsContact C-N 3.31Å; Q89-R91 PolarHBondContact O-N 2.73Å
92	E	84.1	Confident	79.7	Confident	69 Å²	69	88 Å²	88	32%	0.322	46%	0.459	S	S	.	.	H	α-helix	trans	-84.1	-20.3	179.2	-70.5	178.6	-162.1	0	0	113.3	Q88 Q89 L90 G95 Q96	Q88-E92 WeakPolarHBondContact CG-OE1 3.46Å; Q88-E92 PolarHBondContact NE2-OE1 3.12Å; Q88-E92 WeakPolarHBondContact O-CG 3.43Å; Q88-E92 PolarHBondContact O-N 2.86Å; Q89-E92 PolarHBondContact O-N 2.87Å; L90-E92 VanDerWaalsContact C-N 3.34Å; E92-G95 PolarHBondContact O-N 3.31Å; E92-G95 VanDerWaalsContact O-N 3.09Å; E92-Q96 PolarHBondContact O-N 2.89Å
93	L	85.6	Confident	81.5	Confident	78 Å²	78	79.9 Å²	79.9	41%	0.408	42%	0.421	S	S	.	.	H	α-helix	trans	-55.3	-44.3	-174.2	-153.4	116.9	0	0	0	114.7	Q89 L90 G95 Q96 L97	Q89-L93 PolarHBondContact O-N 3.34Å; L90-L93 WeakPolarHBondContact O-CB 3.41Å; L93-G95 VanDerWaalsContact C-N 3.28Å; L93-G95 PolarHBondContact O-N 3.09Å; L93-Q96 WeakPolarHBondContact O-CB 3.45Å; L93-Q96 PolarHBondContact O-N 3.35Å; L93-L97 HydrophobicContact CD2-CD1 3.84Å; L93-L97 HydrophobicContact CD2-CG 4.46Å; L93-L97 WeakPolarHBondContact O-CG 3.38Å; L93-L97 PolarHBondContact O-N 2.9Å
94	P	89.1	Confident	83	Confident	86 Å²	86	80.2 Å²	80.2	56%	0.558	41%	0.413	S	S	*	.	H	α-helix	trans	-61.7	-38.2	177.6	-22.6	34.3	0	0	0	112.4	A98	P94-A98 WeakPolarHBondContact O-CB 3.42Å; P94-A98 PolarHBondContact O-N 3.01Å
95	G	86.6	Confident	84.3	Confident	25 Å²	25	77 Å²	77	26%	0.258	40%	0.404	S	S	.	.	H	α-helix	trans	-69	-37.5	176.6	0	0	0	0	0	112.5	E92 L93 S99	E92-G95 PolarHBondContact O-N 3.31Å; E92-G95 VanDerWaalsContact O-N 3.09Å; L93-G95 VanDerWaalsContact C-N 3.28Å; L93-G95 PolarHBondContact O-N 3.09Å; G95-S99 WeakPolarHBondContact O-CB 3.35Å; G95-S99 PolarHBondContact O-N 3.18Å
96	Q	88.3	Confident	85.5	Confident	74 Å²	74	77.7 Å²	77.7	35%	0.346	40%	0.402	S	S	.	.	H	α-helix	trans	-63.2	-46.4	173.6	-71.1	173.8	-8.1	0	0	111.4	E92 L93 S99 Y100 R293	E92-Q96 PolarHBondContact O-N 2.89Å; L93-Q96 WeakPolarHBondContact O-CB 3.45Å; L93-Q96 PolarHBondContact O-N 3.35Å; Q96-S99 WeakPolarHBondContact O-CB 3.27Å; Q96-S99 PolarHBondContact O-N 2.82Å; Q96-Y100 VanDerWaalsContact O-CB 3.31Å; Q96-Y100 WeakPolarHBondContact O-CB 3.34Å; Q96-Y100 PolarHBondContact O-N 3.35Å; Q96-R293 VanDerWaalsContact CG-CZ 3.5Å
97	L	91.4	Very high	86.4	Confident	107 Å²	107	73.4 Å²	73.4	56%	0.56	38%	0.382	S	S	*	.	H	α-helix	trans	-65	-41.9	178.6	-68.8	174.5	0	0	0	111.8	L93 Y100 A101	L93-L97 HydrophobicContact CD2-CD1 3.84Å; L93-L97 HydrophobicContact CD2-CG 4.46Å; L93-L97 WeakPolarHBondContact O-CG 3.38Å; L93-L97 PolarHBondContact O-N 2.9Å; L97-Y100 PolarHBondContact O-N 3.05Å; L97-A101 VanDerWaalsContact O-CB 3.3Å; L97-A101 WeakPolarHBondContact O-CB 3.46Å; L97-A101 PolarHBondContact O-N 2.87Å
98	A	91.6	Very high	87.4	Confident	42 Å²	42	69.6 Å²	69.6	35%	0.347	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-42.4	175.2	0	0	0	0	0	112.1	P94 A101 L102 L290	P94-A98 WeakPolarHBondContact O-CB 3.42Å; P94-A98 PolarHBondContact O-N 3.01Å; A98-A101 PolarHBondContact O-N 2.79Å; A98-L102 WeakPolarHBondContact O-CB 3.43Å; A98-L102 PolarHBondContact O-N 3.25Å; A98-L290 HydrophobicContact CB-CD1 3.9Å
99	S	92.6	Very high	88.4	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.7	-50.2	175	178.9	0	0	0	0	110.7	G95 Q96 L102 A103 T294 E297	G95-S99 WeakPolarHBondContact O-CB 3.35Å; G95-S99 PolarHBondContact O-N 3.18Å; Q96-S99 WeakPolarHBondContact O-CB 3.27Å; Q96-S99 PolarHBondContact O-N 2.82Å; S99-L102 PolarHBondContact O-N 3.08Å; S99-A103 WeakPolarHBondContact O-CB 3.45Å; S99-A103 PolarHBondContact O-N 3.2Å; S99-T294 VanDerWaalsContact OG-CA 3.28Å; S99-T294 WeakPolarHBondContact OG-CA 3.37Å; S99-E297 WeakPolarHBondContact CB-OE2 3.18Å; S99-E297 PolarHBondContact OG-OE2 3.25Å
100	Y	93.4	Very high	89.4	Confident	127 Å²	127	70.8 Å²	70.8	50%	0.498	36%	0.362	S	S	.	.	H	α-helix	trans	-60.2	-48.4	176.4	-177.6	-90.1	0	0	0	112.1	Q96 L97 L102 A103 H104 H298	Q96-Y100 VanDerWaalsContact O-CB 3.31Å; Q96-Y100 WeakPolarHBondContact O-CB 3.34Å; Q96-Y100 PolarHBondContact O-N 3.35Å; L97-Y100 PolarHBondContact O-N 3.05Å; Y100-L102 VanDerWaalsContact C-N 3.34Å; Y100-L102 PolarHBondContact O-N 3.36Å; Y100-A103 PolarHBondContact O-N 3.2Å; Y100-H104 AromaticContact CD2-CD2 3.61Å; Y100-H104 AromaticContact CD2-NE2 3.65Å; Y100-H104 AromaticContact CE1-CD2 3.98Å; Y100-H104 AromaticContact CE2-CD2 3.43Å; Y100-H104 VanDerWaalsContact CE2-CD2 3.43Å; Y100-H104 WeakPolarHBondContact CE2-CD2 3.46Å; Y100-H104 AromaticContact CE2-CE1 3.85Å; Y100-H104 AromaticContact CE2-NE2 3.18Å; Y100-H104 WeakPolarHBondContact CE2-NE2 3.4Å; Y100-H104 AromaticContact CG-CD2 3.95Å; Y100-H104 AromaticContact CZ-CD2 3.62Å; Y100-H104 AromaticContact CZ-CE1 3.96Å; Y100-H104 AromaticContact CZ-CG 3.97Å; Y100-H104 AromaticContact CZ-NE2 3.64Å; Y100-H104 PolarHBondContact O-CD2 2.69Å; Y100-H104 VanDerWaalsContact O-CD2 3.25Å; Y100-H104 PolarHBondContact O-N 3.11Å; Y100-H298 AromaticContact CD2-CE1 3.83Å
101	A	93.9	Very high	90.1	Very high	56 Å²	56	66.1 Å²	66.1	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-60.7	-43.9	179	0	0	0	0	0	111.6	L97 A98 S105	L97-A101 VanDerWaalsContact O-CB 3.3Å; L97-A101 WeakPolarHBondContact O-CB 3.46Å; L97-A101 PolarHBondContact O-N 2.87Å; A98-A101 PolarHBondContact O-N 2.79Å; A101-S105 WeakPolarHBondContact O-CB 3.46Å; A101-S105 PolarHBondContact O-N 3.23Å; A101-S105 PolarHBondContact O-OG 3.19Å
102	L	92.4	Very high	90.8	Very high	22 Å²	22	55.6 Å²	55.6	12%	0.115	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-45.3	175.5	-177.7	60.9	0	0	0	110.8	A98 S99 Y100 H104 S105 L106 G107 L290 T294	A98-L102 WeakPolarHBondContact O-CB 3.43Å; A98-L102 PolarHBondContact O-N 3.25Å; S99-L102 PolarHBondContact O-N 3.08Å; Y100-L102 VanDerWaalsContact C-N 3.34Å; Y100-L102 PolarHBondContact O-N 3.36Å; L102-H104 PolarHBondContact O-N 2.97Å; L102-S105 PolarHBondContact O-N 3.1Å; L102-L106 HydrophobicContact CD1-CB 4.32Å; L102-G107 VanDerWaalsContact O-CA 3.3Å; L102-G107 WeakPolarHBondContact O-CA 3.49Å; L102-G107 PolarHBondContact O-N 3.2Å; L102-L290 HydrophobicContact CD2-CD2 4.18Å; L102-L290 HydrophobicContact CD2-CG 4.15Å; L102-T294 HydrophobicContact CB-CG2 4.28Å; L102-T294 HydrophobicContact CD2-CG2 4.19Å; L102-T294 HydrophobicContact CG-CG2 4.18Å
103	A	92.9	Very high	91.3	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	I	π-helix	trans	-60.9	-44.8	-179.5	0	0	0	0	0	112.4	S99 Y100 S105 R108 T294 H298 F299	S99-A103 WeakPolarHBondContact O-CB 3.45Å; S99-A103 PolarHBondContact O-N 3.2Å; Y100-A103 PolarHBondContact O-N 3.2Å; A103-S105 VanDerWaalsContact C-N 3.27Å; A103-S105 PolarHBondContact O-N 3.16Å; A103-R108 WeakPolarHBondContact O-CB 3.46Å; A103-R108 PolarHBondContact O-N 2.99Å; A103-T294 HydrophobicContact CB-CG2 3.81Å; A103-H298 HydrophobicContact CB-CB 3.56Å; A103-H298 VanDerWaalsContact CB-CG 3.45Å; A103-F299 HydrophobicContact CB-CE2 3.81Å
104	H	92.7	Very high	91.4	Very high	65 Å²	65	50.2 Å²	50.2	30%	0.301	27%	0.274	S	S	.	.	I	π-helix	trans	-84	2.5	-176.6	-72.8	-99	0	0	0	114.1	Y100 L102 R108 F215	Y100-H104 AromaticContact CD2-CD2 3.61Å; Y100-H104 AromaticContact CD2-NE2 3.65Å; Y100-H104 AromaticContact CE1-CD2 3.98Å; Y100-H104 AromaticContact CE2-CD2 3.43Å; Y100-H104 VanDerWaalsContact CE2-CD2 3.43Å; Y100-H104 WeakPolarHBondContact CE2-CD2 3.46Å; Y100-H104 AromaticContact CE2-CE1 3.85Å; Y100-H104 AromaticContact CE2-NE2 3.18Å; Y100-H104 WeakPolarHBondContact CE2-NE2 3.4Å; Y100-H104 AromaticContact CG-CD2 3.95Å; Y100-H104 AromaticContact CZ-CD2 3.62Å; Y100-H104 AromaticContact CZ-CE1 3.96Å; Y100-H104 AromaticContact CZ-CG 3.97Å; Y100-H104 AromaticContact CZ-NE2 3.64Å; Y100-H104 PolarHBondContact O-CD2 2.69Å; Y100-H104 VanDerWaalsContact O-CD2 3.25Å; Y100-H104 PolarHBondContact O-N 3.11Å; L102-H104 PolarHBondContact O-N 2.97Å; H104-R108 PolarHBondContact O-NH2 2.75Å; H104-R108 VanDerWaalsContact O-NH2 3.07Å; H104-F215 AromaticContact CE1-CZ 3.54Å; H104-F215 AromaticContact ND1-CZ 3.62Å; H104-F215 AromaticContact NE2-CZ 3.96Å
105	S	90.8	Very high	91.5	Very high	52 Å²	52	47.3 Å²	47.3	36%	0.364	26%	0.256	S	S	.	.	I	π-helix	trans	-124.6	-111	177.5	64.5	0	0	0	0	112.1	A101 L102 A103 G107 R108 W109	A101-S105 WeakPolarHBondContact O-CB 3.46Å; A101-S105 PolarHBondContact O-N 3.23Å; A101-S105 PolarHBondContact O-OG 3.19Å; L102-S105 PolarHBondContact O-N 3.1Å; A103-S105 VanDerWaalsContact C-N 3.27Å; A103-S105 PolarHBondContact O-N 3.16Å; S105-G107 VanDerWaalsContact C-N 3.33Å; S105-G107 PolarHBondContact O-N 3.32Å; S105-R108 PolarHBondContact O-N 3.48Å; S105-W109 PolarHBondContact O-N 3.47Å
106	L	89	Confident	91.7	Very high	79 Å²	79	48 Å²	48	41%	0.414	26%	0.255	S	S	.	.	I	π-helix	trans	-62.4	-37	-175.3	-179.6	64.6	0	0	0	112.4	L102 R108 W109 L110	L102-L106 HydrophobicContact CD1-CB 4.32Å; L106-R108 PolarHBondContact O-N 3.32Å; L106-W109 HydrophobicContact CD1-CE3 4.43Å; L106-W109 PolarHBondContact O-N 2.88Å; L106-W109 VanDerWaalsContact O-N 3.17Å; L106-L110 HydrophobicContact CD1-CD1 4.38Å; L106-L110 HydrophobicContact CD1-CG 4.24Å; L106-L110 HydrophobicContact CD2-CD1 4.48Å; L106-L110 HydrophobicContact CG-CD1 3.98Å; L106-L110 HydrophobicContact CG-CG 4.29Å; L106-L110 WeakPolarHBondContact O-CG 3.32Å; L106-L110 PolarHBondContact O-N 3.44Å
107	G	90.1	Very high	91.5	Very high	10 Å²	10	47.7 Å²	47.7	10%	0.103	26%	0.261	C	S	.	.	I	π-helix	trans	-57.4	-50.5	-180	0	0	0	0	0	111.8	L102 S105 W109 L110 V111	L102-G107 VanDerWaalsContact O-CA 3.3Å; L102-G107 WeakPolarHBondContact O-CA 3.49Å; L102-G107 PolarHBondContact O-N 3.2Å; S105-G107 VanDerWaalsContact C-N 3.33Å; S105-G107 PolarHBondContact O-N 3.32Å; G107-W109 VanDerWaalsContact C-N 3.31Å; G107-W109 PolarHBondContact O-N 3.05Å; G107-L110 PolarHBondContact O-N 3.12Å; G107-V111 WeakPolarHBondContact O-CG2 3.45Å; G107-V111 PolarHBondContact O-N 3.25Å
108	R	94.1	Very high	91.2	Very high	42 Å²	42	47.7 Å²	47.7	16%	0.158	26%	0.261	C	S	.	.	H	α-helix	trans	-58.6	-41	175.1	-177.2	172	55	-176	-4.3	112.7	A103 H104 S105 L106 L110 V111 Y112 V213 P214 F299	A103-R108 WeakPolarHBondContact O-CB 3.46Å; A103-R108 PolarHBondContact O-N 2.99Å; H104-R108 PolarHBondContact O-NH2 2.75Å; H104-R108 VanDerWaalsContact O-NH2 3.07Å; S105-R108 PolarHBondContact O-N 3.48Å; L106-R108 PolarHBondContact O-N 3.32Å; R108-L110 VanDerWaalsContact C-N 3.32Å; R108-L110 PolarHBondContact O-N 3.3Å; R108-V111 PolarHBondContact O-N 2.83Å; R108-Y112 PolarHBondContact O-N 3.46Å; R108-V213 VanDerWaalsContact NH1-CB 3.34Å; R108-P214 HydrophobicContact CG-CG 4.17Å; R108-F299 HydrophobicContact CB-CZ 3.82Å; R108-F299 HydrophobicContact CG-CZ 4.33Å
109	W	91.2	Very high	90.8	Very high	129 Å²	129	48.7 Å²	48.7	49%	0.489	26%	0.259	S	S	.	.	H	α-helix	trans	-68	-31.7	-179.9	-61.4	-17.6	0	0	0	113.1	S105 L106 G107 P113 V116	S105-W109 PolarHBondContact O-N 3.47Å; L106-W109 HydrophobicContact CD1-CE3 4.43Å; L106-W109 PolarHBondContact O-N 2.88Å; L106-W109 VanDerWaalsContact O-N 3.17Å; G107-W109 VanDerWaalsContact C-N 3.31Å; G107-W109 PolarHBondContact O-N 3.05Å; W109-P113 WeakPolarHBondContact O-CA 3.31Å; W109-P113 WeakPolarHBondContact O-CB 3.37Å; W109-P113 WeakPolarHBondContact O-CD 3.26Å; W109-P113 VanDerWaalsContact O-N 3.11Å; W109-V116 HydrophobicContact CB-CG2 3.89Å; W109-V116 HydrophobicContact CD2-CG2 4.39Å; W109-V116 HydrophobicContact CG-CG2 3.73Å
110	L	90.7	Very high	90.3	Very high	86 Å²	86	49.9 Å²	49.9	45%	0.45	27%	0.267	S	S	.	.	H	α-helix	trans	-74.6	-38.3	174.6	-68.5	172.7	0	0	0	111.9	L106 G107 R108 M283	L106-L110 HydrophobicContact CD1-CD1 4.38Å; L106-L110 HydrophobicContact CD1-CG 4.24Å; L106-L110 HydrophobicContact CD2-CD1 4.48Å; L106-L110 HydrophobicContact CG-CD1 3.98Å; L106-L110 HydrophobicContact CG-CG 4.29Å; L106-L110 WeakPolarHBondContact O-CG 3.32Å; L106-L110 PolarHBondContact O-N 3.44Å; G107-L110 PolarHBondContact O-N 3.12Å; R108-L110 VanDerWaalsContact C-N 3.32Å; R108-L110 PolarHBondContact O-N 3.3Å; L110-M283 HydrophobicContact CD1-SD 3.79Å
111	V	92.7	Very high	89.8	Confident	19 Å²	19	50.5 Å²	50.5	12%	0.115	27%	0.268	C	S	.	.	H	α-helix	trans	-74.6	-37.7	178.7	-178.1	0	0	0	0	111.2	G107 R108 N180 L275 F299 L301	G107-V111 WeakPolarHBondContact O-CG2 3.45Å; G107-V111 PolarHBondContact O-N 3.25Å; R108-V111 PolarHBondContact O-N 2.83Å; V111-N180 WeakPolarHBondContact O-CB 3.43Å; V111-N180 PolarHBondContact O-ND2 3.07Å; V111-L275 HydrophobicContact CG1-CD2 4.17Å; V111-L275 HydrophobicContact CG2-CD2 4.13Å; V111-F299 HydrophobicContact CB-CD1 4.33Å; V111-F299 HydrophobicContact CB-CE1 4.5Å; V111-F299 HydrophobicContact CG1-CD1 4.08Å; V111-F299 HydrophobicContact CG2-CD1 4.37Å; V111-F299 HydrophobicContact CG2-CD2 4.38Å; V111-F299 HydrophobicContact CG2-CG 4.2Å; V111-L301 HydrophobicContact CG1-CD1 4.44Å
112	Y	94.8	Very high	89.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.			trans	-134.4	67	-176.9	-63.4	-82.5	0	0	0	112.9	R108 G114 S115 N180 F207 P214 D219 V248 F299	R108-Y112 PolarHBondContact O-N 3.46Å; Y112-G114 PolarHBondContact O-N 2.91Å; Y112-S115 PolarHBondContact O-N 2.76Å; Y112-S115 PolarHBondContact O-OG 3.18Å; Y112-N180 CarbonylContact C-O 3.54Å; Y112-N180 HydrophobicContact CD1-CB 4.49Å; Y112-F207 HydrophobicContact CD1-CE2 4.24Å; Y112-F207 HydrophobicContact CD1-CZ 4.1Å; Y112-P214 VanDerWaalsContact CB-CG 3.41Å; Y112-P214 HydrophobicContact CD1-CB 3.82Å; Y112-P214 HydrophobicContact CD1-CG 4.34Å; Y112-P214 HydrophobicContact CD2-CB 3.74Å; Y112-P214 HydrophobicContact CD2-CG 3.92Å; Y112-P214 HydrophobicContact CE1-CB 4.18Å; Y112-P214 HydrophobicContact CE2-CB 4.15Å; Y112-P214 HydrophobicContact CG-CB 3.55Å; Y112-P214 HydrophobicContact CG-CG 3.67Å; Y112-D219 WeakPolarHBondContact CE1-OD2 3.34Å; Y112-D219 VanDerWaalsContact CZ-OD2 3.29Å; Y112-D219 PolarHBondContact OH-OD2 3.26Å; Y112-V248 HydrophobicContact CD1-CG1 4.48Å; Y112-V248 HydrophobicContact CE1-CG1 3.73Å; Y112-F299 HydrophobicContact CD2-CE1 4.22Å; Y112-F299 HydrophobicContact CE2-CD1 4.03Å; Y112-F299 HydrophobicContact CE2-CE1 4.04Å
113	P	92.5	Very high	89.2	Confident	34 Å²	34	49.8 Å²	49.8	22%	0.221	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-60	-28.9	-178.8	23.7	-35.3	0	0	0	113.7	W109 S115 V116 M119 N180 A181	W109-P113 WeakPolarHBondContact O-CA 3.31Å; W109-P113 WeakPolarHBondContact O-CB 3.37Å; W109-P113 WeakPolarHBondContact O-CD 3.26Å; W109-P113 VanDerWaalsContact O-N 3.11Å; P113-S115 PolarHBondContact O-N 3Å; P113-S115 VanDerWaalsContact O-N 3.12Å; P113-V116 VanDerWaalsContact O-CB 3.31Å; P113-V116 WeakPolarHBondContact O-CB 3.4Å; P113-V116 WeakPolarHBondContact O-CG2 3.31Å; P113-V116 PolarHBondContact O-N 3.32Å; P113-M119 VanDerWaalsContact C-SD 3.56Å; P113-M119 HydrophobicContact CB-SD 3.93Å; P113-N180 VanDerWaalsContact CD-O 3.25Å; P113-N180 WeakPolarHBondContact CD-O 3.43Å; P113-A181 HydrophobicContact CG-CB 4.19Å
114	G	89.8	Confident	88.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-62.1	-19.5	178.8	0	0	0	0	0	114.9	Y112 V116 T120 N180	Y112-G114 PolarHBondContact O-N 2.91Å; G114-V116 VanDerWaalsContact C-N 3.34Å; G114-T120 PolarHBondContact O-OG1 3Å; G114-N180 PolarHBondContact N-O 2.9Å; G114-N180 VanDerWaalsContact N-O 3.08Å
115	S	90.8	Very high	88.6	Confident	25 Å²	25	48.6 Å²	48.6	18%	0.175	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-82	-7.7	174.2	68.5	0	0	0	0	114.6	Y112 P113 S117 G206 P214	Y112-S115 PolarHBondContact O-N 2.76Å; Y112-S115 PolarHBondContact O-OG 3.18Å; P113-S115 PolarHBondContact O-N 3Å; P113-S115 VanDerWaalsContact O-N 3.12Å; S115-S117 PolarHBondContact O-N 3.31Å; S115-G206 WeakPolarHBondContact CA-O 3.24Å; S115-P214 WeakPolarHBondContact OG-CG 3.48Å
116	V	89.9	Confident	88.5	Confident	38 Å²	38	50.1 Å²	50.1	23%	0.23	26%	0.261	C	S	.	.			trans	-73.8	115.2	179.7	178.5	0	0	0	0	108.5	W109 P113 G114 L118 M119 T120	W109-V116 HydrophobicContact CB-CG2 3.89Å; W109-V116 HydrophobicContact CD2-CG2 4.39Å; W109-V116 HydrophobicContact CG-CG2 3.73Å; P113-V116 VanDerWaalsContact O-CB 3.31Å; P113-V116 WeakPolarHBondContact O-CB 3.4Å; P113-V116 WeakPolarHBondContact O-CG2 3.31Å; P113-V116 PolarHBondContact O-N 3.32Å; G114-V116 VanDerWaalsContact C-N 3.34Å; V116-L118 HydrophobicContact CG1-CB 4.33Å; V116-L118 PolarHBondContact O-N 3.11Å; V116-M119 HydrophobicContact CB-CB 4.29Å; V116-M119 WeakPolarHBondContact O-CA 3.36Å; V116-M119 WeakPolarHBondContact O-CB 3.4Å; V116-M119 PolarHBondContact O-N 3.24Å; V116-T120 PolarHBondContact O-N 2.9Å; V116-T120 PolarHBondContact O-OG1 2.83Å; V116-T120 VanDerWaalsContact O-OG1 3.13Å
117	S	84.4	Confident	88.7	Confident	68 Å²	68	46.4 Å²	46.4	48%	0.476	24%	0.241	S	C	.	.	H	α-helix	trans	-45.4	-38.5	-177.3	-174.7	0	0	0	0	114.3	S115 R121	S115-S117 PolarHBondContact O-N 3.31Å; S117-R121 WeakPolarHBondContact O-CB 3.33Å; S117-R121 WeakPolarHBondContact O-CG 3.42Å; S117-R121 PolarHBondContact O-N 3.37Å
118	L	84.4	Confident	88.7	Confident	108 Å²	108	48.2 Å²	48.2	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-65.1	-45	176.5	-174.9	67.7	0	0	0	112.6	L18 V116 A122	L18-L118 HydrophobicContact CD1-CD1 4.24Å; L18-L118 HydrophobicContact CD2-CD1 3.57Å; V116-L118 HydrophobicContact CG1-CB 4.33Å; V116-L118 PolarHBondContact O-N 3.11Å; L118-A122 WeakPolarHBondContact O-CB 3.42Å; L118-A122 PolarHBondContact O-N 2.98Å; L118-A122 VanDerWaalsContact O-N 3.09Å
119	M	83.9	Confident	88.6	Confident	63 Å²	63	52.2 Å²	52.2	31%	0.31	27%	0.267	S	S	.	.	H	α-helix	trans	-66	-47	176.9	-178.7	171.1	178.6	0	0	110.6	P113 V116 R121 A122 L123 A181	P113-M119 VanDerWaalsContact C-SD 3.56Å; P113-M119 HydrophobicContact CB-SD 3.93Å; V116-M119 HydrophobicContact CB-CB 4.29Å; V116-M119 WeakPolarHBondContact O-CA 3.36Å; V116-M119 WeakPolarHBondContact O-CB 3.4Å; V116-M119 PolarHBondContact O-N 3.24Å; M119-R121 VanDerWaalsContact C-N 3.32Å; M119-R121 PolarHBondContact O-N 3.46Å; M119-A122 PolarHBondContact O-N 3.49Å; M119-A122 VanDerWaalsContact O-N 3.12Å; M119-L123 HydrophobicContact CE-CD1 3.87Å; M119-L123 HydrophobicContact CG-CD1 3.95Å; M119-L123 WeakPolarHBondContact O-CG 3.39Å; M119-L123 PolarHBondContact O-N 3.11Å; M119-A181 HydrophobicContact CE-CB 3.73Å
120	T	81.7	Confident	88.7	Confident	25 Å²	25	46.6 Å²	46.6	15%	0.153	25%	0.25	C	C	.	.	H	α-helix	trans	-58.1	-43.7	177.7	-40.4	0	0	0	0	111.4	G114 V116 A122 L123 L124	G114-T120 PolarHBondContact O-OG1 3Å; V116-T120 PolarHBondContact O-N 2.9Å; V116-T120 PolarHBondContact O-OG1 2.83Å; V116-T120 VanDerWaalsContact O-OG1 3.13Å; T120-A122 PolarHBondContact O-N 3.23Å; T120-L123 PolarHBondContact O-N 3.35Å; T120-L124 PolarHBondContact O-N 3.49Å
121	R	83.6	Confident	88.8	Confident	140 Å²	140	44 Å²	44	53%	0.528	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-39.6	176	-75.4	174.4	-170.7	-169.7	1.7	112.8	L18 S117 M119 L123 L124	L18-R121 HydrophobicContact CD2-CB 4.36Å; S117-R121 WeakPolarHBondContact O-CB 3.33Å; S117-R121 WeakPolarHBondContact O-CG 3.42Å; S117-R121 PolarHBondContact O-N 3.37Å; M119-R121 VanDerWaalsContact C-N 3.32Å; M119-R121 PolarHBondContact O-N 3.46Å; R121-L123 VanDerWaalsContact C-N 3.31Å; R121-L124 WeakPolarHBondContact O-CB 3.4Å; R121-L124 PolarHBondContact O-N 3.26Å
122	A	85.3	Confident	88.9	Confident	27 Å²	27	48.3 Å²	48.3	22%	0.223	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-33.7	178.2	0	0	0	0	0	112.4	F14 L118 M119 T120	F14-A122 HydrophobicContact CD1-CB 4.45Å; F14-A122 HydrophobicContact CE1-CB 3.83Å; L118-A122 WeakPolarHBondContact O-CB 3.42Å; L118-A122 PolarHBondContact O-N 2.98Å; L118-A122 VanDerWaalsContact O-N 3.09Å; M119-A122 PolarHBondContact O-N 3.49Å; M119-A122 VanDerWaalsContact O-N 3.12Å; T120-A122 PolarHBondContact O-N 3.23Å
123	L	87.9	Confident	88.9	Confident	35 Å²	35	53.8 Å²	53.8	18%	0.183	28%	0.275	C	S	.	.	H	α-helix	trans	-85.4	-14.6	179.3	-67	175	0	0	0	113.7	M119 T120 R121 L126 L127 F183	M119-L123 HydrophobicContact CE-CD1 3.87Å; M119-L123 HydrophobicContact CG-CD1 3.95Å; M119-L123 WeakPolarHBondContact O-CG 3.39Å; M119-L123 PolarHBondContact O-N 3.11Å; T120-L123 PolarHBondContact O-N 3.35Å; R121-L123 VanDerWaalsContact C-N 3.31Å; L123-L126 HydrophobicContact CD2-CD1 4.12Å; L123-L126 WeakPolarHBondContact O-CA 3.37Å; L123-L126 WeakPolarHBondContact O-CB 3.45Å; L123-L126 PolarHBondContact O-N 2.96Å; L123-L127 HydrophobicContact CB-CD1 4.46Å; L123-L127 HydrophobicContact CB-CG 4.34Å; L123-L127 WeakPolarHBondContact O-CG 3.33Å; L123-L127 PolarHBondContact O-N 2.95Å; L123-F183 HydrophobicContact CD1-CD2 4.35Å; L123-F183 HydrophobicContact CD1-CE2 3.52Å; L123-F183 HydrophobicContact CD1-CZ 4.14Å
124	L	85.8	Confident	89.1	Confident	19 Å²	19	52.6 Å²	52.6	10%	0.099	27%	0.267	C	S	.	.	H	α-helix	trans	-50.5	-42.7	-171.9	-177.1	50.2	0	0	0	115.8	Y22 Y24 T120 R121 L126 L127 Q128	Y22-L124 HydrophobicContact CD2-CD2 4.14Å; Y22-L124 HydrophobicContact CD2-CG 4.35Å; Y22-L124 HydrophobicContact CG-CD2 3.96Å; Y22-L124 HydrophobicContact CG-CG 4.14Å; Y24-L124 HydrophobicContact CD2-CD1 3.51Å; Y24-L124 HydrophobicContact CE2-CD1 3.78Å; T120-L124 PolarHBondContact O-N 3.49Å; R121-L124 WeakPolarHBondContact O-CB 3.4Å; R121-L124 PolarHBondContact O-N 3.26Å; L124-L126 VanDerWaalsContact C-N 3.32Å; L124-L126 PolarHBondContact O-N 2.94Å; L124-L127 PolarHBondContact O-N 2.9Å; L124-Q128 HydrophobicContact CD1-CG 4.13Å; L124-Q128 WeakPolarHBondContact O-CG 3.49Å; L124-Q128 PolarHBondContact O-N 3.32Å
125	P	87.5	Confident	89.4	Confident	22 Å²	22	55.6 Å²	55.6	14%	0.143	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-39.1	175.1	-15.1	25	0	0	0	113	Y17 Y22 Q128 Q129	Y17-P125 HydrophobicContact CD1-CB 4.35Å; Y17-P125 HydrophobicContact CD1-CG 3.26Å; Y17-P125 HydrophobicContact CE1-CB 3.79Å; Y17-P125 HydrophobicContact CE1-CG 3.17Å; Y17-P125 HydrophobicContact CG-CG 4.35Å; Y22-P125 HydrophobicContact CE2-CG 4.12Å; P125-Q128 PolarHBondContact O-N 3.34Å; P125-Q129 WeakPolarHBondContact O-CB 3.36Å; P125-Q129 PolarHBondContact O-N 3.46Å
126	L	89.4	Confident	89.6	Confident	84 Å²	84	61.5 Å²	61.5	44%	0.44	31%	0.31	S	S	.	.	H	α-helix	trans	-68.6	-39.3	177.5	-62.8	173.9	0	0	0	111	L123 L124 Q129 G130 M186	L123-L126 HydrophobicContact CD2-CD1 4.12Å; L123-L126 WeakPolarHBondContact O-CA 3.37Å; L123-L126 WeakPolarHBondContact O-CB 3.45Å; L123-L126 PolarHBondContact O-N 2.96Å; L124-L126 VanDerWaalsContact C-N 3.32Å; L124-L126 PolarHBondContact O-N 2.94Å; L126-Q129 PolarHBondContact O-N 3.2Å; L126-G130 PolarHBondContact O-N 2.91Å; L126-M186 HydrophobicContact CB-SD 4.39Å
127	L	91.8	Very high	89.8	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-64.3	-44.4	175.6	-59.4	-178	0	0	0	111.1	L123 L124 Q129 G130 Q131 F183 E185 M186	L123-L127 HydrophobicContact CB-CD1 4.46Å; L123-L127 HydrophobicContact CB-CG 4.34Å; L123-L127 WeakPolarHBondContact O-CG 3.33Å; L123-L127 PolarHBondContact O-N 2.95Å; L124-L127 PolarHBondContact O-N 2.9Å; L127-Q129 PolarHBondContact O-N 3.03Å; L127-G130 PolarHBondContact O-N 3.42Å; L127-Q131 WeakPolarHBondContact O-CB 3.48Å; L127-Q131 PolarHBondContact O-N 3.23Å; L127-F183 HydrophobicContact CD1-CD1 3.8Å; L127-F183 HydrophobicContact CD1-CE1 3.94Å; L127-F183 HydrophobicContact CD1-CG 4.16Å; L127-F183 HydrophobicContact CD1-CZ 4.41Å; L127-F183 HydrophobicContact CD2-CB 3.49Å; L127-F183 VanDerWaalsContact CD2-CB 3.49Å; L127-F183 HydrophobicContact CD2-CD1 4Å; L127-F183 HydrophobicContact CD2-CD2 3.84Å; L127-F183 HydrophobicContact CD2-CG 3.51Å; L127-F183 HydrophobicContact CG-CG 4.49Å; L127-E185 HydrophobicContact CB-CB 4.47Å; L127-E185 HydrophobicContact CB-CG 4.38Å; L127-E185 HydrophobicContact CD2-CB 4.09Å; L127-E185 WeakPolarHBondContact O-CG 3.4Å; L127-M186 HydrophobicContact CD2-CG 4.13Å; L127-M186 HydrophobicContact CD2-SD 3.94Å
128	Q	90.8	Very high	90.3	Very high	47 Å²	47	66 Å²	66	22%	0.22	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-48	175.8	-75	178.4	-22.1	0	0	111.6	Y22 L124 P125 G130 Q131 E132	Y22-Q128 VanDerWaalsContact CD1-OE1 3.23Å; L124-Q128 HydrophobicContact CD1-CG 4.13Å; L124-Q128 WeakPolarHBondContact O-CG 3.49Å; L124-Q128 PolarHBondContact O-N 3.32Å; P125-Q128 PolarHBondContact O-N 3.34Å; Q128-G130 VanDerWaalsContact C-N 3.33Å; Q128-G130 PolarHBondContact O-N 3.04Å; Q128-Q131 PolarHBondContact O-N 3.05Å; Q128-E132 WeakPolarHBondContact O-CB 3.35Å; Q128-E132 WeakPolarHBondContact O-CG 3.45Å; Q128-E132 PolarHBondContact O-N 3.44Å
129	Q	91.4	Very high	90.8	Very high	126 Å²	126	68.2 Å²	68.2	59%	0.589	32%	0.319	S	S	*	.	H	α-helix	trans	-61.2	-41.2	176.9	-173.3	-177.1	5.8	0	0	112.2	P125 L126 L127 R133	P125-Q129 WeakPolarHBondContact O-CB 3.36Å; P125-Q129 PolarHBondContact O-N 3.46Å; L126-Q129 PolarHBondContact O-N 3.2Å; L127-Q129 PolarHBondContact O-N 3.03Å; Q129-R133 WeakPolarHBondContact O-CB 3.4Å; Q129-R133 PolarHBondContact O-N 2.93Å
130	G	93.7	Very high	91.5	Very high	11 Å²	11	65.6 Å²	65.6	11%	0.113	31%	0.308	C	S	.	.	H	α-helix	trans	-63.1	-44.5	176	0	0	0	0	0	111.9	L126 L127 Q128 R133 L134 E185	L126-G130 PolarHBondContact O-N 2.91Å; L127-G130 PolarHBondContact O-N 3.42Å; Q128-G130 VanDerWaalsContact C-N 3.33Å; Q128-G130 PolarHBondContact O-N 3.04Å; G130-R133 PolarHBondContact O-N 3.14Å; G130-L134 WeakPolarHBondContact O-CG 3.12Å; G130-L134 PolarHBondContact O-N 3.47Å; G130-E185 WeakPolarHBondContact CA-O 3.48Å
131	Q	93.6	Very high	92.2	Very high	32 Å²	32	70.5 Å²	70.5	15%	0.15	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-47.4	176.2	-162.8	-160.4	-37.3	0	0	111.8	L127 Q128 R133 L134 V135 R142 M156 E185	L127-Q131 WeakPolarHBondContact O-CB 3.48Å; L127-Q131 PolarHBondContact O-N 3.23Å; Q128-Q131 PolarHBondContact O-N 3.05Å; Q131-R133 PolarHBondContact O-N 3.46Å; Q131-L134 PolarHBondContact O-N 3.23Å; Q131-V135 WeakPolarHBondContact O-CG2 3.3Å; Q131-V135 PolarHBondContact O-N 3.13Å; Q131-R142 VanDerWaalsContact NE2-NH1 3.15Å; Q131-M156 HydrophobicContact CG-CE 3.57Å; Q131-E185 HydrophobicContact CB-CG 4.04Å
132	E	93.8	Very high	92.7	Very high	110 Å²	110	65.2 Å²	65.2	51%	0.514	30%	0.304	S	S	.	.	H	α-helix	trans	-58.5	-46.6	175.9	-74.4	168.8	-177.5	0	0	110.9	Q128 L134 V135 E136	Q128-E132 WeakPolarHBondContact O-CB 3.35Å; Q128-E132 WeakPolarHBondContact O-CG 3.45Å; Q128-E132 PolarHBondContact O-N 3.44Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.48Å; E132-V135 PolarHBondContact O-N 2.53Å; E132-V135 VanDerWaalsContact O-N 3.16Å; E132-E136 WeakPolarHBondContact O-CB 3.43Å; E132-E136 WeakPolarHBondContact O-CG 3.23Å; E132-E136 PolarHBondContact O-N 3.17Å
133	R	94.9	Very high	93.3	Very high	114 Å²	114	64 Å²	64	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-56.2	-44.4	175	178.3	-176.6	170.2	-166.9	-7.2	111.7	Q129 G130 Q131 R137 Y138 E194	Q129-R133 WeakPolarHBondContact O-CB 3.4Å; Q129-R133 PolarHBondContact O-N 2.93Å; G130-R133 PolarHBondContact O-N 3.14Å; Q131-R133 PolarHBondContact O-N 3.46Å; R133-R137 VanDerWaalsContact O-CB 3.24Å; R133-R137 WeakPolarHBondContact O-CB 3.31Å; R133-R137 PolarHBondContact O-N 3.42Å; R133-Y138 HydrophobicContact CG-CE2 4.3Å; R133-Y138 PolarHBondContact NH2-OH 2.9Å; R133-Y138 VanDerWaalsContact NH2-OH 3.1Å; R133-E194 IonicContact NH2-OE1 2.86Å; R133-E194 PolarHBondContact NH2-OE1 3.45Å; R133-E194 VanDerWaalsContact NH2-OE1 3.09Å
134	L	96.3	Very high	93.7	Very high	10 Å²	10	62.6 Å²	62.6	5%	0.052	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-41	179.3	-69.7	173.9	0	0	0	111.8	G130 Q131 E132 Y138 H139 G140 M156 M158 Y184 L189 L193	G130-L134 WeakPolarHBondContact O-CG 3.12Å; G130-L134 PolarHBondContact O-N 3.47Å; Q131-L134 PolarHBondContact O-N 3.23Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.48Å; L134-Y138 HydrophobicContact CD2-CD2 4.25Å; L134-Y138 CarbonylContact O-C 3.58Å; L134-Y138 WeakPolarHBondContact O-CA 3.17Å; L134-Y138 WeakPolarHBondContact O-CB 3.24Å; L134-Y138 PolarHBondContact O-N 2.79Å; L134-H139 PolarHBondContact O-N 3.02Å; L134-G140 PolarHBondContact O-N 3.13Å; L134-M156 HydrophobicContact CB-CG 4.21Å; L134-M156 HydrophobicContact CD1-CG 4.08Å; L134-M158 HydrophobicContact CD2-CE 4.34Å; L134-M158 HydrophobicContact CD2-SD 4.34Å; L134-Y184 HydrophobicContact CD1-CD2 3.95Å; L134-Y184 HydrophobicContact CD1-CE2 4.14Å; L134-L189 HydrophobicContact CD1-CD2 4.25Å; L134-L189 HydrophobicContact CD2-CD2 3.65Å; L134-L193 HydrophobicContact CD2-CD2 3.74Å
135	V	95.6	Very high	94.3	Very high	62 Å²	62	61.7 Å²	61.7	38%	0.376	28%	0.282	S	S	.	.	H	α-helix	trans	-69.5	-52.5	178.5	174.4	0	0	0	0	111.3	Q131 E132 H139 M156	Q131-V135 WeakPolarHBondContact O-CG2 3.3Å; Q131-V135 PolarHBondContact O-N 3.13Å; E132-V135 PolarHBondContact O-N 2.53Å; E132-V135 VanDerWaalsContact O-N 3.16Å; V135-H139 VanDerWaalsContact O-CA 3.22Å; V135-H139 WeakPolarHBondContact O-CA 3.42Å; V135-H139 PolarHBondContact O-N 3.28Å; V135-H139 VanDerWaalsContact O-N 3.14Å; V135-M156 HydrophobicContact CG2-CE 3.86Å; V135-M156 HydrophobicContact CG2-SD 4.23Å
136	E	95.1	Very high	94.8	Very high	150 Å²	150	61 Å²	61	70%	0.701	28%	0.278	S	S	*	.	H	α-helix	trans	-73.8	-44.3	-171.5	-67	-177.3	168.9	0	0	112.6	E132	E132-E136 WeakPolarHBondContact O-CB 3.43Å; E132-E136 WeakPolarHBondContact O-CG 3.23Å; E132-E136 PolarHBondContact O-N 3.17Å
137	R	94.8	Very high	95.2	Very high	168 Å²	168	57 Å²	57	63%	0.634	26%	0.257	S	S	*	.	H	α-helix	trans	-90.2	-31	-173.6	-175	173.9	175.1	178.9	-3.9	113.5	R133	R133-R137 VanDerWaalsContact O-CB 3.24Å; R133-R137 WeakPolarHBondContact O-CB 3.31Å; R133-R137 PolarHBondContact O-N 3.42Å
138	Y	94.8	Very high	95.4	Very high	32 Å²	32	58.7 Å²	58.7	13%	0.125	27%	0.268	C	S	.	.	H	α-helix	trans	-118.3	10.6	-173.8	-57	-87.4	0	0	0	113.1	R133 L134 G140 L193 E194	R133-Y138 HydrophobicContact CG-CE2 4.3Å; R133-Y138 PolarHBondContact NH2-OH 2.9Å; R133-Y138 VanDerWaalsContact NH2-OH 3.1Å; L134-Y138 HydrophobicContact CD2-CD2 4.25Å; L134-Y138 CarbonylContact O-C 3.58Å; L134-Y138 WeakPolarHBondContact O-CA 3.17Å; L134-Y138 WeakPolarHBondContact O-CB 3.24Å; L134-Y138 PolarHBondContact O-N 2.79Å; Y138-G140 PolarHBondContact O-N 3.28Å; Y138-L193 HydrophobicContact CD1-CD1 4.22Å; Y138-L193 HydrophobicContact CD1-CD2 3.75Å; Y138-L193 HydrophobicContact CD1-CG 3.95Å; Y138-L193 HydrophobicContact CD2-CD2 3.99Å; Y138-L193 HydrophobicContact CE1-CD2 3.98Å; Y138-L193 HydrophobicContact CE1-CG 4.13Å; Y138-L193 HydrophobicContact CE2-CD2 4.21Å; Y138-L193 HydrophobicContact CG-CD2 3.74Å; Y138-L193 HydrophobicContact CG-CG 4.4Å; Y138-E194 PolarHBondContact OH-OE1 3.22Å
139	H	95.9	Very high	95.7	Very high	154 Å²	154	59.1 Å²	59.1	71%	0.713	27%	0.272	S	S	*	.			trans	53.1	36.1	179.9	-53.9	-60.8	0	0	0	112.8	L134 V135	L134-H139 PolarHBondContact O-N 3.02Å; V135-H139 VanDerWaalsContact O-CA 3.22Å; V135-H139 WeakPolarHBondContact O-CA 3.42Å; V135-H139 PolarHBondContact O-N 3.28Å; V135-H139 VanDerWaalsContact O-N 3.14Å
140	G	97	Very high	95.9	Very high	8 Å²	8	55.4 Å²	55.4	8%	0.082	27%	0.268	C	S	.	.			trans	-59.6	135	179.5	0	0	0	0	0	112	L134 Y138 F157	L134-G140 PolarHBondContact O-N 3.13Å; Y138-G140 PolarHBondContact O-N 3.28Å; G140-F157 WeakPolarHBondContact CA-O 3.21Å
141	R	96.4	Very high	96.1	Very high	129 Å²	129	55.8 Å²	55.8	49%	0.487	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	111.4	175.4	-66.5	-175.9	-67.2	-171.1	-9.4	109.4	M156 F157 D159	R141-M156 VanDerWaalsContact C-SD 3.56Å; R141-F157 PolarHBondContact N-O 2.93Å; R141-F157 VanDerWaalsContact NH2-CD1 3.29Å; R141-F157 PolarHBondContact O-N 2.71Å; R141-D159 VanDerWaalsContact NH2-CB 3.34Å; R141-D159 IonicContact NH2-OD2 3.3Å; R141-D159 PolarHBondContact NH2-OD2 3.44Å
142	R	95.6	Very high	96.3	Very high	28 Å²	28	56.5 Å²	56.5	11%	0.106	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	137.1	176.3	-165.8	-170.8	-170.6	159.7	18.9	111.1	Y24 W29 Q131 D154 T155 M156	Y24-R142 VanDerWaalsContact CZ-NH2 3.28Å; Y24-R142 PolarHBondContact OH-NH2 2.97Å; W29-R142 HydrophobicContact CZ2-CB 4.13Å; Q131-R142 VanDerWaalsContact NE2-NH1 3.15Å; R142-D154 IonicContact CZ-OD1 3.52Å; R142-D154 IonicContact CZ-OD2 3.25Å; R142-D154 IonicContact NE-OD1 3.25Å; R142-D154 PolarHBondContact NE-OD1 2.99Å; R142-D154 IonicContact NE-OD2 3.7Å; R142-D154 VanDerWaalsContact NH2-CG 3.29Å; R142-D154 IonicContact NH2-OD1 3.67Å; R142-D154 PolarHBondContact NH2-OD1 3.05Å; R142-D154 IonicContact NH2-OD2 3.53Å; R142-D154 PolarHBondContact NH2-OD2 2.86Å; R142-T155 CarbonylContact C-O 2.87Å; R142-T155 VanDerWaalsContact CA-O 3.3Å; R142-T155 WeakPolarHBondContact CA-O 3.4Å; R142-T155 WeakPolarHBondContact CG-O 3.33Å; R142-M156 HydrophobicContact CB-CE 3.83Å; R142-M156 HydrophobicContact CB-SD 4.16Å; R142-M156 HydrophobicContact CG-CE 4.16Å
143	A	96.3	Very high	96.5	Very high	3 Å²	3	51.3 Å²	51.3	3%	0.025	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.3	175.4	0	0	0	0	0	111.5	A32 L145 T155 Y229	A32-A143 HydrophobicContact CB-CB 3.81Å; A143-L145 HydrophobicContact CB-CD2 4.32Å; A143-T155 WeakPolarHBondContact CB-OG1 3.45Å; A143-T155 PolarHBondContact N-O 3.06Å; A143-T155 PolarHBondContact O-N 3.43Å; A143-T155 PolarHBondContact O-OG1 2.84Å; A143-Y229 HydrophobicContact CB-CE1 4.32Å
144	K	97.8	Very high	96.6	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.017	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.9	167.9	174.7	-176.2	-66.2	-168.6	0	108.9	F26 R27 W29 V31 A32 E152	F26-K144 HydrophobicContact CE1-CD 4.45Å; F26-K144 HydrophobicContact CE1-CG 4.26Å; F26-K144 HydrophobicContact CE2-CB 3.8Å; F26-K144 HydrophobicContact CE2-CG 4.14Å; F26-K144 HydrophobicContact CZ-CB 3.82Å; F26-K144 HydrophobicContact CZ-CD 4.24Å; F26-K144 HydrophobicContact CZ-CG 3.64Å; F26-K144 WeakPolarHBondContact O-CE 3.34Å; F26-K144 PolarHBondContact O-NZ 2.8Å; R27-K144 PolarHBondContact O-NZ 2.96Å; R27-K144 VanDerWaalsContact O-NZ 3.16Å; W29-K144 WeakPolarHBondContact O-CE 3.49Å; W29-K144 PolarHBondContact O-NZ 3.36Å; V31-K144 HydrophobicContact CG2-CD 3.86Å; V31-K144 HydrophobicContact CG2-CG 4.44Å; A32-K144 PolarHBondContact N-O 3.47Å; K144-E152 HydrophobicContact CD-CB 4.13Å; K144-E152 HydrophobicContact CD-CG 4.18Å; K144-E152 VanDerWaalsContact CE-OE2 3.3Å; K144-E152 WeakPolarHBondContact CE-OE2 3.1Å; K144-E152 HydrophobicContact CG-CB 4.17Å; K144-E152 IonicContact NZ-OE1 2.8Å; K144-E152 IonicContact NZ-OE2 2.87Å; K144-E152 PolarHBondContact NZ-OE2 3.2Å
145	L	98.3	Very high	96.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	149.8	173.9	-44.9	-177.6	0	0	0	109.9	F33 A143 E152 I153 T155 V225 V226 Y229	F33-L145 HydrophobicContact CB-CD2 3.85Å; F33-L145 CarbonylContact O-C 3.49Å; F33-L145 WeakPolarHBondContact O-CA 3.36Å; A143-L145 HydrophobicContact CB-CD2 4.32Å; L145-E152 CarbonylContact O-C 3.51Å; L145-E152 WeakPolarHBondContact O-CA 3.46Å; L145-I153 HydrophobicContact CB-CB 4.37Å; L145-I153 PolarHBondContact N-O 3.1Å; L145-I153 PolarHBondContact O-N 3.37Å; L145-T155 HydrophobicContact CD1-CG2 3.59Å; L145-T155 HydrophobicContact CG-CG2 3.85Å; L145-V225 HydrophobicContact CB-CG1 4.08Å; L145-V225 HydrophobicContact CB-CG2 4Å; L145-V226 HydrophobicContact CD1-CB 4.47Å; L145-V226 HydrophobicContact CD1-CG2 3.87Å; L145-Y229 HydrophobicContact CD1-CD1 4.12Å; L145-Y229 HydrophobicContact CD1-CG 4.07Å; L145-Y229 HydrophobicContact CD2-CD1 3.94Å; L145-Y229 HydrophobicContact CD2-CD2 3.63Å; L145-Y229 HydrophobicContact CD2-CE1 4.25Å; L145-Y229 HydrophobicContact CD2-CE2 3.94Å; L145-Y229 HydrophobicContact CD2-CG 3.62Å
146	V	98.2	Very high	96.8	Very high	8 Å²	8	42.4 Å²	42.4	5%	0.048	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	113.8	175.1	-178.7	0	0	0	0	110.1	V31 F33 R34 W35	V31-V146 HydrophobicContact CB-CG2 4.41Å; V31-V146 HydrophobicContact CG1-CG2 3.7Å; V31-V146 HydrophobicContact CG2-CG2 3.75Å; F33-V146 PolarHBondContact O-N 2.89Å; R34-V146 HydrophobicContact CB-CB 4.47Å; R34-V146 HydrophobicContact CG-CB 4.22Å; W35-V146 PolarHBondContact N-O 3.28Å
147	A	97.6	Very high	96.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.			trans	-74.9	169	178.3	0	0	0	0	0	112.3	W35 D149 G150 N151 I153 N221 V225	W35-A147 VanDerWaalsContact CD1-C 3.48Å; A147-D149 VanDerWaalsContact C-N 3.25Å; A147-D149 WeakPolarHBondContact CB-OD1 3.16Å; A147-D149 PolarHBondContact O-N 3.18Å; A147-G150 WeakPolarHBondContact O-CA 3.31Å; A147-G150 PolarHBondContact O-N 3.29Å; A147-N151 HydrophobicContact CB-CB 4.48Å; A147-N151 PolarHBondContact N-O 3.29Å; A147-I153 HydrophobicContact CB-CG1 4.32Å; A147-N221 HydrophobicContact CB-CB 4.32Å; A147-V225 HydrophobicContact CB-CG1 4Å
148	C	96.6	Very high	97.1	Very high	37 Å²	37	27.3 Å²	27.3	25%	0.25	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.6	-174.9	67.7	0	0	0	0	115	W35 G150 N221	W35-C148 HydrophobicContact CB-CB 4.41Å; W35-C148 VanDerWaalsContact CD1-CA 3.42Å; W35-C148 HydrophobicContact CD2-CB 3.48Å; W35-C148 VanDerWaalsContact CD2-CB 3.48Å; W35-C148 HydrophobicContact CE3-CB 3.85Å; W35-C148 HydrophobicContact CG-CB 3.72Å; W35-C148 HydrophobicContact CZ2-CB 4.23Å; W35-C148 HydrophobicContact CZ3-CB 4.36Å; C148-G150 VanDerWaalsContact C-N 3.27Å; C148-N221 PolarHBondContact SG-OD1 3.49Å; C148-N221 VanDerWaalsContact SG-OD1 3.38Å
149	D	95.4	Very high	97.2	Very high	56 Å²	56	28.4 Å²	28.4	30%	0.299	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	5.6	171.3	56.2	16	0	0	0	113.1	A147 N151 H218 N221	A147-D149 VanDerWaalsContact C-N 3.25Å; A147-D149 WeakPolarHBondContact CB-OD1 3.16Å; A147-D149 PolarHBondContact O-N 3.18Å; D149-N151 VanDerWaalsContact C-N 3.29Å; D149-N151 PolarHBondContact O-N 2.97Å; D149-N151 VanDerWaalsContact OD1-CB 3.29Å; D149-N151 WeakPolarHBondContact OD1-CB 3.34Å; D149-N151 PolarHBondContact OD1-N 3.5Å; D149-N151 PolarHBondContact OD1-ND2 3.23Å; D149-N151 PolarHBondContact OD2-ND2 2.83Å; D149-H218 IonicContact OD2-CD2 2.94Å; D149-H218 PolarHBondContact OD2-CD2 3.05Å; D149-H218 VanDerWaalsContact OD2-CD2 3.24Å; D149-H218 IonicContact OD2-CG 3.54Å; D149-N221 PolarHBondContact OD2-ND2 3.46Å
150	G	96.2	Very high	97.3	Very high	48 Å²	48	23.7 Å²	23.7	50%	0.495	13%	0.125	S	C	.	.	S	Bend	trans	81.7	1.7	-179.8	0	0	0	0	0	114.3	A147 C148 E152	A147-G150 WeakPolarHBondContact O-CA 3.31Å; A147-G150 PolarHBondContact O-N 3.29Å; C148-G150 VanDerWaalsContact C-N 3.27Å; G150-E152 PolarHBondContact O-N 3.31Å
151	N	97.2	Very high	97.2	Very high	19 Å²	19	27 Å²	27	10%	0.102	14%	0.136	C	C	.	.			trans	-66.1	131.4	174.8	-70.7	-45.1	0	0	0	110.8	A147 D149 I153 G212	A147-N151 HydrophobicContact CB-CB 4.48Å; A147-N151 PolarHBondContact N-O 3.29Å; D149-N151 VanDerWaalsContact C-N 3.29Å; D149-N151 PolarHBondContact O-N 2.97Å; D149-N151 VanDerWaalsContact OD1-CB 3.29Å; D149-N151 WeakPolarHBondContact OD1-CB 3.34Å; D149-N151 PolarHBondContact OD1-N 3.5Å; D149-N151 PolarHBondContact OD1-ND2 3.23Å; D149-N151 PolarHBondContact OD2-ND2 2.83Å; N151-I153 HydrophobicContact CB-CD1 3.99Å; N151-G212 WeakPolarHBondContact OD1-CA 3.39Å
152	E	97.8	Very high	97.1	Very high	47 Å²	47	29.9 Å²	29.9	22%	0.22	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	121.2	169.9	-55	-176.7	164.4	0	0	108.6	F26 K144 L145 G150 S210 T211	F26-E152 HydrophobicContact CE1-CB 3.9Å; F26-E152 HydrophobicContact CZ-CB 4.46Å; K144-E152 HydrophobicContact CD-CB 4.13Å; K144-E152 HydrophobicContact CD-CG 4.18Å; K144-E152 VanDerWaalsContact CE-OE2 3.3Å; K144-E152 WeakPolarHBondContact CE-OE2 3.1Å; K144-E152 HydrophobicContact CG-CB 4.17Å; K144-E152 IonicContact NZ-OE1 2.8Å; K144-E152 IonicContact NZ-OE2 2.87Å; K144-E152 PolarHBondContact NZ-OE2 3.2Å; L145-E152 CarbonylContact O-C 3.51Å; L145-E152 WeakPolarHBondContact O-CA 3.46Å; G150-E152 PolarHBondContact O-N 3.31Å; E152-S210 CarbonylContact O-C 3.55Å; E152-S210 WeakPolarHBondContact O-CA 3.4Å; E152-T211 HydrophobicContact CB-CG2 3.98Å; E152-T211 HydrophobicContact CG-CG2 4.29Å; E152-T211 PolarHBondContact N-OG1 3.18Å; E152-T211 PolarHBondContact O-N 3.2Å
153	I	98.1	Very high	96.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.1	-175.7	-52	-55.3	0	0	0	109.1	L145 A147 N151 T155 W202 P205 A222 V225 V226	L145-I153 HydrophobicContact CB-CB 4.37Å; L145-I153 PolarHBondContact N-O 3.1Å; L145-I153 PolarHBondContact O-N 3.37Å; A147-I153 HydrophobicContact CB-CG1 4.32Å; N151-I153 HydrophobicContact CB-CD1 3.99Å; I153-T155 HydrophobicContact CG2-CG2 4.1Å; I153-W202 HydrophobicContact CG2-CB 4.37Å; I153-W202 HydrophobicContact CG2-CE3 4.02Å; I153-P205 HydrophobicContact CD1-CG 4.08Å; I153-A222 HydrophobicContact CD1-CB 3.61Å; I153-A222 HydrophobicContact CG1-CB 3.82Å; I153-V225 HydrophobicContact CG1-CG1 4.44Å; I153-V226 HydrophobicContact CG2-CG2 4.41Å
154	D	97.3	Very high	96.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.1	177	-172	29.3	0	0	0	111	Y24 F26 R142 Y184 W202 N203 S210	Y24-D154 PolarHBondContact OH-OD2 2.79Å; F26-D154 HydrophobicContact CD2-CB 4.12Å; F26-D154 HydrophobicContact CE1-CB 4.26Å; F26-D154 HydrophobicContact CE2-CB 3.52Å; F26-D154 WeakPolarHBondContact CE2-OD1 3.36Å; F26-D154 HydrophobicContact CZ-CB 3.6Å; R142-D154 IonicContact CZ-OD1 3.52Å; R142-D154 IonicContact CZ-OD2 3.25Å; R142-D154 IonicContact NE-OD1 3.25Å; R142-D154 PolarHBondContact NE-OD1 2.99Å; R142-D154 IonicContact NE-OD2 3.7Å; R142-D154 VanDerWaalsContact NH2-CG 3.29Å; R142-D154 IonicContact NH2-OD1 3.67Å; R142-D154 PolarHBondContact NH2-OD1 3.05Å; R142-D154 IonicContact NH2-OD2 3.53Å; R142-D154 PolarHBondContact NH2-OD2 2.86Å; D154-Y184 HydrophobicContact CB-CE1 4.4Å; D154-Y184 PolarHBondContact OD2-OH 2.85Å; D154-W202 WeakPolarHBondContact O-CA 2.92Å; D154-N203 PolarHBondContact O-N 3.37Å; D154-S210 PolarHBondContact N-OG 3.33Å
155	T	98	Very high	96.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	154.9	-175	67.5	0	0	0	0	112	R142 A143 L145 I153 G201 W202 V226	R142-T155 CarbonylContact C-O 2.87Å; R142-T155 VanDerWaalsContact CA-O 3.3Å; R142-T155 WeakPolarHBondContact CA-O 3.4Å; R142-T155 WeakPolarHBondContact CG-O 3.33Å; A143-T155 WeakPolarHBondContact CB-OG1 3.45Å; A143-T155 PolarHBondContact N-O 3.06Å; A143-T155 PolarHBondContact O-N 3.43Å; A143-T155 PolarHBondContact O-OG1 2.84Å; L145-T155 HydrophobicContact CD1-CG2 3.59Å; L145-T155 HydrophobicContact CG-CG2 3.85Å; I153-T155 HydrophobicContact CG2-CG2 4.1Å; T155-G201 CarbonylContact C-O 3.58Å; T155-G201 WeakPolarHBondContact CA-O 3.42Å; T155-G201 WeakPolarHBondContact CB-O 3.22Å; T155-W202 HydrophobicContact CG2-CB 3.68Å; T155-V226 HydrophobicContact CG2-CG2 4.29Å
156	M	97.9	Very high	95.5	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	123.7	177.1	-174.5	67.7	69.5	0	0	110.4	Q131 L134 V135 R141 R142 M158 Y184 L200 G201	Q131-M156 HydrophobicContact CG-CE 3.57Å; L134-M156 HydrophobicContact CB-CG 4.21Å; L134-M156 HydrophobicContact CD1-CG 4.08Å; V135-M156 HydrophobicContact CG2-CE 3.86Å; V135-M156 HydrophobicContact CG2-SD 4.23Å; R141-M156 VanDerWaalsContact C-SD 3.56Å; R142-M156 HydrophobicContact CB-CE 3.83Å; R142-M156 HydrophobicContact CB-SD 4.16Å; R142-M156 HydrophobicContact CG-CE 4.16Å; M156-M158 HydrophobicContact CG-SD 3.61Å; M156-Y184 HydrophobicContact CB-CD2 3.67Å; M156-Y184 HydrophobicContact CB-CE2 3.36Å; M156-Y184 HydrophobicContact CE-CE2 4.22Å; M156-Y184 HydrophobicContact CG-CE2 4.14Å; M156-L200 WeakPolarHBondContact O-CA 3.31Å; M156-G201 PolarHBondContact N-O 3.28Å; M156-G201 PolarHBondContact O-N 3.49Å
157	F	98.6	Very high	95	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.3	-179	176.9	-136.4	0	0	0	112.4	G140 R141 D159 L173 V199 L200 L234 F236	G140-F157 WeakPolarHBondContact CA-O 3.21Å; R141-F157 PolarHBondContact N-O 2.93Å; R141-F157 VanDerWaalsContact NH2-CD1 3.29Å; R141-F157 PolarHBondContact O-N 2.71Å; F157-D159 HydrophobicContact CD1-CB 4.36Å; F157-D159 HydrophobicContact CE1-CB 3.57Å; F157-D159 HydrophobicContact CE2-CB 4.27Å; F157-D159 HydrophobicContact CZ-CB 3.46Å; F157-D159 VanDerWaalsContact CZ-CB 3.46Å; F157-L173 HydrophobicContact CD2-CD1 4.13Å; F157-L173 HydrophobicContact CE2-CD1 3.74Å; F157-V199 WeakPolarHBondContact CA-O 3.43Å; F157-V199 WeakPolarHBondContact CD2-O 3.21Å; F157-L200 HydrophobicContact CB-CD1 4.1Å; F157-L200 HydrophobicContact CD2-CB 4.5Å; F157-L234 HydrophobicContact CB-CD1 4.39Å; F157-L234 HydrophobicContact CD1-CD1 3.73Å; F157-L234 HydrophobicContact CD1-CD2 3.56Å; F157-L234 HydrophobicContact CD1-CG 4.26Å; F157-L234 HydrophobicContact CD2-CD1 3.9Å; F157-L234 HydrophobicContact CE1-CB 4.49Å; F157-L234 HydrophobicContact CE1-CD1 3.91Å; F157-L234 HydrophobicContact CE1-CD2 3.72Å; F157-L234 HydrophobicContact CE1-CG 4.26Å; F157-L234 HydrophobicContact CE2-CD1 4.16Å; F157-L234 HydrophobicContact CG-CD1 3.74Å; F157-L234 HydrophobicContact CG-CD2 4.34Å; F157-L234 HydrophobicContact CZ-CD1 4.19Å; F157-F236 HydrophobicContact CE1-CE2 4.48Å; F157-F236 AromaticContact CE2-CE2 3.93Å; F157-F236 HydrophobicContact CE2-CE2 3.93Å; F157-F236 HydrophobicContact CE2-CZ 4.19Å; F157-F236 AromaticContact CZ-CE2 3.57Å; F157-F236 HydrophobicContact CZ-CE2 3.57Å; F157-F236 AromaticContact CZ-CZ 3.91Å; F157-F236 HydrophobicContact CZ-CZ 3.91Å
158	M	98.1	Very high	94.8	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114	171	-72.1	68.4	62	0	0	109.1	L134 M156 L189 L193 S198 V199	L134-M158 HydrophobicContact CD2-CE 4.34Å; L134-M158 HydrophobicContact CD2-SD 4.34Å; M156-M158 HydrophobicContact CG-SD 3.61Å; M158-L189 HydrophobicContact CE-CD1 3.69Å; M158-L189 HydrophobicContact CE-CD2 3.75Å; M158-L189 HydrophobicContact CE-CG 4.02Å; M158-L193 HydrophobicContact CB-CD1 3.68Å; M158-L193 HydrophobicContact CE-CD1 4.17Å; M158-L193 HydrophobicContact CE-CD2 4.24Å; M158-L193 HydrophobicContact CG-CD1 3.81Å; M158-L193 HydrophobicContact CG-CD2 4.48Å; M158-S198 VanDerWaalsContact O-CA 3.31Å; M158-S198 WeakPolarHBondContact O-CA 3.3Å; M158-V199 HydrophobicContact CE-CB 3.95Å; M158-V199 HydrophobicContact CE-CG1 4.23Å; M158-V199 PolarHBondContact N-O 3.33Å; M158-V199 PolarHBondContact O-N 3.08Å
159	D	97.8	Very high	94.7	Very high	54 Å²	54	51.8 Å²	51.8	29%	0.289	29%	0.291	S	S	.	.			trans	-97.7	115.4	-176.1	-162	-17.9	0	0	0	110.7	R141 F157 R161	R141-D159 VanDerWaalsContact NH2-CB 3.34Å; R141-D159 IonicContact NH2-OD2 3.3Å; R141-D159 PolarHBondContact NH2-OD2 3.44Å; F157-D159 HydrophobicContact CD1-CB 4.36Å; F157-D159 HydrophobicContact CE1-CB 3.57Å; F157-D159 HydrophobicContact CE2-CB 4.27Å; F157-D159 HydrophobicContact CZ-CB 3.46Å; F157-D159 VanDerWaalsContact CZ-CB 3.46Å; D159-R161 WeakPolarHBondContact OD1-CB 3.36Å; D159-R161 WeakPolarHBondContact OD1-CG 3.41Å; D159-R161 IonicContact OD1-CZ 3.79Å; D159-R161 PolarHBondContact OD1-N 3.23Å; D159-R161 IonicContact OD1-NE 3.84Å; D159-R161 PolarHBondContact OD1-NE 3.48Å; D159-R161 IonicContact OD1-NH2 2.7Å; D159-R161 IonicContact OD2-CZ 2.96Å; D159-R161 IonicContact OD2-NE 3.39Å; D159-R161 PolarHBondContact OD2-NE 3.28Å; D159-R161 IonicContact OD2-NH2 2.88Å; D159-R161 PolarHBondContact OD2-NH2 3.08Å
160	R	96.6	Very high	94.7	Very high	55 Å²	55	49.1 Å²	49.1	21%	0.208	28%	0.276	C	S	.	.			trans	-111.3	12.5	-178.8	-67.9	-130.9	179.9	99.7	-14.2	113.5	Q162 D163 P164 G170 L193 G196 Y197 S198	R160-Q162 PolarHBondContact O-N 2.9Å; R160-D163 CarbonylContact O-C 3.44Å; R160-D163 PolarHBondContact O-N 2.89Å; R160-D163 VanDerWaalsContact O-O 3.13Å; R160-P164 WeakPolarHBondContact O-CA 3.23Å; R160-G170 CarbonylContact C-O 3.44Å; R160-L193 PolarHBondContact NH1-O 3.38Å; R160-L193 PolarHBondContact NH2-O 2.9Å; R160-G196 VanDerWaalsContact NH1-C 3.32Å; R160-Y197 PolarHBondContact NH1-O 3.49Å; R160-S198 PolarHBondContact N-OG 2.76Å
161	R	96.4	Very high	94.8	Very high	79 Å²	79	50.6 Å²	50.6	30%	0.298	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.6	-178.7	-69.7	177.9	-70.5	-170.9	-3.4	113.6	D159 G170 L234 F236	D159-R161 WeakPolarHBondContact OD1-CB 3.36Å; D159-R161 WeakPolarHBondContact OD1-CG 3.41Å; D159-R161 IonicContact OD1-CZ 3.79Å; D159-R161 PolarHBondContact OD1-N 3.23Å; D159-R161 IonicContact OD1-NE 3.84Å; D159-R161 PolarHBondContact OD1-NE 3.48Å; D159-R161 IonicContact OD1-NH2 2.7Å; D159-R161 IonicContact OD2-CZ 2.96Å; D159-R161 IonicContact OD2-NE 3.39Å; D159-R161 PolarHBondContact OD2-NE 3.28Å; D159-R161 IonicContact OD2-NH2 2.88Å; D159-R161 PolarHBondContact OD2-NH2 3.08Å; R161-G170 WeakPolarHBondContact CG-O 3.37Å; R161-L234 PolarHBondContact NH1-O 3.4Å; R161-L234 PolarHBondContact NH2-O 3.09Å; R161-F236 HydrophobicContact CG-CE1 4.22Å; R161-F236 HydrophobicContact CG-CZ 4.21Å
162	Q	94.3	Very high	94.8	Very high	189 Å²	189	53.8 Å²	53.8	88%	0.883	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-22.4	178.4	-62.6	-61.3	-31.7	0	0	113.3	R160	R160-Q162 PolarHBondContact O-N 2.9Å
163	D	91.1	Very high	94.9	Very high	126 Å²	126	51.6 Å²	51.6	67%	0.674	27%	0.273	S	S	*	.	S	Bend	trans	-136.8	75.8	174.3	-177.1	16.7	0	0	0	109.1	R160 G165	R160-D163 CarbonylContact O-C 3.44Å; R160-D163 PolarHBondContact O-N 2.89Å; R160-D163 VanDerWaalsContact O-O 3.13Å; D163-G165 PolarHBondContact O-N 3.23Å
164	P	88.9	Confident	94.9	Very high	41 Å²	41	51.6 Å²	51.6	27%	0.266	27%	0.273	S	S	.	.			trans	-76.4	-3.4	-168.1	31.5	-36.7	0	0	0	114.2	R160 G168 H169 G170 L171	R160-P164 WeakPolarHBondContact O-CA 3.23Å; P164-G168 CarbonylContact O-C 3.36Å; P164-G168 VanDerWaalsContact O-C 3.3Å; P164-G168 WeakPolarHBondContact O-CA 3.48Å; P164-H169 PolarHBondContact O-N 2.72Å; P164-G170 PolarHBondContact O-N 3.1Å; P164-G170 VanDerWaalsContact O-N 3.11Å; P164-L171 HydrophobicContact CB-CD2 4.03Å; P164-L171 HydrophobicContact CB-CG 3.81Å
165	G	91.6	Very high	95	Very high	47 Å²	47	51.6 Å²	51.6	49%	0.485	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	171.3	-173.7	0	0	0	0	0	113.8	D163 H167 G168	D163-G165 PolarHBondContact O-N 3.23Å; G165-H167 PolarHBondContact O-N 3.36Å; G165-G168 PolarHBondContact O-N 3.29Å; G165-G168 VanDerWaalsContact O-N 3.08Å
166	S	81.8	Confident	95	Very high	116 Å²	116	51.6 Å²	51.6	81%	0.811	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.6	-176.2	52.9	0	0	0	0	114.3
167	H	87.7	Confident	95.1	Very high	139 Å²	139	51.6 Å²	51.6	64%	0.644	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	3.6	179.8	-62.3	-67.9	0	0	0	113.6	G165 H169	G165-H167 PolarHBondContact O-N 3.36Å; H167-H169 WeakPolarHBondContact CB-NE2 3.34Å; H167-H169 PolarHBondContact O-N 2.86Å
168	G	93.1	Very high	95	Very high	18 Å²	18	51.5 Å²	51.5	19%	0.186	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	20.8	-179.1	0	0	0	0	0	114.2	P164 G165 G170 L171	P164-G168 CarbonylContact O-C 3.36Å; P164-G168 VanDerWaalsContact O-C 3.3Å; P164-G168 WeakPolarHBondContact O-CA 3.48Å; G165-G168 PolarHBondContact O-N 3.29Å; G165-G168 VanDerWaalsContact O-N 3.08Å; G168-G170 VanDerWaalsContact C-N 3.27Å; G168-G170 PolarHBondContact O-N 2.82Å; G168-L171 WeakPolarHBondContact O-CB 3.42Å; G168-L171 PolarHBondContact O-N 3.1Å; G168-L171 VanDerWaalsContact O-N 3.16Å
169	H	95.2	Very high	94.8	Very high	52 Å²	52	51.5 Å²	51.5	24%	0.241	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-57.8	-39	-177.8	-70.4	177.5	0	0	0	112.1	P164 H167 L171 R172 A195 G196 Y197	P164-H169 PolarHBondContact O-N 2.72Å; H167-H169 WeakPolarHBondContact CB-NE2 3.34Å; H167-H169 PolarHBondContact O-N 2.86Å; H169-L171 PolarHBondContact O-N 2.83Å; H169-L171 VanDerWaalsContact O-N 3.1Å; H169-R172 PolarHBondContact O-N 2.92Å; H169-A195 PolarHBondContact ND1-O 3.48Å; H169-G196 CarbonylContact C-O 3.39Å; H169-Y197 HydrophobicContact CB-CD1 3.96Å; H169-Y197 HydrophobicContact CB-CD2 4.24Å; H169-Y197 HydrophobicContact CB-CE1 3.97Å; H169-Y197 HydrophobicContact CB-CE2 4.24Å; H169-Y197 HydrophobicContact CB-CG 4.1Å; H169-Y197 AromaticContact CD2-CZ 3.78Å; H169-Y197 AromaticContact CG-CE1 3.97Å; H169-Y197 AromaticContact CG-CE2 3.9Å; H169-Y197 AromaticContact CG-CZ 3.67Å; H169-Y197 AromaticContact ND1-CE2 3.72Å; H169-Y197 AromaticContact ND1-CZ 3.86Å; H169-Y197 PolarHBondContact NE2-OH 3.02Å; H169-Y197 WeakPolarHBondContact O-CD1 3.41Å
170	G	96.1	Very high	94.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-65	-15.5	-179.1	0	0	0	0	0	114.7	R160 R161 P164 G168 R172 G196 S198	R160-G170 CarbonylContact C-O 3.44Å; R161-G170 WeakPolarHBondContact CG-O 3.37Å; P164-G170 PolarHBondContact O-N 3.1Å; P164-G170 VanDerWaalsContact O-N 3.11Å; G168-G170 VanDerWaalsContact C-N 3.27Å; G168-G170 PolarHBondContact O-N 2.82Å; G170-R172 VanDerWaalsContact C-N 3.28Å; G170-G196 WeakPolarHBondContact CA-O 3.4Å; G170-G196 PolarHBondContact N-O 3.19Å; G170-S198 PolarHBondContact O-OG 2.63Å
171	L	97.3	Very high	94.1	Very high	80 Å²	80	49.5 Å²	49.5	42%	0.419	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-76.4	-16.3	173.9	-58.6	178.6	0	0	0	113.2	P164 G168 H169	P164-L171 HydrophobicContact CB-CD2 4.03Å; P164-L171 HydrophobicContact CB-CG 3.81Å; G168-L171 WeakPolarHBondContact O-CB 3.42Å; G168-L171 PolarHBondContact O-N 3.1Å; G168-L171 VanDerWaalsContact O-N 3.16Å; H169-L171 PolarHBondContact O-N 2.83Å; H169-L171 VanDerWaalsContact O-N 3.1Å
172	R	97.9	Very high	93.7	Very high	86 Å²	86	46 Å²	46	33%	0.325	26%	0.259	S	S	.	.	S	Bend	trans	-100.5	139.6	176.6	-65	-178.7	179.7	98.5	-1.3	110.1	H169 G170 Y197 S198 H240	H169-R172 PolarHBondContact O-N 2.92Å; G170-R172 VanDerWaalsContact C-N 3.28Å; R172-Y197 HydrophobicContact CB-CD1 4Å; R172-Y197 HydrophobicContact CB-CE1 4.31Å; R172-S198 WeakPolarHBondContact O-CB 3.07Å; R172-S198 PolarHBondContact O-N 2.88Å; R172-H240 CarbonylContact C-O 3.59Å; R172-H240 VanDerWaalsContact CA-O 3.27Å; R172-H240 WeakPolarHBondContact CA-O 3.44Å
173	L	98.8	Very high	93.7	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.7	173	179.2	65.7	0	0	0	109.5	F157 I175 S198 L200 A230 F236 H240 V241 V242	F157-L173 HydrophobicContact CD2-CD1 4.13Å; F157-L173 HydrophobicContact CE2-CD1 3.74Å; L173-I175 HydrophobicContact CD2-CD1 4.45Å; L173-I175 HydrophobicContact CD2-CG1 4.01Å; L173-I175 HydrophobicContact CG-CG1 4.22Å; L173-S198 CarbonylContact C-O 3.3Å; L173-S198 WeakPolarHBondContact CA-O 3.15Å; L173-L200 HydrophobicContact CD1-CB 3.89Å; L173-L200 HydrophobicContact CD2-CB 4.38Å; L173-L200 HydrophobicContact CG-CB 4.45Å; L173-A230 HydrophobicContact CD2-CB 3.48Å; L173-A230 VanDerWaalsContact CD2-CB 3.48Å; L173-F236 HydrophobicContact CB-CB 4.47Å; L173-F236 HydrophobicContact CB-CD1 3.6Å; L173-F236 HydrophobicContact CB-CD2 4.02Å; L173-F236 HydrophobicContact CB-CE1 3.71Å; L173-F236 HydrophobicContact CB-CE2 4.11Å; L173-F236 HydrophobicContact CB-CG 3.76Å; L173-F236 HydrophobicContact CB-CZ 3.96Å; L173-F236 HydrophobicContact CD1-CE2 4.18Å; L173-F236 HydrophobicContact CD1-CZ 4.3Å; L173-F236 HydrophobicContact CD2-CD2 3.81Å; L173-F236 HydrophobicContact CD2-CE2 4.17Å; L173-F236 HydrophobicContact CD2-CG 4.14Å; L173-F236 HydrophobicContact CG-CD2 4.38Å; L173-F236 HydrophobicContact CG-CE2 4.4Å; L173-H240 PolarHBondContact N-O 2.85Å; L173-V241 HydrophobicContact CB-CG2 4.44Å; L173-V241 HydrophobicContact CD2-CG2 4.43Å; L173-V241 CarbonylContact O-C 3.54Å; L173-V241 WeakPolarHBondContact O-CA 3.48Å; L173-V242 PolarHBondContact O-N 2.77Å
174	V	98.9	Very high	94	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.6	166.1	-175	0	0	0	0	108.5	P192 Y197 S198 V199 L200 V242 Y244 F463	V174-P192 HydrophobicContact CB-CB 3.94Å; V174-P192 HydrophobicContact CB-CG 4.38Å; V174-P192 HydrophobicContact CG1-CB 3.89Å; V174-P192 HydrophobicContact CG1-CG 3.99Å; V174-P192 HydrophobicContact CG2-CB 3.88Å; V174-Y197 HydrophobicContact CG2-CD1 3.93Å; V174-Y197 HydrophobicContact CG2-CD2 4.49Å; V174-Y197 HydrophobicContact CG2-CG 3.8Å; V174-S198 PolarHBondContact N-O 2.84Å; V174-V199 HydrophobicContact CB-CG2 4.45Å; V174-V199 CarbonylContact O-C 3.51Å; V174-V199 WeakPolarHBondContact O-CA 3.49Å; V174-L200 PolarHBondContact O-N 3.33Å; V174-V242 CarbonylContact C-O 3.59Å; V174-V242 WeakPolarHBondContact CA-O 3.46Å; V174-V242 HydrophobicContact CG2-CB 4.28Å; V174-Y244 HydrophobicContact CG1-CD1 4.46Å; V174-Y244 HydrophobicContact CG1-CG 4.43Å; V174-F463 HydrophobicContact CB-CZ 4.48Å; V174-F463 HydrophobicContact CG1-CE2 4.32Å; V174-F463 HydrophobicContact CG1-CZ 3.79Å; V174-F463 HydrophobicContact CG2-CE1 3.94Å; V174-F463 HydrophobicContact CG2-CZ 3.83Å
175	I	98.9	Very high	94.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	118.6	169.7	-55.5	177	0	0	0	107.8	L173 L200 M223 V226 V227 A230 V241 V242 Y244	L173-I175 HydrophobicContact CD2-CD1 4.45Å; L173-I175 HydrophobicContact CD2-CG1 4.01Å; L173-I175 HydrophobicContact CG-CG1 4.22Å; I175-L200 WeakPolarHBondContact CA-O 3.44Å; I175-L200 HydrophobicContact CG1-CB 4.39Å; I175-L200 HydrophobicContact CG1-CD2 4.34Å; I175-M223 HydrophobicContact CD1-CE 4.33Å; I175-M223 HydrophobicContact CG2-CE 3.77Å; I175-V226 HydrophobicContact CD1-CG1 4.46Å; I175-V226 HydrophobicContact CG2-CG1 3.66Å; I175-V227 HydrophobicContact CD1-CG2 4.38Å; I175-A230 HydrophobicContact CD1-CB 4.01Å; I175-V241 HydrophobicContact CD1-CG1 3.63Å; I175-V241 HydrophobicContact CG1-CG1 4Å; I175-V242 PolarHBondContact N-O 2.91Å; I175-Y244 PolarHBondContact O-N 2.94Å
176	C	98.8	Very high	94.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116.5	-174.6	-67.5	0	0	0	0	110.8	L189 V199 L200 W202	C176-L189 HydrophobicContact CB-CB 4.27Å; C176-V199 WeakPolarHBondContact SG-CG1 3.25Å; C176-L200 PolarHBondContact N-O 2.99Å; C176-W202 PolarHBondContact O-NE1 3.24Å
177	C	98.5	Very high	94.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	114.5	176.4	-63.3	0	0	0	0	109.5	Y244 W246 G249 T252 A253	C177-Y244 PolarHBondContact N-O 2.89Å; C177-W246 PolarHBondContact O-N 2.95Å; C177-G249 WeakPolarHBondContact CB-O 3.36Å; C177-T252 VanDerWaalsContact CB-OG1 3.29Å; C177-T252 WeakPolarHBondContact CB-OG1 3.46Å; C177-T252 PolarHBondContact SG-OG1 3.49Å; C177-A253 HydrophobicContact CB-CB 4.46Å
178	E	96.8	Very high	94.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.			trans	-79.9	164.6	-171.6	-69.3	-64.5	168.9	0	0	113.9	G187 C188 H204 G249	E178-G187 WeakPolarHBondContact OE1-CA 3.35Å; E178-G187 WeakPolarHBondContact OE2-CA 3.3Å; E178-C188 VanDerWaalsContact CD-N 3.32Å; E178-C188 VanDerWaalsContact CD-SG 3.6Å; E178-C188 PolarHBondContact OE1-N 3.48Å; E178-C188 PolarHBondContact OE1-SG 3.25Å; E178-C188 PolarHBondContact OE2-N 3.03Å; E178-H204 PolarHBondContact O-NE2 3.09Å; E178-G249 WeakPolarHBondContact O-CA 3.37Å; E178-G249 PolarHBondContact O-N 3Å
179	G	94.3	Very high	95	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.			trans	-78.1	179.4	173.7	0	0	0	0	0	112.8	A181 G182 W246	G179-A181 PolarHBondContact O-N 2.87Å; G179-A181 VanDerWaalsContact O-N 3.08Å; G179-G182 PolarHBondContact O-N 3.45Å; G179-W246 WeakPolarHBondContact CA-O 3.17Å; G179-W246 VanDerWaalsContact N-CE3 3.3Å
180	N	90.1	Very high	95	Very high	36 Å²	36	20.3 Å²	20.3	19%	0.193	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-10.7	-174.4	65.5	-9.8	0	0	0	117.1	V111 Y112 P113 G114 F207 V248	V111-N180 WeakPolarHBondContact O-CB 3.43Å; V111-N180 PolarHBondContact O-ND2 3.07Å; Y112-N180 CarbonylContact C-O 3.54Å; Y112-N180 HydrophobicContact CD1-CB 4.49Å; P113-N180 VanDerWaalsContact CD-O 3.25Å; P113-N180 WeakPolarHBondContact CD-O 3.43Å; G114-N180 PolarHBondContact N-O 2.9Å; G114-N180 VanDerWaalsContact N-O 3.08Å; N180-F207 WeakPolarHBondContact O-CE1 3.45Å; N180-F207 VanDerWaalsContact O-CZ 3.24Å; N180-F207 WeakPolarHBondContact O-CZ 3.23Å; N180-V248 HydrophobicContact CB-CB 4.11Å; N180-V248 HydrophobicContact CB-CG1 4.5Å; N180-V248 HydrophobicContact CB-CG2 3.84Å
181	A	89.6	Confident	95	Very high	31 Å²	31	20.4 Å²	20.4	26%	0.256	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.8	11.9	170.1	0	0	0	0	0	111.2	P113 M119 G179 F183	P113-A181 HydrophobicContact CG-CB 4.19Å; M119-A181 HydrophobicContact CE-CB 3.73Å; G179-A181 PolarHBondContact O-N 2.87Å; G179-A181 VanDerWaalsContact O-N 3.08Å; A181-F183 WeakPolarHBondContact O-CD2 3.49Å; A181-F183 WeakPolarHBondContact O-CE2 3.23Å
182	G	88.6	Confident	95	Very high	5 Å²	5	16.6 Å²	16.6	5%	0.052	9%	0.093	C	C	.	.			trans	-87.3	150.5	-178.8	0	0	0	0	0	111.4	G179 F207	G179-G182 PolarHBondContact O-N 3.45Å; G182-F207 WeakPolarHBondContact O-CD1 3.44Å
183	F	95.1	Very high	95	Very high	1 Å²	1	12.6 Å²	12.6	0%	0.004	8%	0.078	C	C	.	.			trans	-138.1	141.1	176.9	-60.5	-94	0	0	0	107.2	L123 L127 A181 E185 M186 G187 N203 F207	L123-F183 HydrophobicContact CD1-CD2 4.35Å; L123-F183 HydrophobicContact CD1-CE2 3.52Å; L123-F183 HydrophobicContact CD1-CZ 4.14Å; L127-F183 HydrophobicContact CD1-CD1 3.8Å; L127-F183 HydrophobicContact CD1-CE1 3.94Å; L127-F183 HydrophobicContact CD1-CG 4.16Å; L127-F183 HydrophobicContact CD1-CZ 4.41Å; L127-F183 HydrophobicContact CD2-CB 3.49Å; L127-F183 VanDerWaalsContact CD2-CB 3.49Å; L127-F183 HydrophobicContact CD2-CD1 4Å; L127-F183 HydrophobicContact CD2-CD2 3.84Å; L127-F183 HydrophobicContact CD2-CG 3.51Å; L127-F183 HydrophobicContact CG-CG 4.49Å; A181-F183 WeakPolarHBondContact O-CD2 3.49Å; A181-F183 WeakPolarHBondContact O-CE2 3.23Å; F183-E185 WeakPolarHBondContact CB-OE2 3.42Å; F183-E185 PolarHBondContact O-N 2.91Å; F183-M186 HydrophobicContact CB-CG 4.42Å; F183-M186 PolarHBondContact O-N 2.79Å; F183-G187 WeakPolarHBondContact O-CA 3.45Å; F183-G187 PolarHBondContact O-N 3.11Å; F183-N203 VanDerWaalsContact CA-OD1 3.29Å; F183-N203 WeakPolarHBondContact CA-OD1 3.3Å; F183-F207 HydrophobicContact CD1-CB 4.16Å; F183-F207 HydrophobicContact CD1-CD1 4.13Å; F183-F207 HydrophobicContact CE1-CB 3.85Å; F183-F207 AromaticContact CE1-CD1 3.73Å; F183-F207 HydrophobicContact CE1-CD1 3.73Å; F183-F207 HydrophobicContact CE1-CG 4.14Å; F183-F207 AromaticContact CZ-CD1 3.98Å; F183-F207 HydrophobicContact CZ-CD1 3.98Å
184	Y	95.6	Very high	94.8	Very high	1 Å²	1	17 Å²	17	0%	0.004	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26	-176.5	74.5	-104.8	0	0	0	112.3	L134 D154 M156 M186 N203	L134-Y184 HydrophobicContact CD1-CD2 3.95Å; L134-Y184 HydrophobicContact CD1-CE2 4.14Å; D154-Y184 HydrophobicContact CB-CE1 4.4Å; D154-Y184 PolarHBondContact OD2-OH 2.85Å; M156-Y184 HydrophobicContact CB-CD2 3.67Å; M156-Y184 HydrophobicContact CB-CE2 3.36Å; M156-Y184 HydrophobicContact CE-CE2 4.22Å; M156-Y184 HydrophobicContact CG-CE2 4.14Å; Y184-M186 PolarHBondContact O-N 3.29Å; Y184-N203 HydrophobicContact CD1-CB 4.24Å; Y184-N203 VanDerWaalsContact CD1-ND2 3.32Å; Y184-N203 WeakPolarHBondContact CD1-ND2 3.17Å; Y184-N203 WeakPolarHBondContact CD1-OD1 3.47Å; Y184-N203 HydrophobicContact CE1-CB 4.49Å; Y184-N203 WeakPolarHBondContact CE1-ND2 3.29Å; Y184-N203 PolarHBondContact N-OD1 2.94Å
185	E	94.8	Very high	94.7	Very high	11 Å²	11	18 Å²	18	5%	0.051	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.6	-179.6	-64.4	93.6	143.1	0	0	113.2	Y24 L127 G130 Q131 F183 N203	Y24-E185 PolarHBondContact OH-OE1 3.44Å; L127-E185 HydrophobicContact CB-CB 4.47Å; L127-E185 HydrophobicContact CB-CG 4.38Å; L127-E185 HydrophobicContact CD2-CB 4.09Å; L127-E185 WeakPolarHBondContact O-CG 3.4Å; G130-E185 WeakPolarHBondContact CA-O 3.48Å; Q131-E185 HydrophobicContact CB-CG 4.04Å; F183-E185 WeakPolarHBondContact CB-OE2 3.42Å; F183-E185 PolarHBondContact O-N 2.91Å; E185-N203 PolarHBondContact OE1-ND2 2.88Å; E185-N203 PolarHBondContact OE2-ND2 2.93Å; E185-N203 PolarHBondContact OE2-OD1 2.8Å
186	M	90.3	Very high	94.6	Very high	105 Å²	105	19.1 Å²	19.1	52%	0.517	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-147.7	10.3	-172.9	61.5	177.3	-74.8	0	0	114.7	L126 L127 F183 Y184	L126-M186 HydrophobicContact CB-SD 4.39Å; L127-M186 HydrophobicContact CD2-CG 4.13Å; L127-M186 HydrophobicContact CD2-SD 3.94Å; F183-M186 HydrophobicContact CB-CG 4.42Å; F183-M186 PolarHBondContact O-N 2.79Å; Y184-M186 PolarHBondContact O-N 3.29Å
187	G	90.2	Very high	94.6	Very high	17 Å²	17	19.4 Å²	19.4	18%	0.175	12%	0.12	C	C	.	.	S	Bend	trans	-102.2	-142	-170.5	0	0	0	0	0	114.8	E178 F183 L189 S190	E178-G187 WeakPolarHBondContact OE1-CA 3.35Å; E178-G187 WeakPolarHBondContact OE2-CA 3.3Å; F183-G187 WeakPolarHBondContact O-CA 3.45Å; F183-G187 PolarHBondContact O-N 3.11Å; G187-L189 PolarHBondContact O-N 3.09Å; G187-L189 VanDerWaalsContact O-N 3.16Å; G187-S190 PolarHBondContact O-OG 3.09Å
188	C	93.9	Very high	94.6	Very high	11 Å²	11	19.4 Å²	19.4	7%	0.074	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-13.1	-173	75.5	0	0	0	0	113.6	E178 S190 P192 Y244 W246	E178-C188 VanDerWaalsContact CD-N 3.32Å; E178-C188 VanDerWaalsContact CD-SG 3.6Å; E178-C188 PolarHBondContact OE1-N 3.48Å; E178-C188 PolarHBondContact OE1-SG 3.25Å; E178-C188 PolarHBondContact OE2-N 3.03Å; C188-S190 PolarHBondContact O-N 3.36Å; C188-P192 VanDerWaalsContact O-CD 3.27Å; C188-P192 WeakPolarHBondContact O-CD 3.37Å; C188-Y244 HydrophobicContact CB-CD1 4.39Å; C188-Y244 HydrophobicContact CB-CE1 3.67Å; C188-Y244 WeakPolarHBondContact O-CE1 3.41Å; C188-W246 HydrophobicContact CB-CB 3.74Å; C188-W246 HydrophobicContact CB-CG 4.31Å
189	L	95.6	Very high	94.7	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.021	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.1	177	-179.4	143	0	0	0	115.1	L134 M158 C176 G187 A191 P192 L193 V199 G201	L134-L189 HydrophobicContact CD1-CD2 4.25Å; L134-L189 HydrophobicContact CD2-CD2 3.65Å; M158-L189 HydrophobicContact CE-CD1 3.69Å; M158-L189 HydrophobicContact CE-CD2 3.75Å; M158-L189 HydrophobicContact CE-CG 4.02Å; C176-L189 HydrophobicContact CB-CB 4.27Å; G187-L189 PolarHBondContact O-N 3.09Å; G187-L189 VanDerWaalsContact O-N 3.16Å; L189-A191 PolarHBondContact O-N 2.97Å; L189-P192 WeakPolarHBondContact O-CD 3.43Å; L189-P192 WeakPolarHBondContact O-CG 3.45Å; L189-L193 HydrophobicContact CD2-CB 4.36Å; L189-L193 HydrophobicContact CD2-CD2 3.87Å; L189-L193 VanDerWaalsContact O-CB 3.24Å; L189-L193 WeakPolarHBondContact O-CB 3.49Å; L189-L193 PolarHBondContact O-N 3.26Å; L189-V199 HydrophobicContact CD1-CG1 3.93Å; L189-V199 HydrophobicContact CG-CG1 3.72Å; L189-G201 VanDerWaalsContact CD1-CA 3.49Å
190	S	94.8	Very high	94.9	Very high	39 Å²	39	19.4 Å²	19.4	27%	0.273	12%	0.12	S	C	.	.	H	α-helix	trans	-62.3	-44.6	-173.6	55.8	0	0	0	0	113.3	G187 C188 L193 E194	G187-S190 PolarHBondContact O-OG 3.09Å; C188-S190 PolarHBondContact O-N 3.36Å; S190-L193 CarbonylContact O-C 3.51Å; S190-L193 PolarHBondContact O-N 3.41Å; S190-E194 WeakPolarHBondContact O-CB 3.14Å; S190-E194 WeakPolarHBondContact O-CG 3.46Å; S190-E194 PolarHBondContact O-N 3.5Å
191	A	96.5	Very high	95.3	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-60.7	-55.8	-175.7	0	0	0	0	0	113.8	L189 L193 E194 A195 L458 F463	L189-A191 PolarHBondContact O-N 2.97Å; A191-L193 VanDerWaalsContact C-N 3.27Å; A191-L193 PolarHBondContact O-N 3.37Å; A191-E194 PolarHBondContact O-N 3.48Å; A191-A195 VanDerWaalsContact O-CB 3.3Å; A191-A195 WeakPolarHBondContact O-CB 3.49Å; A191-A195 PolarHBondContact O-N 2.89Å; A191-L458 HydrophobicContact CB-CB 3.9Å; A191-L458 HydrophobicContact CB-CD2 4.14Å; A191-L458 HydrophobicContact CB-CG 4.24Å; A191-L458 VanDerWaalsContact CB-O 3.23Å; A191-L458 WeakPolarHBondContact CB-O 3.11Å; A191-F463 HydrophobicContact CB-CB 4.33Å
192	P	97.6	Very high	95.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.3	-31.5	175.9	25.9	-34.3	0	0	0	112.4	V174 C188 L189 A195 G196 Y197 V199 Y244 F463	V174-P192 HydrophobicContact CB-CB 3.94Å; V174-P192 HydrophobicContact CB-CG 4.38Å; V174-P192 HydrophobicContact CG1-CB 3.89Å; V174-P192 HydrophobicContact CG1-CG 3.99Å; V174-P192 HydrophobicContact CG2-CB 3.88Å; C188-P192 VanDerWaalsContact O-CD 3.27Å; C188-P192 WeakPolarHBondContact O-CD 3.37Å; L189-P192 WeakPolarHBondContact O-CD 3.43Å; L189-P192 WeakPolarHBondContact O-CG 3.45Å; P192-A195 PolarHBondContact O-N 3.49Å; P192-G196 PolarHBondContact O-N 2.95Å; P192-Y197 HydrophobicContact CB-CD2 4.39Å; P192-Y197 WeakPolarHBondContact O-CB 3.25Å; P192-Y197 WeakPolarHBondContact O-CD2 3.44Å; P192-Y197 PolarHBondContact O-N 3.36Å; P192-Y197 VanDerWaalsContact O-N 3.1Å; P192-V199 HydrophobicContact CB-CG2 4.08Å; P192-V199 HydrophobicContact CG-CG1 4.46Å; P192-V199 HydrophobicContact CG-CG2 4.22Å; P192-Y244 HydrophobicContact CG-CD1 4.26Å; P192-F463 HydrophobicContact CB-CD1 3.95Å; P192-F463 HydrophobicContact CB-CD2 4.34Å; P192-F463 HydrophobicContact CB-CE1 3.78Å; P192-F463 HydrophobicContact CB-CE2 4.18Å; P192-F463 HydrophobicContact CB-CG 4.24Å; P192-F463 HydrophobicContact CB-CZ 3.9Å
193	L	97.1	Very high	96.1	Very high	2 Å²	2	16 Å²	16	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-67	-43.7	176.4	-176.9	68	0	0	0	110.5	L134 Y138 M158 R160 L189 S190 A191 A195 G196 V199	L134-L193 HydrophobicContact CD2-CD2 3.74Å; Y138-L193 HydrophobicContact CD1-CD1 4.22Å; Y138-L193 HydrophobicContact CD1-CD2 3.75Å; Y138-L193 HydrophobicContact CD1-CG 3.95Å; Y138-L193 HydrophobicContact CD2-CD2 3.99Å; Y138-L193 HydrophobicContact CE1-CD2 3.98Å; Y138-L193 HydrophobicContact CE1-CG 4.13Å; Y138-L193 HydrophobicContact CE2-CD2 4.21Å; Y138-L193 HydrophobicContact CG-CD2 3.74Å; Y138-L193 HydrophobicContact CG-CG 4.4Å; M158-L193 HydrophobicContact CB-CD1 3.68Å; M158-L193 HydrophobicContact CE-CD1 4.17Å; M158-L193 HydrophobicContact CE-CD2 4.24Å; M158-L193 HydrophobicContact CG-CD1 3.81Å; M158-L193 HydrophobicContact CG-CD2 4.48Å; R160-L193 PolarHBondContact NH1-O 3.38Å; R160-L193 PolarHBondContact NH2-O 2.9Å; L189-L193 HydrophobicContact CD2-CB 4.36Å; L189-L193 HydrophobicContact CD2-CD2 3.87Å; L189-L193 VanDerWaalsContact O-CB 3.24Å; L189-L193 WeakPolarHBondContact O-CB 3.49Å; L189-L193 PolarHBondContact O-N 3.26Å; S190-L193 CarbonylContact O-C 3.51Å; S190-L193 PolarHBondContact O-N 3.41Å; A191-L193 VanDerWaalsContact C-N 3.27Å; A191-L193 PolarHBondContact O-N 3.37Å; L193-A195 VanDerWaalsContact C-N 3.31Å; L193-A195 PolarHBondContact O-N 2.91Å; L193-G196 PolarHBondContact O-N 3.32Å; L193-V199 HydrophobicContact CB-CG2 3.98Å; L193-V199 HydrophobicContact CD1-CB 4.44Å; L193-V199 HydrophobicContact CD1-CG2 4.21Å
194	E	95.9	Very high	96.2	Very high	92 Å²	92	16 Å²	16	43%	0.43	10%	0.096	S	C	.	.	H	α-helix	trans	-75.3	-24.9	179.2	-70.2	-178.8	-177.4	0	0	111.7	R133 Y138 S190 A191 G196 P460	R133-E194 IonicContact NH2-OE1 2.86Å; R133-E194 PolarHBondContact NH2-OE1 3.45Å; R133-E194 VanDerWaalsContact NH2-OE1 3.09Å; Y138-E194 PolarHBondContact OH-OE1 3.22Å; S190-E194 WeakPolarHBondContact O-CB 3.14Å; S190-E194 WeakPolarHBondContact O-CG 3.46Å; S190-E194 PolarHBondContact O-N 3.5Å; A191-E194 PolarHBondContact O-N 3.48Å; E194-G196 PolarHBondContact O-N 3.01Å; E194-P460 HydrophobicContact CB-CB 4.02Å; E194-P460 HydrophobicContact CB-CG 3.55Å
195	A	96.2	Very high	96.3	Very high	22 Å²	22	16 Å²	16	18%	0.182	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-0.6	171.3	0	0	0	0	0	114.6	H169 A191 P192 L193 Y197 P460	H169-A195 PolarHBondContact ND1-O 3.48Å; A191-A195 VanDerWaalsContact O-CB 3.3Å; A191-A195 WeakPolarHBondContact O-CB 3.49Å; A191-A195 PolarHBondContact O-N 2.89Å; P192-A195 PolarHBondContact O-N 3.49Å; L193-A195 VanDerWaalsContact C-N 3.31Å; L193-A195 PolarHBondContact O-N 2.91Å; A195-Y197 HydrophobicContact CB-CD2 3.93Å; A195-Y197 HydrophobicContact CB-CE2 3.92Å; A195-P460 HydrophobicContact CB-CB 4.24Å
196	G	96.6	Very high	96.3	Very high	23 Å²	23	16.3 Å²	16.3	24%	0.237	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.5	9	171.6	0	0	0	0	0	116.3	R160 H169 G170 P192 L193 E194	R160-G196 VanDerWaalsContact NH1-C 3.32Å; H169-G196 CarbonylContact C-O 3.39Å; G170-G196 WeakPolarHBondContact CA-O 3.4Å; G170-G196 PolarHBondContact N-O 3.19Å; P192-G196 PolarHBondContact O-N 2.95Å; L193-G196 PolarHBondContact O-N 3.32Å; E194-G196 PolarHBondContact O-N 3.01Å
197	Y	98.3	Very high	96.5	Very high	7 Å²	7	11.3 Å²	11.3	3%	0.027	8%	0.078	C	C	.	.			trans	-76.8	159.7	178.1	-66.8	-91.2	0	0	0	112.8	R160 H169 R172 V174 P192 A195 F463 L465	R160-Y197 PolarHBondContact NH1-O 3.49Å; H169-Y197 HydrophobicContact CB-CD1 3.96Å; H169-Y197 HydrophobicContact CB-CD2 4.24Å; H169-Y197 HydrophobicContact CB-CE1 3.97Å; H169-Y197 HydrophobicContact CB-CE2 4.24Å; H169-Y197 HydrophobicContact CB-CG 4.1Å; H169-Y197 AromaticContact CD2-CZ 3.78Å; H169-Y197 AromaticContact CG-CE1 3.97Å; H169-Y197 AromaticContact CG-CE2 3.9Å; H169-Y197 AromaticContact CG-CZ 3.67Å; H169-Y197 AromaticContact ND1-CE2 3.72Å; H169-Y197 AromaticContact ND1-CZ 3.86Å; H169-Y197 PolarHBondContact NE2-OH 3.02Å; H169-Y197 WeakPolarHBondContact O-CD1 3.41Å; R172-Y197 HydrophobicContact CB-CD1 4Å; R172-Y197 HydrophobicContact CB-CE1 4.31Å; V174-Y197 HydrophobicContact CG2-CD1 3.93Å; V174-Y197 HydrophobicContact CG2-CD2 4.49Å; V174-Y197 HydrophobicContact CG2-CG 3.8Å; P192-Y197 HydrophobicContact CB-CD2 4.39Å; P192-Y197 WeakPolarHBondContact O-CB 3.25Å; P192-Y197 WeakPolarHBondContact O-CD2 3.44Å; P192-Y197 PolarHBondContact O-N 3.36Å; P192-Y197 VanDerWaalsContact O-N 3.1Å; A195-Y197 HydrophobicContact CB-CD2 3.93Å; A195-Y197 HydrophobicContact CB-CE2 3.92Å; Y197-F463 HydrophobicContact CD2-CD1 4.14Å; Y197-F463 HydrophobicContact CD2-CE1 4Å; Y197-F463 AromaticContact CE2-CD1 3.78Å; Y197-F463 HydrophobicContact CE2-CD1 3.78Å; Y197-F463 AromaticContact CE2-CE1 3.79Å; Y197-F463 HydrophobicContact CE2-CE1 3.79Å; Y197-L465 HydrophobicContact CE1-CD1 4.24Å; Y197-L465 HydrophobicContact CE1-CD2 4.22Å; Y197-L465 HydrophobicContact CE1-CG 4.34Å
198	S	98.6	Very high	96.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	141.4	156.2	-69.1	0	0	0	0	108.1	M158 R160 G170 R172 L173 V174	M158-S198 VanDerWaalsContact O-CA 3.31Å; M158-S198 WeakPolarHBondContact O-CA 3.3Å; R160-S198 PolarHBondContact N-OG 2.76Å; G170-S198 PolarHBondContact O-OG 2.63Å; R172-S198 WeakPolarHBondContact O-CB 3.07Å; R172-S198 PolarHBondContact O-N 2.88Å; L173-S198 CarbonylContact C-O 3.3Å; L173-S198 WeakPolarHBondContact CA-O 3.15Å; V174-S198 PolarHBondContact N-O 2.84Å
199	V	98.6	Very high	96.3	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.3	-174.1	-174.7	0	0	0	0	111.8	F157 M158 V174 C176 L189 P192 L193	F157-V199 WeakPolarHBondContact CA-O 3.43Å; F157-V199 WeakPolarHBondContact CD2-O 3.21Å; M158-V199 HydrophobicContact CE-CB 3.95Å; M158-V199 HydrophobicContact CE-CG1 4.23Å; M158-V199 PolarHBondContact N-O 3.33Å; M158-V199 PolarHBondContact O-N 3.08Å; V174-V199 HydrophobicContact CB-CG2 4.45Å; V174-V199 CarbonylContact O-C 3.51Å; V174-V199 WeakPolarHBondContact O-CA 3.49Å; C176-V199 WeakPolarHBondContact SG-CG1 3.25Å; L189-V199 HydrophobicContact CD1-CG1 3.93Å; L189-V199 HydrophobicContact CG-CG1 3.72Å; P192-V199 HydrophobicContact CB-CG2 4.08Å; P192-V199 HydrophobicContact CG-CG1 4.46Å; P192-V199 HydrophobicContact CG-CG2 4.22Å; L193-V199 HydrophobicContact CB-CG2 3.98Å; L193-V199 HydrophobicContact CD1-CB 4.44Å; L193-V199 HydrophobicContact CD1-CG2 4.21Å
200	L	98.8	Very high	96.3	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	109.6	171.8	176.3	62.1	0	0	0	109.3	M156 F157 L173 V174 I175 C176 V226 Y229 A230 L234	M156-L200 WeakPolarHBondContact O-CA 3.31Å; F157-L200 HydrophobicContact CB-CD1 4.1Å; F157-L200 HydrophobicContact CD2-CB 4.5Å; L173-L200 HydrophobicContact CD1-CB 3.89Å; L173-L200 HydrophobicContact CD2-CB 4.38Å; L173-L200 HydrophobicContact CG-CB 4.45Å; V174-L200 PolarHBondContact O-N 3.33Å; I175-L200 WeakPolarHBondContact CA-O 3.44Å; I175-L200 HydrophobicContact CG1-CB 4.39Å; I175-L200 HydrophobicContact CG1-CD2 4.34Å; C176-L200 PolarHBondContact N-O 2.99Å; L200-V226 HydrophobicContact CD2-CG1 3.76Å; L200-V226 HydrophobicContact CG-CG1 4.34Å; L200-Y229 HydrophobicContact CD1-CD1 4.46Å; L200-Y229 HydrophobicContact CD1-CE1 4.39Å; L200-Y229 HydrophobicContact CD2-CD1 4.2Å; L200-A230 HydrophobicContact CD2-CB 4.21Å; L200-L234 HydrophobicContact CD2-CD1 4.36Å
201	G	98.4	Very high	96.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	149.7	170.9	0	0	0	0	0	111.8	T155 M156 L189	T155-G201 CarbonylContact C-O 3.58Å; T155-G201 WeakPolarHBondContact CA-O 3.42Å; T155-G201 WeakPolarHBondContact CB-O 3.22Å; M156-G201 PolarHBondContact N-O 3.28Å; M156-G201 PolarHBondContact O-N 3.49Å; L189-G201 VanDerWaalsContact CD1-CA 3.49Å
202	W	98.4	Very high	96.3	Very high	1 Å²	1	13.6 Å²	13.6	0%	0.004	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	153.5	175.5	67.7	-77.5	0	0	0	111.2	I153 D154 T155 C176 A222 M223 V226 T252	I153-W202 HydrophobicContact CG2-CB 4.37Å; I153-W202 HydrophobicContact CG2-CE3 4.02Å; D154-W202 WeakPolarHBondContact O-CA 2.92Å; T155-W202 HydrophobicContact CG2-CB 3.68Å; C176-W202 PolarHBondContact O-NE1 3.24Å; W202-A222 HydrophobicContact CE3-CB 4.23Å; W202-A222 HydrophobicContact CH2-CB 4.26Å; W202-A222 HydrophobicContact CZ3-CB 3.59Å; W202-M223 HydrophobicContact CZ2-CB 4.41Å; W202-M223 HydrophobicContact CZ2-SD 3.76Å; W202-V226 HydrophobicContact CB-CG2 3.95Å; W202-V226 HydrophobicContact CD2-CG2 4.11Å; W202-V226 HydrophobicContact CE3-CG2 4.45Å; W202-V226 HydrophobicContact CG-CG1 4.31Å; W202-V226 HydrophobicContact CG-CG2 3.88Å; W202-T252 HydrophobicContact CH2-CG2 3.89Å; W202-T252 HydrophobicContact CZ2-CG2 4.02Å
203	N	97.4	Very high	96.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	12%	0.116	C	C	.	.	P	Polyproline II helix	trans	-104	135.5	177.1	-80.2	-26.8	0	0	0	111.2	D154 F183 Y184 E185 F207 S210	D154-N203 PolarHBondContact O-N 3.37Å; F183-N203 VanDerWaalsContact CA-OD1 3.29Å; F183-N203 WeakPolarHBondContact CA-OD1 3.3Å; Y184-N203 HydrophobicContact CD1-CB 4.24Å; Y184-N203 VanDerWaalsContact CD1-ND2 3.32Å; Y184-N203 WeakPolarHBondContact CD1-ND2 3.17Å; Y184-N203 WeakPolarHBondContact CD1-OD1 3.47Å; Y184-N203 HydrophobicContact CE1-CB 4.49Å; Y184-N203 WeakPolarHBondContact CE1-ND2 3.29Å; Y184-N203 PolarHBondContact N-OD1 2.94Å; E185-N203 PolarHBondContact OE1-ND2 2.88Å; E185-N203 PolarHBondContact OE2-ND2 2.93Å; E185-N203 PolarHBondContact OE2-OD1 2.8Å; N203-F207 HydrophobicContact CB-CB 4.11Å; N203-S210 PolarHBondContact O-OG 3.1Å
204	H	97.3	Very high	96	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-50.1	153.2	173.2	-67.2	-84.7	0	0	0	112.4	E178 G206 F207 S210 D219	E178-H204 PolarHBondContact O-NE2 3.09Å; H204-G206 PolarHBondContact O-N 2.69Å; H204-F207 HydrophobicContact CB-CB 4.25Å; H204-F207 HydrophobicContact CB-CD1 4.39Å; H204-F207 HydrophobicContact CB-CD2 3.54Å; H204-F207 HydrophobicContact CB-CE2 3.85Å; H204-F207 HydrophobicContact CB-CG 3.84Å; H204-F207 HydrophobicContact CB-CZ 4.41Å; H204-F207 WeakPolarHBondContact O-CB 3.27Å; H204-F207 PolarHBondContact O-N 2.9Å; H204-S210 WeakPolarHBondContact O-CB 3.4Å; H204-D219 IonicContact CE1-OD1 3.1Å; H204-D219 IonicContact CE1-OD2 2.7Å; H204-D219 IonicContact CG-OD1 2.9Å; H204-D219 IonicContact ND1-OD1 3.16Å; H204-D219 PolarHBondContact ND1-OD1 3Å; H204-D219 IonicContact ND1-OD2 2.7Å; H204-D219 PolarHBondContact ND1-OD2 3.28Å
205	P	96.8	Very high	96	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	126.9	169.7	-26.6	36.5	0	0	0	111.7	I153 T211 V213 P214 H218 D219 A222	I153-P205 HydrophobicContact CD1-CG 4.08Å; P205-T211 CarbonylContact C-O 3.57Å; P205-T211 WeakPolarHBondContact CA-O 3.46Å; P205-V213 CarbonylContact O-C 3.48Å; P205-P214 VanDerWaalsContact O-CD 3.28Å; P205-P214 WeakPolarHBondContact O-CD 3.48Å; P205-H218 HydrophobicContact CB-CB 4.11Å; P205-H218 HydrophobicContact CG-CB 3.8Å; P205-D219 VanDerWaalsContact CD-OD1 3.26Å; P205-D219 WeakPolarHBondContact CD-OD1 3.48Å; P205-A222 HydrophobicContact CG-CB 4.02Å
206	G	94.4	Very high	96	Very high	18 Å²	18	12.2 Å²	12.2	19%	0.186	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	5.3	-175.9	0	0	0	0	0	115.8	S115 H204 S210 T211 G212	S115-G206 WeakPolarHBondContact CA-O 3.24Å; H204-G206 PolarHBondContact O-N 2.69Å; G206-S210 WeakPolarHBondContact CA-O 3.32Å; G206-S210 PolarHBondContact N-O 3.46Å; G206-T211 PolarHBondContact N-O 2.98Å; G206-G212 VanDerWaalsContact CA-O 3.26Å; G206-G212 WeakPolarHBondContact CA-O 3.34Å
207	F	94.6	Very high	96	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.094	C	C	.	.	S	Bend	trans	-104.5	138.4	175.5	-76.8	-130.8	0	0	0	111	Y112 N180 G182 F183 N203 H204 G209 S210 P214	Y112-F207 HydrophobicContact CD1-CE2 4.24Å; Y112-F207 HydrophobicContact CD1-CZ 4.1Å; N180-F207 WeakPolarHBondContact O-CE1 3.45Å; N180-F207 VanDerWaalsContact O-CZ 3.24Å; N180-F207 WeakPolarHBondContact O-CZ 3.23Å; G182-F207 WeakPolarHBondContact O-CD1 3.44Å; F183-F207 HydrophobicContact CD1-CB 4.16Å; F183-F207 HydrophobicContact CD1-CD1 4.13Å; F183-F207 HydrophobicContact CE1-CB 3.85Å; F183-F207 AromaticContact CE1-CD1 3.73Å; F183-F207 HydrophobicContact CE1-CD1 3.73Å; F183-F207 HydrophobicContact CE1-CG 4.14Å; F183-F207 AromaticContact CZ-CD1 3.98Å; F183-F207 HydrophobicContact CZ-CD1 3.98Å; N203-F207 HydrophobicContact CB-CB 4.11Å; H204-F207 HydrophobicContact CB-CB 4.25Å; H204-F207 HydrophobicContact CB-CD1 4.39Å; H204-F207 HydrophobicContact CB-CD2 3.54Å; H204-F207 HydrophobicContact CB-CE2 3.85Å; H204-F207 HydrophobicContact CB-CG 3.84Å; H204-F207 HydrophobicContact CB-CZ 4.41Å; H204-F207 WeakPolarHBondContact O-CB 3.27Å; H204-F207 PolarHBondContact O-N 2.9Å; F207-G209 PolarHBondContact O-N 3.14Å; F207-G209 VanDerWaalsContact O-N 3.13Å; F207-S210 WeakPolarHBondContact O-CB 3.41Å; F207-S210 PolarHBondContact O-N 2.85Å; F207-P214 HydrophobicContact CE2-CB 4.15Å; F207-P214 HydrophobicContact CE2-CG 4.1Å
208	G	90.7	Very high	96	Very high	18 Å²	18	15.6 Å²	15.6	19%	0.186	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-119.9	173.6	0	0	0	0	0	111
209	G	90.4	Very high	96	Very high	8 Å²	8	15.6 Å²	15.6	8%	0.082	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-24.9	173.9	0	0	0	0	0	116.3	Y24 F26 F207	Y24-G209 PolarHBondContact OH-N 2.98Å; F26-G209 WeakPolarHBondContact CD1-O 3.34Å; F26-G209 WeakPolarHBondContact CE1-O 3.36Å; F207-G209 PolarHBondContact O-N 3.14Å; F207-G209 VanDerWaalsContact O-N 3.13Å
210	S	95.5	Very high	95.9	Very high	7 Å²	7	15.6 Å²	15.6	5%	0.049	10%	0.104	C	C	.	.			trans	-67.1	136.9	-172.1	-62.2	0	0	0	0	111.7	E152 D154 N203 H204 G206 F207	E152-S210 CarbonylContact O-C 3.55Å; E152-S210 WeakPolarHBondContact O-CA 3.4Å; D154-S210 PolarHBondContact N-OG 3.33Å; N203-S210 PolarHBondContact O-OG 3.1Å; H204-S210 WeakPolarHBondContact O-CB 3.4Å; G206-S210 WeakPolarHBondContact CA-O 3.32Å; G206-S210 PolarHBondContact N-O 3.46Å; F207-S210 WeakPolarHBondContact O-CB 3.41Å; F207-S210 PolarHBondContact O-N 2.85Å
211	T	95.6	Very high	95.9	Very high	48 Å²	48	16.4 Å²	16.4	29%	0.294	11%	0.108	S	C	.	.			trans	-81.1	175.2	176.8	65.9	0	0	0	0	111.5	E152 P205 G206	E152-T211 HydrophobicContact CB-CG2 3.98Å; E152-T211 HydrophobicContact CG-CG2 4.29Å; E152-T211 PolarHBondContact N-OG1 3.18Å; E152-T211 PolarHBondContact O-N 3.2Å; P205-T211 CarbonylContact C-O 3.57Å; P205-T211 WeakPolarHBondContact CA-O 3.46Å; G206-T211 PolarHBondContact N-O 2.98Å
212	G	94.6	Very high	95.9	Very high	39 Å²	39	16.4 Å²	16.4	40%	0.402	11%	0.108	S	C	.	.	S	Bend	trans	87	-156.3	174.6	0	0	0	0	0	113.5	N151 G206	N151-G212 WeakPolarHBondContact OD1-CA 3.39Å; G206-G212 VanDerWaalsContact CA-O 3.26Å; G206-G212 WeakPolarHBondContact CA-O 3.34Å
213	V	94.6	Very high	95.9	Very high	55 Å²	55	16.4 Å²	16.4	33%	0.333	11%	0.108	S	C	.	.			trans	-142.4	146	-179.4	-68.4	0	0	0	0	109.9	R108 P205 F215 H218	R108-V213 VanDerWaalsContact NH1-CB 3.34Å; P205-V213 CarbonylContact O-C 3.48Å; V213-F215 HydrophobicContact CG2-CD2 3.97Å; V213-F215 HydrophobicContact CG2-CE2 3.89Å; V213-F215 PolarHBondContact O-N 3.22Å; V213-H218 PolarHBondContact O-ND1 3.5Å
214	P	94.8	Very high	96	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.11	C	C	.	.			trans	-78.7	127.6	-174.1	32.4	-37.6	0	0	0	111	R108 Y112 S115 P205 F207	R108-P214 HydrophobicContact CG-CG 4.17Å; Y112-P214 VanDerWaalsContact CB-CG 3.41Å; Y112-P214 HydrophobicContact CD1-CB 3.82Å; Y112-P214 HydrophobicContact CD1-CG 4.34Å; Y112-P214 HydrophobicContact CD2-CB 3.74Å; Y112-P214 HydrophobicContact CD2-CG 3.92Å; Y112-P214 HydrophobicContact CE1-CB 4.18Å; Y112-P214 HydrophobicContact CE2-CB 4.15Å; Y112-P214 HydrophobicContact CG-CB 3.55Å; Y112-P214 HydrophobicContact CG-CG 3.67Å; S115-P214 WeakPolarHBondContact OG-CG 3.48Å; P205-P214 VanDerWaalsContact O-CD 3.28Å; P205-P214 WeakPolarHBondContact O-CD 3.48Å; F207-P214 HydrophobicContact CE2-CB 4.15Å; F207-P214 HydrophobicContact CE2-CG 4.1Å
215	F	96.1	Very high	96	Very high	21 Å²	21	16.8 Å²	16.8	9%	0.092	11%	0.11	C	C	.	.			trans	-149.9	155.2	167.4	-78.1	-79.7	0	0	0	107.5	H104 V213 Q217 H218 D219 F299	H104-F215 AromaticContact CE1-CZ 3.54Å; H104-F215 AromaticContact ND1-CZ 3.62Å; H104-F215 AromaticContact NE2-CZ 3.96Å; V213-F215 HydrophobicContact CG2-CD2 3.97Å; V213-F215 HydrophobicContact CG2-CE2 3.89Å; V213-F215 PolarHBondContact O-N 3.22Å; F215-Q217 PolarHBondContact O-N 3.5Å; F215-Q217 VanDerWaalsContact O-N 3.08Å; F215-H218 AromaticContact CD2-CE1 3.84Å; F215-H218 AromaticContact CD2-ND1 3.8Å; F215-H218 PolarHBondContact O-N 3.48Å; F215-D219 PolarHBondContact O-N 2.9Å; F215-F299 HydrophobicContact CD1-CD1 4.41Å; F215-F299 AromaticContact CD1-CE1 3.62Å; F215-F299 HydrophobicContact CD1-CE1 3.62Å; F215-F299 AromaticContact CD1-CZ 3.82Å; F215-F299 HydrophobicContact CD1-CZ 3.82Å; F215-F299 AromaticContact CE1-CE1 3.83Å; F215-F299 HydrophobicContact CE1-CE1 3.83Å; F215-F299 HydrophobicContact CE1-CE2 4.32Å; F215-F299 AromaticContact CE1-CZ 3.5Å; F215-F299 HydrophobicContact CE1-CZ 3.5Å; F215-F299 HydrophobicContact CZ-CZ 4.44Å
216	P	96.6	Very high	96.1	Very high	11 Å²	11	16.8 Å²	16.8	7%	0.071	11%	0.11	C	C	.	.	H	α-helix	trans	-51.4	-39.3	-177.9	-26.4	32.1	0	0	0	113.7	A220 F251 H298 F299 L301	P216-A220 WeakPolarHBondContact O-CB 3.48Å; P216-A220 PolarHBondContact O-N 3.03Å; P216-F251 HydrophobicContact CB-CE1 3.87Å; P216-F251 HydrophobicContact CB-CE2 4.36Å; P216-F251 HydrophobicContact CB-CZ 3.6Å; P216-F251 WeakPolarHBondContact O-CE1 3.43Å; P216-H298 VanDerWaalsContact CD-O 3.26Å; P216-H298 WeakPolarHBondContact CD-O 3.18Å; P216-F299 HydrophobicContact CG-CD1 4.43Å; P216-L301 HydrophobicContact CB-CD2 4.23Å; P216-L301 HydrophobicContact CG-CD2 3.85Å
217	Q	96.4	Very high	96.3	Very high	50 Å²	50	16 Å²	16	23%	0.234	10%	0.101	C	C	.	.	H	α-helix	trans	-69.6	-39	178.1	-172.1	60.8	60.1	0	0	113	F215 A220 N221	F215-Q217 PolarHBondContact O-N 3.5Å; F215-Q217 VanDerWaalsContact O-N 3.08Å; Q217-A220 WeakPolarHBondContact O-CB 3.4Å; Q217-A220 PolarHBondContact O-N 2.86Å; Q217-N221 PolarHBondContact NE2-OD1 3.18Å; Q217-N221 PolarHBondContact O-N 3.07Å; Q217-N221 PolarHBondContact O-ND2 2.9Å; Q217-N221 PolarHBondContact O-OD1 2.77Å
218	H	97.6	Very high	96.5	Very high	51 Å²	51	16.9 Å²	16.9	24%	0.236	11%	0.105	C	C	.	.	H	α-helix	trans	-70.4	-36.6	177.1	-55.6	153.3	0	0	0	111.1	D149 P205 V213 F215 N221 A222	D149-H218 IonicContact OD2-CD2 2.94Å; D149-H218 PolarHBondContact OD2-CD2 3.05Å; D149-H218 VanDerWaalsContact OD2-CD2 3.24Å; D149-H218 IonicContact OD2-CG 3.54Å; P205-H218 HydrophobicContact CB-CB 4.11Å; P205-H218 HydrophobicContact CG-CB 3.8Å; V213-H218 PolarHBondContact O-ND1 3.5Å; F215-H218 AromaticContact CD2-CE1 3.84Å; F215-H218 AromaticContact CD2-ND1 3.8Å; F215-H218 PolarHBondContact O-N 3.48Å; H218-N221 PolarHBondContact O-N 3.29Å; H218-A222 WeakPolarHBondContact O-CB 3.49Å; H218-A222 PolarHBondContact O-N 3.11Å
219	D	97.7	Very high	96.9	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.2	-43.5	172.3	-86.3	-17.7	0	0	0	111.5	Y112 H204 P205 F215 A222 M223 F251 T252	Y112-D219 WeakPolarHBondContact CE1-OD2 3.34Å; Y112-D219 VanDerWaalsContact CZ-OD2 3.29Å; Y112-D219 PolarHBondContact OH-OD2 3.26Å; H204-D219 IonicContact CE1-OD1 3.1Å; H204-D219 IonicContact CE1-OD2 2.7Å; H204-D219 IonicContact CG-OD1 2.9Å; H204-D219 IonicContact ND1-OD1 3.16Å; H204-D219 PolarHBondContact ND1-OD1 3Å; H204-D219 IonicContact ND1-OD2 2.7Å; H204-D219 PolarHBondContact ND1-OD2 3.28Å; P205-D219 VanDerWaalsContact CD-OD1 3.26Å; P205-D219 WeakPolarHBondContact CD-OD1 3.48Å; F215-D219 PolarHBondContact O-N 2.9Å; D219-A222 PolarHBondContact O-N 2.7Å; D219-M223 VanDerWaalsContact O-CB 3.28Å; D219-M223 WeakPolarHBondContact O-CB 3.38Å; D219-M223 PolarHBondContact O-N 3.47Å; D219-F251 HydrophobicContact CB-CE1 4.44Å; D219-T252 HydrophobicContact CB-CG2 3.63Å
220	A	98	Very high	97.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.8	-46.3	173.4	0	0	0	0	0	112.1	P216 Q217 A222 M223 D224 W255	P216-A220 WeakPolarHBondContact O-CB 3.48Å; P216-A220 PolarHBondContact O-N 3.03Å; Q217-A220 WeakPolarHBondContact O-CB 3.4Å; Q217-A220 PolarHBondContact O-N 2.86Å; A220-A222 VanDerWaalsContact C-N 3.34Å; A220-A222 PolarHBondContact O-N 2.79Å; A220-M223 PolarHBondContact O-N 2.68Å; A220-D224 WeakPolarHBondContact O-CB 3.49Å; A220-D224 PolarHBondContact O-N 3.32Å; A220-W255 HydrophobicContact CB-CD2 3.86Å; A220-W255 VanDerWaalsContact CB-CE2 3.48Å; A220-W255 HydrophobicContact CB-CE3 4.46Å; A220-W255 HydrophobicContact CB-CG 4.22Å; A220-W255 HydrophobicContact CB-CH2 4.44Å; A220-W255 HydrophobicContact CB-CZ2 3.78Å; A220-W255 WeakPolarHBondContact O-CH2 3.43Å; A220-W255 WeakPolarHBondContact O-CZ3 3.46Å
221	N	98.3	Very high	97.4	Very high	17 Å²	17	17.6 Å²	17.6	9%	0.091	10%	0.101	C	C	.	.	H	α-helix	trans	-63.2	-38.9	177.9	-63.4	-16.2	0	0	0	112.4	A147 C148 D149 Q217 H218 D224 V225	A147-N221 HydrophobicContact CB-CB 4.32Å; C148-N221 PolarHBondContact SG-OD1 3.49Å; C148-N221 VanDerWaalsContact SG-OD1 3.38Å; D149-N221 PolarHBondContact OD2-ND2 3.46Å; Q217-N221 PolarHBondContact NE2-OD1 3.18Å; Q217-N221 PolarHBondContact O-N 3.07Å; Q217-N221 PolarHBondContact O-ND2 2.9Å; Q217-N221 PolarHBondContact O-OD1 2.77Å; H218-N221 PolarHBondContact O-N 3.29Å; N221-D224 WeakPolarHBondContact O-CB 3.37Å; N221-V225 PolarHBondContact O-N 3.19Å
222	A	98.6	Very high	97.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-67.3	-45.7	175.4	0	0	0	0	0	111.2	I153 W202 P205 H218 D219 A220 D224 V225 V226	I153-A222 HydrophobicContact CD1-CB 3.61Å; I153-A222 HydrophobicContact CG1-CB 3.82Å; W202-A222 HydrophobicContact CE3-CB 4.23Å; W202-A222 HydrophobicContact CH2-CB 4.26Å; W202-A222 HydrophobicContact CZ3-CB 3.59Å; P205-A222 HydrophobicContact CG-CB 4.02Å; H218-A222 WeakPolarHBondContact O-CB 3.49Å; H218-A222 PolarHBondContact O-N 3.11Å; D219-A222 PolarHBondContact O-N 2.7Å; A220-A222 VanDerWaalsContact C-N 3.34Å; A220-A222 PolarHBondContact O-N 2.79Å; A222-D224 VanDerWaalsContact C-N 3.28Å; A222-D224 PolarHBondContact O-N 2.86Å; A222-V225 WeakPolarHBondContact O-CG1 3.44Å; A222-V225 PolarHBondContact O-N 3.05Å; A222-V226 VanDerWaalsContact O-CG2 3.24Å; A222-V226 WeakPolarHBondContact O-CG2 3.3Å; A222-V226 PolarHBondContact O-N 3.03Å; A222-V226 VanDerWaalsContact O-N 3.09Å
223	M	98.6	Very high	97.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.6	-39.3	177.2	-171.3	67.4	-130.7	0	0	111.7	I175 W202 D219 A220 V226 V227 V243 W255 A256	I175-M223 HydrophobicContact CD1-CE 4.33Å; I175-M223 HydrophobicContact CG2-CE 3.77Å; W202-M223 HydrophobicContact CZ2-CB 4.41Å; W202-M223 HydrophobicContact CZ2-SD 3.76Å; D219-M223 VanDerWaalsContact O-CB 3.28Å; D219-M223 WeakPolarHBondContact O-CB 3.38Å; D219-M223 PolarHBondContact O-N 3.47Å; A220-M223 PolarHBondContact O-N 2.68Å; M223-V226 HydrophobicContact CE-CB 4.49Å; M223-V226 HydrophobicContact CE-CG1 4.17Å; M223-V226 PolarHBondContact O-N 3.26Å; M223-V227 HydrophobicContact CE-CG2 3.37Å; M223-V227 WeakPolarHBondContact O-CG2 3.24Å; M223-V227 PolarHBondContact O-N 3.27Å; M223-V243 HydrophobicContact CE-CG1 4.44Å; M223-W255 HydrophobicContact CB-CE3 4.1Å; M223-W255 HydrophobicContact CB-CZ3 4.24Å; M223-W255 HydrophobicContact CG-CE3 4.05Å; M223-W255 HydrophobicContact CG-CZ3 4.36Å; M223-A256 HydrophobicContact CE-CB 3.83Å; M223-A256 HydrophobicContact CG-CB 3.73Å; M223-A256 HydrophobicContact SD-CB 4.23Å
224	D	98.6	Very high	97.7	Very high	10 Å²	10	22.3 Å²	22.3	5%	0.053	10%	0.099	C	C	.	.	H	α-helix	trans	-55.3	-54.4	176.3	-173	40.9	0	0	0	112.1	A220 N221 A222 V226 V227 Q228 W255 Y260	A220-D224 WeakPolarHBondContact O-CB 3.49Å; A220-D224 PolarHBondContact O-N 3.32Å; N221-D224 WeakPolarHBondContact O-CB 3.37Å; A222-D224 VanDerWaalsContact C-N 3.28Å; A222-D224 PolarHBondContact O-N 2.86Å; D224-V226 VanDerWaalsContact C-N 3.28Å; D224-V226 PolarHBondContact O-N 3.44Å; D224-V227 PolarHBondContact O-N 2.94Å; D224-Q228 WeakPolarHBondContact O-CG 3.29Å; D224-Q228 PolarHBondContact O-N 3.17Å; D224-Q228 PolarHBondContact OD1-NE2 3.47Å; D224-Q228 PolarHBondContact OD2-NE2 2.97Å; D224-W255 HydrophobicContact CB-CH2 3.82Å; D224-W255 HydrophobicContact CB-CZ3 4.1Å; D224-Y260 PolarHBondContact OD1-OH 3.37Å
225	V	98.6	Very high	97.9	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.9	-30.5	179.8	68.4	0	0	0	0	112.1	F33 W35 L145 A147 I153 N221 A222 Y229	F33-V225 HydrophobicContact CD1-CG2 3.81Å; F33-V225 HydrophobicContact CE1-CG2 4.15Å; W35-V225 HydrophobicContact CB-CB 4.28Å; W35-V225 HydrophobicContact CB-CG2 4.25Å; L145-V225 HydrophobicContact CB-CG1 4.08Å; L145-V225 HydrophobicContact CB-CG2 4Å; A147-V225 HydrophobicContact CB-CG1 4Å; I153-V225 HydrophobicContact CG1-CG1 4.44Å; N221-V225 PolarHBondContact O-N 3.19Å; A222-V225 WeakPolarHBondContact O-CG1 3.44Å; A222-V225 PolarHBondContact O-N 3.05Å; V225-Y229 VanDerWaalsContact O-CB 3.23Å; V225-Y229 WeakPolarHBondContact O-CB 3.47Å; V225-Y229 PolarHBondContact O-N 2.76Å
226	V	98.8	Very high	98	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-45.7	174.5	169.8	0	0	0	0	111.4	L145 I153 T155 I175 L200 W202 A222 M223 D224 Y229 A230	L145-V226 HydrophobicContact CD1-CB 4.47Å; L145-V226 HydrophobicContact CD1-CG2 3.87Å; I153-V226 HydrophobicContact CG2-CG2 4.41Å; T155-V226 HydrophobicContact CG2-CG2 4.29Å; I175-V226 HydrophobicContact CD1-CG1 4.46Å; I175-V226 HydrophobicContact CG2-CG1 3.66Å; L200-V226 HydrophobicContact CD2-CG1 3.76Å; L200-V226 HydrophobicContact CG-CG1 4.34Å; W202-V226 HydrophobicContact CB-CG2 3.95Å; W202-V226 HydrophobicContact CD2-CG2 4.11Å; W202-V226 HydrophobicContact CE3-CG2 4.45Å; W202-V226 HydrophobicContact CG-CG1 4.31Å; W202-V226 HydrophobicContact CG-CG2 3.88Å; A222-V226 VanDerWaalsContact O-CG2 3.24Å; A222-V226 WeakPolarHBondContact O-CG2 3.3Å; A222-V226 PolarHBondContact O-N 3.03Å; A222-V226 VanDerWaalsContact O-N 3.09Å; M223-V226 HydrophobicContact CE-CB 4.49Å; M223-V226 HydrophobicContact CE-CG1 4.17Å; M223-V226 PolarHBondContact O-N 3.26Å; D224-V226 VanDerWaalsContact C-N 3.28Å; D224-V226 PolarHBondContact O-N 3.44Å; V226-Y229 PolarHBondContact O-N 2.62Å; V226-A230 PolarHBondContact O-N 3.49Å; V226-A230 VanDerWaalsContact O-N 3.07Å
227	V	98.7	Very high	98	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.8	-47.3	175.2	176.7	0	0	0	0	110.4	I175 M223 D224 Y229 A230 L231 A256 Y260 L263	I175-V227 HydrophobicContact CD1-CG2 4.38Å; M223-V227 HydrophobicContact CE-CG2 3.37Å; M223-V227 WeakPolarHBondContact O-CG2 3.24Å; M223-V227 PolarHBondContact O-N 3.27Å; D224-V227 PolarHBondContact O-N 2.94Å; V227-Y229 VanDerWaalsContact C-N 3.29Å; V227-Y229 PolarHBondContact O-N 3.1Å; V227-A230 WeakPolarHBondContact O-CB 3.34Å; V227-A230 PolarHBondContact O-N 3.06Å; V227-A230 VanDerWaalsContact O-N 3.11Å; V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.16Å; V227-L231 WeakPolarHBondContact O-CG 3.48Å; V227-L231 PolarHBondContact O-N 3.45Å; V227-A256 HydrophobicContact CG2-CB 4.18Å; V227-Y260 HydrophobicContact CB-CD2 4.23Å; V227-Y260 HydrophobicContact CB-CE2 3.98Å; V227-Y260 HydrophobicContact CG1-CD1 3.88Å; V227-Y260 HydrophobicContact CG1-CD2 3.81Å; V227-Y260 HydrophobicContact CG1-CE1 3.92Å; V227-Y260 HydrophobicContact CG1-CE2 3.89Å; V227-Y260 HydrophobicContact CG1-CG 3.82Å; V227-Y260 HydrophobicContact CG2-CD2 4.25Å; V227-Y260 HydrophobicContact CG2-CE2 4.3Å; V227-L263 HydrophobicContact CG1-CD1 4.5Å; V227-L263 HydrophobicContact CG1-CD2 4.32Å
228	Q	98.3	Very high	98	Very high	19 Å²	19	30.4 Å²	30.4	9%	0.089	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-40.1	179.1	-71.2	-179.9	40	0	0	112.1	F33 W35 D224 A230 L231 H232 Y260	F33-Q228 HydrophobicContact CE1-CB 3.72Å; F33-Q228 HydrophobicContact CZ-CB 4.05Å; W35-Q228 PolarHBondContact O-OE1 3.17Å; W35-Q228 VanDerWaalsContact O-OE1 3.13Å; D224-Q228 WeakPolarHBondContact O-CG 3.29Å; D224-Q228 PolarHBondContact O-N 3.17Å; D224-Q228 PolarHBondContact OD1-NE2 3.47Å; D224-Q228 PolarHBondContact OD2-NE2 2.97Å; Q228-A230 PolarHBondContact O-N 2.87Å; Q228-L231 PolarHBondContact O-N 2.94Å; Q228-H232 VanDerWaalsContact O-CB 3.31Å; Q228-H232 WeakPolarHBondContact O-CB 3.21Å; Q228-H232 PolarHBondContact O-CD2 3.23Å; Q228-H232 VanDerWaalsContact O-CD2 3.23Å; Q228-H232 PolarHBondContact O-N 3.31Å; Q228-Y260 WeakPolarHBondContact CG-OH 3.35Å
229	Y	98.6	Very high	97.9	Very high	20 Å²	20	30.9 Å²	30.9	8%	0.078	16%	0.159	C	C	.	.	I	π-helix	trans	-59.8	-45.8	174.1	178.9	-115.8	0	0	0	111.6	F33 A143 L145 L200 V225 V226 V227 L231 R233 L234	F33-Y229 HydrophobicContact CB-CD2 3.5Å; F33-Y229 HydrophobicContact CB-CE2 4.04Å; F33-Y229 HydrophobicContact CB-CG 4.45Å; F33-Y229 HydrophobicContact CD1-CD2 4.18Å; F33-Y229 HydrophobicContact CD2-CD2 4.29Å; F33-Y229 AromaticContact CG-CD2 3.76Å; F33-Y229 HydrophobicContact CG-CD2 3.76Å; A143-Y229 HydrophobicContact CB-CE1 4.32Å; L145-Y229 HydrophobicContact CD1-CD1 4.12Å; L145-Y229 HydrophobicContact CD1-CG 4.07Å; L145-Y229 HydrophobicContact CD2-CD1 3.94Å; L145-Y229 HydrophobicContact CD2-CD2 3.63Å; L145-Y229 HydrophobicContact CD2-CE1 4.25Å; L145-Y229 HydrophobicContact CD2-CE2 3.94Å; L145-Y229 HydrophobicContact CD2-CG 3.62Å; L200-Y229 HydrophobicContact CD1-CD1 4.46Å; L200-Y229 HydrophobicContact CD1-CE1 4.39Å; L200-Y229 HydrophobicContact CD2-CD1 4.2Å; V225-Y229 VanDerWaalsContact O-CB 3.23Å; V225-Y229 WeakPolarHBondContact O-CB 3.47Å; V225-Y229 PolarHBondContact O-N 2.76Å; V226-Y229 PolarHBondContact O-N 2.62Å; V227-Y229 VanDerWaalsContact C-N 3.29Å; V227-Y229 PolarHBondContact O-N 3.1Å; Y229-L231 PolarHBondContact O-N 2.78Å; Y229-R233 HydrophobicContact CD2-CB 3.56Å; Y229-R233 HydrophobicContact CD2-CG 3.75Å; Y229-R233 HydrophobicContact CE2-CB 3.79Å; Y229-R233 HydrophobicContact CE2-CG 3.43Å; Y229-R233 VanDerWaalsContact CE2-CG 3.43Å; Y229-R233 HydrophobicContact CG-CB 4.48Å; Y229-R233 WeakPolarHBondContact O-CA 3.21Å; Y229-R233 WeakPolarHBondContact O-CB 3.28Å; Y229-R233 PolarHBondContact O-N 3.22Å; Y229-L234 HydrophobicContact CD1-CD1 3.9Å; Y229-L234 HydrophobicContact CD1-CG 4.01Å; Y229-L234 HydrophobicContact CE1-CD1 3.64Å; Y229-L234 HydrophobicContact CE1-CD2 3.79Å; Y229-L234 HydrophobicContact CE1-CG 3.71Å; Y229-L234 HydrophobicContact CE2-CD2 4.37Å; Y229-L234 PolarHBondContact O-N 3.35Å
230	A	98.6	Very high	97.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	I	π-helix	trans	-59.7	-44.4	177	0	0	0	0	0	113.1	L173 I175 L200 V226 V227 Q228 L234 H235 F236	L173-A230 HydrophobicContact CD2-CB 3.48Å; L173-A230 VanDerWaalsContact CD2-CB 3.48Å; I175-A230 HydrophobicContact CD1-CB 4.01Å; L200-A230 HydrophobicContact CD2-CB 4.21Å; V226-A230 PolarHBondContact O-N 3.49Å; V226-A230 VanDerWaalsContact O-N 3.07Å; V227-A230 WeakPolarHBondContact O-CB 3.34Å; V227-A230 PolarHBondContact O-N 3.06Å; V227-A230 VanDerWaalsContact O-N 3.11Å; Q228-A230 PolarHBondContact O-N 2.87Å; A230-L234 CarbonylContact O-C 3.59Å; A230-L234 WeakPolarHBondContact O-CB 3.24Å; A230-H235 PolarHBondContact O-N 2.89Å; A230-F236 PolarHBondContact O-N 3.26Å; A230-F236 VanDerWaalsContact O-N 3.12Å
231	L	98	Very high	97.9	Very high	28 Å²	28	35 Å²	35	15%	0.147	18%	0.178	C	C	.	.	I	π-helix	trans	-77	-47	-176.6	-61.5	-178.3	0	0	0	112.3	V227 Q228 Y229 H235 F236 P238 V241 Y260 L263	V227-L231 HydrophobicContact CG1-CD1 3.82Å; V227-L231 HydrophobicContact CG1-CG 4.16Å; V227-L231 WeakPolarHBondContact O-CG 3.48Å; V227-L231 PolarHBondContact O-N 3.45Å; Q228-L231 PolarHBondContact O-N 2.94Å; Y229-L231 PolarHBondContact O-N 2.78Å; L231-H235 WeakPolarHBondContact O-CA 3.35Å; L231-F236 WeakPolarHBondContact CD2-O 3.32Å; L231-P238 HydrophobicContact CD1-CG 4.49Å; L231-P238 HydrophobicContact CD2-CB 4.33Å; L231-P238 HydrophobicContact CD2-CG 3.95Å; L231-V241 HydrophobicContact CD2-CG2 3.93Å; L231-Y260 HydrophobicContact CD1-CD1 4.39Å; L231-L263 HydrophobicContact CD2-CD2 4.45Å
232	H	97.2	Very high	98	Very high	79 Å²	79	34.3 Å²	34.3	37%	0.366	18%	0.175	S	C	.	.	I	π-helix	trans	-96.9	-28.9	-167	-59.7	-64	0	0	0	114	F33 V38 Q228 H235	F33-H232 HydrophobicContact CE2-CB 4.38Å; F33-H232 HydrophobicContact CZ-CB 4.32Å; V38-H232 HydrophobicContact CG2-CB 4.25Å; V38-H232 VanDerWaalsContact CG2-CD2 3.4Å; V38-H232 WeakPolarHBondContact CG2-CD2 3.28Å; Q228-H232 VanDerWaalsContact O-CB 3.31Å; Q228-H232 WeakPolarHBondContact O-CB 3.21Å; Q228-H232 PolarHBondContact O-CD2 3.23Å; Q228-H232 VanDerWaalsContact O-CD2 3.23Å; Q228-H232 PolarHBondContact O-N 3.31Å; H232-H235 PolarHBondContact O-CE1 3.27Å; H232-H235 PolarHBondContact O-ND1 3.37Å
233	R	97.2	Very high	98	Very high	153 Å²	153	34.3 Å²	34.3	58%	0.577	18%	0.175	S	C	*	.	I	π-helix	trans	-107.5	-37	-177.9	-174.8	57.9	173	-160	-0.1	113	F33 Y229 H235	F33-R233 HydrophobicContact CD2-CB 3.92Å; F33-R233 HydrophobicContact CD2-CG 4.39Å; F33-R233 HydrophobicContact CE2-CB 4.2Å; Y229-R233 HydrophobicContact CD2-CB 3.56Å; Y229-R233 HydrophobicContact CD2-CG 3.75Å; Y229-R233 HydrophobicContact CE2-CB 3.79Å; Y229-R233 HydrophobicContact CE2-CG 3.43Å; Y229-R233 VanDerWaalsContact CE2-CG 3.43Å; Y229-R233 HydrophobicContact CG-CB 4.48Å; Y229-R233 WeakPolarHBondContact O-CA 3.21Å; Y229-R233 WeakPolarHBondContact O-CB 3.28Å; Y229-R233 PolarHBondContact O-N 3.22Å; R233-H235 PolarHBondContact O-CD2 2.87Å
234	L	97.7	Very high	98	Very high	10 Å²	10	34.4 Å²	34.4	5%	0.052	18%	0.175	C	C	.	.	S	Bend	trans	-87.4	-12.5	174.1	-56.1	-175.8	0	0	0	112.8	F157 R161 L200 Y229 A230 F236	F157-L234 HydrophobicContact CB-CD1 4.39Å; F157-L234 HydrophobicContact CD1-CD1 3.73Å; F157-L234 HydrophobicContact CD1-CD2 3.56Å; F157-L234 HydrophobicContact CD1-CG 4.26Å; F157-L234 HydrophobicContact CD2-CD1 3.9Å; F157-L234 HydrophobicContact CE1-CB 4.49Å; F157-L234 HydrophobicContact CE1-CD1 3.91Å; F157-L234 HydrophobicContact CE1-CD2 3.72Å; F157-L234 HydrophobicContact CE1-CG 4.26Å; F157-L234 HydrophobicContact CE2-CD1 4.16Å; F157-L234 HydrophobicContact CG-CD1 3.74Å; F157-L234 HydrophobicContact CG-CD2 4.34Å; F157-L234 HydrophobicContact CZ-CD1 4.19Å; R161-L234 PolarHBondContact NH1-O 3.4Å; R161-L234 PolarHBondContact NH2-O 3.09Å; L200-L234 HydrophobicContact CD2-CD1 4.36Å; Y229-L234 HydrophobicContact CD1-CD1 3.9Å; Y229-L234 HydrophobicContact CD1-CG 4.01Å; Y229-L234 HydrophobicContact CE1-CD1 3.64Å; Y229-L234 HydrophobicContact CE1-CD2 3.79Å; Y229-L234 HydrophobicContact CE1-CG 3.71Å; Y229-L234 HydrophobicContact CE2-CD2 4.37Å; Y229-L234 PolarHBondContact O-N 3.35Å; A230-L234 CarbonylContact O-C 3.59Å; A230-L234 WeakPolarHBondContact O-CB 3.24Å; L234-F236 HydrophobicContact CB-CD2 3.84Å; L234-F236 HydrophobicContact CB-CE2 4.07Å; L234-F236 PolarHBondContact O-N 2.8Å
235	H	97.4	Very high	98	Very high	141 Å²	141	33.9 Å²	33.9	65%	0.653	17%	0.172	S	C	*	.			trans	59.6	39.4	175.5	-53.9	-64.5	0	0	0	113.9	A230 L231 H232 R233	A230-H235 PolarHBondContact O-N 2.89Å; L231-H235 WeakPolarHBondContact O-CA 3.35Å; H232-H235 PolarHBondContact O-CE1 3.27Å; H232-H235 PolarHBondContact O-ND1 3.37Å; R233-H235 PolarHBondContact O-CD2 2.87Å
236	F	97.9	Very high	98	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.039	18%	0.177	C	C	.	.			trans	-81.9	134.7	165.8	-75.2	-90.8	0	0	0	110	F157 R161 L173 A230 L231 L234 V241	F157-F236 HydrophobicContact CE1-CE2 4.48Å; F157-F236 AromaticContact CE2-CE2 3.93Å; F157-F236 HydrophobicContact CE2-CE2 3.93Å; F157-F236 HydrophobicContact CE2-CZ 4.19Å; F157-F236 AromaticContact CZ-CE2 3.57Å; F157-F236 HydrophobicContact CZ-CE2 3.57Å; F157-F236 AromaticContact CZ-CZ 3.91Å; F157-F236 HydrophobicContact CZ-CZ 3.91Å; R161-F236 HydrophobicContact CG-CE1 4.22Å; R161-F236 HydrophobicContact CG-CZ 4.21Å; L173-F236 HydrophobicContact CB-CB 4.47Å; L173-F236 HydrophobicContact CB-CD1 3.6Å; L173-F236 HydrophobicContact CB-CD2 4.02Å; L173-F236 HydrophobicContact CB-CE1 3.71Å; L173-F236 HydrophobicContact CB-CE2 4.11Å; L173-F236 HydrophobicContact CB-CG 3.76Å; L173-F236 HydrophobicContact CB-CZ 3.96Å; L173-F236 HydrophobicContact CD1-CE2 4.18Å; L173-F236 HydrophobicContact CD1-CZ 4.3Å; L173-F236 HydrophobicContact CD2-CD2 3.81Å; L173-F236 HydrophobicContact CD2-CE2 4.17Å; L173-F236 HydrophobicContact CD2-CG 4.14Å; L173-F236 HydrophobicContact CG-CD2 4.38Å; L173-F236 HydrophobicContact CG-CE2 4.4Å; A230-F236 PolarHBondContact O-N 3.26Å; A230-F236 VanDerWaalsContact O-N 3.12Å; L231-F236 WeakPolarHBondContact CD2-O 3.32Å; L234-F236 HydrophobicContact CB-CD2 3.84Å; L234-F236 HydrophobicContact CB-CE2 4.07Å; L234-F236 PolarHBondContact O-N 2.8Å; F236-V241 HydrophobicContact CB-CG2 3.75Å
237	S	96.8	Very high	97.9	Very high	63 Å²	63	35.4 Å²	35.4	44%	0.441	18%	0.179	S	C	.	.			trans	-64	140.6	168	173.9	0	0	0	0	109.6	A239 H240 V241	S237-A239 PolarHBondContact O-N 3.46Å; S237-A239 VanDerWaalsContact O-N 3.15Å; S237-H240 WeakPolarHBondContact O-CA 3.43Å; S237-H240 PolarHBondContact O-N 3Å; S237-V241 PolarHBondContact O-N 2.98Å
238	P	96.8	Very high	97.8	Very high	39 Å²	39	35.7 Å²	35.7	25%	0.253	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-49.1	-42.2	177.1	-28.3	34.4	0	0	0	113.4	L231 H240 V241 G262 L263 G264	L231-P238 HydrophobicContact CD1-CG 4.49Å; L231-P238 HydrophobicContact CD2-CB 4.33Å; L231-P238 HydrophobicContact CD2-CG 3.95Å; P238-H240 PolarHBondContact O-N 3.3Å; P238-H240 VanDerWaalsContact O-N 3.11Å; P238-V241 PolarHBondContact O-N 3.4Å; P238-G262 CarbonylContact C-O 3.57Å; P238-G262 VanDerWaalsContact CB-O 3.26Å; P238-G262 WeakPolarHBondContact CB-O 3.49Å; P238-L263 HydrophobicContact CB-CD2 4.48Å; P238-L263 CarbonylContact O-C 3.54Å; P238-L263 WeakPolarHBondContact O-CA 3.32Å; P238-G264 PolarHBondContact O-N 2.72Å
239	A	96.1	Very high	97.8	Very high	61 Å²	61	34.8 Å²	34.8	50%	0.504	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-63.9	-17.5	179.1	0	0	0	0	0	114.3	S237 G264	S237-A239 PolarHBondContact O-N 3.46Å; S237-A239 VanDerWaalsContact O-N 3.15Å; A239-G264 WeakPolarHBondContact O-CA 3.19Å
240	H	97.6	Very high	97.8	Very high	85 Å²	85	33.8 Å²	33.8	39%	0.394	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-100.6	1.4	176.5	-69.7	175	0	0	0	113.3	R172 L173 S237 P238	R172-H240 CarbonylContact C-O 3.59Å; R172-H240 VanDerWaalsContact CA-O 3.27Å; R172-H240 WeakPolarHBondContact CA-O 3.44Å; L173-H240 PolarHBondContact N-O 2.85Å; S237-H240 WeakPolarHBondContact O-CA 3.43Å; S237-H240 PolarHBondContact O-N 3Å; P238-H240 PolarHBondContact O-N 3.3Å; P238-H240 VanDerWaalsContact O-N 3.11Å
241	V	98.8	Very high	97.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.9	175.6	180	0	0	0	0	109.6	L173 I175 L231 F236 S237 P238 L263 G264 A265	L173-V241 HydrophobicContact CB-CG2 4.44Å; L173-V241 HydrophobicContact CD2-CG2 4.43Å; L173-V241 CarbonylContact O-C 3.54Å; L173-V241 WeakPolarHBondContact O-CA 3.48Å; I175-V241 HydrophobicContact CD1-CG1 3.63Å; I175-V241 HydrophobicContact CG1-CG1 4Å; L231-V241 HydrophobicContact CD2-CG2 3.93Å; F236-V241 HydrophobicContact CB-CG2 3.75Å; S237-V241 PolarHBondContact O-N 2.98Å; P238-V241 PolarHBondContact O-N 3.4Å; V241-L263 HydrophobicContact CB-CD2 3.83Å; V241-L263 HydrophobicContact CG1-CD2 3.89Å; V241-L263 HydrophobicContact CG2-CD2 4.49Å; V241-G264 WeakPolarHBondContact O-CA 3.27Å; V241-G264 PolarHBondContact O-N 2.86Å; V241-A265 PolarHBondContact O-N 2.92Å
242	V	98.8	Very high	97.8	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.024	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.4	175.2	-179.1	0	0	0	0	107.3	L173 V174 I175 A265 V267 L465	L173-V242 PolarHBondContact O-N 2.77Å; V174-V242 CarbonylContact C-O 3.59Å; V174-V242 WeakPolarHBondContact CA-O 3.46Å; V174-V242 HydrophobicContact CG2-CB 4.28Å; I175-V242 PolarHBondContact N-O 2.91Å; V242-A265 WeakPolarHBondContact CA-O 3.49Å; V242-A265 HydrophobicContact CG1-CB 4.07Å; V242-A265 HydrophobicContact CG2-CB 4.09Å; V242-V267 HydrophobicContact CG1-CG2 4.17Å; V242-L465 HydrophobicContact CB-CD2 4.44Å; V242-L465 HydrophobicContact CG1-CD2 4.03Å; V242-L465 HydrophobicContact CG2-CD2 3.7Å
243	V	98.9	Very high	97.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.2	173.9	-163.8	0	0	0	0	108.6	M223 A253 A256 T257 L263 A265 L266 V267	M223-V243 HydrophobicContact CE-CG1 4.44Å; V243-A253 HydrophobicContact CG1-CB 3.68Å; V243-A256 HydrophobicContact CG1-CB 4.35Å; V243-A256 HydrophobicContact CG2-CB 4.33Å; V243-T257 HydrophobicContact CB-CG2 4.12Å; V243-T257 HydrophobicContact CG2-CG2 3.82Å; V243-L263 HydrophobicContact CG2-CD1 3.64Å; V243-A265 PolarHBondContact N-O 3.28Å; V243-L266 HydrophobicContact CB-CD1 4.27Å; V243-L266 WeakPolarHBondContact O-CA 3.34Å; V243-V267 PolarHBondContact O-N 2.9Å
244	Y	98.9	Very high	98	Very high	1 Å²	1	21.5 Å²	21.5	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112.6	-177.6	175	-139.4	0	0	0	110	V174 I175 C177 C188 P192 V267 D269 L458 F463	V174-Y244 HydrophobicContact CG1-CD1 4.46Å; V174-Y244 HydrophobicContact CG1-CG 4.43Å; I175-Y244 PolarHBondContact O-N 2.94Å; C177-Y244 PolarHBondContact N-O 2.89Å; C188-Y244 HydrophobicContact CB-CD1 4.39Å; C188-Y244 HydrophobicContact CB-CE1 3.67Å; C188-Y244 WeakPolarHBondContact O-CE1 3.41Å; P192-Y244 HydrophobicContact CG-CD1 4.26Å; Y244-V267 WeakPolarHBondContact CA-O 3.43Å; Y244-V267 HydrophobicContact CD2-CB 3.85Å; Y244-V267 HydrophobicContact CD2-CG1 3.76Å; Y244-V267 WeakPolarHBondContact CD2-O 3.5Å; Y244-V267 HydrophobicContact CE2-CG1 4Å; Y244-D269 HydrophobicContact CE2-CB 3.58Å; Y244-D269 WeakPolarHBondContact OH-CB 3.48Å; Y244-D269 PolarHBondContact OH-OD2 3.06Å; Y244-D269 VanDerWaalsContact OH-OD2 3.06Å; Y244-L458 WeakPolarHBondContact OH-CD2 3.4Å; Y244-F463 HydrophobicContact CD1-CD2 4.32Å; Y244-F463 AromaticContact CD1-CE2 3.83Å; Y244-F463 HydrophobicContact CD1-CE2 3.83Å; Y244-F463 HydrophobicContact CD2-CD2 4.46Å; Y244-F463 AromaticContact CD2-CE2 3.88Å; Y244-F463 HydrophobicContact CD2-CE2 3.88Å; Y244-F463 HydrophobicContact CE1-CD2 4.25Å; Y244-F463 HydrophobicContact CE1-CE2 4.21Å; Y244-F463 HydrophobicContact CE2-CD2 4.4Å; Y244-F463 HydrophobicContact CE2-CE2 4.27Å; Y244-F463 HydrophobicContact CG-CD2 4.43Å; Y244-F463 AromaticContact CG-CE2 3.66Å; Y244-F463 HydrophobicContact CG-CE2 3.66Å
245	G	98.5	Very high	98	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.5	-180	0	0	0	0	0	112.5	V267 L268 D269	G245-V267 PolarHBondContact N-O 3.21Å; G245-L268 WeakPolarHBondContact O-CA 3.19Å; G245-D269 PolarHBondContact O-N 2.83Å
246	W	98.3	Very high	98.1	Very high	27 Å²	27	14.5 Å²	14.5	10%	0.102	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.9	171.9	172.7	59.8	0	0	0	110.9	C177 G179 C188 V248 G249 D269 H454 F455	C177-W246 PolarHBondContact O-N 2.95Å; G179-W246 WeakPolarHBondContact CA-O 3.17Å; G179-W246 VanDerWaalsContact N-CE3 3.3Å; C188-W246 HydrophobicContact CB-CB 3.74Å; C188-W246 HydrophobicContact CB-CG 4.31Å; W246-V248 PolarHBondContact O-N 2.87Å; W246-G249 WeakPolarHBondContact O-CA 3.47Å; W246-G249 PolarHBondContact O-N 2.71Å; W246-D269 WeakPolarHBondContact CA-O 3.36Å; W246-H454 AromaticContact CZ2-CD2 3.96Å; W246-H454 AromaticContact CZ2-NE2 3.98Å; W246-H454 PolarHBondContact NE1-O 3.16Å; W246-F455 HydrophobicContact CH2-CD1 4.26Å; W246-F455 HydrophobicContact CZ2-CD1 4.19Å
247	S	97.3	Very high	98.1	Very high	4 Å²	4	14 Å²	14	3%	0.028	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	-122.1	176.4	-169.8	0	0	0	0	112.1	G249 G250 D269 A270 T271 H454	S247-G249 PolarHBondContact O-N 3.16Å; S247-G250 PolarHBondContact O-N 3.33Å; S247-D269 PolarHBondContact N-O 3.14Å; S247-A270 WeakPolarHBondContact CA-O 3.3Å; S247-T271 WeakPolarHBondContact O-CB 3.49Å; S247-T271 PolarHBondContact O-OG1 3.35Å; S247-H454 WeakPolarHBondContact CB-NE2 3.34Å; S247-H454 PolarHBondContact OG-CE1 2.82Å; S247-H454 VanDerWaalsContact OG-CE1 3.25Å; S247-H454 PolarHBondContact OG-NE2 2.85Å
248	V	97.3	Very high	98.1	Very high	6 Å²	6	12.5 Å²	12.5	4%	0.036	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-29.2	174.8	168.2	0	0	0	0	113.2	Y112 N180 W246 G250 F251 F272 L301	Y112-V248 HydrophobicContact CD1-CG1 4.48Å; Y112-V248 HydrophobicContact CE1-CG1 3.73Å; N180-V248 HydrophobicContact CB-CB 4.11Å; N180-V248 HydrophobicContact CB-CG1 4.5Å; N180-V248 HydrophobicContact CB-CG2 3.84Å; W246-V248 PolarHBondContact O-N 2.87Å; V248-G250 PolarHBondContact O-N 3.38Å; V248-G250 VanDerWaalsContact O-N 3.07Å; V248-F251 WeakPolarHBondContact O-CB 3.46Å; V248-F251 PolarHBondContact O-N 2.94Å; V248-F272 HydrophobicContact CG2-CE1 3.99Å; V248-F272 HydrophobicContact CG2-CZ 4.13Å; V248-L301 HydrophobicContact CG1-CD1 4.12Å; V248-L301 HydrophobicContact CG2-CD1 4.46Å
249	G	98.1	Very high	98.1	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.2	-12.8	172.6	0	0	0	0	0	113.9	C177 E178 W246 S247 F251 T252 A253	C177-G249 WeakPolarHBondContact CB-O 3.36Å; E178-G249 WeakPolarHBondContact O-CA 3.37Å; E178-G249 PolarHBondContact O-N 3Å; W246-G249 WeakPolarHBondContact O-CA 3.47Å; W246-G249 PolarHBondContact O-N 2.71Å; S247-G249 PolarHBondContact O-N 3.16Å; G249-F251 PolarHBondContact O-N 3.25Å; G249-T252 PolarHBondContact O-N 3.48Å; G249-T252 PolarHBondContact O-OG1 2.85Å; G249-A253 WeakPolarHBondContact O-CB 3.45Å; G249-A253 PolarHBondContact O-N 2.77Å
250	G	98.4	Very high	98.1	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-57.2	-36.3	167.6	0	0	0	0	0	112.7	S247 V248 A253 T254	S247-G250 PolarHBondContact O-N 3.33Å; V248-G250 PolarHBondContact O-N 3.38Å; V248-G250 VanDerWaalsContact O-N 3.07Å; G250-A253 PolarHBondContact O-N 3Å; G250-T254 WeakPolarHBondContact O-CG2 3.24Å; G250-T254 PolarHBondContact O-N 2.84Å; G250-T254 PolarHBondContact O-OG1 2.85Å
251	F	98.6	Very high	98	Very high	1 Å²	1	7.8 Å²	7.8	0%	0.004	4%	0.041	C	C	.	.	H	α-helix	trans	-62.7	-49.1	176.7	170.4	-96	0	0	0	112.3	P216 D219 V248 G249 A253 T254 W255 L301 V303 Q306	P216-F251 HydrophobicContact CB-CE1 3.87Å; P216-F251 HydrophobicContact CB-CE2 4.36Å; P216-F251 HydrophobicContact CB-CZ 3.6Å; P216-F251 WeakPolarHBondContact O-CE1 3.43Å; D219-F251 HydrophobicContact CB-CE1 4.44Å; V248-F251 WeakPolarHBondContact O-CB 3.46Å; V248-F251 PolarHBondContact O-N 2.94Å; G249-F251 PolarHBondContact O-N 3.25Å; F251-A253 VanDerWaalsContact C-N 3.31Å; F251-A253 PolarHBondContact O-N 2.75Å; F251-T254 PolarHBondContact O-N 2.81Å; F251-T254 PolarHBondContact O-OG1 2.7Å; F251-W255 VanDerWaalsContact O-CB 3.23Å; F251-W255 WeakPolarHBondContact O-CB 3.48Å; F251-W255 PolarHBondContact O-N 2.94Å; F251-L301 HydrophobicContact CB-CB 4.38Å; F251-L301 HydrophobicContact CB-CD2 4.16Å; F251-L301 HydrophobicContact CD1-CD2 3.99Å; F251-L301 HydrophobicContact CD2-CB 4.06Å; F251-L301 HydrophobicContact CD2-CD2 3.79Å; F251-L301 HydrophobicContact CE1-CD2 4.37Å; F251-L301 HydrophobicContact CE2-CD2 4.12Å; F251-L301 HydrophobicContact CG-CB 4.4Å; F251-L301 HydrophobicContact CG-CD2 3.7Å; F251-L301 HydrophobicContact CZ-CD2 4.43Å; F251-V303 HydrophobicContact CB-CG2 4.18Å; F251-Q306 PolarHBondContact O-OE1 3.02Å
252	T	98.3	Very high	97.8	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-68.2	-35.3	179.1	46.6	0	0	0	0	111.4	C177 W202 D219 G249 W255 A256	C177-T252 VanDerWaalsContact CB-OG1 3.29Å; C177-T252 WeakPolarHBondContact CB-OG1 3.46Å; C177-T252 PolarHBondContact SG-OG1 3.49Å; W202-T252 HydrophobicContact CH2-CG2 3.89Å; W202-T252 HydrophobicContact CZ2-CG2 4.02Å; D219-T252 HydrophobicContact CB-CG2 3.63Å; G249-T252 PolarHBondContact O-N 3.48Å; G249-T252 PolarHBondContact O-OG1 2.85Å; T252-W255 PolarHBondContact O-N 2.78Å; T252-A256 WeakPolarHBondContact O-CB 3.43Å; T252-A256 PolarHBondContact O-N 3.48Å
253	A	98.8	Very high	97.7	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-65.4	-45.2	176.4	0	0	0	0	0	113	C177 V243 G249 G250 F251 A256 T257 L266 L268	C177-A253 HydrophobicContact CB-CB 4.46Å; V243-A253 HydrophobicContact CG1-CB 3.68Å; G249-A253 WeakPolarHBondContact O-CB 3.45Å; G249-A253 PolarHBondContact O-N 2.77Å; G250-A253 PolarHBondContact O-N 3Å; F251-A253 VanDerWaalsContact C-N 3.31Å; F251-A253 PolarHBondContact O-N 2.75Å; A253-A256 PolarHBondContact O-N 3.11Å; A253-T257 PolarHBondContact O-N 3.32Å; A253-T257 VanDerWaalsContact O-N 3.17Å; A253-T257 PolarHBondContact O-OG1 3Å; A253-L266 HydrophobicContact CB-CD1 3.77Å; A253-L268 HydrophobicContact CB-CD2 3.98Å
254	T	98.8	Very high	97.6	Very high	0 Å²	0	9 Å²	9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-69.4	-36.2	175	51	0	0	0	0	112	G250 F251 A256 T257 M258 L266 L268 V303 Q306 L307	G250-T254 WeakPolarHBondContact O-CG2 3.24Å; G250-T254 PolarHBondContact O-N 2.84Å; G250-T254 PolarHBondContact O-OG1 2.85Å; F251-T254 PolarHBondContact O-N 2.81Å; F251-T254 PolarHBondContact O-OG1 2.7Å; T254-A256 PolarHBondContact O-N 3.1Å; T254-T257 WeakPolarHBondContact CA-OG1 3.42Å; T254-T257 PolarHBondContact O-N 2.87Å; T254-T257 PolarHBondContact O-OG1 3.41Å; T254-M258 VanDerWaalsContact O-CB 3.23Å; T254-M258 WeakPolarHBondContact O-CB 3.4Å; T254-M258 PolarHBondContact O-N 3Å; T254-L266 HydrophobicContact CG2-CD2 4.02Å; T254-L268 HydrophobicContact CG2-CD1 3.9Å; T254-L268 HydrophobicContact CG2-CD2 4.3Å; T254-V303 HydrophobicContact CG2-CG1 3.69Å; T254-Q306 PolarHBondContact OG1-OE1 2.98Å; T254-L307 HydrophobicContact CG2-CB 3.9Å; T254-L307 HydrophobicContact CG2-CD1 4.44Å
255	W	98.6	Very high	97.6	Very high	4 Å²	4	9.3 Å²	9.3	2%	0.015	6%	0.057	C	C	.	.	H	α-helix	trans	-62.6	-43.6	175	-176.3	94.7	0	0	0	111.6	A55 A220 M223 D224 F251 T252 T259	A55-W255 HydrophobicContact CB-CZ2 3.75Å; A220-W255 HydrophobicContact CB-CD2 3.86Å; A220-W255 VanDerWaalsContact CB-CE2 3.48Å; A220-W255 HydrophobicContact CB-CE3 4.46Å; A220-W255 HydrophobicContact CB-CG 4.22Å; A220-W255 HydrophobicContact CB-CH2 4.44Å; A220-W255 HydrophobicContact CB-CZ2 3.78Å; A220-W255 WeakPolarHBondContact O-CH2 3.43Å; A220-W255 WeakPolarHBondContact O-CZ3 3.46Å; M223-W255 HydrophobicContact CB-CE3 4.1Å; M223-W255 HydrophobicContact CB-CZ3 4.24Å; M223-W255 HydrophobicContact CG-CE3 4.05Å; M223-W255 HydrophobicContact CG-CZ3 4.36Å; D224-W255 HydrophobicContact CB-CH2 3.82Å; D224-W255 HydrophobicContact CB-CZ3 4.1Å; F251-W255 VanDerWaalsContact O-CB 3.23Å; F251-W255 WeakPolarHBondContact O-CB 3.48Å; F251-W255 PolarHBondContact O-N 2.94Å; T252-W255 PolarHBondContact O-N 2.78Å; W255-T259 HydrophobicContact CH2-CG2 4.05Å; W255-T259 HydrophobicContact CZ2-CG2 4.4Å; W255-T259 HydrophobicContact CZ3-CG2 4.41Å; W255-T259 VanDerWaalsContact O-CB 3.3Å; W255-T259 WeakPolarHBondContact O-CB 3.34Å; W255-T259 PolarHBondContact O-N 3.47Å; W255-T259 PolarHBondContact O-OG1 3.37Å
256	A	98.6	Very high	97.6	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.6	-47.8	177.8	0	0	0	0	0	111.3	M223 V227 V243 T252 A253 T254 T259 Y260	M223-A256 HydrophobicContact CE-CB 3.83Å; M223-A256 HydrophobicContact CG-CB 3.73Å; M223-A256 HydrophobicContact SD-CB 4.23Å; V227-A256 HydrophobicContact CG2-CB 4.18Å; V243-A256 HydrophobicContact CG1-CB 4.35Å; V243-A256 HydrophobicContact CG2-CB 4.33Å; T252-A256 WeakPolarHBondContact O-CB 3.43Å; T252-A256 PolarHBondContact O-N 3.48Å; A253-A256 PolarHBondContact O-N 3.11Å; T254-A256 PolarHBondContact O-N 3.1Å; A256-T259 PolarHBondContact O-N 2.91Å; A256-Y260 WeakPolarHBondContact O-CA 3.4Å; A256-Y260 WeakPolarHBondContact O-CB 3.3Å; A256-Y260 WeakPolarHBondContact O-CD2 3.21Å; A256-Y260 PolarHBondContact O-N 3Å
257	T	97.9	Very high	97.6	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-75.7	-28.8	-176.3	49.7	0	0	0	0	113.4	V243 A253 T254 Y260 P261 L263 L266 Y310	V243-T257 HydrophobicContact CB-CG2 4.12Å; V243-T257 HydrophobicContact CG2-CG2 3.82Å; A253-T257 PolarHBondContact O-N 3.32Å; A253-T257 VanDerWaalsContact O-N 3.17Å; A253-T257 PolarHBondContact O-OG1 3Å; T254-T257 WeakPolarHBondContact CA-OG1 3.42Å; T254-T257 PolarHBondContact O-N 2.87Å; T254-T257 PolarHBondContact O-OG1 3.41Å; T257-Y260 CarbonylContact O-C 3.59Å; T257-P261 WeakPolarHBondContact O-CA 3.2Å; T257-L263 HydrophobicContact CG2-CD1 4.28Å; T257-L266 HydrophobicContact CG2-CB 4.19Å; T257-L266 HydrophobicContact CG2-CD1 4.04Å; T257-Y310 HydrophobicContact CG2-CD2 4.35Å; T257-Y310 HydrophobicContact CG2-CE1 4.47Å; T257-Y310 HydrophobicContact CG2-CE2 4.27Å; T257-Y310 HydrophobicContact CG2-CG 4.5Å; T257-Y310 WeakPolarHBondContact O-CD2 3.41Å
258	M	96.9	Very high	97.7	Very high	30 Å²	30	7.9 Å²	7.9	15%	0.148	5%	0.051	C	C	.	.	H	α-helix	trans	-64.7	-43.1	166.5	174.1	-179.1	76.2	0	0	111.8	L62 T254 Q306 C309	L62-M258 HydrophobicContact CD1-SD 4.39Å; T254-M258 VanDerWaalsContact O-CB 3.23Å; T254-M258 WeakPolarHBondContact O-CB 3.4Å; T254-M258 PolarHBondContact O-N 3Å; M258-Q306 HydrophobicContact CE-CG 4.13Å; M258-Q306 HydrophobicContact SD-CB 4.14Å; M258-Q306 HydrophobicContact SD-CG 3.99Å; M258-C309 HydrophobicContact CB-CB 4.08Å; M258-C309 HydrophobicContact CG-CB 3.55Å; M258-C309 HydrophobicContact SD-CB 4.1Å
259	T	97	Very high	97.8	Very high	4 Å²	4	7.6 Å²	7.6	3%	0.025	5%	0.05	C	C	.	.	H	α-helix	trans	-78.6	-32.8	-176	-56.1	0	0	0	0	112.5	L50 W255 A256 P261	L50-T259 HydrophobicContact CB-CG2 4.44Å; W255-T259 HydrophobicContact CH2-CG2 4.05Å; W255-T259 HydrophobicContact CZ2-CG2 4.4Å; W255-T259 HydrophobicContact CZ3-CG2 4.41Å; W255-T259 VanDerWaalsContact O-CB 3.3Å; W255-T259 WeakPolarHBondContact O-CB 3.34Å; W255-T259 PolarHBondContact O-N 3.47Å; W255-T259 PolarHBondContact O-OG1 3.37Å; A256-T259 PolarHBondContact O-N 2.91Å; T259-P261 VanDerWaalsContact C-CD 3.47Å; T259-P261 VanDerWaalsContact O-CD 3.32Å; T259-P261 WeakPolarHBondContact O-CD 3.42Å
260	Y	96.7	Very high	97.7	Very high	23 Å²	23	7.7 Å²	7.7	9%	0.09	5%	0.05	C	C	.	.	S	Bend	trans	-119.1	74.8	178.8	-62.2	-90.7	0	0	0	109.4	A49 D224 V227 Q228 L231 A256 T257 G262 L263	A49-Y260 HydrophobicContact CB-CE1 3.82Å; D224-Y260 PolarHBondContact OD1-OH 3.37Å; V227-Y260 HydrophobicContact CB-CD2 4.23Å; V227-Y260 HydrophobicContact CB-CE2 3.98Å; V227-Y260 HydrophobicContact CG1-CD1 3.88Å; V227-Y260 HydrophobicContact CG1-CD2 3.81Å; V227-Y260 HydrophobicContact CG1-CE1 3.92Å; V227-Y260 HydrophobicContact CG1-CE2 3.89Å; V227-Y260 HydrophobicContact CG1-CG 3.82Å; V227-Y260 HydrophobicContact CG2-CD2 4.25Å; V227-Y260 HydrophobicContact CG2-CE2 4.3Å; Q228-Y260 WeakPolarHBondContact CG-OH 3.35Å; L231-Y260 HydrophobicContact CD1-CD1 4.39Å; A256-Y260 WeakPolarHBondContact O-CA 3.4Å; A256-Y260 WeakPolarHBondContact O-CB 3.3Å; A256-Y260 WeakPolarHBondContact O-CD2 3.21Å; A256-Y260 PolarHBondContact O-N 3Å; T257-Y260 CarbonylContact O-C 3.59Å; Y260-G262 PolarHBondContact O-N 3.01Å; Y260-L263 VanDerWaalsContact O-CG 3.31Å; Y260-L263 WeakPolarHBondContact O-CG 3.33Å; Y260-L263 PolarHBondContact O-N 2.92Å; Y260-L263 VanDerWaalsContact O-N 3.1Å
261	P	94	Very high	97.7	Very high	59 Å²	59	8 Å²	8	38%	0.383	5%	0.052	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-5.6	-172.2	27.7	-36.7	0	0	0	114.6	T257 T259 P311 H418	T257-P261 WeakPolarHBondContact O-CA 3.2Å; T259-P261 VanDerWaalsContact C-CD 3.47Å; T259-P261 VanDerWaalsContact O-CD 3.32Å; T259-P261 WeakPolarHBondContact O-CD 3.42Å; P261-P311 HydrophobicContact CB-CG 4.05Å; P261-H418 PolarHBondContact O-CD2 2.92Å; P261-H418 PolarHBondContact O-NE2 2.89Å; P261-H418 VanDerWaalsContact O-NE2 3.12Å
262	G	94.8	Very high	97.6	Very high	15 Å²	15	8.1 Å²	8.1	16%	0.155	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	4.9	173.9	0	0	0	0	0	115.3	P238 Y260 P417	P238-G262 CarbonylContact C-O 3.57Å; P238-G262 VanDerWaalsContact CB-O 3.26Å; P238-G262 WeakPolarHBondContact CB-O 3.49Å; Y260-G262 PolarHBondContact O-N 3.01Å; G262-P417 VanDerWaalsContact CA-CG 3.48Å
263	L	97.8	Very high	97.6	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.005	6%	0.056	C	C	.	.	S	Bend	trans	-64.1	143.8	170.6	-63.3	178.4	0	0	0	110.1	V227 L231 P238 V241 V243 T257 Y260 A265 Y310 H418	V227-L263 HydrophobicContact CG1-CD1 4.5Å; V227-L263 HydrophobicContact CG1-CD2 4.32Å; L231-L263 HydrophobicContact CD2-CD2 4.45Å; P238-L263 HydrophobicContact CB-CD2 4.48Å; P238-L263 CarbonylContact O-C 3.54Å; P238-L263 WeakPolarHBondContact O-CA 3.32Å; V241-L263 HydrophobicContact CB-CD2 3.83Å; V241-L263 HydrophobicContact CG1-CD2 3.89Å; V241-L263 HydrophobicContact CG2-CD2 4.49Å; V243-L263 HydrophobicContact CG2-CD1 3.64Å; T257-L263 HydrophobicContact CG2-CD1 4.28Å; Y260-L263 VanDerWaalsContact O-CG 3.31Å; Y260-L263 WeakPolarHBondContact O-CG 3.33Å; Y260-L263 PolarHBondContact O-N 2.92Å; Y260-L263 VanDerWaalsContact O-N 3.1Å; L263-A265 PolarHBondContact O-N 3.07Å; L263-Y310 PolarHBondContact O-OH 2.97Å; L263-H418 PolarHBondContact O-CE1 3.16Å; L263-H418 PolarHBondContact O-NE2 3.35Å
264	G	97.1	Very high	97.4	Very high	15 Å²	15	9.7 Å²	9.7	16%	0.155	6%	0.061	C	C	.	.	S	Bend	trans	-67.9	-35.7	-166	0	0	0	0	0	116.1	P238 A239 V241 P313	P238-G264 PolarHBondContact O-N 2.72Å; A239-G264 WeakPolarHBondContact O-CA 3.19Å; V241-G264 WeakPolarHBondContact O-CA 3.27Å; V241-G264 PolarHBondContact O-N 2.86Å; G264-P313 WeakPolarHBondContact O-CD 3.48Å
265	A	98	Very high	97.3	Very high	7 Å²	7	10.5 Å²	10.5	6%	0.058	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	158.1	-178.3	0	0	0	0	0	113.2	V241 V242 V243 L263 Y310 P466	V241-A265 PolarHBondContact O-N 2.92Å; V242-A265 WeakPolarHBondContact CA-O 3.49Å; V242-A265 HydrophobicContact CG1-CB 4.07Å; V242-A265 HydrophobicContact CG2-CB 4.09Å; V243-A265 PolarHBondContact N-O 3.28Å; L263-A265 PolarHBondContact O-N 3.07Å; A265-Y310 VanDerWaalsContact CA-OH 3.26Å; A265-Y310 WeakPolarHBondContact CA-OH 3.41Å; A265-Y310 PolarHBondContact N-OH 3.16Å; A265-P466 HydrophobicContact CB-CG 3.85Å
266	L	98.8	Very high	97.1	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.1	172.8	-179.1	62.1	0	0	0	110.4	V243 A253 T254 T257 L268 L307 Y310 P313 V314 L315 P466	V243-L266 HydrophobicContact CB-CD1 4.27Å; V243-L266 WeakPolarHBondContact O-CA 3.34Å; A253-L266 HydrophobicContact CB-CD1 3.77Å; T254-L266 HydrophobicContact CG2-CD2 4.02Å; T257-L266 HydrophobicContact CG2-CB 4.19Å; T257-L266 HydrophobicContact CG2-CD1 4.04Å; L266-L268 HydrophobicContact CD1-CD2 3.9Å; L266-L268 HydrophobicContact CD1-CG 4.19Å; L266-L268 HydrophobicContact CD2-CD1 4.06Å; L266-L268 HydrophobicContact CD2-CD2 4.48Å; L266-L268 HydrophobicContact CD2-CG 4.17Å; L266-L268 HydrophobicContact CG-CD1 4.42Å; L266-L268 HydrophobicContact CG-CD2 4.25Å; L266-L268 HydrophobicContact CG-CG 3.98Å; L266-L307 HydrophobicContact CD2-CD1 3.57Å; L266-Y310 HydrophobicContact CB-CD1 3.96Å; L266-Y310 HydrophobicContact CB-CE1 3.61Å; L266-Y310 HydrophobicContact CD2-CD1 4.15Å; L266-P313 PolarHBondContact N-O 3.05Å; L266-V314 HydrophobicContact CB-CG2 4.27Å; L266-V314 HydrophobicContact CD2-CG2 4.3Å; L266-V314 WeakPolarHBondContact O-CA 3.4Å; L266-L315 PolarHBondContact O-N 3.43Å; L266-P466 WeakPolarHBondContact O-CG 3.38Å
267	V	98.9	Very high	96.8	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.9	170.9	-176.5	0	0	0	0	108.2	V242 V243 Y244 G245 L315 L317 F463 P466	V242-V267 HydrophobicContact CG1-CG2 4.17Å; V243-V267 PolarHBondContact O-N 2.9Å; Y244-V267 WeakPolarHBondContact CA-O 3.43Å; Y244-V267 HydrophobicContact CD2-CB 3.85Å; Y244-V267 HydrophobicContact CD2-CG1 3.76Å; Y244-V267 WeakPolarHBondContact CD2-O 3.5Å; Y244-V267 HydrophobicContact CE2-CG1 4Å; G245-V267 PolarHBondContact N-O 3.21Å; V267-L315 WeakPolarHBondContact CA-O 3.22Å; V267-L317 HydrophobicContact CG1-CD1 4.07Å; V267-L317 HydrophobicContact CG1-CG 4.22Å; V267-F463 HydrophobicContact CB-CE2 4.38Å; V267-F463 HydrophobicContact CG1-CE2 4.27Å; V267-F463 HydrophobicContact CG2-CE2 4.44Å; V267-F463 HydrophobicContact CG2-CZ 4.5Å; V267-P466 HydrophobicContact CG2-CG 4.18Å
268	L	98.8	Very high	96.6	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	114.6	-179.8	-67.1	178.9	0	0	0	109.8	G245 A253 T254 L266 T271 L307 L315 L316 L317 L347	G245-L268 WeakPolarHBondContact O-CA 3.19Å; A253-L268 HydrophobicContact CB-CD2 3.98Å; T254-L268 HydrophobicContact CG2-CD1 3.9Å; T254-L268 HydrophobicContact CG2-CD2 4.3Å; L266-L268 HydrophobicContact CD1-CD2 3.9Å; L266-L268 HydrophobicContact CD1-CG 4.19Å; L266-L268 HydrophobicContact CD2-CD1 4.06Å; L266-L268 HydrophobicContact CD2-CD2 4.48Å; L266-L268 HydrophobicContact CD2-CG 4.17Å; L266-L268 HydrophobicContact CG-CD1 4.42Å; L266-L268 HydrophobicContact CG-CD2 4.25Å; L266-L268 HydrophobicContact CG-CG 3.98Å; L268-T271 HydrophobicContact CB-CG2 3.71Å; L268-T271 HydrophobicContact CD1-CG2 4.19Å; L268-T271 HydrophobicContact CD2-CG2 4.43Å; L268-T271 HydrophobicContact CG-CG2 4.33Å; L268-L307 HydrophobicContact CD1-CD1 4.27Å; L268-L307 HydrophobicContact CD1-CD2 4.4Å; L268-L315 PolarHBondContact N-O 2.77Å; L268-L316 HydrophobicContact CB-CD2 3.8Å; L268-L316 HydrophobicContact CD1-CD2 3.76Å; L268-L316 HydrophobicContact CG-CD2 4.23Å; L268-L316 CarbonylContact O-C 3.59Å; L268-L316 WeakPolarHBondContact O-CA 3.38Å; L268-L317 PolarHBondContact O-N 3.37Å; L268-L347 HydrophobicContact CD1-CD2 4.03Å
269	D	98.5	Very high	96.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.1	-179.6	177.4	22.2	0	0	0	111.6	Y244 G245 W246 S247 T271 L317 R319	Y244-D269 HydrophobicContact CE2-CB 3.58Å; Y244-D269 WeakPolarHBondContact OH-CB 3.48Å; Y244-D269 PolarHBondContact OH-OD2 3.06Å; Y244-D269 VanDerWaalsContact OH-OD2 3.06Å; G245-D269 PolarHBondContact O-N 2.83Å; W246-D269 WeakPolarHBondContact CA-O 3.36Å; S247-D269 PolarHBondContact N-O 3.14Å; D269-T271 PolarHBondContact O-N 3.31Å; D269-L317 HydrophobicContact CB-CB 4.03Å; D269-L317 HydrophobicContact CB-CD1 4.18Å; D269-R319 IonicContact OD1-CZ 2.63Å; D269-R319 IonicContact OD1-NE 3.98Å; D269-R319 PolarHBondContact OD1-NE 3.27Å; D269-R319 IonicContact OD1-NH2 3.75Å; D269-R319 IonicContact OD2-CZ 2.92Å; D269-R319 IonicContact OD2-NE 2.76Å; D269-R319 PolarHBondContact OD2-NE 3.46Å; D269-R319 IonicContact OD2-NH2 3.99Å; D269-R319 PolarHBondContact OD2-NH2 3.08Å
270	A	97.1	Very high	96.1	Very high	2 Å²	2	14.5 Å²	14.5	2%	0.017	9%	0.092	C	C	.	.	S	Bend	trans	50.8	34.5	173.7	0	0	0	0	0	113.4	S247 L317 R319 D322 V325 H454	S247-A270 WeakPolarHBondContact CA-O 3.3Å; A270-L317 PolarHBondContact N-O 2.78Å; A270-R319 HydrophobicContact CB-CG 4.02Å; A270-D322 WeakPolarHBondContact CB-OD2 3.08Å; A270-V325 WeakPolarHBondContact O-CG1 3.36Å; A270-H454 PolarHBondContact O-CE1 3.31Å
271	T	97.6	Very high	95.7	Very high	7 Å²	7	15.6 Å²	15.6	4%	0.043	10%	0.097	C	C	.	.			trans	-99.3	-175.8	-179.2	-162.1	0	0	0	0	111.7	S247 L268 D269 L347	S247-T271 WeakPolarHBondContact O-CB 3.49Å; S247-T271 PolarHBondContact O-OG1 3.35Å; L268-T271 HydrophobicContact CB-CG2 3.71Å; L268-T271 HydrophobicContact CD1-CG2 4.19Å; L268-T271 HydrophobicContact CD2-CG2 4.43Å; L268-T271 HydrophobicContact CG-CG2 4.33Å; D269-T271 PolarHBondContact O-N 3.31Å; T271-L347 HydrophobicContact CG2-CD2 3.5Å; T271-L347 VanDerWaalsContact CG2-CD2 3.5Å
272	F	97.6	Very high	95.4	Very high	3 Å²	3	17.9 Å²	17.9	1%	0.013	11%	0.11	C	C	.	.			trans	-136.5	167.3	-174.2	52.6	-91.3	0	0	0	110.7	V248 D274 L275 L278 L301 V303 V325 R343	V248-F272 HydrophobicContact CG2-CE1 3.99Å; V248-F272 HydrophobicContact CG2-CZ 4.13Å; F272-D274 WeakPolarHBondContact CD2-O 3.43Å; F272-L275 HydrophobicContact CE2-CB 4.08Å; F272-L275 HydrophobicContact CE2-CD1 4.43Å; F272-L275 HydrophobicContact CZ-CD1 4.3Å; F272-L278 HydrophobicContact CB-CD1 3.74Å; F272-L278 HydrophobicContact CD1-CD1 3.57Å; F272-L278 HydrophobicContact CD2-CD1 4.05Å; F272-L278 HydrophobicContact CE1-CD1 4.17Å; F272-L278 HydrophobicContact CG-CD1 3.5Å; F272-L301 HydrophobicContact CE2-CB 4.1Å; F272-L301 HydrophobicContact CE2-CD1 4.4Å; F272-L301 HydrophobicContact CZ-CB 4.43Å; F272-L301 HydrophobicContact CZ-CD1 3.96Å; F272-V303 HydrophobicContact CD2-CG2 4.38Å; F272-V303 HydrophobicContact CE2-CG2 4.16Å; F272-V303 WeakPolarHBondContact O-CB 3.47Å; F272-V303 WeakPolarHBondContact O-CG1 3.35Å; F272-V325 HydrophobicContact CB-CB 4.43Å; F272-V325 HydrophobicContact CD1-CG1 3.82Å; F272-R343 HydrophobicContact CB-CB 3.5Å; F272-R343 HydrophobicContact CB-CG 4.16Å
273	D	97.1	Very high	95.1	Very high	13 Å²	13	18.3 Å²	18.3	7%	0.07	11%	0.108	C	C	.	.	S	Bend	trans	-84	-38.9	177.8	64.5	-48.1	0	0	0	113.4	V303 A304 R343 E346 L347	D273-V303 PolarHBondContact O-N 3.02Å; D273-A304 HydrophobicContact CB-CB 3.79Å; D273-A304 PolarHBondContact O-N 2.91Å; D273-A304 VanDerWaalsContact O-N 3.1Å; D273-R343 IonicContact OD1-CZ 3.84Å; D273-R343 IonicContact OD1-NE 3.96Å; D273-R343 PolarHBondContact OD1-NE 2.94Å; D273-R343 IonicContact OD1-NH2 3.47Å; D273-R343 PolarHBondContact OD1-NH2 3.28Å; D273-R343 IonicContact OD2-CZ 3.75Å; D273-R343 IonicContact OD2-NE 3.21Å; D273-R343 IonicContact OD2-NH2 3.96Å; D273-R343 PolarHBondContact OD2-NH2 3.45Å; D273-E346 HydrophobicContact CB-CB 4.2Å; D273-L347 HydrophobicContact CB-CB 4.18Å; D273-L347 HydrophobicContact CB-CD1 4.3Å
274	D	95.2	Very high	94.6	Very high	19 Å²	19	21.3 Å²	21.3	10%	0.102	13%	0.127	C	C	.	.			trans	-150.9	142.7	-175.7	-168.3	-85.9	0	0	0	111.1	F272 V276 P277 R296	F272-D274 WeakPolarHBondContact CD2-O 3.43Å; D274-V276 WeakPolarHBondContact OD1-CB 3.33Å; D274-V276 WeakPolarHBondContact OD1-CG2 3.49Å; D274-V276 PolarHBondContact OD1-N 2.96Å; D274-P277 WeakPolarHBondContact O-CD 3.32Å; D274-P277 WeakPolarHBondContact OD1-CD 3.18Å; D274-R296 IonicContact OD1-CZ 3.54Å; D274-R296 IonicContact OD1-NH1 3.67Å; D274-R296 IonicContact OD1-NH2 2.7Å; D274-R296 PolarHBondContact OD1-NH2 3.41Å; D274-R296 IonicContact OD2-CZ 2.77Å; D274-R296 IonicContact OD2-NH1 3.62Å; D274-R296 PolarHBondContact OD2-NH1 2.88Å; D274-R296 IonicContact OD2-NH2 3.24Å; D274-R296 PolarHBondContact OD2-NH2 3.33Å
275	L	95.4	Very high	94.2	Very high	18 Å²	18	27 Å²	27	9%	0.094	15%	0.15	C	C	.	.	H	α-helix	trans	-74.4	-28.5	-179.4	-177.7	62.1	0	0	0	113.5	V111 F272 L278 A279 V295 F299 L301	V111-L275 HydrophobicContact CG1-CD2 4.17Å; V111-L275 HydrophobicContact CG2-CD2 4.13Å; F272-L275 HydrophobicContact CE2-CB 4.08Å; F272-L275 HydrophobicContact CE2-CD1 4.43Å; F272-L275 HydrophobicContact CZ-CD1 4.3Å; L275-L278 HydrophobicContact CD1-CB 4.47Å; L275-L278 PolarHBondContact O-N 2.96Å; L275-L278 VanDerWaalsContact O-N 3.1Å; L275-A279 PolarHBondContact O-N 3.4Å; L275-V295 HydrophobicContact CB-CG1 4Å; L275-V295 HydrophobicContact CD2-CG1 4.01Å; L275-V295 HydrophobicContact CD2-CG2 4.48Å; L275-V295 HydrophobicContact CG-CG1 4.07Å; L275-F299 HydrophobicContact CD2-CB 3.97Å; L275-L301 HydrophobicContact CB-CB 4.07Å; L275-L301 HydrophobicContact CB-CD1 4.38Å; L275-L301 HydrophobicContact CB-CG 4.34Å; L275-L301 HydrophobicContact CD1-CD1 4.45Å; L275-L301 HydrophobicContact CD2-CD1 3.83Å; L275-L301 HydrophobicContact CD2-CG 4.01Å; L275-L301 HydrophobicContact CG-CD1 4.44Å
276	V	95.1	Very high	93.9	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.079	18%	0.182	C	C	.	.	H	α-helix	trans	-57.4	-48.2	-172.1	172.9	0	0	0	0	112.7	D274 L278 A279 L280 V292 V295 R296	D274-V276 WeakPolarHBondContact OD1-CB 3.33Å; D274-V276 WeakPolarHBondContact OD1-CG2 3.49Å; D274-V276 PolarHBondContact OD1-N 2.96Å; V276-L278 VanDerWaalsContact C-N 3.25Å; V276-L278 PolarHBondContact O-N 3.26Å; V276-A279 PolarHBondContact O-N 3.22Å; V276-L280 HydrophobicContact CG1-CD1 3.79Å; V276-L280 HydrophobicContact CG1-CG 4.11Å; V276-L280 WeakPolarHBondContact O-CB 3.31Å; V276-L280 VanDerWaalsContact O-CG 3.3Å; V276-L280 WeakPolarHBondContact O-CG 3.29Å; V276-L280 PolarHBondContact O-N 2.7Å; V276-V292 HydrophobicContact CG1-CG2 3.89Å; V276-V295 HydrophobicContact CG2-CB 4.02Å; V276-V295 HydrophobicContact CG2-CG1 3.49Å; V276-V295 VanDerWaalsContact CG2-CG1 3.49Å; V276-R296 HydrophobicContact CG2-CG 4.23Å
277	P	93.1	Very high	93.5	Very high	33 Å²	33	37.3 Å²	37.3	21%	0.214	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-36.5	178	-24.6	35.2	0	0	0	113.2	D274 K281 T327	D274-P277 WeakPolarHBondContact O-CD 3.32Å; D274-P277 WeakPolarHBondContact OD1-CD 3.18Å; P277-K281 PolarHBondContact O-N 3.26Å; P277-T327 HydrophobicContact CB-CG2 3.63Å
278	L	92.7	Very high	93.2	Very high	18 Å²	18	43.4 Å²	43.4	9%	0.094	23%	0.23	C	C	.	.	H	α-helix	trans	-73.8	-43.8	178.9	-60.4	-179.5	0	0	0	111.6	F272 L275 V276 L280 K281 V282 V325 T327 R343	F272-L278 HydrophobicContact CB-CD1 3.74Å; F272-L278 HydrophobicContact CD1-CD1 3.57Å; F272-L278 HydrophobicContact CD2-CD1 4.05Å; F272-L278 HydrophobicContact CE1-CD1 4.17Å; F272-L278 HydrophobicContact CG-CD1 3.5Å; L275-L278 HydrophobicContact CD1-CB 4.47Å; L275-L278 PolarHBondContact O-N 2.96Å; L275-L278 VanDerWaalsContact O-N 3.1Å; V276-L278 VanDerWaalsContact C-N 3.25Å; V276-L278 PolarHBondContact O-N 3.26Å; L278-L280 VanDerWaalsContact C-N 3.29Å; L278-L280 PolarHBondContact O-N 2.9Å; L278-K281 WeakPolarHBondContact O-CA 3.26Å; L278-K281 VanDerWaalsContact O-CB 3.31Å; L278-K281 WeakPolarHBondContact O-CB 3.43Å; L278-K281 PolarHBondContact O-N 3.14Å; L278-V282 PolarHBondContact O-N 3.49Å; L278-V325 HydrophobicContact CD1-CB 4.38Å; L278-V325 HydrophobicContact CD1-CG1 4.21Å; L278-T327 HydrophobicContact CD2-CG2 4.3Å; L278-R343 HydrophobicContact CD2-CG 3.74Å; L278-R343 HydrophobicContact CG-CG 4.21Å
279	A	92.1	Very high	92.9	Very high	17 Å²	17	46.1 Å²	46.1	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-41.8	174	0	0	0	0	0	111.4	L275 V276 K281 V282 M283 V291 V295	L275-A279 PolarHBondContact O-N 3.4Å; V276-A279 PolarHBondContact O-N 3.22Å; A279-K281 PolarHBondContact O-N 2.8Å; A279-V282 PolarHBondContact O-N 3.28Å; A279-V282 VanDerWaalsContact O-N 3.16Å; A279-M283 WeakPolarHBondContact O-CB 3.04Å; A279-M283 WeakPolarHBondContact O-CG 3.37Å; A279-M283 PolarHBondContact O-N 3.38Å; A279-V291 HydrophobicContact CB-CG1 3.87Å; A279-V295 HydrophobicContact CB-CG2 3.78Å
280	L	91.8	Very high	92.6	Very high	41 Å²	41	48.7 Å²	48.7	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-70.6	-14	174.2	-69.6	-177.8	0	0	0	113.6	V276 L278 K288 V291 V292 R330	V276-L280 HydrophobicContact CG1-CD1 3.79Å; V276-L280 HydrophobicContact CG1-CG 4.11Å; V276-L280 WeakPolarHBondContact O-CB 3.31Å; V276-L280 VanDerWaalsContact O-CG 3.3Å; V276-L280 WeakPolarHBondContact O-CG 3.29Å; V276-L280 PolarHBondContact O-N 2.7Å; L278-L280 VanDerWaalsContact C-N 3.29Å; L278-L280 PolarHBondContact O-N 2.9Å; L280-K288 HydrophobicContact CD1-CG 4.4Å; L280-K288 HydrophobicContact CD2-CB 4.25Å; L280-K288 HydrophobicContact CD2-CG 3.86Å; L280-V291 HydrophobicContact CD2-CB 4.21Å; L280-V291 HydrophobicContact CD2-CG1 4Å; L280-V292 HydrophobicContact CD1-CG2 3.98Å; L280-V292 HydrophobicContact CD2-CG2 4.16Å; L280-V292 HydrophobicContact CG-CG2 4.37Å; L280-R330 PolarHBondContact O-NH2 2.96Å
281	K	87.9	Confident	92.4	Very high	46 Å²	46	48.9 Å²	48.9	20%	0.2	27%	0.273	C	S	.	.	H	α-helix	trans	-77.2	-32	168.4	174.7	-178.7	173.6	-178.3	0	111.8	P277 L278 A279 D323 S326 S328 R330	P277-K281 PolarHBondContact O-N 3.26Å; L278-K281 WeakPolarHBondContact O-CA 3.26Å; L278-K281 VanDerWaalsContact O-CB 3.31Å; L278-K281 WeakPolarHBondContact O-CB 3.43Å; L278-K281 PolarHBondContact O-N 3.14Å; A279-K281 PolarHBondContact O-N 2.8Å; K281-D323 PolarHBondContact NZ-O 3.07Å; K281-S326 WeakPolarHBondContact CD-O 3.38Å; K281-S326 WeakPolarHBondContact CE-O 3.45Å; K281-S326 PolarHBondContact NZ-O 2.89Å; K281-S328 PolarHBondContact NZ-O 2.67Å; K281-R330 PolarHBondContact O-NE 2.87Å; K281-R330 PolarHBondContact O-NH2 2.83Å
282	V	87.2	Confident	92.3	Very high	106 Å²	106	50.7 Å²	50.7	64%	0.642	28%	0.284	S	S	*	.	H	α-helix	trans	-91.1	-42	-176.5	179.3	0	0	0	0	112.5	L278 A279	L278-V282 PolarHBondContact O-N 3.49Å; A279-V282 PolarHBondContact O-N 3.28Å; A279-V282 VanDerWaalsContact O-N 3.16Å
283	M	88.8	Confident	92.1	Very high	24 Å²	24	53.3 Å²	53.3	12%	0.118	29%	0.294	C	S	.	.	S	Bend	trans	-82.9	149.2	-168.2	-65.2	-62	-69.8	0	0	114.3	L110 A279 H285 W287 V291 R330	L110-M283 HydrophobicContact CD1-SD 3.79Å; A279-M283 WeakPolarHBondContact O-CB 3.04Å; A279-M283 WeakPolarHBondContact O-CG 3.37Å; A279-M283 PolarHBondContact O-N 3.38Å; M283-H285 PolarHBondContact O-N 2.98Å; M283-W287 HydrophobicContact CE-CE3 3.74Å; M283-W287 HydrophobicContact CE-CZ3 4.03Å; M283-V291 HydrophobicContact CB-CG1 4.29Å; M283-V291 HydrophobicContact CB-CG2 3.62Å; M283-V291 HydrophobicContact CE-CG2 4.07Å; M283-V291 HydrophobicContact CG-CG1 4.07Å; M283-V291 HydrophobicContact CG-CG2 3.77Å; M283-R330 PolarHBondContact O-NH1 2.82Å; M283-R330 PolarHBondContact O-NH2 2.86Å
284	P	88.5	Confident	92	Very high	64 Å²	64	53 Å²	53	42%	0.416	29%	0.292	S	S	.	.			trans	-52.6	137.2	177.8	-26.3	34.7	0	0	0	113.4	S286 W287	P284-S286 PolarHBondContact O-N 3.22Å; P284-W287 PolarHBondContact O-N 3.08Å
285	H	88.5	Confident	91.9	Very high	134 Å²	134	52.5 Å²	52.5	62%	0.62	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-60.9	-30.4	-177.1	-70.5	-57.3	0	0	0	113.2	M283 W287 K288 R330	M283-H285 PolarHBondContact O-N 2.98Å; H285-W287 PolarHBondContact O-N 2.68Å; H285-K288 WeakPolarHBondContact O-CB 3.4Å; H285-K288 PolarHBondContact O-N 2.65Å; H285-R330 PolarHBondContact CD2-NH1 2.93Å; H285-R330 PolarHBondContact CE1-NE 3.21Å; H285-R330 PolarHBondContact CE1-NH1 3.08Å; H285-R330 VanDerWaalsContact CE1-NH1 3.28Å; H285-R330 WeakPolarHBondContact NE2-CD 3.17Å; H285-R330 PolarHBondContact NE2-NH1 2.79Å
286	S	91.4	Very high	91.8	Very high	105 Å²	105	54.2 Å²	54.2	73%	0.734	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-61.5	-20.3	174.9	52.1	0	0	0	0	113.3	P284	P284-S286 PolarHBondContact O-N 3.22Å
287	W	91	Very high	91.7	Very high	119 Å²	119	55.4 Å²	55.4	45%	0.451	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-99.9	7.7	-178.8	-67.2	14.1	0	0	0	113.1	M283 P284 H285 G289 L290 V291	M283-W287 HydrophobicContact CE-CE3 3.74Å; M283-W287 HydrophobicContact CE-CZ3 4.03Å; P284-W287 PolarHBondContact O-N 3.08Å; H285-W287 PolarHBondContact O-N 2.68Å; W287-G289 VanDerWaalsContact C-N 3.3Å; W287-G289 PolarHBondContact O-N 2.8Å; W287-G289 VanDerWaalsContact O-N 3.13Å; W287-L290 PolarHBondContact O-N 3.35Å; W287-V291 HydrophobicContact CB-CG2 4.05Å; W287-V291 WeakPolarHBondContact O-CG2 3.24Å; W287-V291 PolarHBondContact O-N 2.97Å
288	K	92.2	Very high	91.8	Very high	128 Å²	128	55.9 Å²	55.9	56%	0.557	30%	0.299	S	S	*	.	H	α-helix	trans	-45.6	-50.8	-174.4	178.6	180	178.8	-176.9	0	113	L280 H285 V291 V292	L280-K288 HydrophobicContact CD1-CG 4.4Å; L280-K288 HydrophobicContact CD2-CB 4.25Å; L280-K288 HydrophobicContact CD2-CG 3.86Å; H285-K288 WeakPolarHBondContact O-CB 3.4Å; H285-K288 PolarHBondContact O-N 2.65Å; K288-V291 PolarHBondContact O-N 3.03Å; K288-V292 HydrophobicContact CG-CG2 4.4Å; K288-V292 WeakPolarHBondContact O-CB 3.37Å; K288-V292 VanDerWaalsContact O-CG2 3.25Å; K288-V292 WeakPolarHBondContact O-CG2 3.18Å; K288-V292 PolarHBondContact O-N 3.31Å
289	G	92.4	Very high	91.9	Very high	59 Å²	59	55.1 Å²	55.1	61%	0.608	30%	0.295	S	S	*	.	H	α-helix	trans	-61.9	-44.7	-178.2	0	0	0	0	0	113.2	W287 R293	W287-G289 VanDerWaalsContact C-N 3.3Å; W287-G289 PolarHBondContact O-N 2.8Å; W287-G289 VanDerWaalsContact O-N 3.13Å; G289-R293 WeakPolarHBondContact O-CB 3.29Å; G289-R293 PolarHBondContact O-N 3.02Å
290	L	93.1	Very high	92.1	Very high	53 Å²	53	55 Å²	55	28%	0.277	29%	0.291	S	S	.	.	H	α-helix	trans	-66.7	-42.2	178	-179.4	62.3	0	0	0	111.6	A98 L102 W287 R293 T294	A98-L290 HydrophobicContact CB-CD1 3.9Å; L102-L290 HydrophobicContact CD2-CD2 4.18Å; L102-L290 HydrophobicContact CD2-CG 4.15Å; W287-L290 PolarHBondContact O-N 3.35Å; L290-R293 PolarHBondContact O-N 2.99Å; L290-T294 WeakPolarHBondContact O-CB 3.47Å; L290-T294 PolarHBondContact O-N 2.92Å; L290-T294 PolarHBondContact O-OG1 3.14Å
291	V	92.9	Very high	92.3	Very high	6 Å²	6	53 Å²	53	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-48.7	179.2	173.2	0	0	0	0	110.9	A279 L280 M283 W287 K288 R293 T294 V295	A279-V291 HydrophobicContact CB-CG1 3.87Å; L280-V291 HydrophobicContact CD2-CB 4.21Å; L280-V291 HydrophobicContact CD2-CG1 4Å; M283-V291 HydrophobicContact CB-CG1 4.29Å; M283-V291 HydrophobicContact CB-CG2 3.62Å; M283-V291 HydrophobicContact CE-CG2 4.07Å; M283-V291 HydrophobicContact CG-CG1 4.07Å; M283-V291 HydrophobicContact CG-CG2 3.77Å; W287-V291 HydrophobicContact CB-CG2 4.05Å; W287-V291 WeakPolarHBondContact O-CG2 3.24Å; W287-V291 PolarHBondContact O-N 2.97Å; K288-V291 PolarHBondContact O-N 3.03Å; V291-R293 VanDerWaalsContact C-N 3.3Å; V291-R293 PolarHBondContact O-N 3.48Å; V291-T294 PolarHBondContact O-N 3.22Å; V291-V295 HydrophobicContact CG1-CG2 4.36Å; V291-V295 WeakPolarHBondContact O-CB 3.34Å; V291-V295 WeakPolarHBondContact O-CG2 3.26Å; V291-V295 PolarHBondContact O-N 3.14Å
292	V	94.2	Very high	92.5	Very high	46 Å²	46	51 Å²	51	28%	0.279	27%	0.273	S	S	.	.	H	α-helix	trans	-57.4	-47.5	176.7	171.9	0	0	0	0	110.1	V276 L280 K288 V295 R296	V276-V292 HydrophobicContact CG1-CG2 3.89Å; L280-V292 HydrophobicContact CD1-CG2 3.98Å; L280-V292 HydrophobicContact CD2-CG2 4.16Å; L280-V292 HydrophobicContact CG-CG2 4.37Å; K288-V292 HydrophobicContact CG-CG2 4.4Å; K288-V292 WeakPolarHBondContact O-CB 3.37Å; K288-V292 VanDerWaalsContact O-CG2 3.25Å; K288-V292 WeakPolarHBondContact O-CG2 3.18Å; K288-V292 PolarHBondContact O-N 3.31Å; V292-V295 PolarHBondContact O-N 3.35Å; V292-R296 HydrophobicContact CG1-CG 4.29Å; V292-R296 WeakPolarHBondContact O-CB 3.3Å; V292-R296 WeakPolarHBondContact O-CG 3.27Å; V292-R296 PolarHBondContact O-N 3.16Å
293	R	93.5	Very high	93.1	Very high	58 Å²	58	46 Å²	46	22%	0.219	24%	0.242	C	C	.	.	H	α-helix	trans	-57.8	-51.3	177.1	-177.4	179.1	-172.1	125.5	31.2	111.9	Q96 G289 L290 V291 V295 R296 E297	Q96-R293 VanDerWaalsContact CG-CZ 3.5Å; G289-R293 WeakPolarHBondContact O-CB 3.29Å; G289-R293 PolarHBondContact O-N 3.02Å; L290-R293 PolarHBondContact O-N 2.99Å; V291-R293 VanDerWaalsContact C-N 3.3Å; V291-R293 PolarHBondContact O-N 3.48Å; R293-V295 PolarHBondContact O-N 2.82Å; R293-R296 PolarHBondContact O-N 3.03Å; R293-E297 VanDerWaalsContact CG-CD 3.43Å; R293-E297 HydrophobicContact CG-CG 4.23Å; R293-E297 VanDerWaalsContact CG-OE2 3.26Å; R293-E297 WeakPolarHBondContact CG-OE2 3.41Å; R293-E297 IonicContact CZ-OE1 2.8Å; R293-E297 VanDerWaalsContact CZ-OE1 3.25Å; R293-E297 IonicContact NE-OE1 2.71Å; R293-E297 PolarHBondContact NE-OE1 3.48Å; R293-E297 IonicContact NE-OE2 3.1Å; R293-E297 PolarHBondContact NE-OE2 3.49Å; R293-E297 VanDerWaalsContact NE-OE2 3.1Å; R293-E297 IonicContact NH2-OE1 3.77Å; R293-E297 PolarHBondContact NH2-OE1 3.32Å; R293-E297 VanDerWaalsContact O-CB 3.3Å; R293-E297 WeakPolarHBondContact O-CB 3.4Å; R293-E297 WeakPolarHBondContact O-CG 3.43Å; R293-E297 PolarHBondContact O-N 3.24Å
294	T	94.1	Very high	93.5	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-60	-46.8	-178.1	-54.9	0	0	0	0	111.6	S99 L102 A103 L290 V291 H298	S99-T294 VanDerWaalsContact OG-CA 3.28Å; S99-T294 WeakPolarHBondContact OG-CA 3.37Å; L102-T294 HydrophobicContact CB-CG2 4.28Å; L102-T294 HydrophobicContact CD2-CG2 4.19Å; L102-T294 HydrophobicContact CG-CG2 4.18Å; A103-T294 HydrophobicContact CB-CG2 3.81Å; L290-T294 WeakPolarHBondContact O-CB 3.47Å; L290-T294 PolarHBondContact O-N 2.92Å; L290-T294 PolarHBondContact O-OG1 3.14Å; V291-T294 PolarHBondContact O-N 3.22Å; T294-H298 WeakPolarHBondContact O-CB 3.22Å; T294-H298 PolarHBondContact O-N 2.92Å
295	V	94.5	Very high	93.9	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.055	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-49.3	177.8	171.9	0	0	0	0	110.3	L275 V276 A279 V291 V292 R293 E297 F299 N300	L275-V295 HydrophobicContact CB-CG1 4Å; L275-V295 HydrophobicContact CD2-CG1 4.01Å; L275-V295 HydrophobicContact CD2-CG2 4.48Å; L275-V295 HydrophobicContact CG-CG1 4.07Å; V276-V295 HydrophobicContact CG2-CB 4.02Å; V276-V295 HydrophobicContact CG2-CG1 3.49Å; V276-V295 VanDerWaalsContact CG2-CG1 3.49Å; A279-V295 HydrophobicContact CB-CG2 3.78Å; V291-V295 HydrophobicContact CG1-CG2 4.36Å; V291-V295 WeakPolarHBondContact O-CB 3.34Å; V291-V295 WeakPolarHBondContact O-CG2 3.26Å; V291-V295 PolarHBondContact O-N 3.14Å; V292-V295 PolarHBondContact O-N 3.35Å; R293-V295 PolarHBondContact O-N 2.82Å; V295-E297 PolarHBondContact O-N 3.1Å; V295-F299 CarbonylContact O-C 3.5Å; V295-F299 VanDerWaalsContact O-CA 3.27Å; V295-F299 WeakPolarHBondContact O-CA 3.33Å; V295-F299 PolarHBondContact O-N 3.35Å; V295-N300 PolarHBondContact O-N 2.77Å
296	R	93.8	Very high	94.3	Very high	55 Å²	55	38.9 Å²	38.9	21%	0.208	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-34.1	-178.3	-67.3	-69.1	176.7	-157.9	-4.8	113.6	D274 V276 V292 R293 N300	D274-R296 IonicContact OD1-CZ 3.54Å; D274-R296 IonicContact OD1-NH1 3.67Å; D274-R296 IonicContact OD1-NH2 2.7Å; D274-R296 PolarHBondContact OD1-NH2 3.41Å; D274-R296 IonicContact OD2-CZ 2.77Å; D274-R296 IonicContact OD2-NH1 3.62Å; D274-R296 PolarHBondContact OD2-NH1 2.88Å; D274-R296 IonicContact OD2-NH2 3.24Å; D274-R296 PolarHBondContact OD2-NH2 3.33Å; V276-R296 HydrophobicContact CG2-CG 4.23Å; V292-R296 HydrophobicContact CG1-CG 4.29Å; V292-R296 WeakPolarHBondContact O-CB 3.3Å; V292-R296 WeakPolarHBondContact O-CG 3.27Å; V292-R296 PolarHBondContact O-N 3.16Å; R293-R296 PolarHBondContact O-N 3.03Å; R296-N300 PolarHBondContact NH1-OD1 3.16Å
297	E	92.4	Very high	94.7	Very high	38 Å²	38	34 Å²	34	18%	0.178	17%	0.171	C	C	.	.	H	α-helix	trans	-85.5	-30.1	-177.1	-70.6	177.9	164.3	0	0	113.7	R63 S99 R293 V295	R63-E297 PolarHBondContact NH1-O 3.41Å; R63-E297 VanDerWaalsContact NH1-O 3.16Å; R63-E297 PolarHBondContact NH2-O 3.09Å; S99-E297 WeakPolarHBondContact CB-OE2 3.18Å; S99-E297 PolarHBondContact OG-OE2 3.25Å; R293-E297 VanDerWaalsContact CG-CD 3.43Å; R293-E297 HydrophobicContact CG-CG 4.23Å; R293-E297 VanDerWaalsContact CG-OE2 3.26Å; R293-E297 WeakPolarHBondContact CG-OE2 3.41Å; R293-E297 IonicContact CZ-OE1 2.8Å; R293-E297 VanDerWaalsContact CZ-OE1 3.25Å; R293-E297 IonicContact NE-OE1 2.71Å; R293-E297 PolarHBondContact NE-OE1 3.48Å; R293-E297 IonicContact NE-OE2 3.1Å; R293-E297 PolarHBondContact NE-OE2 3.49Å; R293-E297 VanDerWaalsContact NE-OE2 3.1Å; R293-E297 IonicContact NH2-OE1 3.77Å; R293-E297 PolarHBondContact NH2-OE1 3.32Å; R293-E297 VanDerWaalsContact O-CB 3.3Å; R293-E297 WeakPolarHBondContact O-CB 3.4Å; R293-E297 WeakPolarHBondContact O-CG 3.43Å; R293-E297 PolarHBondContact O-N 3.24Å; V295-E297 PolarHBondContact O-N 3.1Å
298	H	94.6	Very high	94.9	Very high	42 Å²	42	29.4 Å²	29.4	19%	0.194	16%	0.157	C	C	.	.	H	α-helix	trans	-127.1	-22.2	-169.8	-61.2	-77.7	0	0	0	114.9	Y100 A103 P216 T294	Y100-H298 AromaticContact CD2-CE1 3.83Å; A103-H298 HydrophobicContact CB-CB 3.56Å; A103-H298 VanDerWaalsContact CB-CG 3.45Å; P216-H298 VanDerWaalsContact CD-O 3.26Å; P216-H298 WeakPolarHBondContact CD-O 3.18Å; T294-H298 WeakPolarHBondContact O-CB 3.22Å; T294-H298 PolarHBondContact O-N 2.92Å
299	F	95.5	Very high	95.1	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	15%	0.152	C	C	.	.			trans	-135.6	44.8	-176.7	-61.7	-74.2	0	0	0	111.7	A103 R108 V111 Y112 F215 P216 L275 V295 L301	A103-F299 HydrophobicContact CB-CE2 3.81Å; R108-F299 HydrophobicContact CB-CZ 3.82Å; R108-F299 HydrophobicContact CG-CZ 4.33Å; V111-F299 HydrophobicContact CB-CD1 4.33Å; V111-F299 HydrophobicContact CB-CE1 4.5Å; V111-F299 HydrophobicContact CG1-CD1 4.08Å; V111-F299 HydrophobicContact CG2-CD1 4.37Å; V111-F299 HydrophobicContact CG2-CD2 4.38Å; V111-F299 HydrophobicContact CG2-CG 4.2Å; Y112-F299 HydrophobicContact CD2-CE1 4.22Å; Y112-F299 HydrophobicContact CE2-CD1 4.03Å; Y112-F299 HydrophobicContact CE2-CE1 4.04Å; F215-F299 HydrophobicContact CD1-CD1 4.41Å; F215-F299 AromaticContact CD1-CE1 3.62Å; F215-F299 HydrophobicContact CD1-CE1 3.62Å; F215-F299 AromaticContact CD1-CZ 3.82Å; F215-F299 HydrophobicContact CD1-CZ 3.82Å; F215-F299 AromaticContact CE1-CE1 3.83Å; F215-F299 HydrophobicContact CE1-CE1 3.83Å; F215-F299 HydrophobicContact CE1-CE2 4.32Å; F215-F299 AromaticContact CE1-CZ 3.5Å; F215-F299 HydrophobicContact CE1-CZ 3.5Å; F215-F299 HydrophobicContact CZ-CZ 4.44Å; P216-F299 HydrophobicContact CG-CD1 4.43Å; L275-F299 HydrophobicContact CD2-CB 3.97Å; V295-F299 CarbonylContact O-C 3.5Å; V295-F299 VanDerWaalsContact O-CA 3.27Å; V295-F299 WeakPolarHBondContact O-CA 3.33Å; V295-F299 PolarHBondContact O-N 3.35Å; F299-L301 PolarHBondContact O-N 3.28Å
300	N	94.8	Very high	95.3	Very high	14 Å²	14	23.8 Å²	23.8	8%	0.075	12%	0.123	C	C	.	.			trans	-73.7	78	-177.5	-168.4	43.4	0	0	0	110.6	V295 R296 N302	V295-N300 PolarHBondContact O-N 2.77Å; R296-N300 PolarHBondContact NH1-OD1 3.16Å; N300-N302 VanDerWaalsContact C-N 3.31Å; N300-N302 PolarHBondContact O-N 3.45Å; N300-N302 VanDerWaalsContact O-N 3.08Å
301	L	96	Very high	95.3	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.123	C	C	.	.			trans	-81.8	80.4	175.2	-49.4	-176.2	0	0	0	109	V111 P216 V248 F251 F272 L275 F299 V303	V111-L301 HydrophobicContact CG1-CD1 4.44Å; P216-L301 HydrophobicContact CB-CD2 4.23Å; P216-L301 HydrophobicContact CG-CD2 3.85Å; V248-L301 HydrophobicContact CG1-CD1 4.12Å; V248-L301 HydrophobicContact CG2-CD1 4.46Å; F251-L301 HydrophobicContact CB-CB 4.38Å; F251-L301 HydrophobicContact CB-CD2 4.16Å; F251-L301 HydrophobicContact CD1-CD2 3.99Å; F251-L301 HydrophobicContact CD2-CB 4.06Å; F251-L301 HydrophobicContact CD2-CD2 3.79Å; F251-L301 HydrophobicContact CE1-CD2 4.37Å; F251-L301 HydrophobicContact CE2-CD2 4.12Å; F251-L301 HydrophobicContact CG-CB 4.4Å; F251-L301 HydrophobicContact CG-CD2 3.7Å; F251-L301 HydrophobicContact CZ-CD2 4.43Å; F272-L301 HydrophobicContact CE2-CB 4.1Å; F272-L301 HydrophobicContact CE2-CD1 4.4Å; F272-L301 HydrophobicContact CZ-CB 4.43Å; F272-L301 HydrophobicContact CZ-CD1 3.96Å; L275-L301 HydrophobicContact CB-CB 4.07Å; L275-L301 HydrophobicContact CB-CD1 4.38Å; L275-L301 HydrophobicContact CB-CG 4.34Å; L275-L301 HydrophobicContact CD1-CD1 4.45Å; L275-L301 HydrophobicContact CD2-CD1 3.83Å; L275-L301 HydrophobicContact CD2-CG 4.01Å; L275-L301 HydrophobicContact CG-CD1 4.44Å; F299-L301 PolarHBondContact O-N 3.28Å; L301-V303 VanDerWaalsContact C-N 3.33Å; L301-V303 PolarHBondContact O-N 2.7Å
302	N	93.8	Very high	95.4	Very high	3 Å²	3	23 Å²	23	2%	0.016	12%	0.122	C	C	.	.			trans	-91.5	57	-175.5	64	-23.2	0	0	0	112.4	L62 N300 A304 E305 Q306	L62-N302 WeakPolarHBondContact CB-ND2 3.37Å; L62-N302 WeakPolarHBondContact CD1-ND2 3.38Å; N300-N302 VanDerWaalsContact C-N 3.31Å; N300-N302 PolarHBondContact O-N 3.45Å; N300-N302 VanDerWaalsContact O-N 3.08Å; N302-A304 VanDerWaalsContact C-N 3.29Å; N302-A304 PolarHBondContact O-N 2.91Å; N302-E305 HydrophobicContact CB-CB 4.25Å; N302-E305 HydrophobicContact CB-CG 4.43Å; N302-E305 WeakPolarHBondContact CB-OE2 3.3Å; N302-E305 PolarHBondContact ND2-OE2 2.85Å; N302-E305 PolarHBondContact O-N 3.42Å; N302-E305 VanDerWaalsContact O-N 3.11Å; N302-Q306 PolarHBondContact O-N 2.91Å; N302-Q306 PolarHBondContact OD1-NE2 3.01Å
303	V	98.4	Very high	95.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-53.8	-43.1	-173.2	-176.5	0	0	0	0	112	F251 T254 F272 D273 L301 E305 Q306 L307 L347	F251-V303 HydrophobicContact CB-CG2 4.18Å; T254-V303 HydrophobicContact CG2-CG1 3.69Å; F272-V303 HydrophobicContact CD2-CG2 4.38Å; F272-V303 HydrophobicContact CE2-CG2 4.16Å; F272-V303 WeakPolarHBondContact O-CB 3.47Å; F272-V303 WeakPolarHBondContact O-CG1 3.35Å; D273-V303 PolarHBondContact O-N 3.02Å; L301-V303 VanDerWaalsContact C-N 3.33Å; L301-V303 PolarHBondContact O-N 2.7Å; V303-E305 PolarHBondContact O-N 3.28Å; V303-Q306 PolarHBondContact O-N 3.3Å; V303-L307 WeakPolarHBondContact O-CB 3.49Å; V303-L307 PolarHBondContact O-N 2.88Å; V303-L347 HydrophobicContact CG1-CD1 4.21Å
304	A	97.9	Very high	95.8	Very high	10 Å²	10	19.6 Å²	19.6	8%	0.083	11%	0.108	C	C	.	.	H	α-helix	trans	-67.1	-36.4	-179.4	0	0	0	0	0	114	D273 N302 C308 L347 R350	D273-A304 HydrophobicContact CB-CB 3.79Å; D273-A304 PolarHBondContact O-N 2.91Å; D273-A304 VanDerWaalsContact O-N 3.1Å; N302-A304 VanDerWaalsContact C-N 3.29Å; N302-A304 PolarHBondContact O-N 2.91Å; A304-C308 PolarHBondContact O-N 2.99Å; A304-C308 PolarHBondContact O-SG 3Å; A304-L347 HydrophobicContact CB-CD1 3.76Å; A304-R350 HydrophobicContact CB-CB 4.16Å; A304-R350 HydrophobicContact CB-CG 4.18Å
305	E	96.7	Very high	96.1	Very high	64 Å²	64	20 Å²	20	30%	0.299	11%	0.11	S	C	.	.	H	α-helix	trans	-66.8	-47.3	177.6	-70.2	171.6	-170.8	0	0	110.3	L62 N302 V303 L307 C308 C309	L62-E305 HydrophobicContact CD2-CB 4.31Å; N302-E305 HydrophobicContact CB-CB 4.25Å; N302-E305 HydrophobicContact CB-CG 4.43Å; N302-E305 WeakPolarHBondContact CB-OE2 3.3Å; N302-E305 PolarHBondContact ND2-OE2 2.85Å; N302-E305 PolarHBondContact O-N 3.42Å; N302-E305 VanDerWaalsContact O-N 3.11Å; V303-E305 PolarHBondContact O-N 3.28Å; E305-L307 VanDerWaalsContact C-N 3.34Å; E305-L307 PolarHBondContact O-N 3.22Å; E305-C308 PolarHBondContact O-N 2.95Å; E305-C309 PolarHBondContact O-SG 3.49Å
306	Q	97.9	Very high	96.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.4	-40.3	176.6	-63.3	177.2	0.8	0	0	112	F251 T254 M258 N302 V303 C308 C309	F251-Q306 PolarHBondContact O-OE1 3.02Å; T254-Q306 PolarHBondContact OG1-OE1 2.98Å; M258-Q306 HydrophobicContact CE-CG 4.13Å; M258-Q306 HydrophobicContact SD-CB 4.14Å; M258-Q306 HydrophobicContact SD-CG 3.99Å; N302-Q306 PolarHBondContact O-N 2.91Å; N302-Q306 PolarHBondContact OD1-NE2 3.01Å; V303-Q306 PolarHBondContact O-N 3.3Å; Q306-C308 VanDerWaalsContact C-N 3.29Å; Q306-C308 PolarHBondContact O-N 3.45Å; Q306-C309 WeakPolarHBondContact O-CB 3.46Å; Q306-C309 PolarHBondContact O-N 3.05Å; Q306-C309 VanDerWaalsContact O-N 3.1Å
307	L	98.3	Very high	96.5	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-58.1	-41.5	177.3	173.9	60.9	0	0	0	111.9	T254 L266 L268 V303 E305 C309 Y310 V314 L347 L351	T254-L307 HydrophobicContact CG2-CB 3.9Å; T254-L307 HydrophobicContact CG2-CD1 4.44Å; L266-L307 HydrophobicContact CD2-CD1 3.57Å; L268-L307 HydrophobicContact CD1-CD1 4.27Å; L268-L307 HydrophobicContact CD1-CD2 4.4Å; V303-L307 WeakPolarHBondContact O-CB 3.49Å; V303-L307 PolarHBondContact O-N 2.88Å; E305-L307 VanDerWaalsContact C-N 3.34Å; E305-L307 PolarHBondContact O-N 3.22Å; L307-C309 PolarHBondContact O-N 3.4Å; L307-Y310 PolarHBondContact O-N 3.45Å; L307-V314 HydrophobicContact CD1-CG1 3.87Å; L307-V314 HydrophobicContact CD1-CG2 3.87Å; L307-L347 HydrophobicContact CB-CD1 4.47Å; L307-L347 HydrophobicContact CD2-CD1 3.46Å; L307-L347 VanDerWaalsContact CD2-CD1 3.46Å; L307-L347 HydrophobicContact CD2-CD2 4.4Å; L307-L347 HydrophobicContact CD2-CG 3.75Å; L307-L351 HydrophobicContact CD1-CD1 4.29Å; L307-L351 HydrophobicContact CD2-CB 4.06Å; L307-L351 HydrophobicContact CD2-CD1 4.21Å; L307-L351 HydrophobicContact CD2-CD2 4.45Å; L307-L351 HydrophobicContact CD2-CG 4.48Å; L307-L351 HydrophobicContact CG-CD1 4.03Å
308	C	97	Very high	96.7	Very high	23 Å²	23	15.7 Å²	15.7	16%	0.155	9%	0.092	C	C	.	.	H	α-helix	trans	-64.7	-24.5	179.3	-71.5	0	0	0	0	112.7	A304 E305 Q306 Y310 H354	A304-C308 PolarHBondContact O-N 2.99Å; A304-C308 PolarHBondContact O-SG 3Å; E305-C308 PolarHBondContact O-N 2.95Å; Q306-C308 VanDerWaalsContact C-N 3.29Å; Q306-C308 PolarHBondContact O-N 3.45Å; C308-Y310 VanDerWaalsContact C-N 3.33Å; C308-H354 HydrophobicContact CB-CB 4.16Å; C308-H354 PolarHBondContact O-CD2 3.04Å; C308-H354 PolarHBondContact O-NE2 2.86Å; C308-H354 VanDerWaalsContact O-NE2 3.09Å; C308-H354 VanDerWaalsContact SG-CB 3.54Å
309	C	96.1	Very high	96.6	Very high	68 Å²	68	14 Å²	14	46%	0.459	8%	0.084	S	C	.	.	H	α-helix	trans	-78.1	-15.5	177.6	-60.8	0	0	0	0	114	M258 E305 Q306 L307 P311	M258-C309 HydrophobicContact CB-CB 4.08Å; M258-C309 HydrophobicContact CG-CB 3.55Å; M258-C309 HydrophobicContact SD-CB 4.1Å; E305-C309 PolarHBondContact O-SG 3.49Å; Q306-C309 WeakPolarHBondContact O-CB 3.46Å; Q306-C309 PolarHBondContact O-N 3.05Å; Q306-C309 VanDerWaalsContact O-N 3.1Å; L307-C309 PolarHBondContact O-N 3.4Å; C309-P311 WeakPolarHBondContact O-CD 3.37Å
310	Y	95.9	Very high	96.5	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	9%	0.088	C	C	.	.			trans	-85.7	119.5	-179.9	174.9	-126.3	0	0	0	111.1	T257 L263 A265 L266 L307 C308 G312 P313 V314 R355	T257-Y310 HydrophobicContact CG2-CD2 4.35Å; T257-Y310 HydrophobicContact CG2-CE1 4.47Å; T257-Y310 HydrophobicContact CG2-CE2 4.27Å; T257-Y310 HydrophobicContact CG2-CG 4.5Å; T257-Y310 WeakPolarHBondContact O-CD2 3.41Å; L263-Y310 PolarHBondContact O-OH 2.97Å; A265-Y310 VanDerWaalsContact CA-OH 3.26Å; A265-Y310 WeakPolarHBondContact CA-OH 3.41Å; A265-Y310 PolarHBondContact N-OH 3.16Å; L266-Y310 HydrophobicContact CB-CD1 3.96Å; L266-Y310 HydrophobicContact CB-CE1 3.61Å; L266-Y310 HydrophobicContact CD2-CD1 4.15Å; L307-Y310 PolarHBondContact O-N 3.45Å; C308-Y310 VanDerWaalsContact C-N 3.33Å; Y310-G312 VanDerWaalsContact CE1-C 3.48Å; Y310-P313 WeakPolarHBondContact CE1-O 3.37Å; Y310-V314 HydrophobicContact CD1-CG2 3.7Å; Y310-V314 HydrophobicContact CE1-CG2 3.96Å; Y310-R355 PolarHBondContact O-NH2 3.21Å
311	P	93.6	Very high	96.3	Very high	41 Å²	41	19.3 Å²	19.3	27%	0.266	11%	0.109	S	C	.	.			trans	-81.6	-15.6	-178.1	31.4	-35	0	0	0	113.8	P261 C309 F422	P261-P311 HydrophobicContact CB-CG 4.05Å; C309-P311 WeakPolarHBondContact O-CD 3.37Å; P311-F422 WeakPolarHBondContact O-CE2 3.48Å
312	G	95.3	Very high	96	Very high	2 Å²	2	19.6 Å²	19.6	2%	0.021	11%	0.111	C	C	.	.	S	Bend	trans	-81.1	-173	-172.5	0	0	0	0	0	115.7	Y310 R355 H418	Y310-G312 VanDerWaalsContact CE1-C 3.48Å; G312-R355 VanDerWaalsContact O-CZ 3.3Å; G312-R355 PolarHBondContact O-NH1 2.86Å; G312-R355 PolarHBondContact O-NH2 2.86Å; G312-H418 VanDerWaalsContact CA-CG 3.45Å
313	P	97.4	Very high	95.7	Very high	33 Å²	33	23.5 Å²	23.5	21%	0.214	13%	0.132	C	C	.	.			trans	-66.1	134.1	-179.9	-22	33.9	0	0	0	113.4	G264 L266 Y310 P466	G264-P313 WeakPolarHBondContact O-CD 3.48Å; L266-P313 PolarHBondContact N-O 3.05Å; Y310-P313 WeakPolarHBondContact CE1-O 3.37Å; P313-P466 HydrophobicContact CB-CB 3.66Å; P313-P466 HydrophobicContact CB-CG 4.21Å
314	V	98.6	Very high	95.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.1	-178	177.5	0	0	0	0	111.1	L266 L307 Y310 L316 L351 H446	L266-V314 HydrophobicContact CB-CG2 4.27Å; L266-V314 HydrophobicContact CD2-CG2 4.3Å; L266-V314 WeakPolarHBondContact O-CA 3.4Å; L307-V314 HydrophobicContact CD1-CG1 3.87Å; L307-V314 HydrophobicContact CD1-CG2 3.87Å; Y310-V314 HydrophobicContact CD1-CG2 3.7Å; Y310-V314 HydrophobicContact CE1-CG2 3.96Å; V314-L316 HydrophobicContact CG1-CD2 3.86Å; V314-L316 HydrophobicContact CG1-CG 4.39Å; V314-L351 HydrophobicContact CB-CD2 4.19Å; V314-L351 HydrophobicContact CG1-CD2 3.9Å; V314-H446 PolarHBondContact O-ND1 3Å
315	L	98.8	Very high	95.1	Very high	12 Å²	12	25.8 Å²	25.8	6%	0.063	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.7	168.6	-179.6	63.1	0	0	0	110.3	L266 V267 L268 L317 K448 Q464 P466	L266-L315 PolarHBondContact O-N 3.43Å; V267-L315 WeakPolarHBondContact CA-O 3.22Å; L268-L315 PolarHBondContact N-O 2.77Å; L315-L317 HydrophobicContact CD2-CD2 3.76Å; L315-L317 HydrophobicContact CG-CD2 3.94Å; L315-K448 HydrophobicContact CD1-CB 4.17Å; L315-Q464 HydrophobicContact CD2-CB 4.27Å; L315-Q464 WeakPolarHBondContact CD2-O 3.38Å; L315-P466 HydrophobicContact CB-CB 3.91Å; L315-P466 HydrophobicContact CB-CG 3.75Å
316	L	98.7	Very high	94.8	Very high	5 Å²	5	22.7 Å²	22.7	3%	0.026	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.4	172.7	-52.3	-176.1	0	0	0	108.8	L268 V314 L347 L348 H446 L447 K448	L268-L316 HydrophobicContact CB-CD2 3.8Å; L268-L316 HydrophobicContact CD1-CD2 3.76Å; L268-L316 HydrophobicContact CG-CD2 4.23Å; L268-L316 CarbonylContact O-C 3.59Å; L268-L316 WeakPolarHBondContact O-CA 3.38Å; V314-L316 HydrophobicContact CG1-CD2 3.86Å; V314-L316 HydrophobicContact CG1-CG 4.39Å; L316-L347 HydrophobicContact CD1-CD2 4.41Å; L316-L347 HydrophobicContact CD1-CG 4.23Å; L316-L347 HydrophobicContact CD2-CD2 4Å; L316-L347 HydrophobicContact CD2-CG 4.44Å; L316-L348 HydrophobicContact CD1-CB 3.84Å; L316-L348 HydrophobicContact CD1-CD1 4.03Å; L316-H446 WeakPolarHBondContact CB-O 3.25Å; L316-H446 PolarHBondContact N-O 2.96Å; L316-L447 HydrophobicContact CB-CD1 3.52Å; L316-L447 HydrophobicContact CD1-CD1 4.28Å; L316-L447 CarbonylContact O-C 3.57Å; L316-L447 WeakPolarHBondContact O-CA 3.41Å; L316-K448 PolarHBondContact O-N 3.37Å
317	L	98.2	Very high	94.3	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	107.5	170.6	-53.9	-178.3	0	0	0	108.4	V267 L268 D269 A270 L315 K448 V450 L458	V267-L317 HydrophobicContact CG1-CD1 4.07Å; V267-L317 HydrophobicContact CG1-CG 4.22Å; L268-L317 PolarHBondContact O-N 3.37Å; D269-L317 HydrophobicContact CB-CB 4.03Å; D269-L317 HydrophobicContact CB-CD1 4.18Å; A270-L317 PolarHBondContact N-O 2.78Å; L315-L317 HydrophobicContact CD2-CD2 3.76Å; L315-L317 HydrophobicContact CG-CD2 3.94Å; L317-K448 WeakPolarHBondContact CA-O 3.48Å; L317-K448 HydrophobicContact CD2-CB 3.87Å; L317-K448 HydrophobicContact CD2-CD 3.99Å; L317-K448 HydrophobicContact CD2-CG 4.3Å; L317-V450 HydrophobicContact CB-CG2 4.37Å; L317-L458 HydrophobicContact CD1-CD1 4.25Å; L317-L458 HydrophobicContact CD1-CD2 3.65Å
318	R	96.4	Very high	93.2	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.015	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.7	178.4	-174.7	-176.9	70.8	159.6	7.4	109.8	T320 N345 L372 L447 K448 N449 V450	R318-T320 PolarHBondContact O-N 3.5Å; R318-N345 VanDerWaalsContact CD-OD1 3.24Å; R318-N345 WeakPolarHBondContact CD-OD1 3.38Å; R318-N345 PolarHBondContact NH1-OD1 2.89Å; R318-L372 PolarHBondContact NH1-O 3.03Å; R318-L447 HydrophobicContact CB-CD1 3.7Å; R318-L447 HydrophobicContact CB-CD2 4.36Å; R318-L447 HydrophobicContact CB-CG 4.23Å; R318-K448 PolarHBondContact N-O 3.07Å; R318-N449 PolarHBondContact NE-OD1 2.94Å; R318-N449 PolarHBondContact NH2-ND2 3.29Å; R318-N449 VanDerWaalsContact NH2-ND2 3.16Å; R318-N449 PolarHBondContact NH2-OD1 3.44Å; R318-N449 WeakPolarHBondContact O-CA 3.16Å; R318-V450 PolarHBondContact O-N 3.28Å
319	R	94.2	Very high	91.4	Very high	6 Å²	6	28.3 Å²	28.3	2%	0.023	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	120	174.4	-63.3	-170.6	-174	-150.9	-0.2	110.5	D269 A270 Q321 D322 N342 V450 T453 H454 S456	D269-R319 IonicContact OD1-CZ 2.63Å; D269-R319 IonicContact OD1-NE 3.98Å; D269-R319 PolarHBondContact OD1-NE 3.27Å; D269-R319 IonicContact OD1-NH2 3.75Å; D269-R319 IonicContact OD2-CZ 2.92Å; D269-R319 IonicContact OD2-NE 2.76Å; D269-R319 PolarHBondContact OD2-NE 3.46Å; D269-R319 IonicContact OD2-NH2 3.99Å; D269-R319 PolarHBondContact OD2-NH2 3.08Å; A270-R319 HydrophobicContact CB-CG 4.02Å; R319-Q321 VanDerWaalsContact C-N 3.32Å; R319-Q321 PolarHBondContact O-N 3.47Å; R319-D322 HydrophobicContact CB-CB 3.92Å; R319-D322 VanDerWaalsContact O-CB 3.31Å; R319-D322 WeakPolarHBondContact O-CB 3.36Å; R319-D322 PolarHBondContact O-N 2.77Å; R319-N342 PolarHBondContact O-ND2 3Å; R319-V450 WeakPolarHBondContact CA-O 3.31Å; R319-T453 VanDerWaalsContact CD-O 3.27Å; R319-T453 WeakPolarHBondContact CD-O 3.17Å; R319-T453 PolarHBondContact NH1-O 2.84Å; R319-H454 PolarHBondContact NH1-O 3.36Å; R319-S456 PolarHBondContact NH1-O 3.2Å; R319-S456 PolarHBondContact NH2-O 3.23Å
320	T	92.1	Very high	89.2	Confident	16 Å²	16	29.9 Å²	29.9	10%	0.098	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-17.4	-170.6	60.7	0	0	0	0	113.5	R318 V339 N449 V450 E451	R318-T320 PolarHBondContact O-N 3.5Å; T320-V339 HydrophobicContact CG2-CG1 4.44Å; T320-N449 HydrophobicContact CG2-CB 3.84Å; T320-V450 PolarHBondContact N-O 2.88Å; T320-V450 PolarHBondContact OG1-O 3.35Å; T320-E451 WeakPolarHBondContact OG1-CA 3.23Å
321	Q	90.7	Very high	86.7	Confident	112 Å²	112	38 Å²	38	52%	0.523	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	25.7	177.7	-48.3	176.8	20.9	0	0	111.8	R319 A452 T453	R319-Q321 VanDerWaalsContact C-N 3.32Å; R319-Q321 PolarHBondContact O-N 3.47Å; Q321-A452 WeakPolarHBondContact CB-O 3.4Å; Q321-A452 PolarHBondContact N-O 3.39Å; Q321-A452 VanDerWaalsContact N-O 3.16Å; Q321-T453 HydrophobicContact CB-CG2 4.27Å
322	D	90.5	Very high	84.3	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.037	24%	0.239	C	C	.	.			trans	-86.7	114.3	-178.5	-164.5	-39.2	0	0	0	112	A270 R319 V324 V325 S326 H454	A270-D322 WeakPolarHBondContact CB-OD2 3.08Å; R319-D322 HydrophobicContact CB-CB 3.92Å; R319-D322 VanDerWaalsContact O-CB 3.31Å; R319-D322 WeakPolarHBondContact O-CB 3.36Å; R319-D322 PolarHBondContact O-N 2.77Å; D322-V324 PolarHBondContact OD1-N 3.48Å; D322-V325 HydrophobicContact CB-CG2 4.5Å; D322-V325 PolarHBondContact OD1-N 3.49Å; D322-V325 WeakPolarHBondContact OD2-CG2 2.89Å; D322-S326 WeakPolarHBondContact O-CB 3.44Å; D322-H454 VanDerWaalsContact CG-ND1 3.3Å; D322-H454 IonicContact OD1-CG 2.65Å; D322-H454 IonicContact OD1-ND1 2.8Å; D322-H454 PolarHBondContact OD1-ND1 3.28Å; D322-H454 IonicContact OD2-CE1 3.17Å; D322-H454 IonicContact OD2-CG 3.64Å; D322-H454 IonicContact OD2-ND1 2.68Å; D322-H454 PolarHBondContact OD2-ND1 2.81Å
323	D	88.1	Confident	81.9	Confident	84 Å²	84	52 Å²	52	45%	0.449	28%	0.276	S	S	.	.			trans	-99.4	-12.1	175.6	68.3	-30.3	0	0	0	113.1	K281 L334	K281-D323 PolarHBondContact NZ-O 3.07Å; D323-L334 HydrophobicContact CB-CD1 3.69Å
324	V	90.3	Very high	79.7	Confident	56 Å²	56	53.3 Å²	53.3	34%	0.339	28%	0.281	S	S	.	.	S	Bend	trans	-76.9	-54.3	-176.9	177.6	0	0	0	0	110	D322 S326 H454 F455	D322-V324 PolarHBondContact OD1-N 3.48Å; V324-S326 PolarHBondContact O-N 3Å; V324-H454 HydrophobicContact CB-CB 3.92Å; V324-H454 HydrophobicContact CG2-CB 3.57Å; V324-F455 HydrophobicContact CG2-CE2 3.7Å; V324-F455 HydrophobicContact CG2-CZ 3.89Å
325	V	92.5	Very high	77.3	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.012	31%	0.312	C	S	.	.	S	Bend	trans	-92.4	26.3	178.4	-59.7	0	0	0	0	112.4	A270 F272 L278 D322 R343	A270-V325 WeakPolarHBondContact O-CG1 3.36Å; F272-V325 HydrophobicContact CB-CB 4.43Å; F272-V325 HydrophobicContact CD1-CG1 3.82Å; L278-V325 HydrophobicContact CD1-CB 4.38Å; L278-V325 HydrophobicContact CD1-CG1 4.21Å; D322-V325 HydrophobicContact CB-CG2 4.5Å; D322-V325 PolarHBondContact OD1-N 3.49Å; D322-V325 WeakPolarHBondContact OD2-CG2 2.89Å; V325-R343 WeakPolarHBondContact O-CB 3.33Å; V325-R343 VanDerWaalsContact O-CG 3.24Å; V325-R343 WeakPolarHBondContact O-CG 3.29Å; V325-R343 PolarHBondContact O-N 3.01Å
326	S	90.7	Very high	74.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-109.5	133.8	174.4	-179.8	0	0	0	0	110.9	K281 D322 V324 S328 G341	K281-S326 WeakPolarHBondContact CD-O 3.38Å; K281-S326 WeakPolarHBondContact CE-O 3.45Å; K281-S326 PolarHBondContact NZ-O 2.89Å; D322-S326 WeakPolarHBondContact O-CB 3.44Å; V324-S326 PolarHBondContact O-N 3Å; S326-S328 VanDerWaalsContact C-N 3.29Å; S326-S328 PolarHBondContact OG-N 3.24Å; S326-G341 CarbonylContact C-O 3.55Å; S326-G341 VanDerWaalsContact CA-O 3.26Å; S326-G341 WeakPolarHBondContact CA-O 3.41Å; S326-G341 PolarHBondContact OG-O 2.92Å
327	T	87.8	Confident	72.5	Confident	57 Å²	57	65.5 Å²	65.5	35%	0.35	37%	0.371	S	S	.	.			trans	-82.4	-6.2	172.7	46.3	0	0	0	0	113.7	P277 L278 G341 R343	P277-T327 HydrophobicContact CB-CG2 3.63Å; L278-T327 HydrophobicContact CD2-CG2 4.3Å; T327-G341 PolarHBondContact N-O 2.76Å; T327-G341 PolarHBondContact OG1-O 2.94Å; T327-R343 HydrophobicContact CG2-CG 4.37Å
328	S	74.2	Confident	71	Confident	41 Å²	41	66.7 Å²	66.7	29%	0.287	38%	0.384	S	S	.	.			trans	-73.2	142.6	173	-70.2	0	0	0	0	110.7	K281 S326 G341	K281-S328 PolarHBondContact NZ-O 2.67Å; S326-S328 VanDerWaalsContact C-N 3.29Å; S326-S328 PolarHBondContact OG-N 3.24Å; S328-G341 WeakPolarHBondContact OG-CA 3.34Å; S328-G341 PolarHBondContact OG-N 3.3Å
329	G	58.8	Low	70.4	Confident	44 Å²	44	66.6 Å²	66.6	45%	0.454	38%	0.384	S	S	.	.			trans	100.6	46.9	163.3	0	0	0	0	0	118.5
330	R	50.2	Low	70	Confident	100 Å²	100	71.9 Å²	71.9	38%	0.377	41%	0.409	S	S	.	.	S	Bend	trans	-75.4	-26.6	161.7	-90.7	-165.3	-179.4	-132.2	-5.3	114.3	L280 K281 M283 H285	L280-R330 PolarHBondContact O-NH2 2.96Å; K281-R330 PolarHBondContact O-NE 2.87Å; K281-R330 PolarHBondContact O-NH2 2.83Å; M283-R330 PolarHBondContact O-NH1 2.82Å; M283-R330 PolarHBondContact O-NH2 2.86Å; H285-R330 PolarHBondContact CD2-NH1 2.93Å; H285-R330 PolarHBondContact CE1-NE 3.21Å; H285-R330 PolarHBondContact CE1-NH1 3.08Å; H285-R330 VanDerWaalsContact CE1-NH1 3.28Å; H285-R330 WeakPolarHBondContact NE2-CD 3.17Å; H285-R330 PolarHBondContact NE2-NH1 2.79Å
331	L	44	Very low	69.8	Low	171 Å²	171	71.5 Å²	71.5	90%	0.895	41%	0.408	S	S	*	.	S	Bend	trans	-136.9	2	-165.8	-73.9	167.7	0	0	0	115.2
332	R	42.7	Very low	69.9	Low	214 Å²	214	66.4 Å²	66.4	81%	0.808	38%	0.384	S	S	*	.	S	Bend	trans	-144.8	141.7	170.8	-79.3	-173.3	179	162.5	-0.3	109	L334	R332-L334 PolarHBondContact O-N 3.16Å
333	P	45.7	Very low	70.2	Confident	123 Å²	123	67.9 Å²	67.9	80%	0.799	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-48	136.1	161.2	-19.9	30.3	0	0	0	108.3	S335	P333-S335 PolarHBondContact O-N 3.34Å; P333-S335 VanDerWaalsContact O-N 3.13Å
334	L	50.7	Low	70.6	Confident	62 Å²	62	64.2 Å²	64.2	33%	0.325	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-51.4	124.1	168.8	-81.1	152.8	0	0	0	107.4	D323 R332 G338	D323-L334 HydrophobicContact CB-CD1 3.69Å; R332-L334 PolarHBondContact O-N 3.16Å; L334-G338 WeakPolarHBondContact CD2-O 3.35Å
335	S	48.5	Very low	70.9	Confident	93 Å²	93	62 Å²	62	65%	0.65	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-55.7	140.3	162.2	-60.3	0	0	0	0	107.2	P333 G337 G338	P333-S335 PolarHBondContact O-N 3.34Å; P333-S335 VanDerWaalsContact O-N 3.13Å; S335-G337 PolarHBondContact O-N 2.85Å; S335-G337 VanDerWaalsContact O-N 3.09Å; S335-G338 PolarHBondContact O-N 3.4Å
336	P	45.1	Very low	71.1	Confident	138 Å²	138	65 Å²	65	90%	0.896	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.7	123.1	170.7	-24.8	31.9	0	0	0	109.6
337	G	52.3	Low	71.4	Confident	41 Å²	41	65 Å²	65	42%	0.423	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	13.4	-177.3	0	0	0	0	0	116.9	S335 V339	S335-G337 PolarHBondContact O-N 2.85Å; S335-G337 VanDerWaalsContact O-N 3.09Å; G337-V339 PolarHBondContact O-N 2.97Å
338	G	66.4	Low	71.9	Confident	29 Å²	29	62.3 Å²	62.3	30%	0.299	36%	0.355	S	S	.	.			trans	-71.6	59.1	176.8	0	0	0	0	0	115.6	L334 S335 E340	L334-G338 WeakPolarHBondContact CD2-O 3.35Å; S335-G338 PolarHBondContact O-N 3.4Å; G338-E340 VanDerWaalsContact C-N 3.34Å; G338-E340 PolarHBondContact O-N 2.87Å
339	V	83.5	Confident	73.1	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.018	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-78.8	-11.1	-178	-64	0	0	0	0	114.5	T320 G337 G341 N342 N345 L372 A374	T320-V339 HydrophobicContact CG2-CG1 4.44Å; G337-V339 PolarHBondContact O-N 2.97Å; V339-G341 PolarHBondContact O-N 2.95Å; V339-N342 VanDerWaalsContact O-CB 3.3Å; V339-N342 WeakPolarHBondContact O-CB 3.24Å; V339-N342 PolarHBondContact O-N 2.93Å; V339-N342 VanDerWaalsContact O-N 3.08Å; V339-N345 PolarHBondContact O-ND2 3.01Å; V339-L372 VanDerWaalsContact CG2-O 3.29Å; V339-L372 WeakPolarHBondContact CG2-O 3.26Å; V339-A374 WeakPolarHBondContact CG2-O 3.39Å
340	E	84.8	Confident	75	Confident	117 Å²	117	65 Å²	65	55%	0.547	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-59.7	-35.5	-174.4	-175.5	167.3	-149.5	0	0	112.5	G338 N345 R373	G338-E340 VanDerWaalsContact C-N 3.34Å; G338-E340 PolarHBondContact O-N 2.87Å; E340-N345 PolarHBondContact O-ND2 3.49Å; E340-N345 VanDerWaalsContact O-ND2 3.14Å; E340-R373 HydrophobicContact CG-CG 4.49Å; E340-R373 IonicContact OE1-CZ 3.72Å; E340-R373 IonicContact OE1-NE 2.9Å; E340-R373 PolarHBondContact OE1-NE 3.21Å; E340-R373 IonicContact OE1-NH2 3.68Å; E340-R373 PolarHBondContact OE1-NH2 2.92Å
341	G	88	Confident	77.3	Confident	7 Å²	7	60.3 Å²	60.3	7%	0.072	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-82.9	-5.8	179.6	0	0	0	0	0	115.2	S326 T327 S328 V339 R343	S326-G341 CarbonylContact C-O 3.55Å; S326-G341 VanDerWaalsContact CA-O 3.26Å; S326-G341 WeakPolarHBondContact CA-O 3.41Å; S326-G341 PolarHBondContact OG-O 2.92Å; T327-G341 PolarHBondContact N-O 2.76Å; T327-G341 PolarHBondContact OG1-O 2.94Å; S328-G341 WeakPolarHBondContact OG-CA 3.34Å; S328-G341 PolarHBondContact OG-N 3.3Å; V339-G341 PolarHBondContact O-N 2.95Å; G341-R343 PolarHBondContact O-N 2.96Å
342	N	94.2	Very high	79.9	Confident	6 Å²	6	52.1 Å²	52.1	3%	0.032	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-65.2	125.2	-178.9	-172.8	-55.1	0	0	0	110.2	R319 V339 G344 N345	R319-N342 PolarHBondContact O-ND2 3Å; V339-N342 VanDerWaalsContact O-CB 3.3Å; V339-N342 WeakPolarHBondContact O-CB 3.24Å; V339-N342 PolarHBondContact O-N 2.93Å; V339-N342 VanDerWaalsContact O-N 3.08Å; N342-G344 PolarHBondContact O-N 3.42Å; N342-G344 WeakPolarHBondContact OD1-CA 3.43Å; N342-G344 PolarHBondContact OD1-N 2.92Å; N342-N345 WeakPolarHBondContact O-CB 3.25Å; N342-N345 PolarHBondContact O-N 3.27Å; N342-N345 PolarHBondContact O-ND2 3.33Å
343	R	95.9	Very high	82.5	Confident	38 Å²	38	44.7 Å²	44.7	14%	0.143	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-16.8	-175.8	-64.5	-51.3	-65.6	179	-0.2	114	F272 D273 L278 V325 T327 G341 N345 E346 L347	F272-R343 HydrophobicContact CB-CB 3.5Å; F272-R343 HydrophobicContact CB-CG 4.16Å; D273-R343 IonicContact OD1-CZ 3.84Å; D273-R343 IonicContact OD1-NE 3.96Å; D273-R343 PolarHBondContact OD1-NE 2.94Å; D273-R343 IonicContact OD1-NH2 3.47Å; D273-R343 PolarHBondContact OD1-NH2 3.28Å; D273-R343 IonicContact OD2-CZ 3.75Å; D273-R343 IonicContact OD2-NE 3.21Å; D273-R343 IonicContact OD2-NH2 3.96Å; D273-R343 PolarHBondContact OD2-NH2 3.45Å; L278-R343 HydrophobicContact CD2-CG 3.74Å; L278-R343 HydrophobicContact CG-CG 4.21Å; V325-R343 WeakPolarHBondContact O-CB 3.33Å; V325-R343 VanDerWaalsContact O-CG 3.24Å; V325-R343 WeakPolarHBondContact O-CG 3.29Å; V325-R343 PolarHBondContact O-N 3.01Å; T327-R343 HydrophobicContact CG2-CG 4.37Å; G341-R343 PolarHBondContact O-N 2.96Å; R343-N345 PolarHBondContact O-N 3.12Å; R343-E346 PolarHBondContact O-N 3.26Å; R343-L347 PolarHBondContact O-N 2.99Å; R343-L347 VanDerWaalsContact O-N 3.14Å
344	G	96.4	Very high	85	Confident	7 Å²	7	42.4 Å²	42.4	7%	0.072	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-23.4	167.2	0	0	0	0	0	113.4	N342 L348	N342-G344 PolarHBondContact O-N 3.42Å; N342-G344 WeakPolarHBondContact OD1-CA 3.43Å; N342-G344 PolarHBondContact OD1-N 2.92Å; G344-L348 PolarHBondContact O-N 3.36Å
345	N	96.7	Very high	87.3	Confident	9 Å²	9	39.7 Å²	39.7	5%	0.048	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-50.5	173.8	-63.4	-13.2	0	0	0	111.6	R318 V339 E340 N342 R343 L347 L348 L349 L372	R318-N345 VanDerWaalsContact CD-OD1 3.24Å; R318-N345 WeakPolarHBondContact CD-OD1 3.38Å; R318-N345 PolarHBondContact NH1-OD1 2.89Å; V339-N345 PolarHBondContact O-ND2 3.01Å; E340-N345 PolarHBondContact O-ND2 3.49Å; E340-N345 VanDerWaalsContact O-ND2 3.14Å; N342-N345 WeakPolarHBondContact O-CB 3.25Å; N342-N345 PolarHBondContact O-N 3.27Å; N342-N345 PolarHBondContact O-ND2 3.33Å; R343-N345 PolarHBondContact O-N 3.12Å; N345-L347 VanDerWaalsContact C-N 3.29Å; N345-L347 PolarHBondContact O-N 3.2Å; N345-L348 PolarHBondContact O-N 3.49Å; N345-L349 VanDerWaalsContact O-CG 3.3Å; N345-L349 WeakPolarHBondContact O-CG 3.45Å; N345-L349 PolarHBondContact O-N 3.25Å; N345-L372 HydrophobicContact CB-CD1 4.01Å
346	E	96.8	Very high	89.6	Confident	65 Å²	65	35.7 Å²	35.7	30%	0.304	19%	0.194	S	C	.	.	H	α-helix	trans	-65.5	-37.7	178.5	-68.8	-58.5	142.8	0	0	110.7	D273 R343 L348 L349 R350	D273-E346 HydrophobicContact CB-CB 4.2Å; R343-E346 PolarHBondContact O-N 3.26Å; E346-L348 PolarHBondContact O-N 2.88Å; E346-L349 PolarHBondContact O-N 2.88Å; E346-R350 WeakPolarHBondContact O-CB 3.28Å; E346-R350 VanDerWaalsContact O-CG 3.29Å; E346-R350 WeakPolarHBondContact O-CG 2.97Å; E346-R350 PolarHBondContact O-N 2.7Å
347	L	97.4	Very high	92.1	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-46.3	175.5	-171.7	63.8	0	0	0	112.2	L268 T271 D273 V303 A304 L307 L316 R343 N345 R350 L351	L268-L347 HydrophobicContact CD1-CD2 4.03Å; T271-L347 HydrophobicContact CG2-CD2 3.5Å; T271-L347 VanDerWaalsContact CG2-CD2 3.5Å; D273-L347 HydrophobicContact CB-CB 4.18Å; D273-L347 HydrophobicContact CB-CD1 4.3Å; V303-L347 HydrophobicContact CG1-CD1 4.21Å; A304-L347 HydrophobicContact CB-CD1 3.76Å; L307-L347 HydrophobicContact CB-CD1 4.47Å; L307-L347 HydrophobicContact CD2-CD1 3.46Å; L307-L347 VanDerWaalsContact CD2-CD1 3.46Å; L307-L347 HydrophobicContact CD2-CD2 4.4Å; L307-L347 HydrophobicContact CD2-CG 3.75Å; L316-L347 HydrophobicContact CD1-CD2 4.41Å; L316-L347 HydrophobicContact CD1-CG 4.23Å; L316-L347 HydrophobicContact CD2-CD2 4Å; L316-L347 HydrophobicContact CD2-CG 4.44Å; R343-L347 PolarHBondContact O-N 2.99Å; R343-L347 VanDerWaalsContact O-N 3.14Å; N345-L347 VanDerWaalsContact C-N 3.29Å; N345-L347 PolarHBondContact O-N 3.2Å; L347-R350 PolarHBondContact O-N 2.93Å; L347-L351 WeakPolarHBondContact O-CB 3.36Å; L347-L351 PolarHBondContact O-N 3.38Å
348	L	98.6	Very high	94.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-45.3	174.8	-179.7	67.4	0	0	0	111.6	L316 G344 N345 E346 R350 L351 L352 V368 W371 L372 A443 H446 L447	L316-L348 HydrophobicContact CD1-CB 3.84Å; L316-L348 HydrophobicContact CD1-CD1 4.03Å; G344-L348 PolarHBondContact O-N 3.36Å; N345-L348 PolarHBondContact O-N 3.49Å; E346-L348 PolarHBondContact O-N 2.88Å; L348-R350 PolarHBondContact O-N 2.86Å; L348-L351 PolarHBondContact O-N 3.24Å; L348-L352 HydrophobicContact CD1-CD1 4.01Å; L348-L352 HydrophobicContact CD1-CG 4.01Å; L348-L352 HydrophobicContact CD2-CD1 4.35Å; L348-L352 HydrophobicContact CG-CD1 3.92Å; L348-L352 HydrophobicContact CG-CG 4.25Å; L348-L352 WeakPolarHBondContact O-CG 3.04Å; L348-L352 PolarHBondContact O-N 3.26Å; L348-V368 HydrophobicContact CD2-CG1 4.41Å; L348-W371 HydrophobicContact CD2-CZ3 3.99Å; L348-L372 HydrophobicContact CD2-CD2 3.91Å; L348-A443 HydrophobicContact CD2-CB 4.08Å; L348-H446 HydrophobicContact CD1-CB 3.7Å; L348-L447 HydrophobicContact CD1-CB 4.16Å; L348-L447 HydrophobicContact CD2-CB 3.82Å; L348-L447 HydrophobicContact CD2-CD2 4.02Å; L348-L447 HydrophobicContact CD2-CG 4.37Å
349	L	98.6	Very high	95.8	Very high	3 Å²	3	29 Å²	29	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-60	-47.2	-179.4	-70.2	170.8	0	0	0	110.8	N345 E346 L351 L352 E353 M360 V368 I369 L372	N345-L349 VanDerWaalsContact O-CG 3.3Å; N345-L349 WeakPolarHBondContact O-CG 3.45Å; N345-L349 PolarHBondContact O-N 3.25Å; E346-L349 PolarHBondContact O-N 2.88Å; L349-L351 PolarHBondContact O-N 3.27Å; L349-L352 PolarHBondContact O-N 2.98Å; L349-E353 VanDerWaalsContact O-CB 3.24Å; L349-E353 WeakPolarHBondContact O-CB 3.34Å; L349-E353 WeakPolarHBondContact O-CG 3.26Å; L349-E353 PolarHBondContact O-N 3.26Å; L349-M360 HydrophobicContact CD2-CE 3.99Å; L349-V368 HydrophobicContact CD2-CB 4.25Å; L349-V368 HydrophobicContact CD2-CG1 3.78Å; L349-I369 HydrophobicContact CD1-CD1 4.26Å; L349-I369 HydrophobicContact CD1-CG1 3.83Å; L349-I369 HydrophobicContact CD2-CG1 4.02Å; L349-L372 HydrophobicContact CD1-CD1 4.31Å; L349-L372 HydrophobicContact CD2-CD1 4.18Å; L349-L372 HydrophobicContact CG-CD1 4.04Å
350	R	98.4	Very high	96.5	Very high	139 Å²	139	29.4 Å²	29.4	53%	0.525	14%	0.141	S	C	.	.	H	α-helix	trans	-59	-45.3	176.5	-71.3	-67.5	-168.4	142.2	4.8	112.2	A304 E346 L347 L348 E353 H354	A304-R350 HydrophobicContact CB-CB 4.16Å; A304-R350 HydrophobicContact CB-CG 4.18Å; E346-R350 WeakPolarHBondContact O-CB 3.28Å; E346-R350 VanDerWaalsContact O-CG 3.29Å; E346-R350 WeakPolarHBondContact O-CG 2.97Å; E346-R350 PolarHBondContact O-N 2.7Å; L347-R350 PolarHBondContact O-N 2.93Å; L348-R350 PolarHBondContact O-N 2.86Å; R350-E353 PolarHBondContact O-N 3.2Å; R350-H354 VanDerWaalsContact O-CB 3.31Å; R350-H354 WeakPolarHBondContact O-CB 3.38Å; R350-H354 PolarHBondContact O-N 2.94Å
351	L	98.6	Very high	96.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.7	-49.9	176.8	177.2	66	0	0	0	111.6	L307 V314 L347 L348 L349 H354 R355 H446	L307-L351 HydrophobicContact CD1-CD1 4.29Å; L307-L351 HydrophobicContact CD2-CB 4.06Å; L307-L351 HydrophobicContact CD2-CD1 4.21Å; L307-L351 HydrophobicContact CD2-CD2 4.45Å; L307-L351 HydrophobicContact CD2-CG 4.48Å; L307-L351 HydrophobicContact CG-CD1 4.03Å; V314-L351 HydrophobicContact CB-CD2 4.19Å; V314-L351 HydrophobicContact CG1-CD2 3.9Å; L347-L351 WeakPolarHBondContact O-CB 3.36Å; L347-L351 PolarHBondContact O-N 3.38Å; L348-L351 PolarHBondContact O-N 3.24Å; L349-L351 PolarHBondContact O-N 3.27Å; L351-H354 PolarHBondContact O-N 3.45Å; L351-R355 HydrophobicContact CD1-CG 4.13Å; L351-R355 WeakPolarHBondContact O-CB 3.3Å; L351-R355 WeakPolarHBondContact O-CG 3.35Å; L351-R355 PolarHBondContact O-N 3.06Å; L351-H446 HydrophobicContact CD2-CB 4.28Å
352	L	98.6	Very high	97.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.8	-38.3	-177.3	-65.8	179.5	0	0	0	112.2	L348 L349 H354 Y356 M360 V368 L442 A443	L348-L352 HydrophobicContact CD1-CD1 4.01Å; L348-L352 HydrophobicContact CD1-CG 4.01Å; L348-L352 HydrophobicContact CD2-CD1 4.35Å; L348-L352 HydrophobicContact CG-CD1 3.92Å; L348-L352 HydrophobicContact CG-CG 4.25Å; L348-L352 WeakPolarHBondContact O-CG 3.04Å; L348-L352 PolarHBondContact O-N 3.26Å; L349-L352 PolarHBondContact O-N 2.98Å; L352-H354 VanDerWaalsContact C-N 3.32Å; L352-Y356 HydrophobicContact CD2-CD2 4.02Å; L352-Y356 HydrophobicContact CD2-CE2 4.17Å; L352-Y356 CarbonylContact O-C 3.55Å; L352-Y356 WeakPolarHBondContact O-CA 3.18Å; L352-Y356 PolarHBondContact O-N 3.04Å; L352-M360 HydrophobicContact CB-CE 3.92Å; L352-M360 HydrophobicContact CB-CG 3.71Å; L352-M360 HydrophobicContact CB-SD 3.82Å; L352-M360 HydrophobicContact CD1-CE 4.28Å; L352-M360 HydrophobicContact CD1-SD 4.15Å; L352-M360 WeakPolarHBondContact O-CG 3.38Å; L352-V368 HydrophobicContact CD1-CG1 4.38Å; L352-L442 HydrophobicContact CD2-CB 3.92Å; L352-A443 HydrophobicContact CD1-CB 3.95Å
353	E	98.3	Very high	97.3	Very high	58 Å²	58	32 Å²	32	27%	0.271	16%	0.164	S	C	.	.	H	α-helix	trans	-63.8	-39.8	176.7	-75.6	168.4	-178.3	0	0	111.1	L349 R350 P357 M360 R365	L349-E353 VanDerWaalsContact O-CB 3.24Å; L349-E353 WeakPolarHBondContact O-CB 3.34Å; L349-E353 WeakPolarHBondContact O-CG 3.26Å; L349-E353 PolarHBondContact O-N 3.26Å; R350-E353 PolarHBondContact O-N 3.2Å; E353-P357 WeakPolarHBondContact O-CA 3.39Å; E353-P357 WeakPolarHBondContact O-CB 3.32Å; E353-M360 HydrophobicContact CG-CB 3.97Å; E353-M360 HydrophobicContact CG-CE 4.23Å; E353-M360 HydrophobicContact CG-CG 4.43Å; E353-R365 WeakPolarHBondContact OE1-CD 3.26Å; E353-R365 IonicContact OE1-CZ 3.65Å; E353-R365 IonicContact OE1-NE 2.75Å; E353-R365 PolarHBondContact OE1-NE 3.16Å; E353-R365 IonicContact OE1-NH2 3.53Å
354	H	97.9	Very high	97.4	Very high	74 Å²	74	30.2 Å²	30.2	34%	0.343	16%	0.157	S	C	.	.	H	α-helix	trans	-69.4	-50.4	174.4	-179.1	78.4	0	0	0	111.9	C308 R350 L351 L352 P423	C308-H354 HydrophobicContact CB-CB 4.16Å; C308-H354 PolarHBondContact O-CD2 3.04Å; C308-H354 PolarHBondContact O-NE2 2.86Å; C308-H354 VanDerWaalsContact O-NE2 3.09Å; C308-H354 VanDerWaalsContact SG-CB 3.54Å; R350-H354 VanDerWaalsContact O-CB 3.31Å; R350-H354 WeakPolarHBondContact O-CB 3.38Å; R350-H354 PolarHBondContact O-N 2.94Å; L351-H354 PolarHBondContact O-N 3.45Å; L352-H354 VanDerWaalsContact C-N 3.32Å; H354-P423 VanDerWaalsContact O-CB 3.25Å; H354-P423 WeakPolarHBondContact O-CB 3.49Å
355	R	97.6	Very high	97.4	Very high	6 Å²	6	34.3 Å²	34.3	2%	0.023	17%	0.171	C	C	.	.	H	α-helix	trans	-73.7	-33.3	-174.9	-70.1	-168.9	175.4	-163.1	3.9	113.8	Y310 G312 L351 F422 W424	Y310-R355 PolarHBondContact O-NH2 3.21Å; G312-R355 VanDerWaalsContact O-CZ 3.3Å; G312-R355 PolarHBondContact O-NH1 2.86Å; G312-R355 PolarHBondContact O-NH2 2.86Å; L351-R355 HydrophobicContact CD1-CG 4.13Å; L351-R355 WeakPolarHBondContact O-CB 3.3Å; L351-R355 WeakPolarHBondContact O-CG 3.35Å; L351-R355 PolarHBondContact O-N 3.06Å; R355-F422 HydrophobicContact CB-CB 4.48Å; R355-F422 HydrophobicContact CB-CD1 3.57Å; R355-F422 HydrophobicContact CB-CE1 3.86Å; R355-F422 HydrophobicContact CB-CG 3.94Å; R355-F422 HydrophobicContact CB-CZ 4.45Å; R355-F422 HydrophobicContact CG-CB 4.14Å; R355-F422 HydrophobicContact CG-CD1 3.76Å; R355-F422 HydrophobicContact CG-CD2 3.78Å; R355-F422 HydrophobicContact CG-CE1 4.09Å; R355-F422 HydrophobicContact CG-CE2 4.11Å; R355-F422 HydrophobicContact CG-CG 3.6Å; R355-F422 HydrophobicContact CG-CZ 4.26Å; R355-F422 WeakPolarHBondContact O-CD1 3.42Å; R355-W424 PolarHBondContact O-N 3.37Å
356	Y	98	Very high	97.5	Very high	8 Å²	8	35.9 Å²	35.9	3%	0.031	19%	0.185	C	C	.	.			trans	-137.3	58.1	-170.5	-49	-74.8	0	0	0	112.1	L352 A358 V359 M360 L398 F422 W424 V426 L442	L352-Y356 HydrophobicContact CD2-CD2 4.02Å; L352-Y356 HydrophobicContact CD2-CE2 4.17Å; L352-Y356 CarbonylContact O-C 3.55Å; L352-Y356 WeakPolarHBondContact O-CA 3.18Å; L352-Y356 PolarHBondContact O-N 3.04Å; Y356-A358 VanDerWaalsContact C-N 3.28Å; Y356-A358 PolarHBondContact O-N 2.64Å; Y356-V359 WeakPolarHBondContact O-CB 3.43Å; Y356-V359 PolarHBondContact O-N 3.42Å; Y356-M360 PolarHBondContact O-N 3.4Å; Y356-L398 HydrophobicContact CE1-CD2 4.44Å; Y356-F422 AromaticContact CE1-CE1 3.81Å; Y356-F422 HydrophobicContact CE1-CE1 3.81Å; Y356-F422 AromaticContact CZ-CE1 3.85Å; Y356-W424 HydrophobicContact CD1-CB 4.15Å; Y356-W424 HydrophobicContact CE1-CB 4.42Å; Y356-W424 HydrophobicContact CE1-CD2 4.41Å; Y356-W424 AromaticContact CE1-CE3 3.99Å; Y356-W424 HydrophobicContact CE1-CE3 3.99Å; Y356-V426 HydrophobicContact CD1-CG1 3.81Å; Y356-V426 HydrophobicContact CE1-CG1 4.47Å; Y356-L442 HydrophobicContact CD1-CD1 4.06Å; Y356-L442 HydrophobicContact CD2-CD1 3.65Å; Y356-L442 HydrophobicContact CD2-CD2 4.39Å; Y356-L442 HydrophobicContact CD2-CG 4.47Å; Y356-L442 HydrophobicContact CE1-CD1 4.34Å; Y356-L442 HydrophobicContact CE1-CD2 4.29Å; Y356-L442 HydrophobicContact CE2-CD1 3.95Å; Y356-L442 HydrophobicContact CE2-CD2 3.82Å; Y356-L442 HydrophobicContact CE2-CG 4.34Å; Y356-L442 HydrophobicContact CG-CD1 3.69Å
357	P	97.9	Very high	97.5	Very high	50 Å²	50	32.8 Å²	32.8	33%	0.325	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-37	-171.1	22.1	-34.6	0	0	0	113.3	E353 M360 A361 P423 L425	E353-P357 WeakPolarHBondContact O-CA 3.39Å; E353-P357 WeakPolarHBondContact O-CB 3.32Å; P357-M360 CarbonylContact O-C 3.53Å; P357-M360 PolarHBondContact O-N 3.24Å; P357-A361 PolarHBondContact O-N 3.03Å; P357-P423 HydrophobicContact CG-CB 3.9Å; P357-L425 HydrophobicContact CG-CD2 4.09Å
358	A	97.8	Very high	97.5	Very high	19 Å²	19	32.8 Å²	32.8	16%	0.157	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-32.4	178.1	0	0	0	0	0	113	Y356 A361 Q428 R435	Y356-A358 VanDerWaalsContact C-N 3.28Å; Y356-A358 PolarHBondContact O-N 2.64Å; A358-A361 WeakPolarHBondContact O-CB 3.33Å; A358-Q428 HydrophobicContact CB-CG 3.87Å; A358-R435 WeakPolarHBondContact O-CD 3.23Å
359	V	98.2	Very high	97.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-42	172.1	-176.2	0	0	0	0	110.6	Y356 A361 G364 V426 L438 A439 L442	Y356-V359 WeakPolarHBondContact O-CB 3.43Å; Y356-V359 PolarHBondContact O-N 3.42Å; V359-A361 PolarHBondContact O-N 2.79Å; V359-G364 WeakPolarHBondContact O-CA 3.28Å; V359-V426 HydrophobicContact CG2-CG1 3.97Å; V359-V426 WeakPolarHBondContact CG2-O 3.35Å; V359-L438 HydrophobicContact CG1-CB 4.06Å; V359-L438 HydrophobicContact CG1-CD2 4.25Å; V359-L438 HydrophobicContact CG1-CG 3.98Å; V359-L438 HydrophobicContact CG2-CD2 3.57Å; V359-L438 HydrophobicContact CG2-CG 4.12Å; V359-A439 HydrophobicContact CG1-CB 3.76Å; V359-L442 HydrophobicContact CG1-CD1 4.16Å; V359-L442 HydrophobicContact CG2-CD1 4.4Å
360	M	98	Very high	97.3	Very high	10 Å²	10	40 Å²	40	5%	0.049	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	14.6	-178.5	-66.3	-58.3	-70.7	0	0	114.3	L349 L352 E353 Y356 P357 R365 V368 A439	L349-M360 HydrophobicContact CD2-CE 3.99Å; L352-M360 HydrophobicContact CB-CE 3.92Å; L352-M360 HydrophobicContact CB-CG 3.71Å; L352-M360 HydrophobicContact CB-SD 3.82Å; L352-M360 HydrophobicContact CD1-CE 4.28Å; L352-M360 HydrophobicContact CD1-SD 4.15Å; L352-M360 WeakPolarHBondContact O-CG 3.38Å; E353-M360 HydrophobicContact CG-CB 3.97Å; E353-M360 HydrophobicContact CG-CE 4.23Å; E353-M360 HydrophobicContact CG-CG 4.43Å; Y356-M360 PolarHBondContact O-N 3.4Å; P357-M360 CarbonylContact O-C 3.53Å; P357-M360 PolarHBondContact O-N 3.24Å; M360-R365 HydrophobicContact CE-CB 4.32Å; M360-V368 HydrophobicContact CE-CB 4.34Å; M360-V368 HydrophobicContact CE-CG2 4.21Å; M360-V368 HydrophobicContact SD-CG2 4.13Å; M360-A439 HydrophobicContact SD-CB 4.14Å
361	A	93.4	Very high	97.2	Very high	21 Å²	21	33.4 Å²	33.4	17%	0.174	18%	0.175	C	C	.	.	S	Bend	trans	-46.2	161.5	162	0	0	0	0	0	111.5	P357 A358 V359 E363 G364 R365	P357-A361 PolarHBondContact O-N 3.03Å; A358-A361 WeakPolarHBondContact O-CB 3.33Å; V359-A361 PolarHBondContact O-N 2.79Å; A361-E363 PolarHBondContact O-N 3.39Å; A361-G364 WeakPolarHBondContact O-CA 3.37Å; A361-G364 PolarHBondContact O-N 2.81Å; A361-R365 PolarHBondContact O-N 3.16Å
362	P	95.6	Very high	97	Very high	107 Å²	107	33.6 Å²	33.6	70%	0.695	18%	0.177	S	C	*	.	H	α-helix	trans	-46.9	-37.4	-165.5	-32.3	36.2	0	0	0	115.7	A366	P362-A366 WeakPolarHBondContact O-CB 3.48Å; P362-A366 PolarHBondContact O-N 2.8Å
363	E	94.4	Very high	96.7	Very high	58 Å²	58	40 Å²	40	27%	0.271	20%	0.201	S	C	.	.	H	α-helix	trans	-73	-36.3	178.7	-47.4	100	124.8	0	0	113.9	A361 V367 S432 R435 R436	A361-E363 PolarHBondContact O-N 3.39Å; E363-V367 PolarHBondContact O-N 2.92Å; E363-S432 WeakPolarHBondContact OE1-CB 3.5Å; E363-S432 PolarHBondContact OE1-OG 3.35Å; E363-R435 IonicContact OE1-CZ 3.37Å; E363-R435 IonicContact OE1-NH1 3.64Å; E363-R435 IonicContact OE1-NH2 3.62Å; E363-R435 PolarHBondContact OE1-NH2 2.91Å; E363-R435 IonicContact OE2-CZ 3.51Å; E363-R435 IonicContact OE2-NH1 3.69Å; E363-R435 PolarHBondContact OE2-NH1 3.34Å; E363-R435 IonicContact OE2-NH2 2.77Å; E363-R436 HydrophobicContact CB-CG 4.26Å; E363-R436 WeakPolarHBondContact O-CG 3.44Å
364	G	97.3	Very high	96.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.7	-50.5	174.3	0	0	0	0	0	110.9	V359 A361 A366 V367 V368	V359-G364 WeakPolarHBondContact O-CA 3.28Å; A361-G364 WeakPolarHBondContact O-CA 3.37Å; A361-G364 PolarHBondContact O-N 2.81Å; G364-A366 VanDerWaalsContact C-N 3.34Å; G364-A366 PolarHBondContact O-N 2.76Å; G364-V367 WeakPolarHBondContact O-CG1 3.49Å; G364-V367 PolarHBondContact O-N 3.19Å; G364-V368 WeakPolarHBondContact O-CG2 3.44Å; G364-V368 PolarHBondContact O-N 2.84Å; G364-V368 VanDerWaalsContact O-N 3.09Å
365	R	97.9	Very high	95.3	Very high	92 Å²	92	34.8 Å²	34.8	35%	0.347	18%	0.182	S	C	.	.	H	α-helix	trans	-55.3	-48.4	174.4	-172.5	-178.8	-171.5	-78.8	-12.6	112.2	E353 M360 A361 V367 V368 I369	E353-R365 WeakPolarHBondContact OE1-CD 3.26Å; E353-R365 IonicContact OE1-CZ 3.65Å; E353-R365 IonicContact OE1-NE 2.75Å; E353-R365 PolarHBondContact OE1-NE 3.16Å; E353-R365 IonicContact OE1-NH2 3.53Å; M360-R365 HydrophobicContact CE-CB 4.32Å; A361-R365 PolarHBondContact O-N 3.16Å; R365-V367 VanDerWaalsContact C-N 3.3Å; R365-V367 PolarHBondContact O-N 2.98Å; R365-V368 PolarHBondContact O-N 3.13Å; R365-I369 HydrophobicContact CG-CD1 4.02Å; R365-I369 WeakPolarHBondContact O-CG1 3.33Å; R365-I369 PolarHBondContact O-N 3.34Å
366	A	97.5	Very high	94.8	Very high	43 Å²	43	36.2 Å²	36.2	36%	0.355	19%	0.193	S	C	.	.	H	α-helix	trans	-61.9	-35.6	-179.6	0	0	0	0	0	113.1	P362 G364 R370	P362-A366 WeakPolarHBondContact O-CB 3.48Å; P362-A366 PolarHBondContact O-N 2.8Å; G364-A366 VanDerWaalsContact C-N 3.34Å; G364-A366 PolarHBondContact O-N 2.76Å; A366-R370 WeakPolarHBondContact O-CG 3.49Å; A366-R370 PolarHBondContact O-N 2.71Å
367	V	97.7	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-73.7	-37.8	178.3	73.2	0	0	0	0	112.2	E363 G364 R365 R370 W371 F383 Y387 R436 A439 L440	E363-V367 PolarHBondContact O-N 2.92Å; G364-V367 WeakPolarHBondContact O-CG1 3.49Å; G364-V367 PolarHBondContact O-N 3.19Å; R365-V367 VanDerWaalsContact C-N 3.3Å; R365-V367 PolarHBondContact O-N 2.98Å; V367-R370 PolarHBondContact O-N 3.25Å; V367-W371 PolarHBondContact O-N 2.97Å; V367-F383 HydrophobicContact CG2-CE1 4.06Å; V367-F383 HydrophobicContact CG2-CZ 4.18Å; V367-Y387 HydrophobicContact CG2-CD1 4.25Å; V367-Y387 HydrophobicContact CG2-CE1 3.5Å; V367-Y387 HydrophobicContact CG2-CE2 4.07Å; V367-Y387 WeakPolarHBondContact CG2-OH 3.15Å; V367-R436 HydrophobicContact CB-CB 4.4Å; V367-R436 HydrophobicContact CB-CG 4.08Å; V367-R436 HydrophobicContact CG1-CB 3.84Å; V367-R436 HydrophobicContact CG1-CG 3.79Å; V367-A439 HydrophobicContact CG1-CB 4.26Å; V367-L440 HydrophobicContact CG1-CD2 4.43Å; V367-L440 HydrophobicContact CG1-CG 4.09Å; V367-L440 HydrophobicContact CG2-CD1 3.79Å; V367-L440 HydrophobicContact CG2-CD2 4.06Å; V367-L440 HydrophobicContact CG2-CG 3.96Å
368	V	98	Very high	94	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-43.3	176.2	175.8	0	0	0	0	110.5	L348 L349 L352 M360 G364 R365 R370 W371 L372 A439 A443	L348-V368 HydrophobicContact CD2-CG1 4.41Å; L349-V368 HydrophobicContact CD2-CB 4.25Å; L349-V368 HydrophobicContact CD2-CG1 3.78Å; L352-V368 HydrophobicContact CD1-CG1 4.38Å; M360-V368 HydrophobicContact CE-CB 4.34Å; M360-V368 HydrophobicContact CE-CG2 4.21Å; M360-V368 HydrophobicContact SD-CG2 4.13Å; G364-V368 WeakPolarHBondContact O-CG2 3.44Å; G364-V368 PolarHBondContact O-N 2.84Å; G364-V368 VanDerWaalsContact O-N 3.09Å; R365-V368 PolarHBondContact O-N 3.13Å; V368-R370 VanDerWaalsContact C-N 3.3Å; V368-R370 PolarHBondContact O-N 2.91Å; V368-W371 WeakPolarHBondContact O-CB 3.25Å; V368-W371 PolarHBondContact O-N 3.04Å; V368-W371 VanDerWaalsContact O-N 3.08Å; V368-L372 HydrophobicContact CG1-CD1 3.99Å; V368-L372 HydrophobicContact CG1-CG 4.27Å; V368-L372 WeakPolarHBondContact O-CG 3.47Å; V368-L372 PolarHBondContact O-N 3.25Å; V368-A439 HydrophobicContact CG2-CB 3.82Å; V368-A443 HydrophobicContact CG1-CB 3.99Å; V368-A443 HydrophobicContact CG2-CB 4.14Å
369	I	96.8	Very high	93.7	Very high	42 Å²	42	45.1 Å²	45.1	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-57.5	-42.9	174.3	-72.2	169.9	0	0	0	111.8	L349 R365 W371 L372 R373	L349-I369 HydrophobicContact CD1-CD1 4.26Å; L349-I369 HydrophobicContact CD1-CG1 3.83Å; L349-I369 HydrophobicContact CD2-CG1 4.02Å; R365-I369 HydrophobicContact CG-CD1 4.02Å; R365-I369 WeakPolarHBondContact O-CG1 3.33Å; R365-I369 PolarHBondContact O-N 3.34Å; I369-W371 VanDerWaalsContact C-N 3.33Å; I369-W371 PolarHBondContact O-N 2.9Å; I369-L372 PolarHBondContact O-N 3.09Å; I369-R373 WeakPolarHBondContact O-CG 3.48Å; I369-R373 PolarHBondContact O-N 3.36Å
370	R	95.6	Very high	93.4	Very high	112 Å²	112	46 Å²	46	42%	0.423	25%	0.246	S	C	.	.	H	α-helix	trans	-65.8	-36.6	176.6	-73.3	-170.2	-58.1	-126.9	3.1	112.7	A366 V367 V368 R373 F383 Y387	A366-R370 WeakPolarHBondContact O-CG 3.49Å; A366-R370 PolarHBondContact O-N 2.71Å; V367-R370 PolarHBondContact O-N 3.25Å; V368-R370 VanDerWaalsContact C-N 3.3Å; V368-R370 PolarHBondContact O-N 2.91Å; R370-R373 PolarHBondContact O-N 2.93Å; R370-F383 HydrophobicContact CB-CE2 3.94Å; R370-F383 HydrophobicContact CB-CZ 3.72Å; R370-Y387 PolarHBondContact NH2-OH 2.95Å
371	W	95.8	Very high	93.2	Very high	1 Å²	1	48 Å²	48	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-67.6	-41.2	175.3	174.1	79.2	0	0	0	111.7	L348 V367 V368 I369 R373 A374 E380 F383 L440 A443 R444 L447	L348-W371 HydrophobicContact CD2-CZ3 3.99Å; V367-W371 PolarHBondContact O-N 2.97Å; V368-W371 WeakPolarHBondContact O-CB 3.25Å; V368-W371 PolarHBondContact O-N 3.04Å; V368-W371 VanDerWaalsContact O-N 3.08Å; I369-W371 VanDerWaalsContact C-N 3.33Å; I369-W371 PolarHBondContact O-N 2.9Å; W371-R373 PolarHBondContact O-N 3.01Å; W371-R373 VanDerWaalsContact O-N 3.11Å; W371-A374 WeakPolarHBondContact O-CB 3.39Å; W371-A374 PolarHBondContact O-N 3.08Å; W371-E380 HydrophobicContact CZ2-CG 3.72Å; W371-E380 VanDerWaalsContact CZ2-OE1 3.3Å; W371-E380 WeakPolarHBondContact CZ2-OE1 3.44Å; W371-F383 HydrophobicContact CB-CD1 3.91Å; W371-F383 HydrophobicContact CB-CE1 3.73Å; W371-F383 HydrophobicContact CB-CZ 4.34Å; W371-F383 AromaticContact CD1-CD1 3.75Å; W371-F383 HydrophobicContact CG-CD1 4.24Å; W371-F383 HydrophobicContact CG-CE1 4.49Å; W371-L440 HydrophobicContact CB-CD2 3.56Å; W371-L440 HydrophobicContact CG-CD2 3.81Å; W371-A443 HydrophobicContact CE3-CB 4.05Å; W371-A443 HydrophobicContact CH2-CB 4.41Å; W371-A443 HydrophobicContact CZ3-CB 3.87Å; W371-R444 HydrophobicContact CZ2-CB 4.38Å; W371-L447 HydrophobicContact CH2-CB 4.13Å; W371-L447 HydrophobicContact CH2-CD2 3.8Å; W371-L447 HydrophobicContact CH2-CG 4.47Å; W371-L447 HydrophobicContact CZ3-CB 4.4Å; W371-L447 HydrophobicContact CZ3-CD2 3.71Å
372	L	95.1	Very high	93.2	Very high	5 Å²	5	50 Å²	50	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-21.4	177	-73.6	169.9	0	0	0	113.6	R318 V339 N345 L348 L349 V368 I369 A374 L447	R318-L372 PolarHBondContact NH1-O 3.03Å; V339-L372 VanDerWaalsContact CG2-O 3.29Å; V339-L372 WeakPolarHBondContact CG2-O 3.26Å; N345-L372 HydrophobicContact CB-CD1 4.01Å; L348-L372 HydrophobicContact CD2-CD2 3.91Å; L349-L372 HydrophobicContact CD1-CD1 4.31Å; L349-L372 HydrophobicContact CD2-CD1 4.18Å; L349-L372 HydrophobicContact CG-CD1 4.04Å; V368-L372 HydrophobicContact CG1-CD1 3.99Å; V368-L372 HydrophobicContact CG1-CG 4.27Å; V368-L372 WeakPolarHBondContact O-CG 3.47Å; V368-L372 PolarHBondContact O-N 3.25Å; I369-L372 PolarHBondContact O-N 3.09Å; L372-A374 VanDerWaalsContact C-N 3.27Å; L372-A374 PolarHBondContact O-N 3.08Å; L372-L447 HydrophobicContact CD2-CD2 3.58Å
373	R	91.9	Very high	93.1	Very high	134 Å²	134	47 Å²	47	51%	0.506	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-9.7	173.6	-69.7	173.7	171.8	173.2	-1.6	114.1	E340 I369 R370 W371 G375	E340-R373 HydrophobicContact CG-CG 4.49Å; E340-R373 IonicContact OE1-CZ 3.72Å; E340-R373 IonicContact OE1-NE 2.9Å; E340-R373 PolarHBondContact OE1-NE 3.21Å; E340-R373 IonicContact OE1-NH2 3.68Å; E340-R373 PolarHBondContact OE1-NH2 2.92Å; I369-R373 WeakPolarHBondContact O-CG 3.48Å; I369-R373 PolarHBondContact O-N 3.36Å; R370-R373 PolarHBondContact O-N 2.93Å; W371-R373 PolarHBondContact O-N 3.01Å; W371-R373 VanDerWaalsContact O-N 3.11Å; R373-G375 PolarHBondContact O-N 3.3Å; R373-G375 VanDerWaalsContact O-N 3.16Å
374	A	89.8	Confident	93.1	Very high	8 Å²	8	45 Å²	45	7%	0.066	25%	0.247	C	C	.	.			trans	-64.1	115.3	174.1	0	0	0	0	0	109.5	V339 W371 L372 Q379 E380	V339-A374 WeakPolarHBondContact CG2-O 3.39Å; W371-A374 WeakPolarHBondContact O-CB 3.39Å; W371-A374 PolarHBondContact O-N 3.08Å; L372-A374 VanDerWaalsContact C-N 3.27Å; L372-A374 PolarHBondContact O-N 3.08Å; A374-Q379 HydrophobicContact CB-CB 3.95Å; A374-E380 HydrophobicContact CB-CB 4.07Å
375	G	78.1	Confident	92.9	Very high	15 Å²	15	48.1 Å²	48.1	16%	0.155	27%	0.273	C	S	.	.			trans	-87.6	-2.8	-174.2	0	0	0	0	0	114.3	R373	R373-G375 PolarHBondContact O-N 3.3Å; R373-G375 VanDerWaalsContact O-N 3.16Å
376	S	85.9	Confident	92.8	Very high	36 Å²	36	53.8 Å²	53.8	25%	0.252	29%	0.294	S	S	.	.	S	Bend	trans	-145.8	159.2	175.5	71.9	0	0	0	0	112	A378 Q379 E380	S376-A378 PolarHBondContact O-N 3.49Å; S376-Q379 PolarHBondContact O-N 2.76Å; S376-Q379 VanDerWaalsContact O-N 3.16Å; S376-Q379 WeakPolarHBondContact OG-CG 3.42Å; S376-Q379 PolarHBondContact OG-N 2.71Å; S376-E380 PolarHBondContact O-N 2.89Å
377	L	89.1	Confident	92.6	Very high	78 Å²	78	54 Å²	54	41%	0.408	29%	0.286	S	S	.	.	H	α-helix	trans	-58.9	-36.2	177.6	-63.5	176.3	0	0	0	112.3	E380 A381 N449 E451	L377-E380 WeakPolarHBondContact O-CB 3.35Å; L377-E380 PolarHBondContact O-N 3.34Å; L377-A381 WeakPolarHBondContact O-CB 3.5Å; L377-A381 PolarHBondContact O-N 3.32Å; L377-N449 HydrophobicContact CD2-CB 3.62Å; L377-E451 HydrophobicContact CD1-CG 4.2Å; L377-E451 HydrophobicContact CG-CG 4.3Å
378	A	90.9	Very high	92.4	Very high	75 Å²	75	63.4 Å²	63.4	62%	0.62	32%	0.322	S	S	*	.	H	α-helix	trans	-65.9	-42.4	177	0	0	0	0	0	112.4	S376 E380 A382	S376-A378 PolarHBondContact O-N 3.49Å; A378-E380 VanDerWaalsContact C-N 3.34Å; A378-A382 VanDerWaalsContact O-CB 3.32Å; A378-A382 WeakPolarHBondContact O-CB 3.49Å; A378-A382 PolarHBondContact O-N 3.44Å
379	Q	91.3	Very high	92.3	Very high	111 Å²	111	64.4 Å²	64.4	52%	0.519	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-40.7	176	-72.8	178.5	-6.4	0	0	111.3	A374 S376 F383	A374-Q379 HydrophobicContact CB-CB 3.95Å; S376-Q379 PolarHBondContact O-N 2.76Å; S376-Q379 VanDerWaalsContact O-N 3.16Å; S376-Q379 WeakPolarHBondContact OG-CG 3.42Å; S376-Q379 PolarHBondContact OG-N 2.71Å; Q379-F383 VanDerWaalsContact O-CB 3.3Å; Q379-F383 WeakPolarHBondContact O-CB 3.4Å; Q379-F383 PolarHBondContact O-N 3.32Å
380	E	91.8	Very high	92.2	Very high	17 Å²	17	66.2 Å²	66.2	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-60.5	-50.8	176.7	-170.2	-159.2	135.6	0	0	111.2	W371 A374 S376 L377 A378 A382 F383 Y384 N449	W371-E380 HydrophobicContact CZ2-CG 3.72Å; W371-E380 VanDerWaalsContact CZ2-OE1 3.3Å; W371-E380 WeakPolarHBondContact CZ2-OE1 3.44Å; A374-E380 HydrophobicContact CB-CB 4.07Å; S376-E380 PolarHBondContact O-N 2.89Å; L377-E380 WeakPolarHBondContact O-CB 3.35Å; L377-E380 PolarHBondContact O-N 3.34Å; A378-E380 VanDerWaalsContact C-N 3.34Å; E380-A382 PolarHBondContact O-N 2.88Å; E380-F383 PolarHBondContact O-N 3.1Å; E380-Y384 WeakPolarHBondContact O-CB 3.45Å; E380-Y384 PolarHBondContact O-N 3.27Å; E380-N449 PolarHBondContact OE2-ND2 3.49Å
381	A	92.5	Very high	92.2	Very high	52 Å²	52	64 Å²	64	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-61.4	-44.8	178.9	0	0	0	0	0	111.9	L377 F383 Y384 A385	L377-A381 WeakPolarHBondContact O-CB 3.5Å; L377-A381 PolarHBondContact O-N 3.32Å; A381-F383 VanDerWaalsContact C-N 3.35Å; A381-F383 PolarHBondContact O-N 3.39Å; A381-Y384 PolarHBondContact O-N 2.99Å; A381-A385 WeakPolarHBondContact O-CB 3.37Å; A381-A385 PolarHBondContact O-N 3.25Å
382	A	94.3	Very high	92.3	Very high	65 Å²	65	71.5 Å²	71.5	54%	0.537	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-40.8	176.4	0	0	0	0	0	112	A378 E380 R386	A378-A382 VanDerWaalsContact O-CB 3.32Å; A378-A382 WeakPolarHBondContact O-CB 3.49Å; A378-A382 PolarHBondContact O-N 3.44Å; E380-A382 PolarHBondContact O-N 2.88Å; A382-R386 PolarHBondContact O-N 3.45Å; A382-R386 VanDerWaalsContact O-N 3.11Å
383	F	94.2	Very high	92.4	Very high	43 Å²	43	74.3 Å²	74.3	19%	0.189	38%	0.378	C	S	.	.	H	α-helix	trans	-62.9	-47.7	175.5	-170.1	-79.3	0	0	0	110.8	V367 R370 W371 Q379 E380 A381 R386 Y387 L440	V367-F383 HydrophobicContact CG2-CE1 4.06Å; V367-F383 HydrophobicContact CG2-CZ 4.18Å; R370-F383 HydrophobicContact CB-CE2 3.94Å; R370-F383 HydrophobicContact CB-CZ 3.72Å; W371-F383 HydrophobicContact CB-CD1 3.91Å; W371-F383 HydrophobicContact CB-CE1 3.73Å; W371-F383 HydrophobicContact CB-CZ 4.34Å; W371-F383 AromaticContact CD1-CD1 3.75Å; W371-F383 HydrophobicContact CG-CD1 4.24Å; W371-F383 HydrophobicContact CG-CE1 4.49Å; Q379-F383 VanDerWaalsContact O-CB 3.3Å; Q379-F383 WeakPolarHBondContact O-CB 3.4Å; Q379-F383 PolarHBondContact O-N 3.32Å; E380-F383 PolarHBondContact O-N 3.1Å; A381-F383 VanDerWaalsContact C-N 3.35Å; A381-F383 PolarHBondContact O-N 3.39Å; F383-R386 WeakPolarHBondContact O-CB 3.31Å; F383-R386 PolarHBondContact O-N 3.48Å; F383-Y387 HydrophobicContact CD1-CD2 4.1Å; F383-Y387 AromaticContact CD1-CE2 3.92Å; F383-Y387 HydrophobicContact CD1-CE2 3.92Å; F383-Y387 AromaticContact CE1-CD2 3.86Å; F383-Y387 HydrophobicContact CE1-CD2 3.86Å; F383-Y387 AromaticContact CE1-CE2 3.33Å; F383-Y387 HydrophobicContact CE1-CE2 3.33Å; F383-Y387 HydrophobicContact CE2-CE2 4.22Å; F383-Y387 HydrophobicContact CZ-CD2 4.46Å; F383-Y387 AromaticContact CZ-CE2 3.52Å; F383-Y387 HydrophobicContact CZ-CE2 3.52Å; F383-Y387 WeakPolarHBondContact O-CD2 3.4Å; F383-L440 HydrophobicContact CD1-CD2 4.44Å; F383-L440 HydrophobicContact CE1-CD1 4.13Å; F383-L440 HydrophobicContact CE1-CD2 3.97Å
384	Y	93.7	Very high	92.7	Very high	16 Å²	16	67.9 Å²	67.9	6%	0.063	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-46.3	179.2	-166	-91.9	0	0	0	111.8	E380 A381 R386 Y387 V389 L440 R444	E380-Y384 WeakPolarHBondContact O-CB 3.45Å; E380-Y384 PolarHBondContact O-N 3.27Å; A381-Y384 PolarHBondContact O-N 2.99Å; Y384-R386 VanDerWaalsContact C-N 3.3Å; Y384-R386 PolarHBondContact O-N 3.29Å; Y384-Y387 PolarHBondContact O-N 3.05Å; Y384-V389 HydrophobicContact CD2-CG2 4.42Å; Y384-V389 HydrophobicContact CE1-CB 3.76Å; Y384-V389 HydrophobicContact CE1-CG1 4.32Å; Y384-V389 HydrophobicContact CE1-CG2 4.14Å; Y384-V389 HydrophobicContact CE2-CB 4.32Å; Y384-V389 HydrophobicContact CE2-CG1 4.45Å; Y384-V389 HydrophobicContact CE2-CG2 4.04Å; Y384-V389 VanDerWaalsContact OH-CG1 3.28Å; Y384-V389 WeakPolarHBondContact OH-CG1 3.42Å; Y384-L440 HydrophobicContact CD2-CB 4.35Å; Y384-L440 HydrophobicContact CE2-CB 4.2Å; Y384-R444 HydrophobicContact CD2-CB 4.48Å; Y384-R444 HydrophobicContact CE2-CB 4.02Å; Y384-R444 HydrophobicContact CE2-CG 4.46Å
385	A	93.9	Very high	93	Very high	66 Å²	66	69.3 Å²	69.3	55%	0.545	36%	0.36	S	S	.	.	H	α-helix	trans	-58.9	-38.3	177.8	0	0	0	0	0	112.6	A381 Y387 R388	A381-A385 WeakPolarHBondContact O-CB 3.37Å; A381-A385 PolarHBondContact O-N 3.25Å; A385-Y387 VanDerWaalsContact C-N 3.25Å; A385-Y387 PolarHBondContact O-N 2.89Å; A385-R388 PolarHBondContact O-N 3.41Å
386	R	95	Very high	94	Very high	210 Å²	210	71 Å²	71	79%	0.792	37%	0.373	S	S	*	.	H	α-helix	trans	-58.9	-33.5	178.5	-177.9	177.9	176.1	171.1	1.2	113.3	A382 F383 Y384 R388	A382-R386 PolarHBondContact O-N 3.45Å; A382-R386 VanDerWaalsContact O-N 3.11Å; F383-R386 WeakPolarHBondContact O-CB 3.31Å; F383-R386 PolarHBondContact O-N 3.48Å; Y384-R386 VanDerWaalsContact C-N 3.3Å; Y384-R386 PolarHBondContact O-N 3.29Å; R386-R388 VanDerWaalsContact C-N 3.27Å; R386-R388 PolarHBondContact O-N 3.27Å
387	Y	93.9	Very high	94.5	Very high	47 Å²	47	71.1 Å²	71.1	18%	0.184	37%	0.37	C	S	.	.	H	α-helix	trans	-80	-10.6	-179.9	-78.9	-99.3	0	0	0	113.3	V367 R370 F383 Y384 A385 V389 R437 L440	V367-Y387 HydrophobicContact CG2-CD1 4.25Å; V367-Y387 HydrophobicContact CG2-CE1 3.5Å; V367-Y387 HydrophobicContact CG2-CE2 4.07Å; V367-Y387 WeakPolarHBondContact CG2-OH 3.15Å; R370-Y387 PolarHBondContact NH2-OH 2.95Å; F383-Y387 HydrophobicContact CD1-CD2 4.1Å; F383-Y387 AromaticContact CD1-CE2 3.92Å; F383-Y387 HydrophobicContact CD1-CE2 3.92Å; F383-Y387 AromaticContact CE1-CD2 3.86Å; F383-Y387 HydrophobicContact CE1-CD2 3.86Å; F383-Y387 AromaticContact CE1-CE2 3.33Å; F383-Y387 HydrophobicContact CE1-CE2 3.33Å; F383-Y387 HydrophobicContact CE2-CE2 4.22Å; F383-Y387 HydrophobicContact CZ-CD2 4.46Å; F383-Y387 AromaticContact CZ-CE2 3.52Å; F383-Y387 HydrophobicContact CZ-CE2 3.52Å; F383-Y387 WeakPolarHBondContact O-CD2 3.4Å; Y384-Y387 PolarHBondContact O-N 3.05Å; A385-Y387 VanDerWaalsContact C-N 3.25Å; A385-Y387 PolarHBondContact O-N 2.89Å; Y387-V389 VanDerWaalsContact C-N 3.34Å; Y387-V389 PolarHBondContact O-N 2.83Å; Y387-R437 PolarHBondContact O-NE 3.09Å; Y387-R437 PolarHBondContact O-NH2 3.34Å; Y387-R437 VanDerWaalsContact O-NH2 3.13Å; Y387-L440 HydrophobicContact CD1-CD1 3.85Å; Y387-L440 HydrophobicContact CD2-CD1 3.69Å; Y387-L440 HydrophobicContact CE1-CD1 4.39Å; Y387-L440 HydrophobicContact CE2-CD1 4.24Å; Y387-L440 HydrophobicContact CG-CD1 3.47Å; Y387-L440 VanDerWaalsContact CG-CD1 3.47Å
388	R	94	Very high	94.9	Very high	198 Å²	198	67.4 Å²	67.4	75%	0.747	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	59.1	-175.6	-57.4	-177.7	-176	-177	0.1	109.9	A385 R386 D390 R437	A385-R388 PolarHBondContact O-N 3.41Å; R386-R388 VanDerWaalsContact C-N 3.27Å; R386-R388 PolarHBondContact O-N 3.27Å; R388-D390 PolarHBondContact O-N 3.39Å; R388-R437 PolarHBondContact O-NE 2.85Å; R388-R437 PolarHBondContact O-NH2 3.1Å
389	V	94.5	Very high	95.1	Very high	21 Å²	21	70.2 Å²	70.2	13%	0.127	35%	0.346	C	S	.	.			trans	-70.5	125	177.4	-176.6	0	0	0	0	107.5	Y384 Y387 R437 L440 F441	Y384-V389 HydrophobicContact CD2-CG2 4.42Å; Y384-V389 HydrophobicContact CE1-CB 3.76Å; Y384-V389 HydrophobicContact CE1-CG1 4.32Å; Y384-V389 HydrophobicContact CE1-CG2 4.14Å; Y384-V389 HydrophobicContact CE2-CB 4.32Å; Y384-V389 HydrophobicContact CE2-CG1 4.45Å; Y384-V389 HydrophobicContact CE2-CG2 4.04Å; Y384-V389 VanDerWaalsContact OH-CG1 3.28Å; Y384-V389 WeakPolarHBondContact OH-CG1 3.42Å; Y387-V389 VanDerWaalsContact C-N 3.34Å; Y387-V389 PolarHBondContact O-N 2.83Å; V389-R437 HydrophobicContact CG1-CB 4.49Å; V389-R437 HydrophobicContact CG2-CB 4.33Å; V389-R437 HydrophobicContact CG2-CG 4.35Å; V389-L440 HydrophobicContact CG2-CB 4.3Å; V389-L440 HydrophobicContact CG2-CD1 4.47Å; V389-F441 HydrophobicContact CG1-CB 3.96Å
390	D	95.3	Very high	95.3	Very high	80 Å²	80	67.8 Å²	67.8	43%	0.428	34%	0.341	S	S	.	.			trans	-93.4	102.5	176	-180	-20.5	0	0	0	107.2	R388 E392 W393 C394	R388-D390 PolarHBondContact O-N 3.39Å; D390-E392 PolarHBondContact OD1-N 3.01Å; D390-W393 HydrophobicContact CB-CB 3.91Å; D390-W393 VanDerWaalsContact CG-CB 3.41Å; D390-W393 PolarHBondContact OD1-N 3.07Å; D390-C394 PolarHBondContact O-N 3.26Å; D390-C394 VanDerWaalsContact O-N 3.09Å; D390-C394 PolarHBondContact O-SG 3.05Å
391	E	95.8	Very high	95.5	Very high	66 Å²	66	68.9 Å²	68.9	31%	0.308	34%	0.344	S	S	.	.	H	α-helix	trans	-66.7	-36.9	-176	-66.3	-156.2	-156.7	0	0	111.8	C394 L395 F441 R444 K445	E391-C394 PolarHBondContact O-N 3.04Å; E391-L395 WeakPolarHBondContact O-CB 3.16Å; E391-L395 WeakPolarHBondContact O-CG 3.39Å; E391-L395 PolarHBondContact O-N 3.49Å; E391-F441 HydrophobicContact CB-CD2 4.28Å; E391-F441 HydrophobicContact CB-CE2 3.89Å; E391-F441 HydrophobicContact CG-CD2 3.96Å; E391-F441 HydrophobicContact CG-CE2 3.92Å; E391-R444 IonicContact OE1-NH1 3.39Å; E391-R444 PolarHBondContact OE1-NH1 2.69Å; E391-K445 IonicContact OE2-NZ 2.77Å; E391-K445 PolarHBondContact OE2-NZ 3.39Å
392	E	96.9	Very high	95.5	Very high	159 Å²	159	69.6 Å²	69.6	74%	0.743	34%	0.336	S	S	*	.	H	α-helix	trans	-65.3	-45.1	178.5	-67.3	-175.8	173.9	0	0	110.9	D390 C394 L395 A396	D390-E392 PolarHBondContact OD1-N 3.01Å; E392-C394 VanDerWaalsContact C-N 3.33Å; E392-C394 PolarHBondContact O-N 3.2Å; E392-L395 PolarHBondContact O-N 3.42Å; E392-A396 VanDerWaalsContact O-CB 3.3Å; E392-A396 WeakPolarHBondContact O-CB 3.41Å; E392-A396 PolarHBondContact O-N 3.29Å
393	W	97.1	Very high	95.4	Very high	63 Å²	63	68.4 Å²	68.4	24%	0.239	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-42	173.9	171.4	75.8	0	0	0	112	D390 L397 L430 R434 L438	D390-W393 HydrophobicContact CB-CB 3.91Å; D390-W393 VanDerWaalsContact CG-CB 3.41Å; D390-W393 PolarHBondContact OD1-N 3.07Å; W393-L397 HydrophobicContact CH2-CD2 3.93Å; W393-L397 HydrophobicContact CZ2-CD2 3.78Å; W393-L397 VanDerWaalsContact O-CB 3.29Å; W393-L397 WeakPolarHBondContact O-CB 3.31Å; W393-L397 PolarHBondContact O-N 2.87Å; W393-L430 HydrophobicContact CH2-CD1 4.22Å; W393-L430 HydrophobicContact CZ2-CD1 4.41Å; W393-R434 HydrophobicContact CH2-CB 3.78Å; W393-R434 HydrophobicContact CH2-CG 3.95Å; W393-R434 HydrophobicContact CZ2-CB 4.2Å; W393-R434 HydrophobicContact CZ2-CG 4.01Å; W393-L438 HydrophobicContact CZ3-CB 4.47Å
394	C	97.9	Very high	95.2	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-46.6	177.9	-66.8	0	0	0	0	111.3	D390 E391 E392 L397 L398 L438 F441	D390-C394 PolarHBondContact O-N 3.26Å; D390-C394 VanDerWaalsContact O-N 3.09Å; D390-C394 PolarHBondContact O-SG 3.05Å; E391-C394 PolarHBondContact O-N 3.04Å; E392-C394 VanDerWaalsContact C-N 3.33Å; E392-C394 PolarHBondContact O-N 3.2Å; C394-L397 PolarHBondContact O-N 3.5Å; C394-L398 WeakPolarHBondContact O-CB 3.3Å; C394-L398 VanDerWaalsContact O-CG 3.27Å; C394-L398 WeakPolarHBondContact O-CG 3.39Å; C394-L398 PolarHBondContact O-N 3Å; C394-L438 HydrophobicContact CB-CD1 3.98Å; C394-F441 HydrophobicContact CB-CB 4.2Å; C394-F441 HydrophobicContact CB-CD1 3.64Å; C394-F441 HydrophobicContact CB-CD2 3.81Å; C394-F441 HydrophobicContact CB-CE1 3.89Å; C394-F441 HydrophobicContact CB-CE2 4.03Å; C394-F441 HydrophobicContact CB-CG 3.6Å; C394-F441 HydrophobicContact CB-CZ 4.07Å
395	L	97.5	Very high	95	Very high	38 Å²	38	71.9 Å²	71.9	20%	0.199	34%	0.341	C	S	.	.	H	α-helix	trans	-63.3	-46.7	177.9	-73.6	170.5	0	0	0	111.8	E391 E392 L397 L398 R399 F441 W467 L469	E391-L395 WeakPolarHBondContact O-CB 3.16Å; E391-L395 WeakPolarHBondContact O-CG 3.39Å; E391-L395 PolarHBondContact O-N 3.49Å; E392-L395 PolarHBondContact O-N 3.42Å; L395-L397 VanDerWaalsContact C-N 3.32Å; L395-L397 PolarHBondContact O-N 3.25Å; L395-L398 PolarHBondContact O-N 3.1Å; L395-R399 WeakPolarHBondContact O-CB 3.32Å; L395-R399 WeakPolarHBondContact O-CG 3.41Å; L395-R399 PolarHBondContact O-N 3.41Å; L395-F441 HydrophobicContact CD2-CE1 4.4Å; L395-F441 HydrophobicContact CD2-CZ 3.74Å; L395-F441 HydrophobicContact CG-CE2 4.43Å; L395-F441 HydrophobicContact CG-CZ 3.8Å; L395-W467 HydrophobicContact CD2-CZ3 4.08Å; L395-L469 HydrophobicContact CD2-CD1 4.04Å
396	A	97.4	Very high	94.7	Very high	51 Å²	51	72.2 Å²	72.2	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-42.6	178.5	0	0	0	0	0	111.6	E392 S400	E392-A396 VanDerWaalsContact O-CB 3.3Å; E392-A396 WeakPolarHBondContact O-CB 3.41Å; E392-A396 PolarHBondContact O-N 3.29Å; A396-S400 VanDerWaalsContact O-CB 3.28Å; A396-S400 WeakPolarHBondContact O-CB 3.42Å; A396-S400 PolarHBondContact O-N 3Å; A396-S400 PolarHBondContact O-OG 3.13Å
397	L	97.7	Very high	94.3	Very high	37 Å²	37	69.8 Å²	69.8	19%	0.194	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-46.7	176.5	176.3	65.7	0	0	0	111.9	W393 C394 L395 S400 Y401 V426 L430 L438	W393-L397 HydrophobicContact CH2-CD2 3.93Å; W393-L397 HydrophobicContact CZ2-CD2 3.78Å; W393-L397 VanDerWaalsContact O-CB 3.29Å; W393-L397 WeakPolarHBondContact O-CB 3.31Å; W393-L397 PolarHBondContact O-N 2.87Å; C394-L397 PolarHBondContact O-N 3.5Å; L395-L397 VanDerWaalsContact C-N 3.32Å; L395-L397 PolarHBondContact O-N 3.25Å; L397-S400 PolarHBondContact O-N 2.91Å; L397-Y401 WeakPolarHBondContact O-CB 3.22Å; L397-Y401 PolarHBondContact O-N 3.46Å; L397-V426 HydrophobicContact CD2-CG2 4.24Å; L397-V426 HydrophobicContact CG-CG2 4.11Å; L397-L430 HydrophobicContact CD2-CD1 3.82Å; L397-L438 HydrophobicContact CD2-CD2 3.87Å
398	L	97.1	Very high	93.8	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-66	-44.3	-179.7	-71.4	168.5	0	0	0	111.4	Y356 C394 L395 Y401 R402 W424 V426 L438 F441 L442 W467 L469	Y356-L398 HydrophobicContact CE1-CD2 4.44Å; C394-L398 WeakPolarHBondContact O-CB 3.3Å; C394-L398 VanDerWaalsContact O-CG 3.27Å; C394-L398 WeakPolarHBondContact O-CG 3.39Å; C394-L398 PolarHBondContact O-N 3Å; L395-L398 PolarHBondContact O-N 3.1Å; L398-Y401 PolarHBondContact O-N 3.48Å; L398-R402 WeakPolarHBondContact O-CB 3.35Å; L398-R402 PolarHBondContact O-N 2.91Å; L398-W424 HydrophobicContact CD2-CE3 4.45Å; L398-W424 HydrophobicContact CD2-CZ3 4.41Å; L398-V426 HydrophobicContact CD2-CG1 4.06Å; L398-V426 HydrophobicContact CD2-CG2 4.25Å; L398-L438 HydrophobicContact CD1-CD1 4.21Å; L398-L438 HydrophobicContact CD2-CD1 4.45Å; L398-L438 HydrophobicContact CG-CD1 4.26Å; L398-F441 HydrophobicContact CD1-CD1 4.21Å; L398-F441 HydrophobicContact CD1-CE1 3.77Å; L398-L442 HydrophobicContact CD1-CD2 3.93Å; L398-W467 HydrophobicContact CD1-CH2 4.07Å; L398-L469 HydrophobicContact CB-CD1 3.63Å; L398-L469 HydrophobicContact CB-CD2 3.75Å; L398-L469 HydrophobicContact CB-CG 4.35Å; L398-L469 HydrophobicContact CD1-CD1 4.31Å
399	R	95.9	Very high	93.1	Very high	134 Å²	134	67.8 Å²	67.8	51%	0.506	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-43.6	175.6	-72.6	176.5	-176.5	154.4	0.8	112	L395 Y401 R402 A403 L469	L395-R399 WeakPolarHBondContact O-CB 3.32Å; L395-R399 WeakPolarHBondContact O-CG 3.41Å; L395-R399 PolarHBondContact O-N 3.41Å; R399-Y401 VanDerWaalsContact C-N 3.29Å; R399-Y401 PolarHBondContact O-N 3.01Å; R399-R402 PolarHBondContact O-N 3.32Å; R399-A403 WeakPolarHBondContact O-CB 3.36Å; R399-A403 PolarHBondContact O-N 3.21Å; R399-L469 HydrophobicContact CG-CD1 3.9Å; R399-L469 HydrophobicContact CG-CG 4.04Å; R399-L469 PolarHBondContact NE-OXT 3.28Å
400	S	95.3	Very high	91.6	Very high	60 Å²	60	75.2 Å²	75.2	42%	0.42	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-35	176.6	-56.6	0	0	0	0	112	A396 L397 R404	A396-S400 VanDerWaalsContact O-CB 3.28Å; A396-S400 WeakPolarHBondContact O-CB 3.42Å; A396-S400 PolarHBondContact O-N 3Å; A396-S400 PolarHBondContact O-OG 3.13Å; L397-S400 PolarHBondContact O-N 2.91Å; S400-R404 WeakPolarHBondContact O-CG 3.3Å; S400-R404 PolarHBondContact O-N 2.66Å; S400-R404 PolarHBondContact O-NH1 2.8Å
401	Y	95.1	Very high	90.1	Very high	40 Å²	40	73.8 Å²	73.8	16%	0.157	37%	0.368	C	S	.	.	H	α-helix	trans	-67.9	-48.3	174.7	-173.3	-88	0	0	0	111	L397 L398 R399 A403 R404 C405 W424 L425 V426	L397-Y401 WeakPolarHBondContact O-CB 3.22Å; L397-Y401 PolarHBondContact O-N 3.46Å; L398-Y401 PolarHBondContact O-N 3.48Å; R399-Y401 VanDerWaalsContact C-N 3.29Å; R399-Y401 PolarHBondContact O-N 3.01Å; Y401-A403 PolarHBondContact O-N 3.22Å; Y401-R404 PolarHBondContact O-N 3.36Å; Y401-C405 WeakPolarHBondContact CE1-SG 3.45Å; Y401-C405 PolarHBondContact O-N 3.37Å; Y401-C405 PolarHBondContact O-SG 2.98Å; Y401-W424 HydrophobicContact CD1-CB 4.25Å; Y401-W424 AromaticContact CD1-CD2 3.96Å; Y401-W424 HydrophobicContact CD1-CD2 3.96Å; Y401-W424 AromaticContact CD1-CE3 3.81Å; Y401-W424 HydrophobicContact CD1-CE3 3.81Å; Y401-W424 HydrophobicContact CD1-CG 4.15Å; Y401-W424 HydrophobicContact CE1-CB 3.61Å; Y401-W424 AromaticContact CE1-CD2 3.98Å; Y401-W424 HydrophobicContact CE1-CD2 3.98Å; Y401-W424 HydrophobicContact CE1-CE3 4.27Å; Y401-W424 AromaticContact CE1-CG 3.68Å; Y401-W424 HydrophobicContact CE1-CG 3.68Å; Y401-L425 PolarHBondContact OH-N 3.12Å; Y401-V426 HydrophobicContact CD1-CB 4.09Å; Y401-V426 HydrophobicContact CD2-CB 3.74Å; Y401-V426 HydrophobicContact CD2-CG2 4.09Å; Y401-V426 HydrophobicContact CE1-CB 4.35Å; Y401-V426 HydrophobicContact CE2-CB 4.06Å; Y401-V426 HydrophobicContact CG-CB 3.79Å; Y401-V426 HydrophobicContact CG-CG2 4.1Å
402	R	92.8	Very high	88.1	Confident	66 Å²	66	79.3 Å²	79.3	25%	0.249	39%	0.394	C	S	.	.	H	α-helix	trans	-56.3	-49.8	177.3	-178.4	179.8	174.5	171.3	6.9	112	L398 R399 R404 C405 E406 P420 W424 L469	L398-R402 WeakPolarHBondContact O-CB 3.35Å; L398-R402 PolarHBondContact O-N 2.91Å; R399-R402 PolarHBondContact O-N 3.32Å; R402-R404 VanDerWaalsContact C-N 3.32Å; R402-R404 PolarHBondContact O-N 3.13Å; R402-C405 PolarHBondContact O-N 3.47Å; R402-C405 VanDerWaalsContact O-N 3.13Å; R402-E406 HydrophobicContact CG-CG 4.4Å; R402-E406 WeakPolarHBondContact CG-OE1 3.39Å; R402-E406 IonicContact CZ-OE1 3.09Å; R402-E406 IonicContact NE-OE1 3.35Å; R402-E406 PolarHBondContact NE-OE1 3.44Å; R402-E406 IonicContact NH2-OE1 3.5Å; R402-E406 PolarHBondContact NH2-OE1 3.36Å; R402-E406 WeakPolarHBondContact O-CG 3.36Å; R402-E406 PolarHBondContact O-N 2.98Å; R402-P420 HydrophobicContact CG-CG 4.01Å; R402-W424 HydrophobicContact CB-CH2 3.79Å; R402-W424 HydrophobicContact CB-CZ2 4.39Å; R402-W424 HydrophobicContact CB-CZ3 4.27Å; R402-W424 HydrophobicContact CG-CH2 4.01Å; R402-W424 HydrophobicContact CG-CZ2 4.31Å; R402-L469 HydrophobicContact CB-CD2 4.23Å; R402-L469 PolarHBondContact NH1-O 3.19Å
403	A	91.6	Very high	86	Confident	40 Å²	40	79 Å²	79	33%	0.331	39%	0.393	S	S	.	.	H	α-helix	trans	-58.8	-42.2	179.7	0	0	0	0	0	112.2	R399 Y401 E406 E407	R399-A403 WeakPolarHBondContact O-CB 3.36Å; R399-A403 PolarHBondContact O-N 3.21Å; Y401-A403 PolarHBondContact O-N 3.22Å; A403-E406 PolarHBondContact O-N 3.26Å; A403-E407 WeakPolarHBondContact O-CG 3.2Å; A403-E407 PolarHBondContact O-N 3.17Å
404	R	91.4	Very high	83.9	Confident	114 Å²	114	77.1 Å²	77.1	43%	0.43	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-42	174.8	-73.2	-167	-52.2	-87	-3.5	112.6	S400 Y401 R402 E406 E407 E408	S400-R404 WeakPolarHBondContact O-CG 3.3Å; S400-R404 PolarHBondContact O-N 2.66Å; S400-R404 PolarHBondContact O-NH1 2.8Å; Y401-R404 PolarHBondContact O-N 3.36Å; R402-R404 VanDerWaalsContact C-N 3.32Å; R402-R404 PolarHBondContact O-N 3.13Å; R404-E406 VanDerWaalsContact C-N 3.3Å; R404-E406 PolarHBondContact O-N 3.07Å; R404-E407 PolarHBondContact O-N 3.46Å; R404-E408 WeakPolarHBondContact O-CB 3.37Å; R404-E408 WeakPolarHBondContact O-CG 3.31Å; R404-E408 PolarHBondContact O-N 2.74Å
405	C	89.6	Confident	82	Confident	19 Å²	19	84.5 Å²	84.5	13%	0.128	43%	0.425	C	S	.	.	H	α-helix	trans	-64.2	-37.8	175.8	-67.3	0	0	0	0	111.8	Y401 R402 E407 E408 L409 P420	Y401-C405 WeakPolarHBondContact CE1-SG 3.45Å; Y401-C405 PolarHBondContact O-N 3.37Å; Y401-C405 PolarHBondContact O-SG 2.98Å; R402-C405 PolarHBondContact O-N 3.47Å; R402-C405 VanDerWaalsContact O-N 3.13Å; C405-E407 VanDerWaalsContact C-N 3.33Å; C405-E408 PolarHBondContact O-N 3Å; C405-L409 WeakPolarHBondContact O-CB 3.37Å; C405-L409 WeakPolarHBondContact O-CD1 3.37Å; C405-L409 WeakPolarHBondContact O-CG 3.39Å; C405-L409 PolarHBondContact O-N 3.21Å; C405-P420 HydrophobicContact CB-CB 3.92Å; C405-P420 HydrophobicContact CB-CG 4.04Å
406	E	87.4	Confident	80.7	Confident	73 Å²	73	84.2 Å²	84.2	34%	0.341	43%	0.431	S	S	.	.	H	α-helix	trans	-67.2	-32.7	175.3	-71.7	170.4	172.4	0	0	112.2	R402 A403 R404 P420	R402-E406 HydrophobicContact CG-CG 4.4Å; R402-E406 WeakPolarHBondContact CG-OE1 3.39Å; R402-E406 IonicContact CZ-OE1 3.09Å; R402-E406 IonicContact NE-OE1 3.35Å; R402-E406 PolarHBondContact NE-OE1 3.44Å; R402-E406 IonicContact NH2-OE1 3.5Å; R402-E406 PolarHBondContact NH2-OE1 3.36Å; R402-E406 WeakPolarHBondContact O-CG 3.36Å; R402-E406 PolarHBondContact O-N 2.98Å; A403-E406 PolarHBondContact O-N 3.26Å; R404-E406 VanDerWaalsContact C-N 3.3Å; R404-E406 PolarHBondContact O-N 3.07Å; E406-P420 HydrophobicContact CG-CG 4.2Å
407	E	86	Confident	79.8	Confident	158 Å²	158	86.1 Å²	86.1	74%	0.738	44%	0.439	S	S	*	.	H	α-helix	trans	-73.3	-36	172.9	-73.5	171.4	-174	0	0	113	A403 R404 C405	A403-E407 WeakPolarHBondContact O-CG 3.2Å; A403-E407 PolarHBondContact O-N 3.17Å; R404-E407 PolarHBondContact O-N 3.46Å; C405-E407 VanDerWaalsContact C-N 3.33Å
408	E	84.2	Confident	79.4	Confident	152 Å²	152	86.4 Å²	86.4	71%	0.71	44%	0.439	S	S	*	.	H	α-helix	trans	-76.1	-25.4	179.6	-74.8	172.6	-173.5	0	0	113.1	R404 C405	R404-E408 WeakPolarHBondContact O-CB 3.37Å; R404-E408 WeakPolarHBondContact O-CG 3.31Å; R404-E408 PolarHBondContact O-N 2.74Å; C405-E408 PolarHBondContact O-N 3Å
409	L	79.3	Confident	78.8	Confident	51 Å²	51	87 Å²	87	27%	0.267	45%	0.445	S	S	.	.			trans	-84.4	121.1	176.8	-69.7	165.6	0	0	0	109.9	C405 E413 A414 P420	C405-L409 WeakPolarHBondContact O-CB 3.37Å; C405-L409 WeakPolarHBondContact O-CD1 3.37Å; C405-L409 WeakPolarHBondContact O-CG 3.39Å; C405-L409 PolarHBondContact O-N 3.21Å; L409-E413 HydrophobicContact CD2-CB 4.26Å; L409-A414 HydrophobicContact CB-CB 3.69Å; L409-A414 WeakPolarHBondContact O-CB 3.45Å; L409-P420 HydrophobicContact CD1-CB 3.78Å
410	E	63.1	Low	78.4	Confident	178 Å²	178	81 Å²	81	83%	0.832	42%	0.424	S	S	*	.			trans	-99.3	140.2	171	-66	-175.3	171.5	0	0	110.6
411	G	63.3	Low	78	Confident	50 Å²	50	81.6 Å²	81.6	52%	0.515	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	82.8	-150.6	171.1	0	0	0	0	0	116.2	E413 A414	G411-E413 VanDerWaalsContact C-N 3.27Å; G411-E413 PolarHBondContact O-N 3.2Å; G411-A414 WeakPolarHBondContact O-CB 3.4Å; G411-A414 PolarHBondContact O-N 3.48Å
412	E	53.8	Low	77.9	Confident	182 Å²	182	81.4 Å²	81.4	85%	0.85	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-63.7	-24.8	-173.7	-71.7	-169.9	157.6	0	0	113.8	A414 Q415	E412-A414 VanDerWaalsContact C-N 3.3Å; E412-A414 PolarHBondContact O-N 3.4Å; E412-Q415 PolarHBondContact O-N 2.83Å
413	E	52.6	Low	78.1	Confident	153 Å²	153	81.8 Å²	81.8	72%	0.715	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-69.9	-25.3	177.5	-68.9	-172.9	166.4	0	0	113	L409 G411 Q415	L409-E413 HydrophobicContact CD2-CB 4.26Å; G411-E413 VanDerWaalsContact C-N 3.27Å; G411-E413 PolarHBondContact O-N 3.2Å; E413-Q415 VanDerWaalsContact C-N 3.27Å; E413-Q415 PolarHBondContact O-N 2.84Å
414	A	53.4	Low	78.2	Confident	23 Å²	23	80.6 Å²	80.6	19%	0.19	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-75.3	-15.9	174.2	0	0	0	0	0	113.1	L409 G411 E412	L409-A414 HydrophobicContact CB-CB 3.69Å; L409-A414 WeakPolarHBondContact O-CB 3.45Å; G411-A414 WeakPolarHBondContact O-CB 3.4Å; G411-A414 PolarHBondContact O-N 3.48Å; E412-A414 VanDerWaalsContact C-N 3.3Å; E412-A414 PolarHBondContact O-N 3.4Å
415	Q	56.8	Low	78.5	Confident	155 Å²	155	78.7 Å²	78.7	72%	0.724	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-116.5	19.5	-165.6	-71.7	169.5	1.6	0	0	113.8	E412 E413	E412-Q415 PolarHBondContact O-N 2.83Å; E413-Q415 VanDerWaalsContact C-N 3.27Å; E413-Q415 PolarHBondContact O-N 2.84Å
416	G	70.1	Confident	78.7	Confident	31 Å²	31	78 Å²	78	32%	0.32	42%	0.423	S	S	.	.			trans	-51.8	148.4	168.6	0	0	0	0	0	111	H418 G419	G416-H418 PolarHBondContact O-N 2.64Å; G416-G419 PolarHBondContact O-N 2.63Å
417	P	80.1	Confident	79	Confident	92 Å²	92	74.8 Å²	74.8	60%	0.597	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-13	-172.5	22.7	-33.1	0	0	0	114.2	G262	G262-P417 VanDerWaalsContact CA-CG 3.48Å
418	H	87.8	Confident	79.4	Confident	42 Å²	42	73.5 Å²	73.5	19%	0.194	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	10.6	-179.7	-56.5	-60.9	0	0	0	114.1	P261 L263 G312 G416	P261-H418 PolarHBondContact O-CD2 2.92Å; P261-H418 PolarHBondContact O-NE2 2.89Å; P261-H418 VanDerWaalsContact O-NE2 3.12Å; L263-H418 PolarHBondContact O-CE1 3.16Å; L263-H418 PolarHBondContact O-NE2 3.35Å; G312-H418 VanDerWaalsContact CA-CG 3.45Å; G416-H418 PolarHBondContact O-N 2.64Å
419	G	85.3	Confident	79.7	Confident	13 Å²	13	70.6 Å²	70.6	13%	0.134	42%	0.415	C	S	.	.	S	Bend	trans	84.5	-155.8	-176.4	0	0	0	0	0	113.4	G416	G416-G419 PolarHBondContact O-N 2.63Å
420	P	87.2	Confident	80.5	Confident	8 Å²	8	69.6 Å²	69.6	5%	0.052	41%	0.409	C	S	.	.	S	Bend	trans	-66.4	135.7	-170.7	25	-32.4	0	0	0	111.8	R402 C405 E406 L409 W424	R402-P420 HydrophobicContact CG-CG 4.01Å; C405-P420 HydrophobicContact CB-CB 3.92Å; C405-P420 HydrophobicContact CB-CG 4.04Å; E406-P420 HydrophobicContact CG-CG 4.2Å; L409-P420 HydrophobicContact CD1-CB 3.78Å; P420-W424 HydrophobicContact CG-CZ2 3.84Å; P420-W424 PolarHBondContact O-NE1 3.49Å
421	A	88.1	Confident	82.1	Confident	73 Å²	73	64.2 Å²	64.2	60%	0.603	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-61.9	152.6	-178.2	0	0	0	0	0	112.7	W424	A421-W424 PolarHBondContact O-NE1 3.32Å
422	F	92.6	Very high	83.6	Confident	36 Å²	36	63.7 Å²	63.7	16%	0.158	38%	0.38	C	S	.	.	S	Bend	trans	-80.2	155.6	168	-67.3	-68.9	0	0	0	110.1	P311 R355 Y356 W424	P311-F422 WeakPolarHBondContact O-CE2 3.48Å; R355-F422 HydrophobicContact CB-CB 4.48Å; R355-F422 HydrophobicContact CB-CD1 3.57Å; R355-F422 HydrophobicContact CB-CE1 3.86Å; R355-F422 HydrophobicContact CB-CG 3.94Å; R355-F422 HydrophobicContact CB-CZ 4.45Å; R355-F422 HydrophobicContact CG-CB 4.14Å; R355-F422 HydrophobicContact CG-CD1 3.76Å; R355-F422 HydrophobicContact CG-CD2 3.78Å; R355-F422 HydrophobicContact CG-CE1 4.09Å; R355-F422 HydrophobicContact CG-CE2 4.11Å; R355-F422 HydrophobicContact CG-CG 3.6Å; R355-F422 HydrophobicContact CG-CZ 4.26Å; R355-F422 WeakPolarHBondContact O-CD1 3.42Å; Y356-F422 AromaticContact CE1-CE1 3.81Å; Y356-F422 HydrophobicContact CE1-CE1 3.81Å; Y356-F422 AromaticContact CZ-CE1 3.85Å; F422-W424 HydrophobicContact CD1-CB 4.37Å; F422-W424 AromaticContact CD1-CD1 3.61Å; F422-W424 HydrophobicContact CD1-CD2 4.23Å; F422-W424 AromaticContact CD1-CG 3.82Å; F422-W424 HydrophobicContact CD1-CG 3.82Å; F422-W424 AromaticContact CD1-NE1 3.82Å; F422-W424 AromaticContact CE1-CD1 3.95Å; F422-W424 AromaticContact CE1-CD2 3.81Å; F422-W424 HydrophobicContact CE1-CD2 3.81Å; F422-W424 AromaticContact CE1-CE2 3.78Å; F422-W424 HydrophobicContact CE1-CE3 4.42Å; F422-W424 AromaticContact CE1-CG 3.9Å; F422-W424 HydrophobicContact CE1-CG 3.9Å; F422-W424 HydrophobicContact CE1-CZ2 4.32Å; F422-W424 AromaticContact CE1-NE1 3.85Å
423	P	95.5	Very high	85.6	Confident	74 Å²	74	62 Å²	62	48%	0.481	37%	0.366	S	S	.	.	P	Polyproline II helix	cis	-79.5	145.1	6.3	31.5	-36.6	0	0	0	114.4	H354 P357	H354-P423 VanDerWaalsContact O-CB 3.25Å; H354-P423 WeakPolarHBondContact O-CB 3.49Å; P357-P423 HydrophobicContact CG-CB 3.9Å
424	W	95.4	Very high	87.6	Confident	15 Å²	15	60.8 Å²	60.8	6%	0.057	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-94.8	125.2	169.2	-70.3	8.8	0	0	0	110.7	R355 Y356 L398 Y401 R402 P420 A421 F422 V426 L469	R355-W424 PolarHBondContact O-N 3.37Å; Y356-W424 HydrophobicContact CD1-CB 4.15Å; Y356-W424 HydrophobicContact CE1-CB 4.42Å; Y356-W424 HydrophobicContact CE1-CD2 4.41Å; Y356-W424 AromaticContact CE1-CE3 3.99Å; Y356-W424 HydrophobicContact CE1-CE3 3.99Å; L398-W424 HydrophobicContact CD2-CE3 4.45Å; L398-W424 HydrophobicContact CD2-CZ3 4.41Å; Y401-W424 HydrophobicContact CD1-CB 4.25Å; Y401-W424 AromaticContact CD1-CD2 3.96Å; Y401-W424 HydrophobicContact CD1-CD2 3.96Å; Y401-W424 AromaticContact CD1-CE3 3.81Å; Y401-W424 HydrophobicContact CD1-CE3 3.81Å; Y401-W424 HydrophobicContact CD1-CG 4.15Å; Y401-W424 HydrophobicContact CE1-CB 3.61Å; Y401-W424 AromaticContact CE1-CD2 3.98Å; Y401-W424 HydrophobicContact CE1-CD2 3.98Å; Y401-W424 HydrophobicContact CE1-CE3 4.27Å; Y401-W424 AromaticContact CE1-CG 3.68Å; Y401-W424 HydrophobicContact CE1-CG 3.68Å; R402-W424 HydrophobicContact CB-CH2 3.79Å; R402-W424 HydrophobicContact CB-CZ2 4.39Å; R402-W424 HydrophobicContact CB-CZ3 4.27Å; R402-W424 HydrophobicContact CG-CH2 4.01Å; R402-W424 HydrophobicContact CG-CZ2 4.31Å; P420-W424 HydrophobicContact CG-CZ2 3.84Å; P420-W424 PolarHBondContact O-NE1 3.49Å; A421-W424 PolarHBondContact O-NE1 3.32Å; F422-W424 HydrophobicContact CD1-CB 4.37Å; F422-W424 AromaticContact CD1-CD1 3.61Å; F422-W424 HydrophobicContact CD1-CD2 4.23Å; F422-W424 AromaticContact CD1-CG 3.82Å; F422-W424 HydrophobicContact CD1-CG 3.82Å; F422-W424 AromaticContact CD1-NE1 3.82Å; F422-W424 AromaticContact CE1-CD1 3.95Å; F422-W424 AromaticContact CE1-CD2 3.81Å; F422-W424 HydrophobicContact CE1-CD2 3.81Å; F422-W424 AromaticContact CE1-CE2 3.78Å; F422-W424 HydrophobicContact CE1-CE3 4.42Å; F422-W424 AromaticContact CE1-CG 3.9Å; F422-W424 HydrophobicContact CE1-CG 3.9Å; F422-W424 HydrophobicContact CE1-CZ2 4.32Å; F422-W424 AromaticContact CE1-NE1 3.85Å; W424-V426 HydrophobicContact CB-CG1 4.08Å; W424-V426 PolarHBondContact O-N 3.46Å; W424-L469 HydrophobicContact CH2-CD2 3.7Å; W424-L469 HydrophobicContact CZ3-CD2 3.71Å
425	L	96.1	Very high	89.7	Confident	75 Å²	75	61.6 Å²	61.6	39%	0.393	35%	0.353	S	S	.	.			trans	-83.3	16	176.5	-59.5	177	0	0	0	112.8	P357 Y401 G427 Q428	P357-L425 HydrophobicContact CG-CD2 4.09Å; Y401-L425 PolarHBondContact OH-N 3.12Å; L425-G427 PolarHBondContact O-N 3.26Å; L425-Q428 HydrophobicContact CB-CG 4.31Å; L425-Q428 WeakPolarHBondContact O-CG 3.14Å; L425-Q428 PolarHBondContact O-N 2.91Å
426	V	95.3	Very high	91.6	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.018	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	133.8	169.4	66.7	0	0	0	0	109.3	Y356 V359 L397 L398 Y401 W424 L438	Y356-V426 HydrophobicContact CD1-CG1 3.81Å; Y356-V426 HydrophobicContact CE1-CG1 4.47Å; V359-V426 HydrophobicContact CG2-CG1 3.97Å; V359-V426 WeakPolarHBondContact CG2-O 3.35Å; L397-V426 HydrophobicContact CD2-CG2 4.24Å; L397-V426 HydrophobicContact CG-CG2 4.11Å; L398-V426 HydrophobicContact CD2-CG1 4.06Å; L398-V426 HydrophobicContact CD2-CG2 4.25Å; Y401-V426 HydrophobicContact CD1-CB 4.09Å; Y401-V426 HydrophobicContact CD2-CB 3.74Å; Y401-V426 HydrophobicContact CD2-CG2 4.09Å; Y401-V426 HydrophobicContact CE1-CB 4.35Å; Y401-V426 HydrophobicContact CE2-CB 4.06Å; Y401-V426 HydrophobicContact CG-CB 3.79Å; Y401-V426 HydrophobicContact CG-CG2 4.1Å; W424-V426 HydrophobicContact CB-CG1 4.08Å; W424-V426 PolarHBondContact O-N 3.46Å; V426-L438 HydrophobicContact CG2-CD2 4.29Å
427	G	93.5	Very high	92.9	Very high	6 Å²	6	58.3 Å²	58.3	6%	0.062	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	-15.5	-174	0	0	0	0	0	114.9	L425 G429 L430	L425-G427 PolarHBondContact O-N 3.26Å; G427-G429 PolarHBondContact O-N 2.83Å; G427-L430 WeakPolarHBondContact O-CB 3.36Å; G427-L430 PolarHBondContact O-N 2.62Å; G427-L430 VanDerWaalsContact O-N 3.09Å
428	Q	93.8	Very high	93.8	Very high	132 Å²	132	53.9 Å²	53.9	62%	0.617	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	136.4	167	-74.4	-175.2	-2.7	0	0	110.6	A358 L425 L430	A358-Q428 HydrophobicContact CB-CG 3.87Å; L425-Q428 HydrophobicContact CB-CG 4.31Å; L425-Q428 WeakPolarHBondContact O-CG 3.14Å; L425-Q428 PolarHBondContact O-N 2.91Å; Q428-L430 PolarHBondContact O-N 3.21Å; Q428-L430 VanDerWaalsContact O-N 3.15Å
429	G	91.6	Very high	94.3	Very high	90 Å²	90	51.9 Å²	51.9	93%	0.928	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-5.1	-175.4	0	0	0	0	0	115.5	G427	G427-G429 PolarHBondContact O-N 2.83Å
430	L	95.5	Very high	94.9	Very high	30 Å²	30	51.3 Å²	51.3	16%	0.157	28%	0.28	C	S	.	.			trans	-77.8	140	175.2	-62.9	-171	0	0	0	111.7	W393 L397 G427 Q428 R434 R435 L438	W393-L430 HydrophobicContact CH2-CD1 4.22Å; W393-L430 HydrophobicContact CZ2-CD1 4.41Å; L397-L430 HydrophobicContact CD2-CD1 3.82Å; G427-L430 WeakPolarHBondContact O-CB 3.36Å; G427-L430 PolarHBondContact O-N 2.62Å; G427-L430 VanDerWaalsContact O-N 3.09Å; Q428-L430 PolarHBondContact O-N 3.21Å; Q428-L430 VanDerWaalsContact O-N 3.15Å; L430-R434 HydrophobicContact CB-CB 4.13Å; L430-R434 HydrophobicContact CD1-CB 4.27Å; L430-R435 HydrophobicContact CB-CG 3.8Å; L430-R435 PolarHBondContact O-NE 2.89Å; L430-L438 HydrophobicContact CD1-CD2 4.37Å
431	S	95.6	Very high	95.4	Very high	66 Å²	66	50.9 Å²	50.9	46%	0.462	28%	0.278	S	S	.	.			trans	-58.2	151.4	170.8	70.8	0	0	0	0	111.6	R433 R434 R435	S431-R433 PolarHBondContact O-N 3.42Å; S431-R434 PolarHBondContact O-N 2.92Å; S431-R434 PolarHBondContact OG-N 2.86Å; S431-R435 PolarHBondContact O-N 2.84Å
432	S	95.1	Very high	95.9	Very high	39 Å²	39	47.5 Å²	47.5	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-56.8	-28.6	-179.7	-49.3	0	0	0	0	112.6	E363 R435 R436	E363-S432 WeakPolarHBondContact OE1-CB 3.5Å; E363-S432 PolarHBondContact OE1-OG 3.35Å; S432-R435 PolarHBondContact OG-NH2 3.04Å; S432-R435 VanDerWaalsContact OG-NH2 3.1Å; S432-R436 VanDerWaalsContact O-CG 3.31Å; S432-R436 WeakPolarHBondContact O-CG 3.47Å; S432-R436 PolarHBondContact O-N 3.13Å; S432-R436 VanDerWaalsContact O-N 3.09Å; S432-R436 PolarHBondContact O-NH1 3.41Å
433	R	95.6	Very high	96.2	Very high	145 Å²	145	45.8 Å²	45.8	55%	0.547	24%	0.242	S	C	.	.	H	α-helix	trans	-66.7	-44.7	174.2	-177.6	178.5	177.7	176.7	-0.5	112.3	S431 R437	S431-R433 PolarHBondContact O-N 3.42Å; R433-R437 WeakPolarHBondContact O-CG 3.49Å; R433-R437 PolarHBondContact O-N 3.19Å
434	R	95.8	Very high	96.2	Very high	128 Å²	128	47.3 Å²	47.3	48%	0.483	24%	0.238	S	C	.	.	H	α-helix	trans	-68.3	-42.2	178.1	-79	-177.8	173.7	174.2	-1.2	111.1	W393 L430 S431 R436 R437 L438	W393-R434 HydrophobicContact CH2-CB 3.78Å; W393-R434 HydrophobicContact CH2-CG 3.95Å; W393-R434 HydrophobicContact CZ2-CB 4.2Å; W393-R434 HydrophobicContact CZ2-CG 4.01Å; L430-R434 HydrophobicContact CB-CB 4.13Å; L430-R434 HydrophobicContact CD1-CB 4.27Å; S431-R434 PolarHBondContact O-N 2.92Å; S431-R434 PolarHBondContact OG-N 2.86Å; R434-R436 PolarHBondContact O-N 3.42Å; R434-R437 PolarHBondContact O-N 3.47Å; R434-L438 PolarHBondContact O-N 3.42Å
435	R	96.3	Very high	96.3	Very high	40 Å²	40	49.3 Å²	49.3	15%	0.151	25%	0.247	C	C	.	.	H	α-helix	trans	-57.2	-47.4	174.2	-71.2	-170.5	-83.9	133.6	5.8	112.1	A358 E363 L430 S431 S432 R437 L438 A439	A358-R435 WeakPolarHBondContact O-CD 3.23Å; E363-R435 IonicContact OE1-CZ 3.37Å; E363-R435 IonicContact OE1-NH1 3.64Å; E363-R435 IonicContact OE1-NH2 3.62Å; E363-R435 PolarHBondContact OE1-NH2 2.91Å; E363-R435 IonicContact OE2-CZ 3.51Å; E363-R435 IonicContact OE2-NH1 3.69Å; E363-R435 PolarHBondContact OE2-NH1 3.34Å; E363-R435 IonicContact OE2-NH2 2.77Å; L430-R435 HydrophobicContact CB-CG 3.8Å; L430-R435 PolarHBondContact O-NE 2.89Å; S431-R435 PolarHBondContact O-N 2.84Å; S432-R435 PolarHBondContact OG-NH2 3.04Å; S432-R435 VanDerWaalsContact OG-NH2 3.1Å; R435-R437 VanDerWaalsContact C-N 3.33Å; R435-R437 PolarHBondContact O-N 3.18Å; R435-L438 PolarHBondContact O-N 2.91Å; R435-A439 WeakPolarHBondContact O-CB 3.22Å; R435-A439 PolarHBondContact O-N 3Å
436	R	97.5	Very high	96.4	Very high	71 Å²	71	45.9 Å²	45.9	27%	0.268	23%	0.229	S	C	.	.	H	α-helix	trans	-57.9	-41	175.7	-76.7	-171.2	-61.6	-92.8	6.5	113.7	E363 V367 S432 R434 L440	E363-R436 HydrophobicContact CB-CG 4.26Å; E363-R436 WeakPolarHBondContact O-CG 3.44Å; V367-R436 HydrophobicContact CB-CB 4.4Å; V367-R436 HydrophobicContact CB-CG 4.08Å; V367-R436 HydrophobicContact CG1-CB 3.84Å; V367-R436 HydrophobicContact CG1-CG 3.79Å; S432-R436 VanDerWaalsContact O-CG 3.31Å; S432-R436 WeakPolarHBondContact O-CG 3.47Å; S432-R436 PolarHBondContact O-N 3.13Å; S432-R436 VanDerWaalsContact O-N 3.09Å; S432-R436 PolarHBondContact O-NH1 3.41Å; R434-R436 PolarHBondContact O-N 3.42Å; R436-L440 WeakPolarHBondContact O-CG 3.42Å; R436-L440 PolarHBondContact O-N 3.32Å; R436-L440 VanDerWaalsContact O-N 3.14Å
437	R	97.5	Very high	96.5	Very high	46 Å²	46	45.9 Å²	45.9	17%	0.174	23%	0.229	C	C	.	.	H	α-helix	trans	-68.3	-45.1	179.4	-73.1	169.4	168.2	-169.4	-14.4	111.8	Y387 R388 V389 R433 R434 R435 A439 L440 F441	Y387-R437 PolarHBondContact O-NE 3.09Å; Y387-R437 PolarHBondContact O-NH2 3.34Å; Y387-R437 VanDerWaalsContact O-NH2 3.13Å; R388-R437 PolarHBondContact O-NE 2.85Å; R388-R437 PolarHBondContact O-NH2 3.1Å; V389-R437 HydrophobicContact CG1-CB 4.49Å; V389-R437 HydrophobicContact CG2-CB 4.33Å; V389-R437 HydrophobicContact CG2-CG 4.35Å; R433-R437 WeakPolarHBondContact O-CG 3.49Å; R433-R437 PolarHBondContact O-N 3.19Å; R434-R437 PolarHBondContact O-N 3.47Å; R435-R437 VanDerWaalsContact C-N 3.33Å; R435-R437 PolarHBondContact O-N 3.18Å; R437-A439 VanDerWaalsContact C-N 3.35Å; R437-L440 PolarHBondContact O-N 2.98Å; R437-F441 PolarHBondContact O-N 2.92Å
438	L	98.2	Very high	96.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-39.3	177	-175	59.4	0	0	0	111.6	V359 W393 C394 L397 L398 V426 L430 R434 R435 L440 F441 L442	V359-L438 HydrophobicContact CG1-CB 4.06Å; V359-L438 HydrophobicContact CG1-CD2 4.25Å; V359-L438 HydrophobicContact CG1-CG 3.98Å; V359-L438 HydrophobicContact CG2-CD2 3.57Å; V359-L438 HydrophobicContact CG2-CG 4.12Å; W393-L438 HydrophobicContact CZ3-CB 4.47Å; C394-L438 HydrophobicContact CB-CD1 3.98Å; L397-L438 HydrophobicContact CD2-CD2 3.87Å; L398-L438 HydrophobicContact CD1-CD1 4.21Å; L398-L438 HydrophobicContact CD2-CD1 4.45Å; L398-L438 HydrophobicContact CG-CD1 4.26Å; V426-L438 HydrophobicContact CG2-CD2 4.29Å; L430-L438 HydrophobicContact CD1-CD2 4.37Å; R434-L438 PolarHBondContact O-N 3.42Å; R435-L438 PolarHBondContact O-N 2.91Å; L438-L440 PolarHBondContact O-N 3.3Å; L438-F441 HydrophobicContact CD1-CD1 4.33Å; L438-F441 WeakPolarHBondContact O-CB 3.32Å; L438-F441 PolarHBondContact O-N 3.44Å; L438-L442 HydrophobicContact CD1-CD1 4.36Å; L438-L442 HydrophobicContact CD1-CG 4.39Å; L438-L442 HydrophobicContact CG-CD1 4.1Å; L438-L442 WeakPolarHBondContact O-CG 3.38Å; L438-L442 PolarHBondContact O-N 3Å
439	A	98.4	Very high	96.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.8	-45.5	174.9	0	0	0	0	0	111.9	V359 M360 V367 V368 R435 R437 L442 A443	V359-A439 HydrophobicContact CG1-CB 3.76Å; M360-A439 HydrophobicContact SD-CB 4.14Å; V367-A439 HydrophobicContact CG1-CB 4.26Å; V368-A439 HydrophobicContact CG2-CB 3.82Å; R435-A439 WeakPolarHBondContact O-CB 3.22Å; R435-A439 PolarHBondContact O-N 3Å; R437-A439 VanDerWaalsContact C-N 3.35Å; A439-L442 PolarHBondContact O-N 3.49Å; A439-A443 WeakPolarHBondContact O-CB 3.4Å; A439-A443 PolarHBondContact O-N 3.12Å
440	L	98.3	Very high	96.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.8	-39.7	175.9	-73.5	175.1	0	0	0	112.7	V367 W371 F383 Y384 Y387 V389 R436 R437 L438 A443 R444	V367-L440 HydrophobicContact CG1-CD2 4.43Å; V367-L440 HydrophobicContact CG1-CG 4.09Å; V367-L440 HydrophobicContact CG2-CD1 3.79Å; V367-L440 HydrophobicContact CG2-CD2 4.06Å; V367-L440 HydrophobicContact CG2-CG 3.96Å; W371-L440 HydrophobicContact CB-CD2 3.56Å; W371-L440 HydrophobicContact CG-CD2 3.81Å; F383-L440 HydrophobicContact CD1-CD2 4.44Å; F383-L440 HydrophobicContact CE1-CD1 4.13Å; F383-L440 HydrophobicContact CE1-CD2 3.97Å; Y384-L440 HydrophobicContact CD2-CB 4.35Å; Y384-L440 HydrophobicContact CE2-CB 4.2Å; Y387-L440 HydrophobicContact CD1-CD1 3.85Å; Y387-L440 HydrophobicContact CD2-CD1 3.69Å; Y387-L440 HydrophobicContact CE1-CD1 4.39Å; Y387-L440 HydrophobicContact CE2-CD1 4.24Å; Y387-L440 HydrophobicContact CG-CD1 3.47Å; Y387-L440 VanDerWaalsContact CG-CD1 3.47Å; V389-L440 HydrophobicContact CG2-CB 4.3Å; V389-L440 HydrophobicContact CG2-CD1 4.47Å; R436-L440 WeakPolarHBondContact O-CG 3.42Å; R436-L440 PolarHBondContact O-N 3.32Å; R436-L440 VanDerWaalsContact O-N 3.14Å; R437-L440 PolarHBondContact O-N 2.98Å; L438-L440 PolarHBondContact O-N 3.3Å; L440-A443 PolarHBondContact O-N 2.96Å; L440-R444 WeakPolarHBondContact O-CB 3.42Å; L440-R444 PolarHBondContact O-N 2.96Å
441	F	98.3	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-57.3	-53.8	174.3	175.1	-95.8	0	0	0	111	V389 E391 C394 L395 L398 R437 L438 A443 R444 K445 W467	V389-F441 HydrophobicContact CG1-CB 3.96Å; E391-F441 HydrophobicContact CB-CD2 4.28Å; E391-F441 HydrophobicContact CB-CE2 3.89Å; E391-F441 HydrophobicContact CG-CD2 3.96Å; E391-F441 HydrophobicContact CG-CE2 3.92Å; C394-F441 HydrophobicContact CB-CB 4.2Å; C394-F441 HydrophobicContact CB-CD1 3.64Å; C394-F441 HydrophobicContact CB-CD2 3.81Å; C394-F441 HydrophobicContact CB-CE1 3.89Å; C394-F441 HydrophobicContact CB-CE2 4.03Å; C394-F441 HydrophobicContact CB-CG 3.6Å; C394-F441 HydrophobicContact CB-CZ 4.07Å; L395-F441 HydrophobicContact CD2-CE1 4.4Å; L395-F441 HydrophobicContact CD2-CZ 3.74Å; L395-F441 HydrophobicContact CG-CE2 4.43Å; L395-F441 HydrophobicContact CG-CZ 3.8Å; L398-F441 HydrophobicContact CD1-CD1 4.21Å; L398-F441 HydrophobicContact CD1-CE1 3.77Å; R437-F441 PolarHBondContact O-N 2.92Å; L438-F441 HydrophobicContact CD1-CD1 4.33Å; L438-F441 WeakPolarHBondContact O-CB 3.32Å; L438-F441 PolarHBondContact O-N 3.44Å; F441-A443 PolarHBondContact O-N 3.37Å; F441-R444 PolarHBondContact O-N 3.23Å; F441-K445 HydrophobicContact CD1-CG 4.31Å; F441-K445 HydrophobicContact CE1-CG 3.93Å; F441-K445 HydrophobicContact CE2-CD 4.39Å; F441-K445 HydrophobicContact CE2-CG 4.25Å; F441-K445 HydrophobicContact CZ-CD 4.21Å; F441-K445 HydrophobicContact CZ-CG 3.9Å; F441-K445 WeakPolarHBondContact O-CG 3.12Å; F441-K445 PolarHBondContact O-N 2.8Å; F441-W467 HydrophobicContact CE1-CH2 4.3Å
442	L	98.4	Very high	96.5	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-41.2	-179.9	-69.1	167	0	0	0	112	L352 Y356 V359 L398 L438 A439 R444 K445 H446 W467	L352-L442 HydrophobicContact CD2-CB 3.92Å; Y356-L442 HydrophobicContact CD1-CD1 4.06Å; Y356-L442 HydrophobicContact CD2-CD1 3.65Å; Y356-L442 HydrophobicContact CD2-CD2 4.39Å; Y356-L442 HydrophobicContact CD2-CG 4.47Å; Y356-L442 HydrophobicContact CE1-CD1 4.34Å; Y356-L442 HydrophobicContact CE1-CD2 4.29Å; Y356-L442 HydrophobicContact CE2-CD1 3.95Å; Y356-L442 HydrophobicContact CE2-CD2 3.82Å; Y356-L442 HydrophobicContact CE2-CG 4.34Å; Y356-L442 HydrophobicContact CG-CD1 3.69Å; V359-L442 HydrophobicContact CG1-CD1 4.16Å; V359-L442 HydrophobicContact CG2-CD1 4.4Å; L398-L442 HydrophobicContact CD1-CD2 3.93Å; L438-L442 HydrophobicContact CD1-CD1 4.36Å; L438-L442 HydrophobicContact CD1-CG 4.39Å; L438-L442 HydrophobicContact CG-CD1 4.1Å; L438-L442 WeakPolarHBondContact O-CG 3.38Å; L438-L442 PolarHBondContact O-N 3Å; A439-L442 PolarHBondContact O-N 3.49Å; L442-R444 VanDerWaalsContact C-N 3.34Å; L442-R444 PolarHBondContact O-N 3.09Å; L442-K445 PolarHBondContact O-N 3.37Å; L442-H446 PolarHBondContact O-CD2 3.19Å; L442-H446 VanDerWaalsContact O-CD2 3.32Å; L442-H446 PolarHBondContact O-N 3.28Å; L442-W467 HydrophobicContact CD2-CH2 4.41Å; L442-W467 HydrophobicContact CD2-CZ2 4.06Å
443	A	98.1	Very high	96.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.3	-45.9	175.2	0	0	0	0	0	112.2	L348 L352 V368 W371 A439 L440 F441 K445 H446 L447	L348-A443 HydrophobicContact CD2-CB 4.08Å; L352-A443 HydrophobicContact CD1-CB 3.95Å; V368-A443 HydrophobicContact CG1-CB 3.99Å; V368-A443 HydrophobicContact CG2-CB 4.14Å; W371-A443 HydrophobicContact CE3-CB 4.05Å; W371-A443 HydrophobicContact CH2-CB 4.41Å; W371-A443 HydrophobicContact CZ3-CB 3.87Å; A439-A443 WeakPolarHBondContact O-CB 3.4Å; A439-A443 PolarHBondContact O-N 3.12Å; L440-A443 PolarHBondContact O-N 2.96Å; F441-A443 PolarHBondContact O-N 3.37Å; A443-K445 VanDerWaalsContact C-N 3.33Å; A443-K445 PolarHBondContact O-N 3.02Å; A443-H446 PolarHBondContact O-N 3.46Å; A443-L447 WeakPolarHBondContact O-CB 3.45Å; A443-L447 PolarHBondContact O-N 2.95Å
444	R	96.7	Very high	96.3	Very high	107 Å²	107	33.4 Å²	33.4	40%	0.404	15%	0.145	S	C	.	.	H	α-helix	trans	-70.2	-27	178.6	-168.5	177.6	-179.8	-151.3	-2.1	113.4	W371 Y384 E391 L440 F441 L442	W371-R444 HydrophobicContact CZ2-CB 4.38Å; Y384-R444 HydrophobicContact CD2-CB 4.48Å; Y384-R444 HydrophobicContact CE2-CB 4.02Å; Y384-R444 HydrophobicContact CE2-CG 4.46Å; E391-R444 IonicContact OE1-NH1 3.39Å; E391-R444 PolarHBondContact OE1-NH1 2.69Å; L440-R444 WeakPolarHBondContact O-CB 3.42Å; L440-R444 PolarHBondContact O-N 2.96Å; F441-R444 PolarHBondContact O-N 3.23Å; L442-R444 VanDerWaalsContact C-N 3.34Å; L442-R444 PolarHBondContact O-N 3.09Å
445	K	97.5	Very high	96	Very high	57 Å²	57	33.8 Å²	33.8	25%	0.248	15%	0.151	C	C	.	.	H	α-helix	trans	-77.5	-28.2	175.3	-65.7	-63.2	179.5	-166	0	112.7	E391 F441 L442 A443 W467	E391-K445 IonicContact OE2-NZ 2.77Å; E391-K445 PolarHBondContact OE2-NZ 3.39Å; F441-K445 HydrophobicContact CD1-CG 4.31Å; F441-K445 HydrophobicContact CE1-CG 3.93Å; F441-K445 HydrophobicContact CE2-CD 4.39Å; F441-K445 HydrophobicContact CE2-CG 4.25Å; F441-K445 HydrophobicContact CZ-CD 4.21Å; F441-K445 HydrophobicContact CZ-CG 3.9Å; F441-K445 WeakPolarHBondContact O-CG 3.12Å; F441-K445 PolarHBondContact O-N 2.8Å; L442-K445 PolarHBondContact O-N 3.37Å; A443-K445 VanDerWaalsContact C-N 3.33Å; A443-K445 PolarHBondContact O-N 3.02Å; K445-W467 HydrophobicContact CB-CD2 3.75Å; K445-W467 VanDerWaalsContact CB-CE2 3.49Å; K445-W467 HydrophobicContact CB-CG 3.82Å; K445-W467 HydrophobicContact CB-CZ2 4.06Å; K445-W467 HydrophobicContact CD-CD2 4.24Å; K445-W467 HydrophobicContact CD-CE3 4.37Å; K445-W467 HydrophobicContact CD-CG 4.37Å; K445-W467 HydrophobicContact CG-CD2 4.06Å; K445-W467 HydrophobicContact CG-CE3 4.36Å; K445-W467 HydrophobicContact CG-CG 4.42Å; K445-W467 HydrophobicContact CG-CZ2 4.4Å
446	H	98.2	Very high	95.8	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.009	16%	0.157	C	C	.	.	H	α-helix	trans	-98.6	-17.9	-179.2	-76.7	-69.5	0	0	0	114.8	V314 L316 L348 L351 L442 A443 W467	V314-H446 PolarHBondContact O-ND1 3Å; L316-H446 WeakPolarHBondContact CB-O 3.25Å; L316-H446 PolarHBondContact N-O 2.96Å; L348-H446 HydrophobicContact CD1-CB 3.7Å; L351-H446 HydrophobicContact CD2-CB 4.28Å; L442-H446 PolarHBondContact O-CD2 3.19Å; L442-H446 VanDerWaalsContact O-CD2 3.32Å; L442-H446 PolarHBondContact O-N 3.28Å; A443-H446 PolarHBondContact O-N 3.46Å; H446-W467 AromaticContact CD2-NE1 3.78Å; H446-W467 AromaticContact CE1-NE1 3.42Å; H446-W467 PolarHBondContact CE1-NE1 2.86Å; H446-W467 AromaticContact ND1-NE1 3.79Å; H446-W467 AromaticContact NE2-NE1 3.38Å; H446-W467 PolarHBondContact NE2-NE1 3.09Å
447	L	97.6	Very high	95.5	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128	179.3	-170.8	82.1	0	0	0	110.8	L316 R318 L348 W371 L372 A443	L316-L447 HydrophobicContact CB-CD1 3.52Å; L316-L447 HydrophobicContact CD1-CD1 4.28Å; L316-L447 CarbonylContact O-C 3.57Å; L316-L447 WeakPolarHBondContact O-CA 3.41Å; R318-L447 HydrophobicContact CB-CD1 3.7Å; R318-L447 HydrophobicContact CB-CD2 4.36Å; R318-L447 HydrophobicContact CB-CG 4.23Å; L348-L447 HydrophobicContact CD1-CB 4.16Å; L348-L447 HydrophobicContact CD2-CB 3.82Å; L348-L447 HydrophobicContact CD2-CD2 4.02Å; L348-L447 HydrophobicContact CD2-CG 4.37Å; W371-L447 HydrophobicContact CH2-CB 4.13Å; W371-L447 HydrophobicContact CH2-CD2 3.8Å; W371-L447 HydrophobicContact CH2-CG 4.47Å; W371-L447 HydrophobicContact CZ3-CB 4.4Å; W371-L447 HydrophobicContact CZ3-CD2 3.71Å; L372-L447 HydrophobicContact CD2-CD2 3.58Å; A443-L447 WeakPolarHBondContact O-CB 3.45Å; A443-L447 PolarHBondContact O-N 2.95Å
448	K	96.3	Very high	95.4	Very high	43 Å²	43	33.3 Å²	33.3	19%	0.187	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.5	169.8	-179.5	-179	175.1	-164.2	0	109.3	L315 L316 L317 R318 E462 Q464	L315-K448 HydrophobicContact CD1-CB 4.17Å; L316-K448 PolarHBondContact O-N 3.37Å; L317-K448 WeakPolarHBondContact CA-O 3.48Å; L317-K448 HydrophobicContact CD2-CB 3.87Å; L317-K448 HydrophobicContact CD2-CD 3.99Å; L317-K448 HydrophobicContact CD2-CG 4.3Å; R318-K448 PolarHBondContact N-O 3.07Å; K448-E462 WeakPolarHBondContact CE-OE2 3.31Å; K448-E462 PolarHBondContact NZ-O 2.95Å; K448-E462 VanDerWaalsContact NZ-O 3.1Å; K448-E462 IonicContact NZ-OE2 2.87Å; K448-E462 PolarHBondContact NZ-OE2 2.85Å; K448-Q464 VanDerWaalsContact NZ-CD 3.35Å
449	N	95.1	Very high	95.3	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.053	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	137.3	173.3	-79.3	-43.1	0	0	0	110.5	R318 T320 L377 E380	R318-N449 PolarHBondContact NE-OD1 2.94Å; R318-N449 PolarHBondContact NH2-ND2 3.29Å; R318-N449 VanDerWaalsContact NH2-ND2 3.16Å; R318-N449 PolarHBondContact NH2-OD1 3.44Å; R318-N449 WeakPolarHBondContact O-CA 3.16Å; T320-N449 HydrophobicContact CG2-CB 3.84Å; L377-N449 HydrophobicContact CD2-CB 3.62Å; E380-N449 PolarHBondContact OE2-ND2 3.49Å
450	V	94.4	Very high	95.1	Very high	12 Å²	12	39.6 Å²	39.6	7%	0.073	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.2	174	-176.8	0	0	0	0	108	L317 R318 R319 T320 A452 L458 E462	L317-V450 HydrophobicContact CB-CG2 4.37Å; R318-V450 PolarHBondContact O-N 3.28Å; R319-V450 WeakPolarHBondContact CA-O 3.31Å; T320-V450 PolarHBondContact N-O 2.88Å; T320-V450 PolarHBondContact OG1-O 3.35Å; V450-A452 HydrophobicContact CG1-CB 3.97Å; V450-A452 PolarHBondContact O-N 2.98Å; V450-L458 HydrophobicContact CG1-CD1 4.17Å; V450-L458 HydrophobicContact CG2-CD1 4.33Å; V450-E462 HydrophobicContact CG1-CG 4.39Å
451	E	92.3	Very high	95	Very high	110 Å²	110	46 Å²	46	51%	0.514	23%	0.229	S	C	.	.			trans	-79.4	70	-179.8	-67.1	-170.5	164.3	0	0	111.5	T320 L377	T320-E451 WeakPolarHBondContact OG1-CA 3.23Å; L377-E451 HydrophobicContact CD1-CG 4.2Å; L377-E451 HydrophobicContact CG-CG 4.3Å
452	A	91.5	Very high	94.8	Very high	14 Å²	14	49 Å²	49	12%	0.116	24%	0.243	C	C	.	.			trans	-142.4	160.8	-176.1	0	0	0	0	0	112.1	Q321 V450	Q321-A452 WeakPolarHBondContact CB-O 3.4Å; Q321-A452 PolarHBondContact N-O 3.39Å; Q321-A452 VanDerWaalsContact N-O 3.16Å; V450-A452 HydrophobicContact CG1-CB 3.97Å; V450-A452 PolarHBondContact O-N 2.98Å
453	T	92.3	Very high	94.7	Very high	56 Å²	56	49.2 Å²	49.2	34%	0.344	24%	0.244	S	C	.	.			trans	-81.3	169	170.2	74	0	0	0	0	110.8	R319 Q321 F455 S456	R319-T453 VanDerWaalsContact CD-O 3.27Å; R319-T453 WeakPolarHBondContact CD-O 3.17Å; R319-T453 PolarHBondContact NH1-O 2.84Å; Q321-T453 HydrophobicContact CB-CG2 4.27Å; T453-F455 VanDerWaalsContact C-N 3.27Å; T453-F455 PolarHBondContact O-N 3.39Å; T453-S456 PolarHBondContact N-OG 2.88Å; T453-S456 PolarHBondContact O-N 2.86Å; T453-S456 PolarHBondContact OG1-N 2.92Å; T453-S456 PolarHBondContact OG1-OG 3.47Å
454	H	92.7	Very high	94.6	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-37.6	-179.5	-167.2	77.7	0	0	0	113.9	W246 S247 A270 R319 D322 V324	W246-H454 AromaticContact CZ2-CD2 3.96Å; W246-H454 AromaticContact CZ2-NE2 3.98Å; W246-H454 PolarHBondContact NE1-O 3.16Å; S247-H454 WeakPolarHBondContact CB-NE2 3.34Å; S247-H454 PolarHBondContact OG-CE1 2.82Å; S247-H454 VanDerWaalsContact OG-CE1 3.25Å; S247-H454 PolarHBondContact OG-NE2 2.85Å; A270-H454 PolarHBondContact O-CE1 3.31Å; R319-H454 PolarHBondContact NH1-O 3.36Å; D322-H454 VanDerWaalsContact CG-ND1 3.3Å; D322-H454 IonicContact OD1-CG 2.65Å; D322-H454 IonicContact OD1-ND1 2.8Å; D322-H454 PolarHBondContact OD1-ND1 3.28Å; D322-H454 IonicContact OD2-CE1 3.17Å; D322-H454 IonicContact OD2-CG 3.64Å; D322-H454 IonicContact OD2-ND1 2.68Å; D322-H454 PolarHBondContact OD2-ND1 2.81Å; V324-H454 HydrophobicContact CB-CB 3.92Å; V324-H454 HydrophobicContact CG2-CB 3.57Å
455	F	90.5	Very high	94.5	Very high	135 Å²	135	51 Å²	51	59%	0.592	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-2.9	-172.8	-59.2	-70.6	0	0	0	114.3	W246 V324 T453	W246-F455 HydrophobicContact CH2-CD1 4.26Å; W246-F455 HydrophobicContact CZ2-CD1 4.19Å; V324-F455 HydrophobicContact CG2-CE2 3.7Å; V324-F455 HydrophobicContact CG2-CZ 3.89Å; T453-F455 VanDerWaalsContact C-N 3.27Å; T453-F455 PolarHBondContact O-N 3.39Å
456	S	92.2	Very high	94.5	Very high	40 Å²	40	49 Å²	49	28%	0.28	25%	0.251	S	S	.	.	S	Bend	trans	-59.9	138.8	173.6	-62.8	0	0	0	0	109.9	R319 T453 L458	R319-S456 PolarHBondContact NH1-O 3.2Å; R319-S456 PolarHBondContact NH2-O 3.23Å; T453-S456 PolarHBondContact N-OG 2.88Å; T453-S456 PolarHBondContact O-N 2.86Å; T453-S456 PolarHBondContact OG1-N 2.92Å; T453-S456 PolarHBondContact OG1-OG 3.47Å; S456-L458 PolarHBondContact O-N 2.87Å
457	P	90.8	Very high	94.3	Very high	95 Å²	95	51.3 Å²	51.3	62%	0.617	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-55.8	142.7	166.6	-24.7	35.4	0	0	0	110.2
458	L	95.3	Very high	93.8	Very high	12 Å²	12	53.9 Å²	53.9	6%	0.063	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-77.5	128.9	169.9	-174.1	72.4	0	0	0	107.6	A191 Y244 L317 V450 S456 E462 F463	A191-L458 HydrophobicContact CB-CB 3.9Å; A191-L458 HydrophobicContact CB-CD2 4.14Å; A191-L458 HydrophobicContact CB-CG 4.24Å; A191-L458 VanDerWaalsContact CB-O 3.23Å; A191-L458 WeakPolarHBondContact CB-O 3.11Å; Y244-L458 WeakPolarHBondContact OH-CD2 3.4Å; L317-L458 HydrophobicContact CD1-CD1 4.25Å; L317-L458 HydrophobicContact CD1-CD2 3.65Å; V450-L458 HydrophobicContact CG1-CD1 4.17Å; V450-L458 HydrophobicContact CG2-CD1 4.33Å; S456-L458 PolarHBondContact O-N 2.87Å; L458-E462 HydrophobicContact CD1-CB 3.65Å; L458-E462 HydrophobicContact CG-CB 3.98Å; L458-F463 HydrophobicContact CD2-CB 4.12Å; L458-F463 HydrophobicContact CD2-CD2 4.36Å
459	E	96	Very high	93.3	Very high	114 Å²	114	54.1 Å²	54.1	53%	0.533	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-67.5	147.2	176.6	-61.8	-59.4	143.4	0	0	110.7	E461 E462 F463	E459-E461 PolarHBondContact O-N 3.48Å; E459-E462 HydrophobicContact CB-CG 4.08Å; E459-E462 WeakPolarHBondContact O-CB 3.47Å; E459-E462 PolarHBondContact O-N 3.37Å; E459-F463 PolarHBondContact O-N 3Å
460	P	95.2	Very high	93.2	Very high	19 Å²	19	56.4 Å²	56.4	12%	0.123	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-36.1	-177.2	-25.5	36	0	0	0	113.6	E194 A195 E462 F463	E194-P460 HydrophobicContact CB-CB 4.02Å; E194-P460 HydrophobicContact CB-CG 3.55Å; A195-P460 HydrophobicContact CB-CB 4.24Å; P460-E462 PolarHBondContact O-N 2.85Å; P460-F463 PolarHBondContact O-N 3.25Å
461	E	94.7	Very high	93.1	Very high	135 Å²	135	58.7 Å²	58.7	63%	0.631	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-21.4	-179.8	-55.9	73.4	-157.4	0	0	112.5	E459 Q464	E459-E461 PolarHBondContact O-N 3.48Å; E461-Q464 PolarHBondContact O-NE2 3.01Å; E461-Q464 VanDerWaalsContact O-NE2 3.09Å
462	E	95.6	Very high	93.2	Very high	61 Å²	61	55.8 Å²	55.8	29%	0.285	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-27.7	177.9	-67.5	-63.4	154.6	0	0	111.9	K448 V450 L458 E459 P460 Q464	K448-E462 WeakPolarHBondContact CE-OE2 3.31Å; K448-E462 PolarHBondContact NZ-O 2.95Å; K448-E462 VanDerWaalsContact NZ-O 3.1Å; K448-E462 IonicContact NZ-OE2 2.87Å; K448-E462 PolarHBondContact NZ-OE2 2.85Å; V450-E462 HydrophobicContact CG1-CG 4.39Å; L458-E462 HydrophobicContact CD1-CB 3.65Å; L458-E462 HydrophobicContact CG-CB 3.98Å; E459-E462 HydrophobicContact CB-CG 4.08Å; E459-E462 WeakPolarHBondContact O-CB 3.47Å; E459-E462 PolarHBondContact O-N 3.37Å; P460-E462 PolarHBondContact O-N 2.85Å; E462-Q464 PolarHBondContact O-N 3.36Å
463	F	96.5	Very high	93.3	Very high	7 Å²	7	58.3 Å²	58.3	3%	0.031	32%	0.315	C	S	.	.			trans	-72.3	105.4	173.5	-174.1	-92.3	0	0	0	110.8	V174 A191 P192 Y197 Y244 V267 L458 E459 P460	V174-F463 HydrophobicContact CB-CZ 4.48Å; V174-F463 HydrophobicContact CG1-CE2 4.32Å; V174-F463 HydrophobicContact CG1-CZ 3.79Å; V174-F463 HydrophobicContact CG2-CE1 3.94Å; V174-F463 HydrophobicContact CG2-CZ 3.83Å; A191-F463 HydrophobicContact CB-CB 4.33Å; P192-F463 HydrophobicContact CB-CD1 3.95Å; P192-F463 HydrophobicContact CB-CD2 4.34Å; P192-F463 HydrophobicContact CB-CE1 3.78Å; P192-F463 HydrophobicContact CB-CE2 4.18Å; P192-F463 HydrophobicContact CB-CG 4.24Å; P192-F463 HydrophobicContact CB-CZ 3.9Å; Y197-F463 HydrophobicContact CD2-CD1 4.14Å; Y197-F463 HydrophobicContact CD2-CE1 4Å; Y197-F463 AromaticContact CE2-CD1 3.78Å; Y197-F463 HydrophobicContact CE2-CD1 3.78Å; Y197-F463 AromaticContact CE2-CE1 3.79Å; Y197-F463 HydrophobicContact CE2-CE1 3.79Å; Y244-F463 HydrophobicContact CD1-CD2 4.32Å; Y244-F463 AromaticContact CD1-CE2 3.83Å; Y244-F463 HydrophobicContact CD1-CE2 3.83Å; Y244-F463 HydrophobicContact CD2-CD2 4.46Å; Y244-F463 AromaticContact CD2-CE2 3.88Å; Y244-F463 HydrophobicContact CD2-CE2 3.88Å; Y244-F463 HydrophobicContact CE1-CD2 4.25Å; Y244-F463 HydrophobicContact CE1-CE2 4.21Å; Y244-F463 HydrophobicContact CE2-CD2 4.4Å; Y244-F463 HydrophobicContact CE2-CE2 4.27Å; Y244-F463 HydrophobicContact CG-CD2 4.43Å; Y244-F463 AromaticContact CG-CE2 3.66Å; Y244-F463 HydrophobicContact CG-CE2 3.66Å; V267-F463 HydrophobicContact CB-CE2 4.38Å; V267-F463 HydrophobicContact CG1-CE2 4.27Å; V267-F463 HydrophobicContact CG2-CE2 4.44Å; V267-F463 HydrophobicContact CG2-CZ 4.5Å; L458-F463 HydrophobicContact CD2-CB 4.12Å; L458-F463 HydrophobicContact CD2-CD2 4.36Å; E459-F463 PolarHBondContact O-N 3Å; P460-F463 PolarHBondContact O-N 3.25Å
464	Q	94.4	Very high	93.3	Very high	94 Å²	94	58.4 Å²	58.4	44%	0.439	31%	0.313	S	S	.	.			trans	-126.6	147.4	-178.3	-64.4	176.5	7	0	0	110	L315 K448 E461 E462	L315-Q464 HydrophobicContact CD2-CB 4.27Å; L315-Q464 WeakPolarHBondContact CD2-O 3.38Å; K448-Q464 VanDerWaalsContact NZ-CD 3.35Å; E461-Q464 PolarHBondContact O-NE2 3.01Å; E461-Q464 VanDerWaalsContact O-NE2 3.09Å; E462-Q464 PolarHBondContact O-N 3.36Å
465	L	96.1	Very high	93.4	Very high	50 Å²	50	62.3 Å²	62.3	26%	0.262	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-71.3	149.1	171.5	-62.3	-177.6	0	0	0	110.2	Y197 V242	Y197-L465 HydrophobicContact CE1-CD1 4.24Å; Y197-L465 HydrophobicContact CE1-CD2 4.22Å; Y197-L465 HydrophobicContact CE1-CG 4.34Å; V242-L465 HydrophobicContact CB-CD2 4.44Å; V242-L465 HydrophobicContact CG1-CD2 4.03Å; V242-L465 HydrophobicContact CG2-CD2 3.7Å
466	P	96.8	Very high	93.6	Very high	16 Å²	16	57.1 Å²	57.1	10%	0.104	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-58.8	152.7	174	-19.9	31.3	0	0	0	112.4	A265 L266 V267 P313 L315	A265-P466 HydrophobicContact CB-CG 3.85Å; L266-P466 WeakPolarHBondContact O-CG 3.38Å; V267-P466 HydrophobicContact CG2-CG 4.18Å; P313-P466 HydrophobicContact CB-CB 3.66Å; P313-P466 HydrophobicContact CB-CG 4.21Å; L315-P466 HydrophobicContact CB-CB 3.91Å; L315-P466 HydrophobicContact CB-CG 3.75Å
467	W	93.7	Very high	93.7	Very high	49 Å²	49	58.4 Å²	58.4	19%	0.186	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-65.3	146.1	172.8	81.7	-66.5	0	0	0	111.3	L395 L398 F441 L442 K445 H446 L469	L395-W467 HydrophobicContact CD2-CZ3 4.08Å; L398-W467 HydrophobicContact CD1-CH2 4.07Å; F441-W467 HydrophobicContact CE1-CH2 4.3Å; L442-W467 HydrophobicContact CD2-CH2 4.41Å; L442-W467 HydrophobicContact CD2-CZ2 4.06Å; K445-W467 HydrophobicContact CB-CD2 3.75Å; K445-W467 VanDerWaalsContact CB-CE2 3.49Å; K445-W467 HydrophobicContact CB-CG 3.82Å; K445-W467 HydrophobicContact CB-CZ2 4.06Å; K445-W467 HydrophobicContact CD-CD2 4.24Å; K445-W467 HydrophobicContact CD-CE3 4.37Å; K445-W467 HydrophobicContact CD-CG 4.37Å; K445-W467 HydrophobicContact CG-CD2 4.06Å; K445-W467 HydrophobicContact CG-CE3 4.36Å; K445-W467 HydrophobicContact CG-CG 4.42Å; K445-W467 HydrophobicContact CG-CZ2 4.4Å; H446-W467 AromaticContact CD2-NE1 3.78Å; H446-W467 AromaticContact CE1-NE1 3.42Å; H446-W467 PolarHBondContact CE1-NE1 2.86Å; H446-W467 AromaticContact ND1-NE1 3.79Å; H446-W467 AromaticContact NE2-NE1 3.38Å; H446-W467 PolarHBondContact NE2-NE1 3.09Å; W467-L469 HydrophobicContact CH2-CB 4.28Å; W467-L469 HydrophobicContact CH2-CD1 4.12Å; W467-L469 HydrophobicContact CZ3-CB 4.02Å; W467-L469 HydrophobicContact CZ3-CD1 3.84Å
468	G	86.7	Confident	93.9	Very high	59 Å²	59	55.3 Å²	55.3	61%	0.608	29%	0.293	S	S	*	.			trans	-114.8	145.9	167.4	0	0	0	0	0	110.1
469	L	86.2	Confident	93.8	Very high	48 Å²	48	59.3 Å²	59.3	25%	0.251	31%	0.314	S	S	.	.			trans	-81.4	0	179.6	179	67.6	0	0	0	113.1	L395 L398 R399 R402 W424 W467	L395-L469 HydrophobicContact CD2-CD1 4.04Å; L398-L469 HydrophobicContact CB-CD1 3.63Å; L398-L469 HydrophobicContact CB-CD2 3.75Å; L398-L469 HydrophobicContact CB-CG 4.35Å; L398-L469 HydrophobicContact CD1-CD1 4.31Å; R399-L469 HydrophobicContact CG-CD1 3.9Å; R399-L469 HydrophobicContact CG-CG 4.04Å; R399-L469 PolarHBondContact NE-OXT 3.28Å; R402-L469 HydrophobicContact CB-CD2 4.23Å; R402-L469 PolarHBondContact NH1-O 3.19Å; W424-L469 HydrophobicContact CH2-CD2 3.7Å; W424-L469 HydrophobicContact CZ3-CD2 3.71Å; W467-L469 HydrophobicContact CH2-CB 4.28Å; W467-L469 HydrophobicContact CH2-CD1 4.12Å; W467-L469 HydrophobicContact CZ3-CB 4.02Å; W467-L469 HydrophobicContact CZ3-CD1 3.84Å

Retrieved 469 of 469 residues in 968.6 ms (Link to these results)

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