A0A077ZA42_TRITR Loading...

Large subunit GTPase 1 homolog

AlphaFold DB , UniProt , Accession A0A077ZA42, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 546 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.9	Very low	34.7	Very low	245 Å²	245	198.8 Å²	198.8	100%	1.207	90%	0.9	S	S	*	*				0	134	0	-83.4	-179.5	171.2	0	0	109.2	A3	M1-A3 PolarHBondContact O-N 2.9Å
2	K	37	Very low	34.6	Very low	219 Å²	219	195.1 Å²	195.1	95%	0.952	89%	0.891	S	S	*	*			trans	-57.2	121.9	178	-71.7	171	173.8	174.2	0	110.8
3	A	37.3	Very low	34.2	Very low	97 Å²	97	184.5 Å²	184.5	80%	0.802	87%	0.869	S	S	*	*			trans	-121.1	94.1	159.2	0	0	0	0	0	108	M1 Q5	M1-A3 PolarHBondContact O-N 2.9Å; A3-Q5 PolarHBondContact O-N 3.48Å
4	S	36.6	Very low	33.7	Very low	103 Å²	103	185.4 Å²	185.4	72%	0.72	87%	0.867	S	S	*	*			trans	-66.7	105.1	175.4	174.6	0	0	0	0	109.9
5	Q	37.6	Very low	33.4	Very low	188 Å²	188	181.3 Å²	181.3	88%	0.879	86%	0.86	S	S	*	*			trans	-97.2	95.7	164.9	-83.3	178.6	-13.5	0	0	109	A3 R7	A3-Q5 PolarHBondContact O-N 3.48Å; Q5-R7 PolarHBondContact O-N 3.35Å; Q5-R7 VanDerWaalsContact O-N 3.11Å
6	R	33.8	Very low	33.1	Very low	234 Å²	234	176.6 Å²	176.6	88%	0.883	84%	0.837	S	S	*	*			trans	-51.5	108.1	172.2	-71.7	173.1	169.3	171.8	-4	110.3	R8	R6-R8 PolarHBondContact O-N 3.49Å
7	R	34.7	Very low	32.8	Very low	238 Å²	238	173.4 Å²	173.4	90%	0.898	83%	0.832	S	S	*	*			trans	-65.7	120	166.6	-86	179.4	168.6	175.4	-3.5	109.1	Q5 V9	Q5-R7 PolarHBondContact O-N 3.35Å; Q5-R7 VanDerWaalsContact O-N 3.11Å; R7-V9 PolarHBondContact O-N 3.04Å
8	R	31.4	Very low	32.6	Very low	250 Å²	250	170.6 Å²	170.6	94%	0.943	83%	0.827	S	S	*	*			trans	-52.6	106	168.6	-99.6	174.9	166.5	174.1	-3.7	109.5	R6 R10	R6-R8 PolarHBondContact O-N 3.49Å; R8-R10 PolarHBondContact O-N 3.21Å
9	V	34.2	Very low	32.3	Very low	134 Å²	134	170.6 Å²	170.6	81%	0.812	83%	0.826	S	S	*	*			trans	-67.6	117.7	165.2	177.7	0	0	0	0	107.1	R7 R11	R7-V9 PolarHBondContact O-N 3.04Å; V9-R11 PolarHBondContact O-N 3.04Å
10	R	31.5	Very low	32.2	Very low	229 Å²	229	167.6 Å²	167.6	86%	0.864	82%	0.82	S	S	*	*			trans	-58.2	129	175	-74.1	178.7	171	179	-3.7	108.4	R8 I12	R8-R10 PolarHBondContact O-N 3.21Å; R10-I12 PolarHBondContact O-N 3.26Å
11	R	28.2	Very low	32.1	Very low	250 Å²	250	166 Å²	166	94%	0.943	82%	0.82	S	S	*	*			trans	-57.1	104.2	172.9	-73.8	178.9	175.8	175.1	-2.6	108.6	V9	V9-R11 PolarHBondContact O-N 3.04Å
12	I	33.4	Very low	31.4	Very low	154 Å²	154	161.6 Å²	161.6	79%	0.79	80%	0.8	S	S	*	*			trans	-64	132.4	162.9	-67.5	165.3	0	0	0	106.1	R10	R10-I12 PolarHBondContact O-N 3.26Å
13	G	30.1	Very low	31.2	Very low	58 Å²	58	155.5 Å²	155.5	60%	0.598	78%	0.783	S	S	*	*			trans	-52.5	153.8	-174.8	0	0	0	0	0	112.7	V15	G13-V15 PolarHBondContact O-N 3.44Å
14	K	27.4	Very low	30.8	Very low	196 Å²	196	155.3 Å²	155.3	85%	0.852	78%	0.776	S	S	*	*			trans	-48.1	114.7	178.7	-77	177.1	171.1	-177.7	0	109.9	E16	K14-E16 PolarHBondContact O-N 3.21Å
15	V	29.4	Very low	30.6	Very low	124 Å²	124	157.2 Å²	157.2	75%	0.752	78%	0.783	S	S	*	*			trans	-73.8	107.1	165.5	178.2	0	0	0	0	105.6	G13 T17	G13-V15 PolarHBondContact O-N 3.44Å; V15-T17 PolarHBondContact O-N 2.56Å
16	E	28.4	Very low	30.4	Very low	106 Å²	106	153.3 Å²	153.3	50%	0.495	78%	0.783	S	S	.	*			trans	-82.9	104.6	170	-78.6	-179	-178.6	0	0	108.5	K14 V18 H508	K14-E16 PolarHBondContact O-N 3.21Å; E16-V18 PolarHBondContact O-N 3.33Å; E16-V18 VanDerWaalsContact O-N 3.08Å; E16-H508 IonicContact OE1-CE1 3.91Å; E16-H508 PolarHBondContact OE1-CE1 2.67Å; E16-H508 IonicContact OE1-NE2 3.25Å; E16-H508 PolarHBondContact OE1-NE2 2.93Å; E16-H508 IonicContact OE2-CE1 2.93Å; E16-H508 IonicContact OE2-NE2 3.87Å
17	T	27.1	Very low	30.9	Very low	123 Å²	123	144.9 Å²	144.9	76%	0.755	77%	0.77	S	S	*	*			trans	-69.1	96.2	167.8	49	0	0	0	0	108	V15 E19	V15-T17 PolarHBondContact O-N 2.56Å; T17-E19 PolarHBondContact O-N 3.22Å
18	V	30.3	Very low	31.8	Very low	123 Å²	123	140 Å²	140	75%	0.745	76%	0.757	S	S	*	*			trans	-79.5	109.5	164.9	-177.1	0	0	0	0	106.4	E16 P20	E16-V18 PolarHBondContact O-N 3.33Å; E16-V18 VanDerWaalsContact O-N 3.08Å; V18-P20 WeakPolarHBondContact O-CD 3.48Å
19	E	26.1	Very low	33.3	Very low	171 Å²	171	129.6 Å²	129.6	80%	0.799	72%	0.72	S	S	*	*			trans	-62.6	121.3	167.9	-74.7	-174.1	155.8	0	0	108.2	T17 V21	T17-E19 PolarHBondContact O-N 3.22Å; E19-V21 PolarHBondContact O-N 3.23Å
20	P	31.3	Very low	35.1	Very low	110 Å²	110	131 Å²	131	71%	0.714	71%	0.711	S	S	*	*			trans	-68.2	111.9	171.6	27.1	-29.8	0	0	0	107.2	V18 L22	V18-P20 WeakPolarHBondContact O-CD 3.48Å; P20-L22 PolarHBondContact O-N 3.03Å
21	V	28.9	Very low	37.2	Very low	133 Å²	133	122.6 Å²	122.6	81%	0.806	69%	0.687	S	S	*	*			trans	-64.7	94.7	163.3	178.1	0	0	0	0	105.6	E19 P23	E19-V21 PolarHBondContact O-N 3.23Å; V21-P23 VanDerWaalsContact O-CD 3.22Å; V21-P23 WeakPolarHBondContact O-CD 3.3Å; V21-P23 VanDerWaalsContact O-N 3.07Å
22	L	25.5	Very low	39.6	Very low	153 Å²	153	112.8 Å²	112.8	80%	0.801	66%	0.655	S	S	*	*			trans	-52.1	114.4	165.9	-80.7	157	0	0	0	106.7	P20 S24	P20-L22 PolarHBondContact O-N 3.03Å; L22-S24 PolarHBondContact O-N 3.05Å
23	P	31.6	Very low	41.3	Very low	91 Å²	91	107 Å²	107	59%	0.591	63%	0.626	S	S	*	*			trans	-65.3	109.5	174.7	25.2	-28.5	0	0	0	106.6	V21 T25	V21-P23 VanDerWaalsContact O-CD 3.22Å; V21-P23 WeakPolarHBondContact O-CD 3.3Å; V21-P23 VanDerWaalsContact O-N 3.07Å; P23-T25 PolarHBondContact O-N 2.84Å
24	S	29.2	Very low	42.9	Very low	94 Å²	94	109.8 Å²	109.8	66%	0.657	62%	0.624	S	S	*	*			trans	-45.4	124.6	170.5	55.6	0	0	0	0	109.3	L22 A26 G27	L22-S24 PolarHBondContact O-N 3.05Å; S24-A26 PolarHBondContact O-N 3.31Å; S24-G27 PolarHBondContact O-N 2.8Å
25	T	32.4	Very low	44.6	Very low	142 Å²	142	102.1 Å²	102.1	87%	0.871	59%	0.591	S	S	*	*	S	Bend	trans	-39.5	130.8	165.2	37.3	0	0	0	0	110.3	P23	P23-T25 PolarHBondContact O-N 2.84Å
26	A	34.3	Very low	46.4	Very low	106 Å²	106	100 Å²	100	88%	0.876	58%	0.578	S	S	*	*	S	Bend	trans	82.8	31.8	-168.5	0	0	0	0	0	117.3	S24 Q28	S24-A26 PolarHBondContact O-N 3.31Å; A26-Q28 PolarHBondContact O-N 3.36Å
27	G	43.1	Very low	48.2	Very low	58 Å²	58	100.3 Å²	100.3	60%	0.598	58%	0.584	S	S	*	*			trans	-56.8	130.1	173.6	0	0	0	0	0	113.5	S24 L29	S24-G27 PolarHBondContact O-N 2.8Å; G27-L29 PolarHBondContact O-N 3.02Å
28	Q	54	Low	50.1	Low	134 Å²	134	97.6 Å²	97.6	63%	0.626	56%	0.564	S	S	*	*			trans	-45.1	133.3	173.2	-70.6	167.5	-11.1	0	0	111.4	A26 R30	A26-Q28 PolarHBondContact O-N 3.36Å; Q28-R30 WeakPolarHBondContact O-CG 3.28Å; Q28-R30 PolarHBondContact O-N 3.13Å
29	L	62.3	Low	51.8	Low	32 Å²	32	95.7 Å²	95.7	17%	0.168	55%	0.55	C	S	.	.			trans	-48	119.3	172.2	-68.9	-178.2	0	0	0	110.4	G27 D138 K324 H325	G27-L29 PolarHBondContact O-N 3.02Å; L29-D138 HydrophobicContact CD2-CB 3.41Å; L29-D138 VanDerWaalsContact CD2-CB 3.41Å; L29-K324 HydrophobicContact CB-CB 4.42Å; L29-K324 VanDerWaalsContact CD1-O 3.31Å; L29-K324 WeakPolarHBondContact CD1-O 3.48Å; L29-K324 WeakPolarHBondContact O-CD 3.3Å; L29-K324 WeakPolarHBondContact O-CE 3.48Å; L29-K324 PolarHBondContact O-NZ 2.67Å; L29-H325 WeakPolarHBondContact CD1-CE1 3.36Å; L29-H325 VanDerWaalsContact CD1-ND1 3.32Å; L29-H325 WeakPolarHBondContact CD1-ND1 3.06Å
30	R	73.1	Confident	54	Low	165 Å²	165	89.8 Å²	89.8	62%	0.623	52%	0.522	S	S	*	.			trans	-133.3	137.4	178.2	-75.5	175.5	-172.6	-163.5	2.9	107.9	Q28 N136	Q28-R30 WeakPolarHBondContact O-CG 3.28Å; Q28-R30 PolarHBondContact O-N 3.13Å; R30-N136 PolarHBondContact O-ND2 3.43Å
31	S	76.2	Confident	55.8	Low	52 Å²	52	89.6 Å²	89.6	36%	0.364	51%	0.51	S	S	.	.			trans	-69.1	135.4	170.1	174.7	0	0	0	0	108.9	E134	S31-E134 VanDerWaalsContact CA-OE2 3.24Å; S31-E134 WeakPolarHBondContact CA-OE2 3.45Å; S31-E134 WeakPolarHBondContact CB-OE2 3.48Å; S31-E134 PolarHBondContact OG-OE2 3.27Å
32	V	76.7	Confident	57.8	Low	44 Å²	44	87.7 Å²	87.7	27%	0.267	49%	0.491	S	S	.	.			trans	-126.8	93.7	178	-176.8	0	0	0	0	107.3	E35 E134 K135	V32-E35 HydrophobicContact CG1-CG 3.4Å; V32-E134 PolarHBondContact N-OE1 2.79Å; V32-E134 PolarHBondContact N-OE2 2.95Å; V32-K135 WeakPolarHBondContact O-CB 3.46Å; V32-K135 PolarHBondContact O-N 2.67Å
33	T	69.4	Low	60	Low	32 Å²	32	81.6 Å²	81.6	20%	0.196	46%	0.461	C	S	.	.	S	Bend	trans	-93	-24.9	179.2	55.1	0	0	0	0	113.2	P132 F133 V344 L361	T33-P132 WeakPolarHBondContact O-CB 3.26Å; T33-F133 WeakPolarHBondContact CA-O 3.33Å; T33-V344 HydrophobicContact CG2-CB 4.12Å; T33-V344 HydrophobicContact CG2-CG2 3.95Å; T33-L361 HydrophobicContact CG2-CD2 4.06Å
34	Q	64.5	Low	61.9	Low	116 Å²	116	79.3 Å²	79.3	54%	0.542	44%	0.442	S	S	.	.			trans	-137.7	137.2	178.4	-67.6	-179.8	-14.3	0	0	107.9	P132	Q34-P132 HydrophobicContact CG-CB 3.92Å; Q34-P132 HydrophobicContact CG-CG 4.02Å; Q34-P132 VanDerWaalsContact NE2-CG 3.32Å
35	E	63.4	Low	63.8	Low	36 Å²	36	75.2 Å²	75.2	17%	0.168	41%	0.414	C	S	.	.			trans	-125.3	145.4	176.5	-73.6	173.4	161	0	0	107	V32 D39 E40 S43 R116 K135	V32-E35 HydrophobicContact CG1-CG 3.4Å; E35-D39 HydrophobicContact CB-CB 3.9Å; E35-D39 HydrophobicContact CG-CB 4.23Å; E35-E40 HydrophobicContact CB-CB 4.09Å; E35-E40 WeakPolarHBondContact OE2-CA 3.36Å; E35-E40 WeakPolarHBondContact OE2-CB 3.43Å; E35-S43 VanDerWaalsContact OE1-CB 3.26Å; E35-S43 WeakPolarHBondContact OE1-CB 3.44Å; E35-S43 PolarHBondContact OE1-OG 3.13Å; E35-R116 IonicContact OE2-NH2 2.8Å; E35-R116 PolarHBondContact OE2-NH2 3.18Å; E35-K135 VanDerWaalsContact CD-CD 3.43Å; E35-K135 HydrophobicContact CG-CD 3.91Å; E35-K135 WeakPolarHBondContact OE2-CD 3.3Å; E35-K135 IonicContact OE2-NZ 2.88Å; E35-K135 PolarHBondContact OE2-NZ 3.03Å
36	T	67.6	Low	65.7	Low	79 Å²	79	74.3 Å²	74.3	49%	0.485	40%	0.4	S	S	.	.			trans	-69.1	162.5	163.5	66.1	0	0	0	0	109.9	L38 D39 E40	T36-L38 PolarHBondContact O-N 3.41Å; T36-L38 VanDerWaalsContact O-N 3.1Å; T36-D39 WeakPolarHBondContact CB-OD2 3.37Å; T36-D39 WeakPolarHBondContact CG2-OD2 3.44Å; T36-D39 PolarHBondContact N-OD2 3.35Å; T36-D39 VanDerWaalsContact N-OD2 3.09Å; T36-D39 PolarHBondContact O-N 3.32Å; T36-D39 PolarHBondContact OG1-N 2.79Å; T36-D39 PolarHBondContact OG1-OD2 2.79Å; T36-E40 WeakPolarHBondContact O-CB 3.25Å; T36-E40 PolarHBondContact O-N 3.06Å
37	N	65.7	Low	67.3	Low	113 Å²	113	71 Å²	71	60%	0.604	37%	0.366	S	S	*	.	H	α-helix	trans	-54.1	-32.4	176	-68.3	-3.7	0	0	0	112.5	F41	N37-F41 WeakPolarHBondContact O-CB 3.47Å; N37-F41 PolarHBondContact O-N 3.31Å
38	L	66.1	Low	68.5	Low	65 Å²	65	74.5 Å²	74.5	34%	0.34	36%	0.362	S	S	.	.	H	α-helix	trans	-71.9	-49.5	173.8	-82.6	-173.4	0	0	0	112.2	T36 E40 F41 F42 V61	T36-L38 PolarHBondContact O-N 3.41Å; T36-L38 VanDerWaalsContact O-N 3.1Å; L38-E40 PolarHBondContact O-N 3.23Å; L38-F41 WeakPolarHBondContact O-CB 3.34Å; L38-F41 PolarHBondContact O-N 3.16Å; L38-F41 VanDerWaalsContact O-N 3.09Å; L38-F42 HydrophobicContact CB-CE2 4.45Å; L38-F42 HydrophobicContact CD2-CE2 4.42Å; L38-F42 WeakPolarHBondContact O-CD2 3.37Å; L38-F42 PolarHBondContact O-N 2.76Å; L38-V61 HydrophobicContact CD1-CG2 3.32Å; L38-V61 HydrophobicContact CD2-CG2 3.74Å; L38-V61 HydrophobicContact CG-CG1 4.43Å; L38-V61 HydrophobicContact CG-CG2 3.5Å
39	D	67.4	Low	68.9	Low	84 Å²	84	71.1 Å²	71.1	45%	0.449	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-39.7	179.3	-58.8	-40.4	0	0	0	110.5	E35 T36 F42 S43	E35-D39 HydrophobicContact CB-CB 3.9Å; E35-D39 HydrophobicContact CG-CB 4.23Å; T36-D39 WeakPolarHBondContact CB-OD2 3.37Å; T36-D39 WeakPolarHBondContact CG2-OD2 3.44Å; T36-D39 PolarHBondContact N-OD2 3.35Å; T36-D39 VanDerWaalsContact N-OD2 3.09Å; T36-D39 PolarHBondContact O-N 3.32Å; T36-D39 PolarHBondContact OG1-N 2.79Å; T36-D39 PolarHBondContact OG1-OD2 2.79Å; D39-F42 PolarHBondContact O-N 3.41Å; D39-S43 WeakPolarHBondContact O-CB 3.28Å; D39-S43 PolarHBondContact O-N 3.43Å
40	E	70.8	Confident	68.9	Low	46 Å²	46	76.9 Å²	76.9	22%	0.215	38%	0.382	C	S	.	.	H	α-helix	trans	-64.6	-41.1	176	-176.6	168.9	150.5	0	0	112.1	E35 T36 L38 S43 K44 K135	E35-E40 HydrophobicContact CB-CB 4.09Å; E35-E40 WeakPolarHBondContact OE2-CA 3.36Å; E35-E40 WeakPolarHBondContact OE2-CB 3.43Å; T36-E40 WeakPolarHBondContact O-CB 3.25Å; T36-E40 PolarHBondContact O-N 3.06Å; L38-E40 PolarHBondContact O-N 3.23Å; E40-S43 PolarHBondContact O-N 3.12Å; E40-K44 HydrophobicContact CG-CD 4.11Å; E40-K44 HydrophobicContact CG-CG 4.39Å; E40-K44 VanDerWaalsContact O-CB 3.31Å; E40-K44 WeakPolarHBondContact O-CB 3.19Å; E40-K44 VanDerWaalsContact O-CG 3.28Å; E40-K44 WeakPolarHBondContact O-CG 3.32Å; E40-K44 PolarHBondContact O-N 3.41Å; E40-K44 WeakPolarHBondContact OE1-CE 3.45Å; E40-K44 IonicContact OE1-NZ 3.37Å; E40-K44 PolarHBondContact OE1-NZ 3.21Å; E40-K135 IonicContact OE2-NZ 2.78Å; E40-K135 PolarHBondContact OE2-NZ 3.16Å
41	F	70.6	Confident	67.9	Low	107 Å²	107	76.8 Å²	76.8	47%	0.469	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-47.4	174.7	175.7	-94	0	0	0	111.7	N37 L38 A45 F52	N37-F41 WeakPolarHBondContact O-CB 3.47Å; N37-F41 PolarHBondContact O-N 3.31Å; L38-F41 WeakPolarHBondContact O-CB 3.34Å; L38-F41 PolarHBondContact O-N 3.16Å; L38-F41 VanDerWaalsContact O-N 3.09Å; F41-A45 WeakPolarHBondContact O-CB 3.43Å; F41-A45 PolarHBondContact O-N 2.87Å; F41-F52 HydrophobicContact CZ-CE1 4.19Å; F41-F52 HydrophobicContact CZ-CE2 4.21Å; F41-F52 AromaticContact CZ-CZ 3.95Å; F41-F52 HydrophobicContact CZ-CZ 3.95Å
42	F	70.6	Confident	66.9	Low	93 Å²	93	79.7 Å²	79.7	41%	0.408	40%	0.401	S	S	.	.	H	α-helix	trans	-66.3	-43.4	177.7	-71.6	-64.9	0	0	0	112	L38 D39 K44 A45 E46	L38-F42 HydrophobicContact CB-CE2 4.45Å; L38-F42 HydrophobicContact CD2-CE2 4.42Å; L38-F42 WeakPolarHBondContact O-CD2 3.37Å; L38-F42 PolarHBondContact O-N 2.76Å; D39-F42 PolarHBondContact O-N 3.41Å; F42-K44 PolarHBondContact O-N 3.06Å; F42-A45 WeakPolarHBondContact O-CB 3.47Å; F42-A45 PolarHBondContact O-N 3.26Å; F42-A45 VanDerWaalsContact O-N 3.09Å; F42-E46 WeakPolarHBondContact O-CG 3.36Å; F42-E46 PolarHBondContact O-N 3.41Å
43	S	70.3	Confident	65.4	Low	24 Å²	24	82.4 Å²	82.4	17%	0.168	43%	0.428	C	S	.	.	H	α-helix	trans	-57.7	-46.5	175	177.5	0	0	0	0	111.8	E35 D39 E40 A45 M47	E35-S43 VanDerWaalsContact OE1-CB 3.26Å; E35-S43 WeakPolarHBondContact OE1-CB 3.44Å; E35-S43 PolarHBondContact OE1-OG 3.13Å; D39-S43 WeakPolarHBondContact O-CB 3.28Å; D39-S43 PolarHBondContact O-N 3.43Å; E40-S43 PolarHBondContact O-N 3.12Å; S43-A45 VanDerWaalsContact C-N 3.3Å; S43-A45 PolarHBondContact O-N 2.94Å; S43-M47 WeakPolarHBondContact O-CB 3.39Å; S43-M47 WeakPolarHBondContact O-CG 3.45Å; S43-M47 PolarHBondContact O-N 3.16Å
44	K	72.3	Confident	64.5	Low	44 Å²	44	84.6 Å²	84.6	19%	0.191	45%	0.449	C	S	.	.	H	α-helix	trans	-63.8	-33.4	174.3	-76.4	178.2	173.7	173.9	0	112.7	E40 F42 R48 M113 E120	E40-K44 HydrophobicContact CG-CD 4.11Å; E40-K44 HydrophobicContact CG-CG 4.39Å; E40-K44 VanDerWaalsContact O-CB 3.31Å; E40-K44 WeakPolarHBondContact O-CB 3.19Å; E40-K44 VanDerWaalsContact O-CG 3.28Å; E40-K44 WeakPolarHBondContact O-CG 3.32Å; E40-K44 PolarHBondContact O-N 3.41Å; E40-K44 WeakPolarHBondContact OE1-CE 3.45Å; E40-K44 IonicContact OE1-NZ 3.37Å; E40-K44 PolarHBondContact OE1-NZ 3.21Å; F42-K44 PolarHBondContact O-N 3.06Å; K44-R48 VanDerWaalsContact O-CG 3.31Å; K44-R48 WeakPolarHBondContact O-CG 3.44Å; K44-R48 PolarHBondContact O-N 2.72Å; K44-M113 HydrophobicContact CG-CE 4.27Å; K44-E120 WeakPolarHBondContact CE-OE1 3.38Å; K44-E120 IonicContact NZ-OE1 2.71Å; K44-E120 PolarHBondContact NZ-OE1 3.4Å; K44-E120 IonicContact NZ-OE2 2.67Å; K44-E120 PolarHBondContact NZ-OE2 3.05Å
45	A	69.5	Low	63.4	Low	8 Å²	8	87 Å²	87	7%	0.066	46%	0.46	C	S	.	.	H	α-helix	trans	-73.1	-49.6	178.4	0	0	0	0	0	112.7	F41 F42 S43 M47 R48 G49 R50 F52	F41-A45 WeakPolarHBondContact O-CB 3.43Å; F41-A45 PolarHBondContact O-N 2.87Å; F42-A45 WeakPolarHBondContact O-CB 3.47Å; F42-A45 PolarHBondContact O-N 3.26Å; F42-A45 VanDerWaalsContact O-N 3.09Å; S43-A45 VanDerWaalsContact C-N 3.3Å; S43-A45 PolarHBondContact O-N 2.94Å; A45-M47 VanDerWaalsContact C-N 3.32Å; A45-M47 PolarHBondContact O-N 2.83Å; A45-R48 PolarHBondContact O-N 3.49Å; A45-R48 VanDerWaalsContact O-N 3.09Å; A45-G49 PolarHBondContact O-N 3.15Å; A45-R50 PolarHBondContact O-N 3.32Å; A45-R50 VanDerWaalsContact O-N 3.11Å; A45-F52 HydrophobicContact CB-CD2 3.47Å; A45-F52 VanDerWaalsContact CB-CD2 3.47Å; A45-F52 HydrophobicContact CB-CE2 3.42Å; A45-F52 VanDerWaalsContact CB-CE2 3.42Å
46	E	72.2	Confident	62.3	Low	123 Å²	123	95.2 Å²	95.2	58%	0.575	50%	0.495	S	S	*	.	H	α-helix	trans	-57.5	-44.8	176.6	-74.8	-179.2	-177.8	0	0	110.9	F42 R48 G49	F42-E46 WeakPolarHBondContact O-CG 3.36Å; F42-E46 PolarHBondContact O-N 3.41Å; E46-R48 PolarHBondContact O-N 3.17Å; E46-G49 PolarHBondContact O-N 3.21Å
47	M	67.7	Low	61	Low	35 Å²	35	98 Å²	98	17%	0.172	51%	0.507	C	S	.	.	H	α-helix	trans	-65	-25.4	178	-71.3	-69.7	-70.7	0	0	113.8	S43 A45 G49 Q109 F112 M113 L137	S43-M47 WeakPolarHBondContact O-CB 3.39Å; S43-M47 WeakPolarHBondContact O-CG 3.45Å; S43-M47 PolarHBondContact O-N 3.16Å; A45-M47 VanDerWaalsContact C-N 3.32Å; A45-M47 PolarHBondContact O-N 2.83Å; M47-G49 VanDerWaalsContact C-N 3.26Å; M47-Q109 HydrophobicContact CE-CB 4.5Å; M47-Q109 HydrophobicContact CE-CG 4.1Å; M47-F112 HydrophobicContact CE-CD1 3.74Å; M47-F112 HydrophobicContact CE-CE1 4.27Å; M47-M113 HydrophobicContact CB-CG 4.39Å; M47-M113 HydrophobicContact CB-SD 3.77Å; M47-M113 HydrophobicContact CE-SD 4.34Å; M47-M113 HydrophobicContact CG-SD 4.32Å; M47-L137 HydrophobicContact CE-CB 4.02Å; M47-L137 HydrophobicContact CE-CD2 3.87Å
48	R	67.2	Low	60	Low	133 Å²	133	99.5 Å²	99.5	50%	0.502	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	1.7	173.1	-73.1	177.9	-176.7	-179.4	4.1	112.7	K44 A45 E46 R50	K44-R48 VanDerWaalsContact O-CG 3.31Å; K44-R48 WeakPolarHBondContact O-CG 3.44Å; K44-R48 PolarHBondContact O-N 2.72Å; A45-R48 PolarHBondContact O-N 3.49Å; A45-R48 VanDerWaalsContact O-N 3.09Å; E46-R48 PolarHBondContact O-N 3.17Å; R48-R50 HydrophobicContact CB-CG 4.34Å; R48-R50 PolarHBondContact O-N 3.14Å
49	G	62.3	Low	59.3	Low	63 Å²	63	101.5 Å²	101.5	65%	0.649	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	26.4	-175	0	0	0	0	0	113.2	A45 E46 M47	A45-G49 PolarHBondContact O-N 3.15Å; E46-G49 PolarHBondContact O-N 3.21Å; M47-G49 VanDerWaalsContact C-N 3.26Å
50	R	63.8	Low	58.3	Low	152 Å²	152	106.4 Å²	106.4	57%	0.574	55%	0.549	S	S	*	.			trans	-101.6	108.8	176.7	-67	-173.8	-172.5	172.6	0.4	109.5	A45 R48 F52	A45-R50 PolarHBondContact O-N 3.32Å; A45-R50 VanDerWaalsContact O-N 3.11Å; R48-R50 HydrophobicContact CB-CG 4.34Å; R48-R50 PolarHBondContact O-N 3.14Å; R50-F52 HydrophobicContact CB-CE2 4.42Å; R50-F52 PolarHBondContact O-N 3.12Å
51	D	51.1	Low	57.3	Low	163 Å²	163	106.7 Å²	106.7	87%	0.872	55%	0.554	S	S	*	*			trans	-72.2	115.3	167.4	-66.8	-24.8	0	0	0	109.1	A53	D51-A53 PolarHBondContact O-N 3.32Å
52	F	54.8	Low	55.9	Low	114 Å²	114	108.2 Å²	108.2	50%	0.5	57%	0.565	S	S	.	*			trans	-86.8	101.2	167.8	-80.6	-90.3	0	0	0	109.4	F41 A45 R50 A54	F41-F52 HydrophobicContact CZ-CE1 4.19Å; F41-F52 HydrophobicContact CZ-CE2 4.21Å; F41-F52 AromaticContact CZ-CZ 3.95Å; F41-F52 HydrophobicContact CZ-CZ 3.95Å; A45-F52 HydrophobicContact CB-CD2 3.47Å; A45-F52 VanDerWaalsContact CB-CD2 3.47Å; A45-F52 HydrophobicContact CB-CE2 3.42Å; A45-F52 VanDerWaalsContact CB-CE2 3.42Å; R50-F52 HydrophobicContact CB-CE2 4.42Å; R50-F52 PolarHBondContact O-N 3.12Å; F52-A54 PolarHBondContact O-N 3.03Å; F52-A54 VanDerWaalsContact O-N 3.09Å
53	A	45	Very low	54.5	Low	101 Å²	101	112 Å²	112	84%	0.835	58%	0.582	S	S	*	*			trans	-76.9	78.2	153.9	0	0	0	0	0	107.8	D51 E55	D51-A53 PolarHBondContact O-N 3.32Å; A53-E55 PolarHBondContact O-N 3.03Å; A53-E55 VanDerWaalsContact O-N 3.12Å
54	A	51.5	Low	52.7	Low	78 Å²	78	116 Å²	116	65%	0.645	61%	0.605	S	S	*	*			trans	-64.8	112.1	163.5	0	0	0	0	0	106.8	F52 K56	F52-A54 PolarHBondContact O-N 3.03Å; F52-A54 VanDerWaalsContact O-N 3.09Å; A54-K56 PolarHBondContact O-N 2.78Å
55	E	40.4	Very low	50.9	Low	166 Å²	166	118.7 Å²	118.7	78%	0.776	63%	0.629	S	S	*	*			trans	-48.4	130.2	161.2	-87.2	-172.2	151	0	0	107	A53 L57	A53-E55 PolarHBondContact O-N 3.03Å; A53-E55 VanDerWaalsContact O-N 3.12Å; E55-L57 PolarHBondContact O-N 2.72Å
56	K	40.9	Very low	49.6	Very low	208 Å²	208	125 Å²	125	90%	0.904	67%	0.667	S	S	*	*	S	Bend	trans	-60.2	70.4	-178.4	-82.4	-177.8	169.6	-178.9	0	111.8	A54	A54-K56 PolarHBondContact O-N 2.78Å
57	L	40.9	Very low	47.9	Very low	138 Å²	138	123.6 Å²	123.6	72%	0.723	67%	0.671	S	S	*	*	S	Bend	trans	-115.2	89.2	168.4	-67.2	175.7	0	0	0	106	E55 P59	E55-L57 PolarHBondContact O-N 2.72Å; L57-P59 WeakPolarHBondContact O-CD 3.48Å
58	D	44.3	Very low	46.4	Very low	145 Å²	145	128.8 Å²	128.8	78%	0.775	70%	0.698	S	S	*	*			trans	10.9	82.1	165.7	-68.1	-19.6	0	0	0	114.9	K60	D58-K60 PolarHBondContact O-N 2.92Å
59	P	51.2	Low	45.1	Very low	106 Å²	106	125.6 Å²	125.6	69%	0.688	70%	0.695	S	S	*	*			trans	-63.7	110	174.6	24.1	-31	0	0	0	108.7	L57 V61	L57-P59 WeakPolarHBondContact O-CD 3.48Å; P59-V61 PolarHBondContact O-N 3.3Å
60	K	46.2	Very low	44.1	Very low	187 Å²	187	126.8 Å²	126.8	81%	0.813	69%	0.691	S	S	*	*			trans	-78.5	105.6	171.7	-72.4	-179.5	-178.5	172.8	0	108.6	D58 I62	D58-K60 PolarHBondContact O-N 2.92Å; K60-I62 PolarHBondContact O-N 2.78Å; K60-I62 VanDerWaalsContact O-N 3.16Å
61	V	51	Low	43.4	Very low	53 Å²	53	129 Å²	129	32%	0.321	71%	0.708	S	S	.	*			trans	-70.6	108.4	168.2	-171.5	0	0	0	0	107.9	L38 P59 F63	L38-V61 HydrophobicContact CD1-CG2 3.32Å; L38-V61 HydrophobicContact CD2-CG2 3.74Å; L38-V61 HydrophobicContact CG-CG1 4.43Å; L38-V61 HydrophobicContact CG-CG2 3.5Å; P59-V61 PolarHBondContact O-N 3.3Å; V61-F63 HydrophobicContact CB-CE2 4.48Å; V61-F63 HydrophobicContact CG1-CE2 4.35Å; V61-F63 HydrophobicContact CG1-CZ 4.35Å; V61-F63 PolarHBondContact O-N 3.16Å
62	I	41	Very low	42.9	Very low	138 Å²	138	128.7 Å²	128.7	71%	0.708	71%	0.706	S	S	*	*			trans	-80.2	106.1	168.5	-57.9	173.5	0	0	0	105.8	K60 T64	K60-I62 PolarHBondContact O-N 2.78Å; K60-I62 VanDerWaalsContact O-N 3.16Å; I62-T64 PolarHBondContact O-N 2.89Å
63	F	40	Very low	42.7	Very low	174 Å²	174	126.9 Å²	126.9	76%	0.763	71%	0.705	S	S	*	*			trans	-69.8	86.7	164.7	-65.6	-86.2	0	0	0	107.3	V61 S65	V61-F63 HydrophobicContact CB-CE2 4.48Å; V61-F63 HydrophobicContact CG1-CE2 4.35Å; V61-F63 HydrophobicContact CG1-CZ 4.35Å; V61-F63 PolarHBondContact O-N 3.16Å; F63-S65 VanDerWaalsContact C-N 3.31Å; F63-S65 PolarHBondContact O-N 3.44Å
64	T	33.2	Very low	42.7	Very low	107 Å²	107	126 Å²	126	66%	0.656	70%	0.697	S	S	*	*			trans	-66.4	105.2	157.2	-21.9	0	0	0	0	104.1	I62 V66	I62-T64 PolarHBondContact O-N 2.89Å; T64-V66 PolarHBondContact O-N 2.81Å
65	S	35.3	Very low	42.8	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	68%	0.683	S	S	*	*			trans	-40.4	122.2	166.3	46	0	0	0	0	106.7	F63 S67	F63-S65 VanDerWaalsContact C-N 3.31Å; F63-S65 PolarHBondContact O-N 3.44Å; S65-S67 VanDerWaalsContact C-N 3.28Å; S65-S67 PolarHBondContact O-N 2.84Å
66	V	40.8	Very low	43.8	Very low	140 Å²	140	124.8 Å²	124.8	85%	0.848	68%	0.68	S	S	*	*			trans	-40.9	100.8	179.3	178	0	0	0	0	106.5	T64 L68	T64-V66 PolarHBondContact O-N 2.81Å; V66-L68 PolarHBondContact O-N 2.82Å
67	S	37.1	Very low	45.1	Very low	94 Å²	94	120.2 Å²	120.2	66%	0.657	67%	0.671	S	S	*	*			trans	-69.9	113.6	180	-169.8	0	0	0	0	101.8	S65	S65-S67 VanDerWaalsContact C-N 3.28Å; S65-S67 PolarHBondContact O-N 2.84Å
68	L	37.1	Very low	46.5	Very low	144 Å²	144	116.3 Å²	116.3	75%	0.754	65%	0.651	S	S	*	*			trans	-43.5	133.1	153.9	-72.5	162.5	0	0	0	105.7	V66	V66-L68 PolarHBondContact O-N 2.82Å
69	P	38.6	Very low	48.1	Very low	67 Å²	67	112 Å²	112	44%	0.435	63%	0.632	S	S	.	*			trans	-49.4	135.2	-179.3	18.2	-29.3	0	0	0	107.5	E71	P69-E71 PolarHBondContact O-N 2.87Å
70	P	41	Very low	49.2	Very low	88 Å²	88	115.3 Å²	115.3	57%	0.571	64%	0.636	S	S	*	*			trans	-51.5	136.5	-175.7	15.1	-24.2	0	0	0	108.2	N72 V73	P70-N72 PolarHBondContact O-N 2.82Å; P70-V73 HydrophobicContact CG-CG2 3.9Å; P70-V73 PolarHBondContact O-N 2.85Å
71	E	49.6	Very low	50.7	Low	198 Å²	198	111.9 Å²	111.9	93%	0.925	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.3	-11.2	-171.8	-71.8	178.4	151.4	0	0	114.9	P69	P69-E71 PolarHBondContact O-N 2.87Å
72	N	41.7	Very low	52.1	Low	156 Å²	156	113.9 Å²	113.9	83%	0.834	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	9.4	-178	-64.1	-36.5	0	0	0	115.5	P70 A74	P70-N72 PolarHBondContact O-N 2.82Å; N72-A74 PolarHBondContact O-N 2.78Å
73	V	50.7	Low	54.1	Low	77 Å²	77	109 Å²	109	47%	0.467	61%	0.607	S	S	.	*	S	Bend	trans	-76.4	110.7	162.1	-173.2	0	0	0	0	106.5	P70 L75	P70-V73 HydrophobicContact CG-CG2 3.9Å; P70-V73 PolarHBondContact O-N 2.85Å; V73-L75 HydrophobicContact CG1-CD2 4.26Å; V73-L75 PolarHBondContact O-N 3Å
74	A	44.6	Very low	56	Low	82 Å²	82	104.1 Å²	104.1	68%	0.678	60%	0.595	S	S	*	*			trans	-61.9	89.3	167.5	0	0	0	0	0	107.9	N72 H76	N72-A74 PolarHBondContact O-N 2.78Å; A74-H76 PolarHBondContact O-N 3.2Å
75	L	53.9	Low	58.4	Low	66 Å²	66	106.1 Å²	106.1	35%	0.346	59%	0.594	S	S	.	*			trans	-61	131.1	170.7	-63.8	175.2	0	0	0	106.7	V73 P77	V73-L75 HydrophobicContact CG1-CD2 4.26Å; V73-L75 PolarHBondContact O-N 3Å; L75-P77 VanDerWaalsContact C-CD 3.43Å; L75-P77 WeakPolarHBondContact O-CD 3.48Å
76	H	61.5	Low	60.7	Low	152 Å²	152	106.8 Å²	106.8	70%	0.704	58%	0.581	S	S	*	*			trans	-90.1	90.4	164.4	-70.9	-67.4	0	0	0	106.8	A74 L78	A74-H76 PolarHBondContact O-N 3.2Å; H76-L78 PolarHBondContact O-N 3.19Å
77	P	66.6	Low	62.9	Low	112 Å²	112	101.3 Å²	101.3	73%	0.727	55%	0.547	S	S	*	.			trans	-59.1	114.2	175.9	24	-32.9	0	0	0	108.1	L75	L75-P77 VanDerWaalsContact C-CD 3.43Å; L75-P77 WeakPolarHBondContact O-CD 3.48Å
78	L	70.5	Confident	65.4	Low	56 Å²	56	103 Å²	103	29%	0.293	54%	0.539	S	S	.	.			trans	-62	145.3	177.3	-70	170.9	0	0	0	109.3	H76 E82 L83 L122	H76-L78 PolarHBondContact O-N 3.19Å; L78-E82 HydrophobicContact CB-CB 4.2Å; L78-E82 HydrophobicContact CD2-CB 4.11Å; L78-L83 HydrophobicContact CB-CB 4.45Å; L78-L122 HydrophobicContact CD1-CD1 4.5Å
79	S	78.3	Confident	68.1	Low	54 Å²	54	96.4 Å²	96.4	38%	0.378	50%	0.504	S	S	.	.			trans	-61.8	156.5	168.3	63.4	0	0	0	0	110.6	D81 E82 L83	S79-D81 PolarHBondContact O-N 2.93Å; S79-D81 VanDerWaalsContact O-N 3.16Å; S79-E82 WeakPolarHBondContact CB-OE2 3.4Å; S79-E82 PolarHBondContact N-OE2 2.88Å; S79-E82 PolarHBondContact O-N 3.41Å; S79-E82 VanDerWaalsContact O-N 3.17Å; S79-E82 WeakPolarHBondContact OG-CB 3.39Å; S79-E82 WeakPolarHBondContact OG-CG 3.36Å; S79-E82 PolarHBondContact OG-N 3.13Å; S79-E82 PolarHBondContact OG-OE2 3.07Å; S79-L83 WeakPolarHBondContact O-CB 3.34Å; S79-L83 PolarHBondContact O-N 3.36Å
80	K	74.9	Confident	70.7	Confident	177 Å²	177	93.3 Å²	93.3	77%	0.77	49%	0.485	S	S	*	.	H	α-helix	trans	-53.7	-37.4	177.2	-171.1	178.8	-180	-179.2	0	111.8	S84	K80-S84 WeakPolarHBondContact O-CB 3.27Å; K80-S84 PolarHBondContact O-N 3.14Å
81	D	77.5	Confident	73.3	Confident	114 Å²	114	92.5 Å²	92.5	61%	0.61	47%	0.47	S	S	*	.	H	α-helix	trans	-72.7	-43.3	-179.5	-66.4	-9.6	0	0	0	111.9	S79 L83 S84 K85	S79-D81 PolarHBondContact O-N 2.93Å; S79-D81 VanDerWaalsContact O-N 3.16Å; D81-L83 VanDerWaalsContact C-N 3.34Å; D81-S84 PolarHBondContact O-N 2.9Å; D81-S84 PolarHBondContact O-OG 3.1Å; D81-K85 WeakPolarHBondContact O-CG 3.28Å; D81-K85 PolarHBondContact O-N 2.85Å; D81-K85 VanDerWaalsContact O-N 3.12Å
82	E	81.3	Confident	75.4	Confident	96 Å²	96	85.9 Å²	85.9	45%	0.449	44%	0.437	S	S	.	.	H	α-helix	trans	-63.5	-42	175.1	-73.8	162.6	154.6	0	0	111.7	L78 S79 S84 K85 R86	L78-E82 HydrophobicContact CB-CB 4.2Å; L78-E82 HydrophobicContact CD2-CB 4.11Å; S79-E82 WeakPolarHBondContact CB-OE2 3.4Å; S79-E82 PolarHBondContact N-OE2 2.88Å; S79-E82 PolarHBondContact O-N 3.41Å; S79-E82 VanDerWaalsContact O-N 3.17Å; S79-E82 WeakPolarHBondContact OG-CB 3.39Å; S79-E82 WeakPolarHBondContact OG-CG 3.36Å; S79-E82 PolarHBondContact OG-N 3.13Å; S79-E82 PolarHBondContact OG-OE2 3.07Å; E82-S84 VanDerWaalsContact C-N 3.32Å; E82-S84 PolarHBondContact O-N 2.8Å; E82-K85 PolarHBondContact O-N 3.5Å; E82-R86 PolarHBondContact O-N 3.3Å; E82-R86 VanDerWaalsContact O-N 3.15Å
83	L	82.2	Confident	77.8	Confident	35 Å²	35	79.9 Å²	79.9	18%	0.183	41%	0.406	C	S	.	.	H	α-helix	trans	-60.1	-44.7	175.9	-175.3	60.5	0	0	0	110.8	L78 S79 D81 K85 R86 L87 L122 A348	L78-L83 HydrophobicContact CB-CB 4.45Å; S79-L83 WeakPolarHBondContact O-CB 3.34Å; S79-L83 PolarHBondContact O-N 3.36Å; D81-L83 VanDerWaalsContact C-N 3.34Å; L83-K85 VanDerWaalsContact C-N 3.29Å; L83-K85 PolarHBondContact O-N 3.44Å; L83-R86 PolarHBondContact O-N 3.02Å; L83-L87 HydrophobicContact CD1-CD1 3.68Å; L83-L87 HydrophobicContact CD1-CG 3.94Å; L83-L87 HydrophobicContact CD2-CD1 4.47Å; L83-L87 HydrophobicContact CG-CD1 3.74Å; L83-L87 HydrophobicContact CG-CG 4.3Å; L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 WeakPolarHBondContact O-CG 3.38Å; L83-L87 PolarHBondContact O-N 3.35Å; L83-L122 HydrophobicContact CD1-CD1 4.12Å; L83-L122 HydrophobicContact CD1-CD2 4.07Å; L83-A348 HydrophobicContact CD1-CB 4.25Å; L83-A348 HydrophobicContact CD2-CB 3.7Å; L83-A348 HydrophobicContact CG-CB 4.22Å
84	S	80.1	Confident	79.6	Confident	72 Å²	72	80 Å²	80	50%	0.503	40%	0.404	S	S	.	.	H	α-helix	trans	-61.7	-34.9	177.1	76.3	0	0	0	0	113.3	K80 D81 E82	K80-S84 WeakPolarHBondContact O-CB 3.27Å; K80-S84 PolarHBondContact O-N 3.14Å; D81-S84 PolarHBondContact O-N 2.9Å; D81-S84 PolarHBondContact O-OG 3.1Å; E82-S84 VanDerWaalsContact C-N 3.32Å; E82-S84 PolarHBondContact O-N 2.8Å
85	K	83.5	Confident	81.6	Confident	148 Å²	148	83 Å²	83	64%	0.643	40%	0.398	S	S	*	.	H	α-helix	trans	-73.5	-27.4	178.4	-72.3	174.1	-177.4	174.5	0	113.2	D81 E82 L83 R88	D81-K85 WeakPolarHBondContact O-CG 3.28Å; D81-K85 PolarHBondContact O-N 2.85Å; D81-K85 VanDerWaalsContact O-N 3.12Å; E82-K85 PolarHBondContact O-N 3.5Å; L83-K85 VanDerWaalsContact C-N 3.29Å; L83-K85 PolarHBondContact O-N 3.44Å; K85-R88 WeakPolarHBondContact O-CD 3.29Å; K85-R88 WeakPolarHBondContact O-CG 3.44Å; K85-R88 PolarHBondContact O-NE 3.38Å
86	R	83.7	Confident	83.2	Confident	115 Å²	115	86.5 Å²	86.5	43%	0.434	41%	0.413	S	S	.	.	H	α-helix	trans	-90	-31.8	177.8	-63.4	-161.3	78.6	174.2	2.6	112.8	E82 L83 R88 L122	E82-R86 PolarHBondContact O-N 3.3Å; E82-R86 VanDerWaalsContact O-N 3.15Å; L83-R86 PolarHBondContact O-N 3.02Å; R86-R88 PolarHBondContact O-N 3.14Å; R86-L122 HydrophobicContact CB-CD1 3.44Å; R86-L122 VanDerWaalsContact CB-CD1 3.44Å; R86-L122 HydrophobicContact CG-CD1 4.41Å
87	L	86.9	Confident	84.4	Confident	24 Å²	24	85.6 Å²	85.6	13%	0.126	41%	0.412	C	S	.	.	S	Bend	trans	-79	59	175.4	-64.3	-179.8	0	0	0	112.6	L83 L119 L122 L130 A348	L83-L87 HydrophobicContact CD1-CD1 3.68Å; L83-L87 HydrophobicContact CD1-CG 3.94Å; L83-L87 HydrophobicContact CD2-CD1 4.47Å; L83-L87 HydrophobicContact CG-CD1 3.74Å; L83-L87 HydrophobicContact CG-CG 4.3Å; L83-L87 WeakPolarHBondContact O-CB 3.4Å; L83-L87 WeakPolarHBondContact O-CG 3.38Å; L83-L87 PolarHBondContact O-N 3.35Å; L87-L119 HydrophobicContact CD2-CD2 3.81Å; L87-L122 HydrophobicContact CD2-CD1 4.03Å; L87-L122 HydrophobicContact CD2-CD2 4.16Å; L87-L122 HydrophobicContact CG-CD1 4.39Å; L87-L130 HydrophobicContact CD1-CD2 4.29Å; L87-L130 HydrophobicContact CD2-CD1 4.5Å; L87-L130 HydrophobicContact CD2-CD2 3.46Å; L87-L130 VanDerWaalsContact CD2-CD2 3.46Å; L87-A348 HydrophobicContact CD1-CB 3.47Å; L87-A348 VanDerWaalsContact CD1-CB 3.47Å
88	R	90	Very high	85.4	Confident	129 Å²	129	81.1 Å²	81.1	49%	0.487	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-90.1	154.1	175	-67.5	-171.3	-77	176.5	0.3	110.9	K85 R86 W115 D169	K85-R88 WeakPolarHBondContact O-CD 3.29Å; K85-R88 WeakPolarHBondContact O-CG 3.44Å; K85-R88 PolarHBondContact O-NE 3.38Å; R86-R88 PolarHBondContact O-N 3.14Å; R88-W115 PolarHBondContact O-NE1 3.1Å; R88-D169 WeakPolarHBondContact CA-OD2 3.44Å; R88-D169 WeakPolarHBondContact CB-OD2 3.29Å; R88-D169 WeakPolarHBondContact CG-OD1 3.46Å
89	M	92.7	Very high	86.2	Confident	6 Å²	6	82.9 Å²	82.9	3%	0.03	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-76.4	151.7	167.2	64.4	169.3	-80.3	0	0	111	R91 W140 L143 M147 D169 L170 A173 F345	M89-R91 VanDerWaalsContact CG-NH1 3.32Å; M89-R91 PolarHBondContact O-N 2.83Å; M89-R91 PolarHBondContact O-NH1 2.72Å; M89-W140 HydrophobicContact CB-CH2 3.94Å; M89-W140 HydrophobicContact CB-CZ3 3.68Å; M89-W140 HydrophobicContact CE-CE3 4.22Å; M89-W140 HydrophobicContact CE-CZ3 3.89Å; M89-W140 HydrophobicContact SD-CZ3 4.49Å; M89-L143 HydrophobicContact CE-CD2 3.53Å; M89-L143 HydrophobicContact CE-CG 4.32Å; M89-L143 HydrophobicContact SD-CD2 4.29Å; M89-M147 HydrophobicContact CE-CE 3.79Å; M89-M147 HydrophobicContact CE-SD 4.48Å; M89-D169 VanDerWaalsContact CG-OD2 3.25Å; M89-D169 WeakPolarHBondContact CG-OD2 3.47Å; M89-D169 PolarHBondContact N-OD2 3.36Å; M89-L170 HydrophobicContact SD-CB 4.41Å; M89-L170 HydrophobicContact SD-CD1 3.85Å; M89-A173 HydrophobicContact SD-CB 4.24Å; M89-F345 HydrophobicContact CB-CD1 4.36Å; M89-F345 HydrophobicContact SD-CE1 4.11Å
90	P	94.6	Very high	86.9	Confident	3 Å²	3	83.4 Å²	83.4	2%	0.019	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-63.9	129.1	-179.2	28.5	-34.4	0	0	0	109.9	F112 W115 W140 W144	P90-F112 HydrophobicContact CB-CD2 4.03Å; P90-F112 HydrophobicContact CG-CD2 3.99Å; P90-F112 HydrophobicContact CG-CE2 4.1Å; P90-W115 HydrophobicContact CB-CB 4.19Å; P90-W115 HydrophobicContact CB-CD2 3.78Å; P90-W115 HydrophobicContact CB-CE3 4.07Å; P90-W115 HydrophobicContact CB-CG 3.81Å; P90-W115 HydrophobicContact CG-CD2 4.05Å; P90-W115 HydrophobicContact CG-CE3 4.1Å; P90-W115 HydrophobicContact CG-CH2 4.42Å; P90-W115 HydrophobicContact CG-CZ2 4.35Å; P90-W115 HydrophobicContact CG-CZ3 4.31Å; P90-W140 VanDerWaalsContact CD-CZ3 3.45Å; P90-W140 HydrophobicContact CG-CD2 3.53Å; P90-W140 HydrophobicContact CG-CE3 3.52Å; P90-W140 HydrophobicContact CG-CG 4.06Å; P90-W140 HydrophobicContact CG-CH2 4.26Å; P90-W140 HydrophobicContact CG-CZ2 4.26Å; P90-W140 HydrophobicContact CG-CZ3 3.94Å; P90-W144 HydrophobicContact CB-CZ2 4.16Å; P90-W144 HydrophobicContact CG-CZ2 4.3Å; P90-W144 PolarHBondContact O-NE1 3.22Å
91	R	94.1	Very high	87.6	Confident	70 Å²	70	79.4 Å²	79.4	26%	0.264	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-82.2	143.3	174.6	-62.6	-57.9	-170.8	-93.9	5.3	109.6	M89 D169 E176	M89-R91 VanDerWaalsContact CG-NH1 3.32Å; M89-R91 PolarHBondContact O-N 2.83Å; M89-R91 PolarHBondContact O-NH1 2.72Å; R91-D169 IonicContact CZ-OD1 3.15Å; R91-D169 IonicContact CZ-OD2 3.12Å; R91-D169 IonicContact NH1-OD1 3.45Å; R91-D169 IonicContact NH1-OD2 2.78Å; R91-D169 PolarHBondContact NH1-OD2 3.34Å; R91-D169 IonicContact NH2-OD1 2.76Å; R91-D169 PolarHBondContact NH2-OD1 3.29Å; R91-D169 IonicContact NH2-OD2 3.19Å; R91-D169 PolarHBondContact NH2-OD2 2.55Å; R91-E176 IonicContact CZ-OE2 3.75Å; R91-E176 IonicContact NE-OE2 3.39Å; R91-E176 PolarHBondContact NE-OE2 3.37Å; R91-E176 IonicContact NH2-OE1 3.77Å; R91-E176 IonicContact NH2-OE2 3.76Å; R91-E176 PolarHBondContact NH2-OE2 2.95Å
92	R	94.3	Very high	88.3	Confident	60 Å²	60	81.9 Å²	81.9	23%	0.226	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-73.2	128.1	172.1	-164.1	179.4	-169.1	-168	-6.4	108.7	E108 W144 E148	R92-E108 IonicContact CZ-OE1 3.95Å; R92-E108 VanDerWaalsContact CZ-OE1 3.26Å; R92-E108 IonicContact NE-OE1 3.62Å; R92-E108 PolarHBondContact NE-OE1 2.82Å; R92-E108 IonicContact NH2-OE1 2.8Å; R92-E108 PolarHBondContact NH2-OE1 2.86Å; R92-W144 HydrophobicContact CB-CB 4.35Å; R92-W144 HydrophobicContact CB-CD2 3.62Å; R92-W144 HydrophobicContact CB-CE3 3.91Å; R92-W144 HydrophobicContact CB-CG 3.83Å; R92-W144 HydrophobicContact CB-CZ2 4.39Å; R92-W144 HydrophobicContact CB-CZ3 4.42Å; R92-W144 HydrophobicContact CG-CD2 3.84Å; R92-W144 HydrophobicContact CG-CE3 3.57Å; R92-W144 HydrophobicContact CG-CG 4.29Å; R92-W144 HydrophobicContact CG-CZ3 3.99Å; R92-E148 WeakPolarHBondContact CD-OE1 3.42Å; R92-E148 IonicContact CZ-OE1 2.72Å; R92-E148 IonicContact NE-OE1 2.83Å; R92-E148 IonicContact NH1-OE1 3.26Å; R92-E148 PolarHBondContact NH1-OE1 3.03Å; R92-E148 IonicContact NH1-OE2 3.99Å; R92-E148 PolarHBondContact NH1-OE2 3.06Å
93	P	92.3	Very high	88.8	Confident	30 Å²	30	81.5 Å²	81.5	20%	0.195	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-62	156.9	172.6	27.1	-34.4	0	0	0	110.7	W95 L107 E108 A111	P93-W95 PolarHBondContact O-N 2.72Å; P93-L107 HydrophobicContact CG-CB 4.22Å; P93-E108 HydrophobicContact CG-CB 4.47Å; P93-E108 HydrophobicContact CG-CG 3.88Å; P93-A111 HydrophobicContact CG-CB 4.38Å
94	N	89.1	Confident	89.3	Confident	78 Å²	78	81.1 Å²	81.1	42%	0.417	41%	0.407	S	S	.	.			trans	-63.3	113	176.5	-175.7	-2.1	0	0	0	109.8	Q96 L97	N94-Q96 PolarHBondContact O-N 3.31Å; N94-Q96 WeakPolarHBondContact OD1-CB 3.22Å; N94-Q96 WeakPolarHBondContact OD1-CG 3.3Å; N94-Q96 PolarHBondContact OD1-N 3.39Å; N94-L97 HydrophobicContact CB-CD1 4.09Å; N94-L97 HydrophobicContact CB-CG 4.14Å; N94-L97 WeakPolarHBondContact O-CB 3.47Å; N94-L97 PolarHBondContact O-N 3.06Å; N94-L97 VanDerWaalsContact O-N 3.16Å
95	W	85.7	Confident	89.8	Confident	146 Å²	146	79.6 Å²	79.6	55%	0.553	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-67.5	-18.8	-176.5	61.4	-89.5	0	0	0	113.4	P93 L97 A98 L104	P93-W95 PolarHBondContact O-N 2.72Å; W95-L97 PolarHBondContact O-N 3.45Å; W95-A98 PolarHBondContact O-N 2.71Å; W95-L104 HydrophobicContact CB-CD1 3.66Å; W95-L104 HydrophobicContact CB-CD2 4.04Å
96	Q	87.1	Confident	90.2	Very high	140 Å²	140	77.1 Å²	77.1	65%	0.654	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-68.4	-17	175.2	-62.4	177.4	-16.5	0	0	113.2	N94	N94-Q96 PolarHBondContact O-N 3.31Å; N94-Q96 WeakPolarHBondContact OD1-CB 3.22Å; N94-Q96 WeakPolarHBondContact OD1-CG 3.3Å; N94-Q96 PolarHBondContact OD1-N 3.39Å
97	L	87.1	Confident	90.7	Very high	132 Å²	132	74.6 Å²	74.6	69%	0.691	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-75.2	-16.8	175.4	-61.4	175.1	0	0	0	112.5	N94 W95 L107	N94-L97 HydrophobicContact CB-CD1 4.09Å; N94-L97 HydrophobicContact CB-CG 4.14Å; N94-L97 WeakPolarHBondContact O-CB 3.47Å; N94-L97 PolarHBondContact O-N 3.06Å; N94-L97 VanDerWaalsContact O-N 3.16Å; W95-L97 PolarHBondContact O-N 3.45Å; L97-L107 HydrophobicContact CB-CD1 4.19Å
98	A	87.1	Confident	91	Very high	18 Å²	18	73.8 Å²	73.8	15%	0.149	38%	0.38	C	S	.	.			trans	-96.4	129.9	176.6	0	0	0	0	0	110.5	W95 E103 L104 L107	W95-A98 PolarHBondContact O-N 2.71Å; A98-E103 HydrophobicContact CB-CB 3.98Å; A98-L104 HydrophobicContact CB-CB 3.64Å; A98-L104 HydrophobicContact CB-CD1 4.24Å; A98-L107 HydrophobicContact CB-CD1 4.06Å
99	A	88.6	Confident	91.2	Very high	93 Å²	93	70.2 Å²	70.2	77%	0.769	37%	0.369	S	S	*	.	S	Bend	trans	-81.9	-29.9	172.3	0	0	0	0	0	111.4	E103	A99-E103 WeakPolarHBondContact CA-OE2 3.37Å; A99-E103 WeakPolarHBondContact CB-OE2 3.18Å; A99-E103 PolarHBondContact N-OE2 3.33Å
100	T	92.5	Very high	91.2	Very high	66 Å²	66	74.2 Å²	74.2	41%	0.405	39%	0.39	S	S	.	.	S	Bend	trans	-122.2	160.8	-178.1	71.4	0	0	0	0	113	E102 E103 L104	T100-E102 PolarHBondContact O-N 3.33Å; T100-E103 PolarHBondContact N-OE2 2.93Å; T100-E103 PolarHBondContact O-N 2.98Å; T100-E103 WeakPolarHBondContact OG1-CB 3.31Å; T100-E103 VanDerWaalsContact OG1-CG 3.26Å; T100-E103 WeakPolarHBondContact OG1-CG 3.44Å; T100-E103 PolarHBondContact OG1-N 3.29Å; T100-E103 VanDerWaalsContact OG1-N 3.13Å; T100-L104 PolarHBondContact O-N 3.49Å
101	S	90	Very high	91.1	Very high	93 Å²	93	75.5 Å²	75.5	65%	0.65	40%	0.401	S	S	*	.	H	α-helix	trans	-64.1	-29.2	174.6	-174.3	0	0	0	0	112.7	S105	S101-S105 WeakPolarHBondContact O-CB 3.37Å; S101-S105 PolarHBondContact O-N 2.92Å; S101-S105 PolarHBondContact O-OG 3.34Å
102	E	91.2	Very high	91.1	Very high	166 Å²	166	72.1 Å²	72.1	78%	0.776	39%	0.388	S	S	*	.	H	α-helix	trans	-73.4	-45.6	178.3	-66.6	178.9	-178.5	0	0	110.6	T100 L104 S105 L106	T100-E102 PolarHBondContact O-N 3.33Å; E102-L104 VanDerWaalsContact C-N 3.31Å; E102-L104 PolarHBondContact O-N 3.28Å; E102-S105 WeakPolarHBondContact O-CB 3.05Å; E102-S105 PolarHBondContact O-N 2.94Å; E102-S105 VanDerWaalsContact O-N 3.12Å; E102-L106 PolarHBondContact O-N 3.43Å
103	E	92.2	Very high	91	Very high	87 Å²	87	70 Å²	70	41%	0.407	38%	0.381	S	S	.	.	H	α-helix	trans	-58	-43.6	172.6	-75.1	167.3	-164	0	0	111.6	A98 A99 T100 S105 L106 L107	A98-E103 HydrophobicContact CB-CB 3.98Å; A99-E103 WeakPolarHBondContact CA-OE2 3.37Å; A99-E103 WeakPolarHBondContact CB-OE2 3.18Å; A99-E103 PolarHBondContact N-OE2 3.33Å; T100-E103 PolarHBondContact N-OE2 2.93Å; T100-E103 PolarHBondContact O-N 2.98Å; T100-E103 WeakPolarHBondContact OG1-CB 3.31Å; T100-E103 VanDerWaalsContact OG1-CG 3.26Å; T100-E103 WeakPolarHBondContact OG1-CG 3.44Å; T100-E103 PolarHBondContact OG1-N 3.29Å; T100-E103 VanDerWaalsContact OG1-N 3.13Å; E103-S105 VanDerWaalsContact C-N 3.31Å; E103-S105 PolarHBondContact O-N 3.36Å; E103-L106 PolarHBondContact O-N 3.29Å; E103-L107 WeakPolarHBondContact O-CG 3.37Å; E103-L107 PolarHBondContact O-N 2.88Å
104	L	92.3	Very high	91	Very high	28 Å²	28	74.5 Å²	74.5	15%	0.147	40%	0.399	C	S	.	.	H	α-helix	trans	-60.7	-43.4	175.8	-178.7	57.2	0	0	0	111.4	W95 A98 T100 E102 L106 L107 E108	W95-L104 HydrophobicContact CB-CD1 3.66Å; W95-L104 HydrophobicContact CB-CD2 4.04Å; A98-L104 HydrophobicContact CB-CB 3.64Å; A98-L104 HydrophobicContact CB-CD1 4.24Å; T100-L104 PolarHBondContact O-N 3.49Å; E102-L104 VanDerWaalsContact C-N 3.31Å; E102-L104 PolarHBondContact O-N 3.28Å; L104-L106 VanDerWaalsContact C-N 3.3Å; L104-L106 PolarHBondContact O-N 2.88Å; L104-L107 PolarHBondContact O-N 3.09Å; L104-E108 HydrophobicContact CD1-CG 4.26Å; L104-E108 HydrophobicContact CG-CG 4.5Å; L104-E108 WeakPolarHBondContact O-CB 3.29Å; L104-E108 VanDerWaalsContact O-CG 3.29Å; L104-E108 WeakPolarHBondContact O-CG 3.39Å; L104-E108 PolarHBondContact O-N 3.22Å
105	S	91.1	Very high	91.2	Very high	40 Å²	40	71.7 Å²	71.7	28%	0.28	38%	0.383	S	S	.	.	H	α-helix	trans	-62.5	-39.7	179.2	-60.9	0	0	0	0	111.5	S101 E102 E103 Q109 R141	S101-S105 WeakPolarHBondContact O-CB 3.37Å; S101-S105 PolarHBondContact O-N 2.92Å; S101-S105 PolarHBondContact O-OG 3.34Å; E102-S105 WeakPolarHBondContact O-CB 3.05Å; E102-S105 PolarHBondContact O-N 2.94Å; E102-S105 VanDerWaalsContact O-N 3.12Å; E103-S105 VanDerWaalsContact C-N 3.31Å; E103-S105 PolarHBondContact O-N 3.36Å; S105-Q109 WeakPolarHBondContact O-CB 3.34Å; S105-Q109 VanDerWaalsContact O-CG 3.25Å; S105-Q109 WeakPolarHBondContact O-CG 3.38Å; S105-Q109 PolarHBondContact O-N 3.05Å; S105-R141 PolarHBondContact O-NH2 2.96Å
106	L	91.9	Very high	91.5	Very high	96 Å²	96	64.9 Å²	64.9	50%	0.503	36%	0.357	S	S	.	.	H	α-helix	trans	-69.6	-41.5	176.6	-174.6	66.4	0	0	0	112.1	E102 E103 L104 Q109 N110	E102-L106 PolarHBondContact O-N 3.43Å; E103-L106 PolarHBondContact O-N 3.29Å; L104-L106 VanDerWaalsContact C-N 3.3Å; L104-L106 PolarHBondContact O-N 2.88Å; L106-Q109 PolarHBondContact O-N 2.71Å; L106-N110 WeakPolarHBondContact O-CB 3.46Å; L106-N110 VanDerWaalsContact O-CG 3.24Å; L106-N110 PolarHBondContact O-N 3.33Å; L106-N110 PolarHBondContact O-ND2 3Å
107	L	93.4	Very high	91.6	Very high	62 Å²	62	63.1 Å²	63.1	33%	0.325	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-45.8	174.3	-73.7	-180	0	0	0	111.4	P93 L97 A98 E103 L104 Q109 N110 A111	P93-L107 HydrophobicContact CG-CB 4.22Å; L97-L107 HydrophobicContact CB-CD1 4.19Å; A98-L107 HydrophobicContact CB-CD1 4.06Å; E103-L107 WeakPolarHBondContact O-CG 3.37Å; E103-L107 PolarHBondContact O-N 2.88Å; L104-L107 PolarHBondContact O-N 3.09Å; L107-Q109 VanDerWaalsContact C-N 3.34Å; L107-Q109 PolarHBondContact O-N 3.05Å; L107-N110 PolarHBondContact O-N 3.44Å; L107-A111 WeakPolarHBondContact O-CB 3.42Å; L107-A111 PolarHBondContact O-N 3.27Å
108	E	94.3	Very high	91.7	Very high	6 Å²	6	60.3 Å²	60.3	3%	0.028	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-41.4	175.8	-72.7	174.3	171.2	0	0	111.6	R92 P93 L104 F112 R141 W144	R92-E108 IonicContact CZ-OE1 3.95Å; R92-E108 VanDerWaalsContact CZ-OE1 3.26Å; R92-E108 IonicContact NE-OE1 3.62Å; R92-E108 PolarHBondContact NE-OE1 2.82Å; R92-E108 IonicContact NH2-OE1 2.8Å; R92-E108 PolarHBondContact NH2-OE1 2.86Å; P93-E108 HydrophobicContact CG-CB 4.47Å; P93-E108 HydrophobicContact CG-CG 3.88Å; L104-E108 HydrophobicContact CD1-CG 4.26Å; L104-E108 HydrophobicContact CG-CG 4.5Å; L104-E108 WeakPolarHBondContact O-CB 3.29Å; L104-E108 VanDerWaalsContact O-CG 3.29Å; L104-E108 WeakPolarHBondContact O-CG 3.39Å; L104-E108 PolarHBondContact O-N 3.22Å; E108-F112 VanDerWaalsContact O-CB 3.25Å; E108-F112 WeakPolarHBondContact O-CB 3.44Å; E108-F112 PolarHBondContact O-N 3.12Å; E108-R141 IonicContact OE2-CZ 2.8Å; E108-R141 IonicContact OE2-NE 2.72Å; E108-R141 PolarHBondContact OE2-NE 3.06Å; E108-R141 IonicContact OE2-NH2 2.83Å; E108-R141 PolarHBondContact OE2-NH2 3.09Å; E108-W144 HydrophobicContact CB-CZ3 4.22Å; E108-W144 HydrophobicContact CG-CZ3 3.98Å
109	Q	93	Very high	91.8	Very high	54 Å²	54	59.6 Å²	59.6	25%	0.252	33%	0.327	S	S	.	.	H	α-helix	trans	-61.9	-47.1	174.6	-78.5	169.2	-10.1	0	0	112	M47 S105 L106 L107 F112 M113 L137	M47-Q109 HydrophobicContact CE-CB 4.5Å; M47-Q109 HydrophobicContact CE-CG 4.1Å; S105-Q109 WeakPolarHBondContact O-CB 3.34Å; S105-Q109 VanDerWaalsContact O-CG 3.25Å; S105-Q109 WeakPolarHBondContact O-CG 3.38Å; S105-Q109 PolarHBondContact O-N 3.05Å; L106-Q109 PolarHBondContact O-N 2.71Å; L107-Q109 VanDerWaalsContact C-N 3.34Å; L107-Q109 PolarHBondContact O-N 3.05Å; Q109-F112 PolarHBondContact O-N 3.48Å; Q109-M113 WeakPolarHBondContact O-CB 3.39Å; Q109-M113 VanDerWaalsContact O-CG 3.26Å; Q109-M113 WeakPolarHBondContact O-CG 3.46Å; Q109-M113 PolarHBondContact O-N 2.98Å; Q109-L137 HydrophobicContact CB-CD2 4.29Å; Q109-L137 HydrophobicContact CG-CD2 3.65Å
110	N	92.9	Very high	91.7	Very high	90 Å²	90	57.6 Å²	57.6	48%	0.481	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-47.7	-179.5	-71.8	-25.9	0	0	0	111.8	L106 L107 F112 M113 E114	L106-N110 WeakPolarHBondContact O-CB 3.46Å; L106-N110 VanDerWaalsContact O-CG 3.24Å; L106-N110 PolarHBondContact O-N 3.33Å; L106-N110 PolarHBondContact O-ND2 3Å; L107-N110 PolarHBondContact O-N 3.44Å; N110-F112 VanDerWaalsContact C-N 3.3Å; N110-F112 PolarHBondContact O-N 3.49Å; N110-M113 PolarHBondContact O-N 3.23Å; N110-E114 PolarHBondContact O-N 3.39Å
111	A	93.4	Very high	91.4	Very high	30 Å²	30	57.8 Å²	57.8	25%	0.248	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-39.5	176.9	0	0	0	0	0	111.9	P93 L107 E114 W115	P93-A111 HydrophobicContact CG-CB 4.38Å; L107-A111 WeakPolarHBondContact O-CB 3.42Å; L107-A111 PolarHBondContact O-N 3.27Å; A111-E114 PolarHBondContact O-N 2.93Å; A111-W115 WeakPolarHBondContact O-CB 3.46Å; A111-W115 PolarHBondContact O-N 3.18Å
112	F	94.4	Very high	91.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.6	-37.5	176.3	-174.4	-104.4	0	0	0	112.8	M47 P90 E108 Q109 N110 W115 R116 K135 L137 W140	M47-F112 HydrophobicContact CE-CD1 3.74Å; M47-F112 HydrophobicContact CE-CE1 4.27Å; P90-F112 HydrophobicContact CB-CD2 4.03Å; P90-F112 HydrophobicContact CG-CD2 3.99Å; P90-F112 HydrophobicContact CG-CE2 4.1Å; E108-F112 VanDerWaalsContact O-CB 3.25Å; E108-F112 WeakPolarHBondContact O-CB 3.44Å; E108-F112 PolarHBondContact O-N 3.12Å; Q109-F112 PolarHBondContact O-N 3.48Å; N110-F112 VanDerWaalsContact C-N 3.3Å; N110-F112 PolarHBondContact O-N 3.49Å; F112-W115 AromaticContact CD2-CE3 3.73Å; F112-W115 HydrophobicContact CD2-CE3 3.73Å; F112-W115 HydrophobicContact CD2-CZ3 4.02Å; F112-W115 AromaticContact CE2-CE3 3.53Å; F112-W115 HydrophobicContact CE2-CE3 3.53Å; F112-W115 HydrophobicContact CE2-CH2 4.35Å; F112-W115 AromaticContact CE2-CZ3 3.31Å; F112-W115 HydrophobicContact CE2-CZ3 3.31Å; F112-W115 HydrophobicContact CG-CE3 4.46Å; F112-W115 HydrophobicContact CZ-CE3 4.13Å; F112-W115 AromaticContact CZ-CZ3 3.69Å; F112-W115 HydrophobicContact CZ-CZ3 3.69Å; F112-W115 PolarHBondContact O-N 3.34Å; F112-R116 HydrophobicContact CE1-CG 4.21Å; F112-R116 HydrophobicContact CZ-CG 4.48Å; F112-R116 PolarHBondContact O-N 3.33Å; F112-K135 VanDerWaalsContact CE1-O 3.29Å; F112-K135 WeakPolarHBondContact CE1-O 3.41Å; F112-K135 WeakPolarHBondContact CZ-O 3.49Å; F112-L137 HydrophobicContact CB-CD1 3.79Å; F112-L137 HydrophobicContact CB-CD2 4.28Å; F112-L137 HydrophobicContact CD1-CB 4.06Å; F112-L137 HydrophobicContact CD1-CD1 4.37Å; F112-L137 HydrophobicContact CD2-CD1 3.79Å; F112-L137 HydrophobicContact CE1-CB 4.16Å; F112-L137 HydrophobicContact CE2-CD1 4.46Å; F112-L137 HydrophobicContact CG-CB 4.27Å; F112-L137 HydrophobicContact CG-CD1 3.73Å; F112-L137 HydrophobicContact CG-CG 4.4Å; F112-L137 HydrophobicContact CZ-CB 4.49Å; F112-W140 AromaticContact CE2-CD1 3.36Å; F112-W140 AromaticContact CE2-CG 3.98Å; F112-W140 HydrophobicContact CE2-CG 3.98Å; F112-W140 AromaticContact CE2-NE1 3.57Å; F112-W140 AromaticContact CZ-CD1 3.83Å; F112-W140 AromaticContact CZ-NE1 3.96Å
113	M	91.1	Very high	90.8	Very high	15 Å²	15	49 Å²	49	7%	0.074	25%	0.249	C	C	.	.	H	α-helix	trans	-70.8	-35.8	176.7	-71.9	-57.3	-63.7	0	0	112.4	K44 M47 Q109 N110 R116 K117	K44-M113 HydrophobicContact CG-CE 4.27Å; M47-M113 HydrophobicContact CB-CG 4.39Å; M47-M113 HydrophobicContact CB-SD 3.77Å; M47-M113 HydrophobicContact CE-SD 4.34Å; M47-M113 HydrophobicContact CG-SD 4.32Å; Q109-M113 WeakPolarHBondContact O-CB 3.39Å; Q109-M113 VanDerWaalsContact O-CG 3.26Å; Q109-M113 WeakPolarHBondContact O-CG 3.46Å; Q109-M113 PolarHBondContact O-N 2.98Å; N110-M113 PolarHBondContact O-N 3.23Å; M113-R116 PolarHBondContact O-N 3.16Å; M113-K117 WeakPolarHBondContact O-CG 3.25Å; M113-K117 PolarHBondContact O-N 2.85Å; M113-K117 VanDerWaalsContact O-N 3.08Å
114	E	92	Very high	90.4	Very high	124 Å²	124	51.9 Å²	51.9	58%	0.579	26%	0.262	S	S	*	.	H	α-helix	trans	-61.4	-48.6	171	-174.8	173.6	-160.5	0	0	110.7	N110 A111 R116 K117 D118	N110-E114 PolarHBondContact O-N 3.39Å; A111-E114 PolarHBondContact O-N 2.93Å; E114-R116 VanDerWaalsContact C-N 3.33Å; E114-R116 PolarHBondContact O-N 3.23Å; E114-K117 WeakPolarHBondContact O-CB 3.22Å; E114-K117 PolarHBondContact O-N 3.12Å; E114-K117 VanDerWaalsContact O-N 3.08Å; E114-D118 PolarHBondContact O-N 2.93Å
115	W	94	Very high	89.8	Confident	20 Å²	20	55.7 Å²	55.7	8%	0.076	28%	0.283	C	S	.	.	H	α-helix	trans	-56.9	-42	174.3	170.4	73	0	0	0	113.5	R88 P90 A111 F112 K117 D118 L119 F133 W140 P346	R88-W115 PolarHBondContact O-NE1 3.1Å; P90-W115 HydrophobicContact CB-CB 4.19Å; P90-W115 HydrophobicContact CB-CD2 3.78Å; P90-W115 HydrophobicContact CB-CE3 4.07Å; P90-W115 HydrophobicContact CB-CG 3.81Å; P90-W115 HydrophobicContact CG-CD2 4.05Å; P90-W115 HydrophobicContact CG-CE3 4.1Å; P90-W115 HydrophobicContact CG-CH2 4.42Å; P90-W115 HydrophobicContact CG-CZ2 4.35Å; P90-W115 HydrophobicContact CG-CZ3 4.31Å; A111-W115 WeakPolarHBondContact O-CB 3.46Å; A111-W115 PolarHBondContact O-N 3.18Å; F112-W115 AromaticContact CD2-CE3 3.73Å; F112-W115 HydrophobicContact CD2-CE3 3.73Å; F112-W115 HydrophobicContact CD2-CZ3 4.02Å; F112-W115 AromaticContact CE2-CE3 3.53Å; F112-W115 HydrophobicContact CE2-CE3 3.53Å; F112-W115 HydrophobicContact CE2-CH2 4.35Å; F112-W115 AromaticContact CE2-CZ3 3.31Å; F112-W115 HydrophobicContact CE2-CZ3 3.31Å; F112-W115 HydrophobicContact CG-CE3 4.46Å; F112-W115 HydrophobicContact CZ-CE3 4.13Å; F112-W115 AromaticContact CZ-CZ3 3.69Å; F112-W115 HydrophobicContact CZ-CZ3 3.69Å; F112-W115 PolarHBondContact O-N 3.34Å; W115-K117 PolarHBondContact O-N 3.01Å; W115-D118 PolarHBondContact O-N 3.49Å; W115-L119 HydrophobicContact CD2-CD1 4.24Å; W115-L119 HydrophobicContact CH2-CD1 3.87Å; W115-L119 HydrophobicContact CZ2-CD1 3.45Å; W115-L119 VanDerWaalsContact CZ2-CD1 3.45Å; W115-L119 HydrophobicContact CZ2-CG 4.5Å; W115-L119 HydrophobicContact CZ3-CD1 4.39Å; W115-L119 PolarHBondContact O-N 3.32Å; W115-F133 AromaticContact CH2-CD2 3.71Å; W115-F133 HydrophobicContact CH2-CD2 3.71Å; W115-F133 AromaticContact CH2-CE2 3.64Å; W115-F133 HydrophobicContact CH2-CE2 3.64Å; W115-F133 HydrophobicContact CZ3-CD2 4.35Å; W115-F133 AromaticContact CZ3-CE2 3.91Å; W115-F133 HydrophobicContact CZ3-CE2 3.91Å; W115-W140 AromaticContact CH2-CZ2 3.76Å; W115-W140 HydrophobicContact CH2-CZ2 3.76Å; W115-W140 HydrophobicContact CZ2-CZ2 4.2Å; W115-P346 HydrophobicContact CZ2-CG 3.92Å
116	R	91.3	Very high	89.1	Confident	3 Å²	3	54.5 Å²	54.5	1%	0.011	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-40.4	175.3	-76.9	-175.1	68	164	1.1	112.4	E35 F112 M113 E114 D118 L119 E120	E35-R116 IonicContact OE2-NH2 2.8Å; E35-R116 PolarHBondContact OE2-NH2 3.18Å; F112-R116 HydrophobicContact CE1-CG 4.21Å; F112-R116 HydrophobicContact CZ-CG 4.48Å; F112-R116 PolarHBondContact O-N 3.33Å; M113-R116 PolarHBondContact O-N 3.16Å; E114-R116 VanDerWaalsContact C-N 3.33Å; E114-R116 PolarHBondContact O-N 3.23Å; R116-D118 VanDerWaalsContact C-N 3.34Å; R116-L119 PolarHBondContact O-N 2.87Å; R116-E120 WeakPolarHBondContact O-CG 3.26Å; R116-E120 PolarHBondContact O-N 3.46Å
117	K	89.7	Confident	88.1	Confident	102 Å²	102	51.3 Å²	51.3	44%	0.443	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-42.4	175.6	-70.6	171.2	-176.8	176.2	0	111.3	M113 E114 W115 L119 E120 D121	M113-K117 WeakPolarHBondContact O-CG 3.25Å; M113-K117 PolarHBondContact O-N 2.85Å; M113-K117 VanDerWaalsContact O-N 3.08Å; E114-K117 WeakPolarHBondContact O-CB 3.22Å; E114-K117 PolarHBondContact O-N 3.12Å; E114-K117 VanDerWaalsContact O-N 3.08Å; W115-K117 PolarHBondContact O-N 3.01Å; K117-L119 PolarHBondContact O-N 2.94Å; K117-E120 PolarHBondContact O-N 2.78Å; K117-E120 VanDerWaalsContact O-N 3.12Å; K117-D121 WeakPolarHBondContact O-CB 3.47Å; K117-D121 VanDerWaalsContact O-CG 3.29Å; K117-D121 PolarHBondContact O-N 3.25Å
118	D	90.2	Very high	87.3	Confident	74 Å²	74	49.5 Å²	49.5	40%	0.396	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-36.2	177.2	-73.7	-22.3	0	0	0	112.5	E114 W115 R116 L122	E114-D118 PolarHBondContact O-N 2.93Å; W115-D118 PolarHBondContact O-N 3.49Å; R116-D118 VanDerWaalsContact C-N 3.34Å; D118-L122 WeakPolarHBondContact O-CB 3.18Å; D118-L122 PolarHBondContact O-N 2.93Å; D118-L122 VanDerWaalsContact O-N 3.07Å
119	L	88.9	Confident	86.6	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-71	-41.6	174.3	-67.4	-178.1	0	0	0	112.3	L87 W115 R116 K117 L122 Q123 L130 F133 P346	L87-L119 HydrophobicContact CD2-CD2 3.81Å; W115-L119 HydrophobicContact CD2-CD1 4.24Å; W115-L119 HydrophobicContact CH2-CD1 3.87Å; W115-L119 HydrophobicContact CZ2-CD1 3.45Å; W115-L119 VanDerWaalsContact CZ2-CD1 3.45Å; W115-L119 HydrophobicContact CZ2-CG 4.5Å; W115-L119 HydrophobicContact CZ3-CD1 4.39Å; W115-L119 PolarHBondContact O-N 3.32Å; R116-L119 PolarHBondContact O-N 2.87Å; K117-L119 PolarHBondContact O-N 2.94Å; L119-L122 WeakPolarHBondContact O-CB 3.36Å; L119-L122 PolarHBondContact O-N 3.33Å; L119-Q123 WeakPolarHBondContact O-CG 3.18Å; L119-Q123 PolarHBondContact O-N 3.19Å; L119-L130 HydrophobicContact CB-CD1 3.99Å; L119-L130 HydrophobicContact CD2-CD1 4.15Å; L119-L130 HydrophobicContact CG-CD1 4.48Å; L119-F133 HydrophobicContact CD1-CE1 4.17Å; L119-F133 HydrophobicContact CD1-CE2 4.04Å; L119-F133 HydrophobicContact CD1-CZ 3.77Å; L119-P346 HydrophobicContact CD1-CB 4.25Å; L119-P346 HydrophobicContact CD1-CG 4.19Å
120	E	86.4	Confident	86.1	Confident	51 Å²	51	54.3 Å²	54.3	24%	0.238	28%	0.283	C	S	.	.	H	α-helix	trans	-61.2	-48.6	175.4	-72.7	168.8	-156.5	0	0	110.7	K44 R116 K117 L122 Q123 E124	K44-E120 WeakPolarHBondContact CE-OE1 3.38Å; K44-E120 IonicContact NZ-OE1 2.71Å; K44-E120 PolarHBondContact NZ-OE1 3.4Å; K44-E120 IonicContact NZ-OE2 2.67Å; K44-E120 PolarHBondContact NZ-OE2 3.05Å; R116-E120 WeakPolarHBondContact O-CG 3.26Å; R116-E120 PolarHBondContact O-N 3.46Å; K117-E120 PolarHBondContact O-N 2.78Å; K117-E120 VanDerWaalsContact O-N 3.12Å; E120-L122 PolarHBondContact O-N 3.21Å; E120-Q123 PolarHBondContact O-N 3.24Å; E120-E124 PolarHBondContact O-N 3.5Å
121	D	86.9	Confident	85.8	Confident	70 Å²	70	50.4 Å²	50.4	37%	0.374	26%	0.262	S	S	.	.	H	α-helix	trans	-58.6	-35.8	175.4	-71.4	-9	0	0	0	111.6	K117 N125	K117-D121 WeakPolarHBondContact O-CB 3.47Å; K117-D121 VanDerWaalsContact O-CG 3.29Å; K117-D121 PolarHBondContact O-N 3.25Å; D121-N125 VanDerWaalsContact O-CB 3.28Å; D121-N125 WeakPolarHBondContact O-CB 3.48Å; D121-N125 PolarHBondContact O-N 2.79Å; D121-N125 PolarHBondContact O-ND2 3.24Å
122	L	85.5	Confident	85.4	Confident	1 Å²	1	50 Å²	50	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-44.5	175.5	-176.2	147.2	0	0	0	111.2	L78 L83 R86 L87 D118 L119 E120 S126 C128 L130	L78-L122 HydrophobicContact CD1-CD1 4.5Å; L83-L122 HydrophobicContact CD1-CD1 4.12Å; L83-L122 HydrophobicContact CD1-CD2 4.07Å; R86-L122 HydrophobicContact CB-CD1 3.44Å; R86-L122 VanDerWaalsContact CB-CD1 3.44Å; R86-L122 HydrophobicContact CG-CD1 4.41Å; L87-L122 HydrophobicContact CD2-CD1 4.03Å; L87-L122 HydrophobicContact CD2-CD2 4.16Å; L87-L122 HydrophobicContact CG-CD1 4.39Å; D118-L122 WeakPolarHBondContact O-CB 3.18Å; D118-L122 PolarHBondContact O-N 2.93Å; D118-L122 VanDerWaalsContact O-N 3.07Å; L119-L122 WeakPolarHBondContact O-CB 3.36Å; L119-L122 PolarHBondContact O-N 3.33Å; E120-L122 PolarHBondContact O-N 3.21Å; L122-S126 VanDerWaalsContact O-CB 3.32Å; L122-S126 WeakPolarHBondContact O-CB 3.32Å; L122-S126 PolarHBondContact O-N 3.25Å; L122-S126 PolarHBondContact O-OG 3.37Å; L122-C128 HydrophobicContact CD2-CB 3.83Å; L122-L130 HydrophobicContact CD2-CD2 4.11Å
123	Q	83	Confident	85.2	Confident	75 Å²	75	50.9 Å²	50.9	35%	0.35	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-43.7	178.1	-68.3	-171.7	-86.5	0	0	112	L119 E120 G127 L130	L119-Q123 WeakPolarHBondContact O-CG 3.18Å; L119-Q123 PolarHBondContact O-N 3.19Å; E120-Q123 PolarHBondContact O-N 3.24Å; Q123-G127 WeakPolarHBondContact O-CA 3.07Å; Q123-G127 PolarHBondContact O-N 2.74Å; Q123-L130 HydrophobicContact CG-CB 4.35Å; Q123-L130 HydrophobicContact CG-CD1 3.61Å; Q123-L130 HydrophobicContact CG-CG 3.62Å
124	E	82.6	Confident	85.2	Confident	146 Å²	146	50.1 Å²	50.1	68%	0.682	26%	0.258	S	S	*	.	H	α-helix	trans	-69.2	-45.2	-178.4	-68.6	-176	177.9	0	0	112.6	E120	E120-E124 PolarHBondContact O-N 3.5Å
125	N	79.9	Confident	85.1	Confident	109 Å²	109	45.4 Å²	45.4	58%	0.583	24%	0.235	S	C	*	.	H	α-helix	trans	-87.5	-32.3	-172.1	-65.7	-55.6	0	0	0	114.1	D121	D121-N125 VanDerWaalsContact O-CB 3.28Å; D121-N125 WeakPolarHBondContact O-CB 3.48Å; D121-N125 PolarHBondContact O-N 2.79Å; D121-N125 PolarHBondContact O-ND2 3.24Å
126	S	75.7	Confident	84.9	Confident	14 Å²	14	46.1 Å²	46.1	10%	0.098	24%	0.241	C	C	.	.	H	α-helix	trans	-95.4	-12	-179.8	73.7	0	0	0	0	113.4	L122 C128	L122-S126 VanDerWaalsContact O-CB 3.32Å; L122-S126 WeakPolarHBondContact O-CB 3.32Å; L122-S126 PolarHBondContact O-N 3.25Å; L122-S126 PolarHBondContact O-OG 3.37Å; S126-C128 PolarHBondContact O-N 3.15Å; S126-C128 WeakPolarHBondContact OG-CB 3.42Å; S126-C128 PolarHBondContact OG-N 3.44Å
127	G	71.4	Confident	85	Confident	30 Å²	30	46.1 Å²	46.1	31%	0.309	24%	0.241	S	C	.	.			trans	65.8	12.8	-173.4	0	0	0	0	0	113.5	Q123	Q123-G127 WeakPolarHBondContact O-CA 3.07Å; Q123-G127 PolarHBondContact O-N 2.74Å
128	C	77.2	Confident	85.1	Confident	24 Å²	24	44.2 Å²	44.2	16%	0.162	24%	0.235	C	C	.	.			trans	-71.8	129.6	178.6	-180	0	0	0	0	110.8	L122 S126 A348	L122-C128 HydrophobicContact CD2-CB 3.83Å; S126-C128 PolarHBondContact O-N 3.15Å; S126-C128 WeakPolarHBondContact OG-CB 3.42Å; S126-C128 PolarHBondContact OG-N 3.44Å; C128-A348 WeakPolarHBondContact SG-CB 3.29Å
129	I	78.7	Confident	85.1	Confident	144 Å²	144	41.2 Å²	41.2	74%	0.738	22%	0.219	S	C	*	.			trans	-87.9	112.4	173.2	-58.9	172.2	0	0	0	108.1
130	L	84	Confident	85.4	Confident	16 Å²	16	41.1 Å²	41.1	8%	0.084	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-78.9	140.8	174.7	-63.1	-179.9	0	0	0	111.2	L87 L119 L122 Q123 A348	L87-L130 HydrophobicContact CD1-CD2 4.29Å; L87-L130 HydrophobicContact CD2-CD1 4.5Å; L87-L130 HydrophobicContact CD2-CD2 3.46Å; L87-L130 VanDerWaalsContact CD2-CD2 3.46Å; L119-L130 HydrophobicContact CB-CD1 3.99Å; L119-L130 HydrophobicContact CD2-CD1 4.15Å; L119-L130 HydrophobicContact CG-CD1 4.48Å; L122-L130 HydrophobicContact CD2-CD2 4.11Å; Q123-L130 HydrophobicContact CG-CB 4.35Å; Q123-L130 HydrophobicContact CG-CD1 3.61Å; Q123-L130 HydrophobicContact CG-CG 3.62Å; L130-A348 HydrophobicContact CD2-CB 4.29Å
131	T	85.4	Confident	85.8	Confident	8 Å²	8	40.1 Å²	40.1	5%	0.049	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-64.3	152.4	166.9	59.9	0	0	0	0	111	F133 A347 F350 M355	T131-F133 PolarHBondContact O-N 2.81Å; T131-A347 HydrophobicContact CG2-CB 4.36Å; T131-A347 WeakPolarHBondContact CG2-O 3.38Å; T131-A347 PolarHBondContact N-O 3.43Å; T131-A347 PolarHBondContact OG1-N 3.43Å; T131-A347 PolarHBondContact OG1-O 3.29Å; T131-A347 VanDerWaalsContact OG1-O 3.08Å; T131-F350 WeakPolarHBondContact CG2-O 3.43Å; T131-M355 WeakPolarHBondContact CB-SD 3.41Å; T131-M355 HydrophobicContact CG2-SD 3.76Å
132	P	86	Confident	86.2	Confident	21 Å²	21	37.4 Å²	37.4	14%	0.136	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-50.6	138.4	168.7	-27	36	0	0	0	111.5	T33 Q34 V344 L352 M355 L361	T33-P132 WeakPolarHBondContact O-CB 3.26Å; Q34-P132 HydrophobicContact CG-CB 3.92Å; Q34-P132 HydrophobicContact CG-CG 4.02Å; Q34-P132 VanDerWaalsContact NE2-CG 3.32Å; P132-V344 WeakPolarHBondContact O-CG1 3.28Å; P132-L352 HydrophobicContact CG-CD1 3.62Å; P132-M355 WeakPolarHBondContact O-CE 3.08Å; P132-L361 HydrophobicContact CB-CD1 4.26Å; P132-L361 HydrophobicContact CB-CD2 4.38Å; P132-L361 HydrophobicContact CG-CD1 4.05Å
133	F	90.1	Very high	86.6	Confident	19 Å²	19	37.7 Å²	37.7	8%	0.083	20%	0.199	C	C	.	.			trans	-143.4	161.7	-178.1	65.6	-92.6	0	0	0	110.7	T33 W115 L119 T131 K135 P346	T33-F133 WeakPolarHBondContact CA-O 3.33Å; W115-F133 AromaticContact CH2-CD2 3.71Å; W115-F133 HydrophobicContact CH2-CD2 3.71Å; W115-F133 AromaticContact CH2-CE2 3.64Å; W115-F133 HydrophobicContact CH2-CE2 3.64Å; W115-F133 HydrophobicContact CZ3-CD2 4.35Å; W115-F133 AromaticContact CZ3-CE2 3.91Å; W115-F133 HydrophobicContact CZ3-CE2 3.91Å; L119-F133 HydrophobicContact CD1-CE1 4.17Å; L119-F133 HydrophobicContact CD1-CE2 4.04Å; L119-F133 HydrophobicContact CD1-CZ 3.77Å; T131-F133 PolarHBondContact O-N 2.81Å; F133-K135 HydrophobicContact CD2-CG 4.41Å; F133-K135 HydrophobicContact CE2-CG 4.03Å; F133-K135 HydrophobicContact CZ-CG 4.47Å; F133-K135 PolarHBondContact O-N 2.73Å; F133-P346 HydrophobicContact CB-CB 4Å; F133-P346 HydrophobicContact CD1-CB 4.01Å; F133-P346 HydrophobicContact CG-CB 4.01Å
134	E	91.1	Very high	87.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.			trans	-67.7	117.2	-178.4	-177	60.1	-114.2	0	0	111.9	S31 V32 N136 I139 W140 L343 V344	S31-E134 VanDerWaalsContact CA-OE2 3.24Å; S31-E134 WeakPolarHBondContact CA-OE2 3.45Å; S31-E134 WeakPolarHBondContact CB-OE2 3.48Å; S31-E134 PolarHBondContact OG-OE2 3.27Å; V32-E134 PolarHBondContact N-OE1 2.79Å; V32-E134 PolarHBondContact N-OE2 2.95Å; E134-N136 HydrophobicContact CG-CB 4.43Å; E134-N136 WeakPolarHBondContact OE1-CB 3.47Å; E134-N136 PolarHBondContact OE1-N 3.27Å; E134-I139 HydrophobicContact CG-CB 4.11Å; E134-I139 HydrophobicContact CG-CD1 4.21Å; E134-I139 HydrophobicContact CG-CG2 4.44Å; E134-I139 WeakPolarHBondContact OE2-CD1 3.44Å; E134-W140 PolarHBondContact O-NE1 3.04Å; E134-L343 HydrophobicContact CB-CD1 3.47Å; E134-L343 VanDerWaalsContact CB-CD1 3.47Å; E134-L343 HydrophobicContact CB-CG 4.1Å; E134-L343 HydrophobicContact CG-CD1 3.46Å; E134-L343 VanDerWaalsContact CG-CD1 3.46Å; E134-V344 PolarHBondContact N-O 3.07Å
135	K	89.6	Confident	87.8	Confident	25 Å²	25	32.1 Å²	32.1	11%	0.109	17%	0.169	C	C	.	.			trans	-93.9	-11	177.7	-66.6	-179.1	167	-171.9	0	113.3	V32 E35 E40 F112 F133 L137	V32-K135 WeakPolarHBondContact O-CB 3.46Å; V32-K135 PolarHBondContact O-N 2.67Å; E35-K135 VanDerWaalsContact CD-CD 3.43Å; E35-K135 HydrophobicContact CG-CD 3.91Å; E35-K135 WeakPolarHBondContact OE2-CD 3.3Å; E35-K135 IonicContact OE2-NZ 2.88Å; E35-K135 PolarHBondContact OE2-NZ 3.03Å; E40-K135 IonicContact OE2-NZ 2.78Å; E40-K135 PolarHBondContact OE2-NZ 3.16Å; F112-K135 VanDerWaalsContact CE1-O 3.29Å; F112-K135 WeakPolarHBondContact CE1-O 3.41Å; F112-K135 WeakPolarHBondContact CZ-O 3.49Å; F133-K135 HydrophobicContact CD2-CG 4.41Å; F133-K135 HydrophobicContact CE2-CG 4.03Å; F133-K135 HydrophobicContact CZ-CG 4.47Å; F133-K135 PolarHBondContact O-N 2.73Å; K135-L137 PolarHBondContact O-N 2.76Å
136	N	89.4	Confident	88.6	Confident	35 Å²	35	27 Å²	27	19%	0.187	14%	0.141	C	C	.	.			trans	-83.5	111.1	178.8	-171.3	-17.6	0	0	0	112.5	R30 E134 D138 I139	R30-N136 PolarHBondContact O-ND2 3.43Å; E134-N136 HydrophobicContact CG-CB 4.43Å; E134-N136 WeakPolarHBondContact OE1-CB 3.47Å; E134-N136 PolarHBondContact OE1-N 3.27Å; N136-D138 PolarHBondContact O-N 3.43Å; N136-D138 WeakPolarHBondContact OD1-CB 3.24Å; N136-D138 PolarHBondContact OD1-N 3.46Å; N136-I139 HydrophobicContact CB-CD1 4.14Å; N136-I139 HydrophobicContact CB-CG1 4.19Å; N136-I139 PolarHBondContact O-N 2.62Å
137	L	92.2	Very high	89.6	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-56	-33.5	177.3	176.6	57.7	0	0	0	113.5	M47 Q109 F112 K135 I139 W140 R141 W144	M47-L137 HydrophobicContact CE-CB 4.02Å; M47-L137 HydrophobicContact CE-CD2 3.87Å; Q109-L137 HydrophobicContact CB-CD2 4.29Å; Q109-L137 HydrophobicContact CG-CD2 3.65Å; F112-L137 HydrophobicContact CB-CD1 3.79Å; F112-L137 HydrophobicContact CB-CD2 4.28Å; F112-L137 HydrophobicContact CD1-CB 4.06Å; F112-L137 HydrophobicContact CD1-CD1 4.37Å; F112-L137 HydrophobicContact CD2-CD1 3.79Å; F112-L137 HydrophobicContact CE1-CB 4.16Å; F112-L137 HydrophobicContact CE2-CD1 4.46Å; F112-L137 HydrophobicContact CG-CB 4.27Å; F112-L137 HydrophobicContact CG-CD1 3.73Å; F112-L137 HydrophobicContact CG-CG 4.4Å; F112-L137 HydrophobicContact CZ-CB 4.49Å; K135-L137 PolarHBondContact O-N 2.76Å; L137-I139 PolarHBondContact O-N 3.15Å; L137-W140 HydrophobicContact CD1-CB 4.41Å; L137-W140 WeakPolarHBondContact O-CB 3.42Å; L137-W140 PolarHBondContact O-N 2.64Å; L137-W140 VanDerWaalsContact O-N 3.14Å; L137-R141 HydrophobicContact CD1-CG 4.46Å; L137-R141 HydrophobicContact CG-CG 4.44Å; L137-R141 WeakPolarHBondContact O-CG 3.16Å; L137-R141 PolarHBondContact O-N 3.31Å; L137-W144 HydrophobicContact CD1-CH2 3.65Å; L137-W144 HydrophobicContact CD1-CZ3 3.94Å
138	D	91.8	Very high	90.7	Very high	61 Å²	61	28.3 Å²	28.3	33%	0.326	14%	0.138	S	C	.	.	H	α-helix	trans	-65.7	-26.3	-177.7	-72.2	-36.2	0	0	0	113.4	L29 N136 R141 Q142	L29-D138 HydrophobicContact CD2-CB 3.41Å; L29-D138 VanDerWaalsContact CD2-CB 3.41Å; N136-D138 PolarHBondContact O-N 3.43Å; N136-D138 WeakPolarHBondContact OD1-CB 3.24Å; N136-D138 PolarHBondContact OD1-N 3.46Å; D138-R141 IonicContact OD1-CZ 2.75Å; D138-R141 IonicContact OD1-NH1 2.82Å; D138-R141 PolarHBondContact OD1-NH1 3.19Å; D138-Q142 WeakPolarHBondContact O-CG 3.46Å; D138-Q142 PolarHBondContact O-N 2.92Å; D138-Q142 PolarHBondContact O-NE2 3.14Å
139	I	91.8	Very high	91.5	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.062	16%	0.155	C	C	.	.	H	α-helix	trans	-77.8	-40	176.1	-53.9	-177.6	0	0	0	109.6	E134 N136 L137 R141 Q142 L143 P341 L343	E134-I139 HydrophobicContact CG-CB 4.11Å; E134-I139 HydrophobicContact CG-CD1 4.21Å; E134-I139 HydrophobicContact CG-CG2 4.44Å; E134-I139 WeakPolarHBondContact OE2-CD1 3.44Å; N136-I139 HydrophobicContact CB-CD1 4.14Å; N136-I139 HydrophobicContact CB-CG1 4.19Å; N136-I139 PolarHBondContact O-N 2.62Å; L137-I139 PolarHBondContact O-N 3.15Å; I139-R141 VanDerWaalsContact C-N 3.3Å; I139-R141 PolarHBondContact O-N 2.91Å; I139-Q142 WeakPolarHBondContact O-CB 3.34Å; I139-Q142 PolarHBondContact O-N 3.42Å; I139-L143 PolarHBondContact O-N 3.23Å; I139-P341 HydrophobicContact CG2-CB 3.8Å; I139-P341 HydrophobicContact CG2-CG 4.26Å; I139-L343 HydrophobicContact CB-CD1 4.04Å; I139-L343 HydrophobicContact CG2-CD1 3.42Å; I139-L343 VanDerWaalsContact CG2-CD1 3.42Å
140	W	94.9	Very high	92.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.2	-39.8	170.3	-70.9	99.8	0	0	0	112.2	M89 P90 F112 W115 E134 L137 Q142 L143 W144 L343 F345	M89-W140 HydrophobicContact CB-CH2 3.94Å; M89-W140 HydrophobicContact CB-CZ3 3.68Å; M89-W140 HydrophobicContact CE-CE3 4.22Å; M89-W140 HydrophobicContact CE-CZ3 3.89Å; M89-W140 HydrophobicContact SD-CZ3 4.49Å; P90-W140 VanDerWaalsContact CD-CZ3 3.45Å; P90-W140 HydrophobicContact CG-CD2 3.53Å; P90-W140 HydrophobicContact CG-CE3 3.52Å; P90-W140 HydrophobicContact CG-CG 4.06Å; P90-W140 HydrophobicContact CG-CH2 4.26Å; P90-W140 HydrophobicContact CG-CZ2 4.26Å; P90-W140 HydrophobicContact CG-CZ3 3.94Å; F112-W140 AromaticContact CE2-CD1 3.36Å; F112-W140 AromaticContact CE2-CG 3.98Å; F112-W140 HydrophobicContact CE2-CG 3.98Å; F112-W140 AromaticContact CE2-NE1 3.57Å; F112-W140 AromaticContact CZ-CD1 3.83Å; F112-W140 AromaticContact CZ-NE1 3.96Å; W115-W140 AromaticContact CH2-CZ2 3.76Å; W115-W140 HydrophobicContact CH2-CZ2 3.76Å; W115-W140 HydrophobicContact CZ2-CZ2 4.2Å; E134-W140 PolarHBondContact O-NE1 3.04Å; L137-W140 HydrophobicContact CD1-CB 4.41Å; L137-W140 WeakPolarHBondContact O-CB 3.42Å; L137-W140 PolarHBondContact O-N 2.64Å; L137-W140 VanDerWaalsContact O-N 3.14Å; W140-Q142 VanDerWaalsContact C-N 3.26Å; W140-Q142 PolarHBondContact O-N 2.89Å; W140-L143 HydrophobicContact CE3-CD2 4.06Å; W140-L143 HydrophobicContact CZ3-CD2 3.97Å; W140-L143 WeakPolarHBondContact O-CB 3.35Å; W140-L143 PolarHBondContact O-N 3.18Å; W140-W144 HydrophobicContact CB-CZ2 4.44Å; W140-W144 PolarHBondContact O-N 3.36Å; W140-L343 HydrophobicContact CD2-CD1 4.39Å; W140-L343 HydrophobicContact CD2-CD2 3.69Å; W140-L343 HydrophobicContact CE3-CD2 3.39Å; W140-L343 HydrophobicContact CH2-CD2 3.45Å; W140-L343 VanDerWaalsContact CH2-CD2 3.45Å; W140-L343 HydrophobicContact CH2-CG 4.42Å; W140-L343 HydrophobicContact CZ2-CD2 3.75Å; W140-L343 HydrophobicContact CZ2-CG 4.39Å; W140-L343 HydrophobicContact CZ3-CD2 3.21Å; W140-F345 AromaticContact CH2-CD1 3.65Å; W140-F345 HydrophobicContact CH2-CD1 3.65Å; W140-F345 HydrophobicContact CH2-CE1 4.01Å; W140-F345 HydrophobicContact CH2-CG 4.43Å; W140-F345 AromaticContact CZ3-CD1 3.97Å; W140-F345 HydrophobicContact CZ3-CD1 3.97Å; W140-F345 AromaticContact CZ3-CE1 3.85Å; W140-F345 HydrophobicContact CZ3-CE1 3.85Å
141	R	94.5	Very high	93	Very high	29 Å²	29	27 Å²	27	11%	0.109	12%	0.121	C	C	.	.	H	α-helix	trans	-57.4	-36.9	171.8	-72	174.1	172.1	135.6	1.1	112.6	S105 E108 L137 D138 I139 W144 R145	S105-R141 PolarHBondContact O-NH2 2.96Å; E108-R141 IonicContact OE2-CZ 2.8Å; E108-R141 IonicContact OE2-NE 2.72Å; E108-R141 PolarHBondContact OE2-NE 3.06Å; E108-R141 IonicContact OE2-NH2 2.83Å; E108-R141 PolarHBondContact OE2-NH2 3.09Å; L137-R141 HydrophobicContact CD1-CG 4.46Å; L137-R141 HydrophobicContact CG-CG 4.44Å; L137-R141 WeakPolarHBondContact O-CG 3.16Å; L137-R141 PolarHBondContact O-N 3.31Å; D138-R141 IonicContact OD1-CZ 2.75Å; D138-R141 IonicContact OD1-NH1 2.82Å; D138-R141 PolarHBondContact OD1-NH1 3.19Å; I139-R141 VanDerWaalsContact C-N 3.3Å; I139-R141 PolarHBondContact O-N 2.91Å; R141-W144 HydrophobicContact CB-CE3 4.41Å; R141-W144 HydrophobicContact CG-CE3 4.01Å; R141-W144 HydrophobicContact CG-CZ3 3.92Å; R141-R145 WeakPolarHBondContact O-CD 3.39Å; R141-R145 WeakPolarHBondContact O-CG 3.02Å; R141-R145 PolarHBondContact O-N 3.23Å; R141-R145 VanDerWaalsContact O-N 3.14Å
142	Q	94.5	Very high	93.6	Very high	13 Å²	13	26.7 Å²	26.7	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-66.4	-41.3	175.1	-56	-50.7	-55.4	0	0	111.5	D138 I139 W140 R145 V146 L326 P341	D138-Q142 WeakPolarHBondContact O-CG 3.46Å; D138-Q142 PolarHBondContact O-N 2.92Å; D138-Q142 PolarHBondContact O-NE2 3.14Å; I139-Q142 WeakPolarHBondContact O-CB 3.34Å; I139-Q142 PolarHBondContact O-N 3.42Å; W140-Q142 VanDerWaalsContact C-N 3.26Å; W140-Q142 PolarHBondContact O-N 2.89Å; Q142-R145 PolarHBondContact O-N 3.46Å; Q142-V146 PolarHBondContact O-N 3.02Å; Q142-V146 VanDerWaalsContact O-N 3.07Å; Q142-L326 VanDerWaalsContact OE1-CB 3.3Å; Q142-P341 HydrophobicContact CB-CG 4.17Å; Q142-P341 HydrophobicContact CG-CG 4.01Å
143	L	95.4	Very high	94.1	Very high	8 Å²	8	25.7 Å²	25.7	4%	0.042	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-48.2	177.1	178.2	61.5	0	0	0	111.3	M89 I139 W140 R145 V146 M147 L170 V294 L343 F345	M89-L143 HydrophobicContact CE-CD2 3.53Å; M89-L143 HydrophobicContact CE-CG 4.32Å; M89-L143 HydrophobicContact SD-CD2 4.29Å; I139-L143 PolarHBondContact O-N 3.23Å; W140-L143 HydrophobicContact CE3-CD2 4.06Å; W140-L143 HydrophobicContact CZ3-CD2 3.97Å; W140-L143 WeakPolarHBondContact O-CB 3.35Å; W140-L143 PolarHBondContact O-N 3.18Å; L143-R145 VanDerWaalsContact C-N 3.31Å; L143-R145 PolarHBondContact O-N 2.94Å; L143-V146 PolarHBondContact O-N 3.4Å; L143-V146 VanDerWaalsContact O-N 3.13Å; L143-M147 HydrophobicContact CD1-CG 4.36Å; L143-M147 HydrophobicContact CG-CE 4.26Å; L143-M147 HydrophobicContact CG-SD 4.47Å; L143-M147 WeakPolarHBondContact O-CG 3.16Å; L143-M147 PolarHBondContact O-N 2.93Å; L143-L170 HydrophobicContact CD1-CD1 4.22Å; L143-L170 HydrophobicContact CD2-CD1 4.32Å; L143-V294 HydrophobicContact CD1-CB 4.12Å; L143-V294 HydrophobicContact CD1-CG1 3.63Å; L143-L343 HydrophobicContact CD2-CD2 3.64Å; L143-F345 HydrophobicContact CD2-CE1 3.81Å; L143-F345 HydrophobicContact CD2-CZ 3.86Å
144	W	95.8	Very high	94.5	Very high	6 Å²	6	24.8 Å²	24.8	2%	0.023	11%	0.109	C	C	.	.	H	α-helix	trans	-56.5	-45.3	176.7	-61.6	-31.8	0	0	0	112.1	P90 R92 E108 L137 W140 R141 V146 M147 E148	P90-W144 HydrophobicContact CB-CZ2 4.16Å; P90-W144 HydrophobicContact CG-CZ2 4.3Å; P90-W144 PolarHBondContact O-NE1 3.22Å; R92-W144 HydrophobicContact CB-CB 4.35Å; R92-W144 HydrophobicContact CB-CD2 3.62Å; R92-W144 HydrophobicContact CB-CE3 3.91Å; R92-W144 HydrophobicContact CB-CG 3.83Å; R92-W144 HydrophobicContact CB-CZ2 4.39Å; R92-W144 HydrophobicContact CB-CZ3 4.42Å; R92-W144 HydrophobicContact CG-CD2 3.84Å; R92-W144 HydrophobicContact CG-CE3 3.57Å; R92-W144 HydrophobicContact CG-CG 4.29Å; R92-W144 HydrophobicContact CG-CZ3 3.99Å; E108-W144 HydrophobicContact CB-CZ3 4.22Å; E108-W144 HydrophobicContact CG-CZ3 3.98Å; L137-W144 HydrophobicContact CD1-CH2 3.65Å; L137-W144 HydrophobicContact CD1-CZ3 3.94Å; W140-W144 HydrophobicContact CB-CZ2 4.44Å; W140-W144 PolarHBondContact O-N 3.36Å; R141-W144 HydrophobicContact CB-CE3 4.41Å; R141-W144 HydrophobicContact CG-CE3 4.01Å; R141-W144 HydrophobicContact CG-CZ3 3.92Å; W144-V146 VanDerWaalsContact C-N 3.31Å; W144-V146 PolarHBondContact O-N 3.3Å; W144-M147 PolarHBondContact O-N 3Å; W144-E148 WeakPolarHBondContact O-CB 3.47Å; W144-E148 VanDerWaalsContact O-CG 3.3Å; W144-E148 WeakPolarHBondContact O-CG 3.26Å; W144-E148 PolarHBondContact O-N 2.9Å
145	R	95.1	Very high	94.8	Very high	98 Å²	98	24.8 Å²	24.8	37%	0.37	11%	0.109	S	C	.	.	H	α-helix	trans	-62.2	-35.8	177.8	-70	166.4	-175.6	-171.9	1	113	R141 Q142 L143 R149 L326	R141-R145 WeakPolarHBondContact O-CD 3.39Å; R141-R145 WeakPolarHBondContact O-CG 3.02Å; R141-R145 PolarHBondContact O-N 3.23Å; R141-R145 VanDerWaalsContact O-N 3.14Å; Q142-R145 PolarHBondContact O-N 3.46Å; L143-R145 VanDerWaalsContact C-N 3.31Å; L143-R145 PolarHBondContact O-N 2.94Å; R145-R149 WeakPolarHBondContact O-CB 3.43Å; R145-R149 WeakPolarHBondContact O-CD 3.43Å; R145-R149 WeakPolarHBondContact O-CG 3.42Å; R145-R149 PolarHBondContact O-N 3.42Å; R145-L326 HydrophobicContact CB-CD2 3.98Å
146	V	95.8	Very high	95.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.4	-52.9	173.8	172.7	0	0	0	0	110	Q142 L143 W144 E148 R149 S150 G292 V294 L326 A340	Q142-V146 PolarHBondContact O-N 3.02Å; Q142-V146 VanDerWaalsContact O-N 3.07Å; L143-V146 PolarHBondContact O-N 3.4Å; L143-V146 VanDerWaalsContact O-N 3.13Å; W144-V146 VanDerWaalsContact C-N 3.31Å; W144-V146 PolarHBondContact O-N 3.3Å; V146-E148 VanDerWaalsContact C-N 3.28Å; V146-E148 PolarHBondContact O-N 2.92Å; V146-R149 PolarHBondContact O-N 2.86Å; V146-S150 WeakPolarHBondContact O-CB 3.09Å; V146-S150 PolarHBondContact O-N 3.4Å; V146-S150 PolarHBondContact O-OG 3.06Å; V146-G292 VanDerWaalsContact CG1-CA 3.49Å; V146-V294 HydrophobicContact CB-CG1 4.3Å; V146-V294 HydrophobicContact CG1-CG1 3.66Å; V146-L326 HydrophobicContact CG2-CD1 3.33Å; V146-A340 HydrophobicContact CB-CB 4.47Å; V146-A340 HydrophobicContact CG2-CB 3.48Å; V146-A340 VanDerWaalsContact CG2-CB 3.48Å
147	M	95.8	Very high	95.5	Very high	10 Å²	10	22 Å²	22	5%	0.049	10%	0.095	C	C	.	.	H	α-helix	trans	-59.4	-38.9	-177.7	-65.7	-170	-59.2	0	0	112.2	M89 L143 W144 S150 L170 V174 L177 K181	M89-M147 HydrophobicContact CE-CE 3.79Å; M89-M147 HydrophobicContact CE-SD 4.48Å; L143-M147 HydrophobicContact CD1-CG 4.36Å; L143-M147 HydrophobicContact CG-CE 4.26Å; L143-M147 HydrophobicContact CG-SD 4.47Å; L143-M147 WeakPolarHBondContact O-CG 3.16Å; L143-M147 PolarHBondContact O-N 2.93Å; W144-M147 PolarHBondContact O-N 3Å; M147-S150 PolarHBondContact O-OG 3.49Å; M147-L170 HydrophobicContact SD-CD1 3.59Å; M147-L170 VanDerWaalsContact SD-CD1 3.59Å; M147-V174 HydrophobicContact CB-CG2 4.5Å; M147-V174 HydrophobicContact CG-CG2 4.05Å; M147-V174 HydrophobicContact SD-CG2 3.73Å; M147-L177 HydrophobicContact CB-CD2 4.21Å; M147-K181 PolarHBondContact O-NZ 3.34Å
148	E	94.5	Very high	95.7	Very high	63 Å²	63	21.9 Å²	21.9	29%	0.294	9%	0.094	S	C	.	.	H	α-helix	trans	-64.9	-45.5	176.6	-74.6	167.6	-171.2	0	0	112.9	R92 W144 V146 L177 K181	R92-E148 WeakPolarHBondContact CD-OE1 3.42Å; R92-E148 IonicContact CZ-OE1 2.72Å; R92-E148 IonicContact NE-OE1 2.83Å; R92-E148 IonicContact NH1-OE1 3.26Å; R92-E148 PolarHBondContact NH1-OE1 3.03Å; R92-E148 IonicContact NH1-OE2 3.99Å; R92-E148 PolarHBondContact NH1-OE2 3.06Å; W144-E148 WeakPolarHBondContact O-CB 3.47Å; W144-E148 VanDerWaalsContact O-CG 3.3Å; W144-E148 WeakPolarHBondContact O-CG 3.26Å; W144-E148 PolarHBondContact O-N 2.9Å; V146-E148 VanDerWaalsContact C-N 3.28Å; V146-E148 PolarHBondContact O-N 2.92Å; E148-L177 HydrophobicContact CB-CD2 4.33Å; E148-L177 HydrophobicContact CG-CD1 4.38Å; E148-L177 HydrophobicContact CG-CD2 3.79Å; E148-K181 PolarHBondContact O-NZ 3.2Å
149	R	94.7	Very high	95.9	Very high	135 Å²	135	19 Å²	19	51%	0.509	8%	0.079	S	C	.	.	H	α-helix	trans	-77.5	-27.7	-174.5	-70.6	175.4	176.3	-156.8	-2.5	113.7	R145 V146 V290	R145-R149 WeakPolarHBondContact O-CB 3.43Å; R145-R149 WeakPolarHBondContact O-CD 3.43Å; R145-R149 WeakPolarHBondContact O-CG 3.42Å; R145-R149 PolarHBondContact O-N 3.42Å; V146-R149 PolarHBondContact O-N 2.86Å; R149-V290 HydrophobicContact CB-CG1 4.5Å; R149-V290 WeakPolarHBondContact O-CB 3.4Å; R149-V290 WeakPolarHBondContact O-CG1 3.41Å
150	S	96.9	Very high	96	Very high	0 Å²	0	19 Å²	19	0%	0	8%	0.078	C	C	.	.			trans	-82.3	137	-172.3	58.1	0	0	0	0	113.5	V146 M147 I152 V153 K181 V290	V146-S150 WeakPolarHBondContact O-CB 3.09Å; V146-S150 PolarHBondContact O-N 3.4Å; V146-S150 PolarHBondContact O-OG 3.06Å; M147-S150 PolarHBondContact O-OG 3.49Å; S150-I152 WeakPolarHBondContact CB-O 3.26Å; S150-V153 WeakPolarHBondContact OG-CG2 3.25Å; S150-K181 PolarHBondContact O-NZ 3.09Å; S150-V290 CarbonylContact C-O 3.5Å; S150-V290 WeakPolarHBondContact CA-O 3.42Å
151	D	97.4	Very high	96	Very high	22 Å²	22	19.8 Å²	19.8	12%	0.118	8%	0.082	C	C	.	.	S	Bend	trans	-82.5	-30.2	168	-56.3	-57.6	0	0	0	111.2	K181 V182 R279 L282 I289 V290	D151-K181 WeakPolarHBondContact O-CA 3.46Å; D151-V182 PolarHBondContact O-N 2.8Å; D151-R279 PolarHBondContact O-NH1 3.47Å; D151-L282 HydrophobicContact CB-CD1 3.88Å; D151-I289 HydrophobicContact CB-CG2 4.25Å; D151-V290 PolarHBondContact N-O 2.91Å; D151-V290 PolarHBondContact OD2-N 3.15Å
152	I	97.8	Very high	96.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.3	173.4	-54.8	169.6	0	0	0	108.9	S150 V154 V182 F184 L275 L278 R279 I289 V290 I291 G292	S150-I152 WeakPolarHBondContact CB-O 3.26Å; I152-V154 HydrophobicContact CG2-CG2 4.16Å; I152-V182 CarbonylContact C-O 3.28Å; I152-V182 WeakPolarHBondContact CA-O 3.15Å; I152-V182 HydrophobicContact CG1-CB 4.38Å; I152-V182 HydrophobicContact CG2-CB 4.37Å; I152-F184 HydrophobicContact CG2-CB 4.35Å; I152-L275 HydrophobicContact CD1-CB 4.31Å; I152-L275 WeakPolarHBondContact CD1-O 3.34Å; I152-L275 HydrophobicContact CG2-CD2 4.22Å; I152-L278 HydrophobicContact CD1-CB 4.23Å; I152-R279 HydrophobicContact CD1-CB 4.15Å; I152-R279 HydrophobicContact CD1-CG 3.71Å; I152-R279 HydrophobicContact CG1-CB 4.37Å; I152-R279 HydrophobicContact CG1-CG 3.45Å; I152-R279 VanDerWaalsContact CG1-CG 3.45Å; I152-I289 HydrophobicContact CD1-CG2 4.06Å; I152-I289 HydrophobicContact CG1-CG2 4.45Å; I152-V290 PolarHBondContact N-O 2.98Å; I152-I291 HydrophobicContact CD1-CG1 4.47Å; I152-I291 CarbonylContact O-C 3.52Å; I152-I291 WeakPolarHBondContact O-CA 3.48Å; I152-G292 PolarHBondContact O-N 3.09Å
153	V	97.9	Very high	96	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	109.1	173.1	179.2	0	0	0	0	108.7	S150 V174 V182 V183 F184 G292 V294	S150-V153 WeakPolarHBondContact OG-CG2 3.25Å; V153-V174 HydrophobicContact CB-CG1 4.39Å; V153-V174 HydrophobicContact CB-CG2 4.21Å; V153-V174 HydrophobicContact CG1-CG2 4.19Å; V153-V174 HydrophobicContact CG2-CG1 3.85Å; V153-V174 HydrophobicContact CG2-CG2 3.81Å; V153-V182 PolarHBondContact N-O 3.33Å; V153-V183 WeakPolarHBondContact O-CA 3.33Å; V153-F184 PolarHBondContact O-N 2.86Å; V153-G292 CarbonylContact C-O 3.56Å; V153-V294 HydrophobicContact CG1-CG1 4.34Å; V153-V294 HydrophobicContact CG1-CG2 3.44Å; V153-V294 VanDerWaalsContact CG1-CG2 3.44Å
154	V	97.9	Very high	95.9	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	108.7	174.5	179.9	0	0	0	0	108.6	I152 L156 F184 L186 L275 I291 G292 M293 V294	I152-V154 HydrophobicContact CG2-CG2 4.16Å; V154-L156 HydrophobicContact CG1-CD1 3.91Å; V154-F184 CarbonylContact C-O 3.47Å; V154-F184 VanDerWaalsContact CA-O 3.29Å; V154-F184 WeakPolarHBondContact CA-O 3.32Å; V154-F184 HydrophobicContact CG1-CD1 4.35Å; V154-F184 HydrophobicContact CG2-CB 4.34Å; V154-L186 HydrophobicContact CG1-CB 3.58Å; V154-L186 HydrophobicContact CG1-CD2 4.13Å; V154-L186 HydrophobicContact CG1-CG 4.47Å; V154-L275 HydrophobicContact CG2-CD1 4.2Å; V154-L275 HydrophobicContact CG2-CD2 4Å; V154-I291 HydrophobicContact CB-CG2 4.43Å; V154-I291 HydrophobicContact CG2-CG2 3.5Å; V154-I291 VanDerWaalsContact CG2-CG2 3.5Å; V154-G292 PolarHBondContact N-O 3.32Å; V154-M293 HydrophobicContact CB-SD 3.79Å; V154-M293 HydrophobicContact CG1-CE 4.36Å; V154-M293 HydrophobicContact CG1-SD 4.11Å; V154-M293 HydrophobicContact CG2-SD 4.23Å; V154-V294 PolarHBondContact O-N 3.17Å
155	Q	97.5	Very high	95.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.3	172.1	-176.5	173	51.7	0	0	109.3	V157 V167 L170 F184 L185 L186 V294	Q155-V157 HydrophobicContact CG-CG1 4.23Å; Q155-V167 VanDerWaalsContact NE2-N 3.13Å; Q155-L170 HydrophobicContact CB-CD2 4.26Å; Q155-L170 HydrophobicContact CG-CD2 4.12Å; Q155-F184 PolarHBondContact N-O 3Å; Q155-L185 HydrophobicContact CB-CD2 4.06Å; Q155-L185 HydrophobicContact CG-CD2 4.43Å; Q155-L186 PolarHBondContact O-N 3.25Å; Q155-V294 WeakPolarHBondContact CA-O 3.48Å; Q155-V294 HydrophobicContact CB-CG2 4.18Å
156	L	97.3	Very high	95.8	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.8	176.3	-77.1	85.8	0	0	0	110.1	V154 L186 M293 V294 V299 K301 T304	V154-L156 HydrophobicContact CG1-CD1 3.91Å; L156-L186 WeakPolarHBondContact CA-O 3.15Å; L156-L186 HydrophobicContact CD2-CD2 4.34Å; L156-L186 HydrophobicContact CG-CB 4.27Å; L156-L186 HydrophobicContact CG-CD2 4.2Å; L156-M293 HydrophobicContact CD1-CB 4.26Å; L156-M293 HydrophobicContact CD1-CE 3.55Å; L156-M293 HydrophobicContact CD1-SD 4.24Å; L156-M293 HydrophobicContact CD2-CE 4.38Å; L156-M293 HydrophobicContact CG-CE 4.45Å; L156-V294 PolarHBondContact N-O 3.4Å; L156-V299 HydrophobicContact CB-CB 4.27Å; L156-V299 HydrophobicContact CB-CG2 3.65Å; L156-K301 HydrophobicContact CD1-CG 4.26Å; L156-K301 VanDerWaalsContact CD2-CA 3.48Å; L156-K301 HydrophobicContact CD2-CB 3.98Å; L156-K301 HydrophobicContact CD2-CG 4.44Å; L156-T304 HydrophobicContact CD2-CG2 4.43Å
157	V	96.9	Very high	95.6	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.006	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.9	176.7	-59.7	0	0	0	0	109.4	Q155 P162 F165 R166 L186 L187 S188	Q155-V157 HydrophobicContact CG-CG1 4.23Å; V157-P162 HydrophobicContact CG2-CB 4.08Å; V157-F165 HydrophobicContact CB-CB 3.73Å; V157-F165 HydrophobicContact CG1-CB 3.81Å; V157-R166 HydrophobicContact CG1-CB 4.4Å; V157-L186 PolarHBondContact N-O 2.79Å; V157-L187 HydrophobicContact CG2-CB 4.41Å; V157-L187 HydrophobicContact CG2-CD1 4.23Å; V157-L187 HydrophobicContact CG2-CG 3.78Å; V157-L187 CarbonylContact O-C 3.48Å; V157-S188 PolarHBondContact O-N 3.33Å; V157-S188 PolarHBondContact O-OG 2.85Å
158	D	95.7	Very high	95.4	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	124.1	173.2	-164.1	-44.4	0	0	0	108.9	R160 N161 P162 F165 K189	D158-R160 PolarHBondContact O-N 3.11Å; D158-R160 VanDerWaalsContact O-N 3.08Å; D158-R160 WeakPolarHBondContact OD1-CB 3.39Å; D158-R160 WeakPolarHBondContact OD1-CG 3.31Å; D158-R160 IonicContact OD1-CZ 3.55Å; D158-R160 PolarHBondContact OD1-N 3.41Å; D158-R160 IonicContact OD1-NE 3.62Å; D158-R160 PolarHBondContact OD1-NE 2.64Å; D158-R160 IonicContact OD1-NH2 3.56Å; D158-R160 IonicContact OD2-CZ 2.55Å; D158-R160 IonicContact OD2-NE 3.5Å; D158-R160 PolarHBondContact OD2-NE 3.39Å; D158-R160 IonicContact OD2-NH2 2.79Å; D158-R160 PolarHBondContact OD2-NH2 3.3Å; D158-N161 CarbonylContact O-C 3.53Å; D158-N161 VanDerWaalsContact O-C 3.28Å; D158-N161 PolarHBondContact O-N 3.06Å; D158-P162 WeakPolarHBondContact O-CA 3.35Å; D158-P162 VanDerWaalsContact O-N 3.15Å; D158-F165 HydrophobicContact CB-CD2 3.46Å; D158-F165 VanDerWaalsContact CB-CD2 3.46Å; D158-F165 HydrophobicContact CB-CE1 4.32Å; D158-F165 HydrophobicContact CB-CE2 3.17Å; D158-F165 HydrophobicContact CB-CG 4.19Å; D158-F165 HydrophobicContact CB-CZ 3.61Å; D158-K189 WeakPolarHBondContact OD2-CD 3.49Å; D158-K189 WeakPolarHBondContact OD2-CE 3.35Å; D158-K189 IonicContact OD2-NZ 3.34Å; D158-K189 PolarHBondContact OD2-NZ 2.91Å
159	A	96.1	Very high	95.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.4	-175.7	0	0	0	0	0	113.3	N161 P162 L187 S188 A190 L193	A159-N161 VanDerWaalsContact C-N 3.34Å; A159-N161 PolarHBondContact O-N 3.49Å; A159-P162 WeakPolarHBondContact O-CD 3.44Å; A159-L187 HydrophobicContact CB-CB 4.11Å; A159-S188 WeakPolarHBondContact CB-O 3.12Å; A159-S188 PolarHBondContact N-O 3.49Å; A159-A190 HydrophobicContact CB-CB 4.26Å; A159-L193 HydrophobicContact CB-CD1 3.68Å; A159-L193 HydrophobicContact CB-CD2 4.3Å; A159-L193 WeakPolarHBondContact O-CD2 3.13Å
160	R	94.2	Very high	95.3	Very high	11 Å²	11	11.3 Å²	11.3	4%	0.042	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-28.4	-178.1	-62.6	177.1	-69	162.2	6.4	113.6	D158 L192 L193 C440 Y447 C448 V449	D158-R160 PolarHBondContact O-N 3.11Å; D158-R160 VanDerWaalsContact O-N 3.08Å; D158-R160 WeakPolarHBondContact OD1-CB 3.39Å; D158-R160 WeakPolarHBondContact OD1-CG 3.31Å; D158-R160 IonicContact OD1-CZ 3.55Å; D158-R160 PolarHBondContact OD1-N 3.41Å; D158-R160 IonicContact OD1-NE 3.62Å; D158-R160 PolarHBondContact OD1-NE 2.64Å; D158-R160 IonicContact OD1-NH2 3.56Å; D158-R160 IonicContact OD2-CZ 2.55Å; D158-R160 IonicContact OD2-NE 3.5Å; D158-R160 PolarHBondContact OD2-NE 3.39Å; D158-R160 IonicContact OD2-NH2 2.79Å; D158-R160 PolarHBondContact OD2-NH2 3.3Å; R160-L192 HydrophobicContact CG-CB 4.13Å; R160-L192 HydrophobicContact CG-CD1 4.28Å; R160-L193 HydrophobicContact CG-CD1 3.88Å; R160-C440 PolarHBondContact NH1-O 2.91Å; R160-Y447 WeakPolarHBondContact CD-O 3.47Å; R160-C448 WeakPolarHBondContact O-CA 3.35Å; R160-V449 PolarHBondContact O-N 3.36Å
161	N	94.3	Very high	95.2	Very high	17 Å²	17	13.3 Å²	13.3	9%	0.091	7%	0.073	C	C	.	.	S	Bend	trans	-153.2	75.1	172.2	-177.1	-10.8	0	0	0	108.1	D158 A159 L163 I164 F165 V449	D158-N161 CarbonylContact O-C 3.53Å; D158-N161 VanDerWaalsContact O-C 3.28Å; D158-N161 PolarHBondContact O-N 3.06Å; A159-N161 VanDerWaalsContact C-N 3.34Å; A159-N161 PolarHBondContact O-N 3.49Å; N161-L163 PolarHBondContact O-N 3.24Å; N161-L163 VanDerWaalsContact O-N 3.15Å; N161-I164 HydrophobicContact CB-CG2 4.02Å; N161-I164 VanDerWaalsContact O-CG2 3.29Å; N161-I164 WeakPolarHBondContact O-CG2 3.46Å; N161-I164 PolarHBondContact O-N 2.99Å; N161-I164 PolarHBondContact OD1-N 2.99Å; N161-F165 VanDerWaalsContact O-CD2 3.32Å; N161-F165 WeakPolarHBondContact O-CD2 3.39Å; N161-V449 HydrophobicContact CB-CB 3.99Å; N161-V449 HydrophobicContact CB-CG2 4.01Å
162	P	95.7	Very high	95	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-57.2	-34.1	-173.7	-29.3	38.8	0	0	0	113.8	V157 D158 A159 I164 F165 R166 L187 W201 F205	V157-P162 HydrophobicContact CG2-CB 4.08Å; D158-P162 WeakPolarHBondContact O-CA 3.35Å; D158-P162 VanDerWaalsContact O-N 3.15Å; A159-P162 WeakPolarHBondContact O-CD 3.44Å; P162-I164 PolarHBondContact O-N 3.47Å; P162-F165 PolarHBondContact O-N 3.34Å; P162-R166 PolarHBondContact O-N 3.17Å; P162-L187 HydrophobicContact CB-CD2 4.38Å; P162-L187 HydrophobicContact CG-CD2 3.8Å; P162-L187 HydrophobicContact CG-CG 4.47Å; P162-W201 HydrophobicContact CB-CE3 4.49Å; P162-W201 HydrophobicContact CB-CZ3 4.32Å; P162-W201 HydrophobicContact CG-CD2 3.91Å; P162-W201 HydrophobicContact CG-CE3 3.98Å; P162-W201 HydrophobicContact CG-CH2 4.26Å; P162-W201 HydrophobicContact CG-CZ2 4.21Å; P162-W201 HydrophobicContact CG-CZ3 4.15Å; P162-F205 HydrophobicContact CB-CE2 4.05Å; P162-F205 HydrophobicContact CB-CZ 3.64Å; P162-F205 HydrophobicContact CG-CE2 4.16Å; P162-F205 HydrophobicContact CG-CZ 4.24Å
163	L	93.5	Very high	94.9	Very high	41 Å²	41	16 Å²	16	22%	0.215	9%	0.09	C	C	.	.	H	α-helix	trans	-68.8	-31.3	-174.6	-64.9	-178.7	0	0	0	113.2	N161 F165 R166 W201 Y204 P452	N161-L163 PolarHBondContact O-N 3.24Å; N161-L163 VanDerWaalsContact O-N 3.15Å; L163-F165 PolarHBondContact O-N 3.5Å; L163-R166 PolarHBondContact O-N 3.48Å; L163-W201 HydrophobicContact CD1-CH2 4.1Å; L163-W201 HydrophobicContact CD1-CZ3 4.34Å; L163-W201 HydrophobicContact CG-CH2 3.9Å; L163-W201 HydrophobicContact CG-CZ3 4.01Å; L163-Y204 HydrophobicContact CD2-CE1 4.07Å; L163-P452 HydrophobicContact CD1-CG 3.66Å
164	I	92.3	Very high	94.8	Very high	5 Å²	5	16 Å²	16	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-67.5	-28.6	175.3	-160.2	175	0	0	0	112.7	N161 P162 F350 H354 M360	N161-I164 HydrophobicContact CB-CG2 4.02Å; N161-I164 VanDerWaalsContact O-CG2 3.29Å; N161-I164 WeakPolarHBondContact O-CG2 3.46Å; N161-I164 PolarHBondContact O-N 2.99Å; N161-I164 PolarHBondContact OD1-N 2.99Å; P162-I164 PolarHBondContact O-N 3.47Å; I164-F350 VanDerWaalsContact CA-CE2 3.41Å; I164-F350 VanDerWaalsContact CA-CZ 3.47Å; I164-F350 HydrophobicContact CB-CD2 4.33Å; I164-F350 HydrophobicContact CB-CE1 4.22Å; I164-F350 HydrophobicContact CB-CE2 3.88Å; I164-F350 HydrophobicContact CB-CZ 3.84Å; I164-F350 HydrophobicContact CD1-CB 4.28Å; I164-F350 HydrophobicContact CD1-CD1 4.31Å; I164-F350 HydrophobicContact CD1-CD2 4.33Å; I164-F350 HydrophobicContact CD1-CG 4.07Å; I164-F350 HydrophobicContact CG1-CB 4.39Å; I164-F350 HydrophobicContact CG1-CD1 4.13Å; I164-F350 HydrophobicContact CG1-CD2 3.56Å; I164-F350 HydrophobicContact CG1-CE1 4.24Å; I164-F350 HydrophobicContact CG1-CE2 3.61Å; I164-F350 HydrophobicContact CG1-CG 3.78Å; I164-F350 HydrophobicContact CG1-CZ 3.98Å; I164-H354 HydrophobicContact CD1-CB 3.45Å; I164-H354 VanDerWaalsContact CD1-CB 3.45Å; I164-M360 HydrophobicContact CB-CE 4.38Å; I164-M360 HydrophobicContact CD1-CE 4.43Å; I164-M360 HydrophobicContact CG1-CE 3.92Å; I164-M360 HydrophobicContact CG2-CE 3.89Å; I164-M360 WeakPolarHBondContact O-CE 3.5Å
165	F	94.8	Very high	94.7	Very high	3 Å²	3	20.5 Å²	20.5	1%	0.013	11%	0.11	C	C	.	.	H	α-helix	trans	-94.2	-12.5	-179.3	-67.2	-84.2	0	0	0	113.5	V157 D158 N161 P162 L163 Y296 V299 A358 M360	V157-F165 HydrophobicContact CB-CB 3.73Å; V157-F165 HydrophobicContact CG1-CB 3.81Å; D158-F165 HydrophobicContact CB-CD2 3.46Å; D158-F165 VanDerWaalsContact CB-CD2 3.46Å; D158-F165 HydrophobicContact CB-CE1 4.32Å; D158-F165 HydrophobicContact CB-CE2 3.17Å; D158-F165 HydrophobicContact CB-CG 4.19Å; D158-F165 HydrophobicContact CB-CZ 3.61Å; N161-F165 VanDerWaalsContact O-CD2 3.32Å; N161-F165 WeakPolarHBondContact O-CD2 3.39Å; P162-F165 PolarHBondContact O-N 3.34Å; L163-F165 PolarHBondContact O-N 3.5Å; F165-Y296 HydrophobicContact CB-CD2 4.23Å; F165-Y296 HydrophobicContact CD1-CD2 4.07Å; F165-Y296 HydrophobicContact CD1-CG 4.12Å; F165-Y296 VanDerWaalsContact O-CD2 3.28Å; F165-Y296 WeakPolarHBondContact O-CD2 3.44Å; F165-Y296 WeakPolarHBondContact O-CE2 3.46Å; F165-V299 HydrophobicContact CD1-CG1 3.19Å; F165-V299 HydrophobicContact CE1-CG1 3.39Å; F165-V299 HydrophobicContact CG-CG1 4.03Å; F165-V299 HydrophobicContact CZ-CG1 4.37Å; F165-A358 HydrophobicContact CE1-CB 4.39Å; F165-A358 HydrophobicContact CE2-CB 4.02Å; F165-A358 HydrophobicContact CZ-CB 3.57Å; F165-M360 HydrophobicContact CB-CE 4.48Å; F165-M360 HydrophobicContact CD1-CE 3.24Å; F165-M360 HydrophobicContact CD2-CE 4.15Å; F165-M360 HydrophobicContact CE1-CE 3.32Å; F165-M360 HydrophobicContact CE1-CG 3.9Å; F165-M360 HydrophobicContact CE2-CE 4.16Å; F165-M360 HydrophobicContact CG-CE 3.71Å; F165-M360 HydrophobicContact CZ-CE 3.82Å; F165-M360 HydrophobicContact CZ-CG 4.47Å
166	R	93.8	Very high	94.6	Very high	17 Å²	17	26 Å²	26	6%	0.064	14%	0.135	C	C	.	.			trans	-81.5	136.2	179.4	-172.3	173.6	-179.7	178.7	0.7	109.8	V157 P162 L163 E171 D210	V157-R166 HydrophobicContact CG1-CB 4.4Å; P162-R166 PolarHBondContact O-N 3.17Å; L163-R166 PolarHBondContact O-N 3.48Å; R166-E171 IonicContact CZ-OE1 3.64Å; R166-E171 IonicContact NE-OE1 3.43Å; R166-E171 PolarHBondContact NE-OE1 3.27Å; R166-E171 VanDerWaalsContact NH2-CD 3.35Å; R166-E171 IonicContact NH2-OE1 2.99Å; R166-E171 PolarHBondContact NH2-OE1 2.79Å; R166-E171 IonicContact NH2-OE2 2.8Å; R166-E171 PolarHBondContact NH2-OE2 2.73Å; R166-E171 VanDerWaalsContact NH2-OE2 3.12Å; R166-D210 IonicContact CZ-OD1 3.46Å; R166-D210 IonicContact CZ-OD2 3.8Å; R166-D210 VanDerWaalsContact NH1-CG 3.28Å; R166-D210 IonicContact NH1-OD1 3.3Å; R166-D210 PolarHBondContact NH1-OD1 2.57Å; R166-D210 IonicContact NH1-OD2 3.52Å; R166-D210 PolarHBondContact NH1-OD2 3.01Å; R166-D210 IonicContact NH2-OD1 3.69Å; R166-D210 PolarHBondContact NH2-OD1 3.43Å; R166-D210 IonicContact NH2-OD2 3.61Å
167	V	93	Very high	94.5	Very high	13 Å²	13	30 Å²	30	8%	0.079	16%	0.156	C	C	.	.			trans	-118.5	96.4	177	-174.1	0	0	0	0	107.7	Q155 D169 L170 Y296 F345	Q155-V167 VanDerWaalsContact NE2-N 3.13Å; V167-D169 PolarHBondContact O-N 3.45Å; V167-L170 HydrophobicContact CB-CB 3.9Å; V167-L170 HydrophobicContact CG1-CB 3.98Å; V167-L170 WeakPolarHBondContact O-CB 3.26Å; V167-L170 PolarHBondContact O-N 2.97Å; V167-Y296 HydrophobicContact CG2-CE2 3.56Å; V167-F345 HydrophobicContact CG1-CD1 3.9Å; V167-F345 HydrophobicContact CG1-CE1 4.22Å; V167-F345 HydrophobicContact CG1-CG 4.22Å; V167-F345 HydrophobicContact CG2-CB 4.33Å; V167-F345 HydrophobicContact CG2-CD1 4.14Å; V167-F345 HydrophobicContact CG2-CD2 3.61Å; V167-F345 HydrophobicContact CG2-CE1 4.35Å; V167-F345 HydrophobicContact CG2-CE2 3.86Å; V167-F345 HydrophobicContact CG2-CG 3.78Å; V167-F345 HydrophobicContact CG2-CZ 4.22Å
168	P	91.4	Very high	94.4	Very high	84 Å²	84	31.8 Å²	31.8	55%	0.545	17%	0.169	S	C	.	.	H	α-helix	trans	-56.9	-38.3	-177.7	-27.1	35.2	0	0	0	112.9	L170 E171 V172	P168-L170 PolarHBondContact O-N 3.01Å; P168-E171 WeakPolarHBondContact O-CB 3.4Å; P168-E171 PolarHBondContact O-N 3.13Å; P168-E171 VanDerWaalsContact O-N 3.13Å; P168-V172 PolarHBondContact O-N 3.08Å
169	D	93.7	Very high	94.4	Very high	20 Å²	20	36.3 Å²	36.3	11%	0.107	20%	0.198	C	C	.	.	H	α-helix	trans	-69.3	-20.1	180	-170.9	56.3	0	0	0	113.6	R88 M89 R91 V167 E171 V172 A173	R88-D169 WeakPolarHBondContact CA-OD2 3.44Å; R88-D169 WeakPolarHBondContact CB-OD2 3.29Å; R88-D169 WeakPolarHBondContact CG-OD1 3.46Å; M89-D169 VanDerWaalsContact CG-OD2 3.25Å; M89-D169 WeakPolarHBondContact CG-OD2 3.47Å; M89-D169 PolarHBondContact N-OD2 3.36Å; R91-D169 IonicContact CZ-OD1 3.15Å; R91-D169 IonicContact CZ-OD2 3.12Å; R91-D169 IonicContact NH1-OD1 3.45Å; R91-D169 IonicContact NH1-OD2 2.78Å; R91-D169 PolarHBondContact NH1-OD2 3.34Å; R91-D169 IonicContact NH2-OD1 2.76Å; R91-D169 PolarHBondContact NH2-OD1 3.29Å; R91-D169 IonicContact NH2-OD2 3.19Å; R91-D169 PolarHBondContact NH2-OD2 2.55Å; V167-D169 PolarHBondContact O-N 3.45Å; D169-E171 VanDerWaalsContact C-N 3.32Å; D169-V172 PolarHBondContact O-N 3.49Å; D169-A173 WeakPolarHBondContact O-CB 3.32Å; D169-A173 PolarHBondContact O-N 2.89Å
170	L	94.2	Very high	94.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-41	171.1	-178.5	79.6	0	0	0	110.4	M89 L143 M147 Q155 V167 P168 V172 A173 V174 V294	M89-L170 HydrophobicContact SD-CB 4.41Å; M89-L170 HydrophobicContact SD-CD1 3.85Å; L143-L170 HydrophobicContact CD1-CD1 4.22Å; L143-L170 HydrophobicContact CD2-CD1 4.32Å; M147-L170 HydrophobicContact SD-CD1 3.59Å; M147-L170 VanDerWaalsContact SD-CD1 3.59Å; Q155-L170 HydrophobicContact CB-CD2 4.26Å; Q155-L170 HydrophobicContact CG-CD2 4.12Å; V167-L170 HydrophobicContact CB-CB 3.9Å; V167-L170 HydrophobicContact CG1-CB 3.98Å; V167-L170 WeakPolarHBondContact O-CB 3.26Å; V167-L170 PolarHBondContact O-N 2.97Å; P168-L170 PolarHBondContact O-N 3.01Å; L170-V172 VanDerWaalsContact C-N 3.32Å; L170-A173 PolarHBondContact O-N 3.35Å; L170-V174 VanDerWaalsContact O-CG2 3.27Å; L170-V174 WeakPolarHBondContact O-CG2 3.44Å; L170-V174 PolarHBondContact O-N 2.93Å; L170-V294 HydrophobicContact CD2-CG2 3.69Å
171	E	93.4	Very high	94.5	Very high	43 Å²	43	42 Å²	42	20%	0.201	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-43	-179.9	-42.9	-174.2	178.3	0	0	110.2	R166 P168 D169 V174 K175 V183	R166-E171 IonicContact CZ-OE1 3.64Å; R166-E171 IonicContact NE-OE1 3.43Å; R166-E171 PolarHBondContact NE-OE1 3.27Å; R166-E171 VanDerWaalsContact NH2-CD 3.35Å; R166-E171 IonicContact NH2-OE1 2.99Å; R166-E171 PolarHBondContact NH2-OE1 2.79Å; R166-E171 IonicContact NH2-OE2 2.8Å; R166-E171 PolarHBondContact NH2-OE2 2.73Å; R166-E171 VanDerWaalsContact NH2-OE2 3.12Å; P168-E171 WeakPolarHBondContact O-CB 3.4Å; P168-E171 PolarHBondContact O-N 3.13Å; P168-E171 VanDerWaalsContact O-N 3.13Å; D169-E171 VanDerWaalsContact C-N 3.32Å; E171-V174 PolarHBondContact O-N 3.23Å; E171-K175 WeakPolarHBondContact O-CG 3.27Å; E171-K175 PolarHBondContact O-N 2.86Å; E171-V183 HydrophobicContact CB-CG1 4.44Å; E171-V183 HydrophobicContact CB-CG2 4.43Å; E171-V183 HydrophobicContact CG-CG1 4.03Å
172	V	94.5	Very high	94.6	Very high	71 Å²	71	42.2 Å²	42.2	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-59.4	-50	173.2	-179.5	0	0	0	0	110.6	P168 D169 L170 V174 K175 E176	P168-V172 PolarHBondContact O-N 3.08Å; D169-V172 PolarHBondContact O-N 3.49Å; L170-V172 VanDerWaalsContact C-N 3.32Å; V172-V174 VanDerWaalsContact C-N 3.31Å; V172-V174 PolarHBondContact O-N 3.19Å; V172-K175 PolarHBondContact O-N 3.33Å; V172-E176 HydrophobicContact CG1-CG 4.24Å; V172-E176 WeakPolarHBondContact CG1-OE1 3.33Å; V172-E176 WeakPolarHBondContact O-CB 3.38Å; V172-E176 VanDerWaalsContact O-CG 3.32Å; V172-E176 WeakPolarHBondContact O-CG 3.43Å; V172-E176 PolarHBondContact O-N 2.84Å
173	A	95.1	Very high	94.6	Very high	7 Å²	7	43.2 Å²	43.2	6%	0.058	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-37.8	-180	0	0	0	0	0	113.1	M89 D169 L170 L177	M89-A173 HydrophobicContact SD-CB 4.24Å; D169-A173 WeakPolarHBondContact O-CB 3.32Å; D169-A173 PolarHBondContact O-N 2.89Å; L170-A173 PolarHBondContact O-N 3.35Å; A173-L177 PolarHBondContact O-N 3.07Å
174	V	96.1	Very high	94.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.6	-42.1	176.7	171.9	0	0	0	0	111.1	M147 V153 L170 E171 V172 L177 C178 K181 V183	M147-V174 HydrophobicContact CB-CG2 4.5Å; M147-V174 HydrophobicContact CG-CG2 4.05Å; M147-V174 HydrophobicContact SD-CG2 3.73Å; V153-V174 HydrophobicContact CB-CG1 4.39Å; V153-V174 HydrophobicContact CB-CG2 4.21Å; V153-V174 HydrophobicContact CG1-CG2 4.19Å; V153-V174 HydrophobicContact CG2-CG1 3.85Å; V153-V174 HydrophobicContact CG2-CG2 3.81Å; L170-V174 VanDerWaalsContact O-CG2 3.27Å; L170-V174 WeakPolarHBondContact O-CG2 3.44Å; L170-V174 PolarHBondContact O-N 2.93Å; E171-V174 PolarHBondContact O-N 3.23Å; V172-V174 VanDerWaalsContact C-N 3.31Å; V172-V174 PolarHBondContact O-N 3.19Å; V174-L177 PolarHBondContact O-N 3.23Å; V174-C178 PolarHBondContact O-N 3.17Å; V174-C178 VanDerWaalsContact O-N 3.16Å; V174-K181 HydrophobicContact CG1-CB 3.71Å; V174-K181 HydrophobicContact CG1-CD 4.09Å; V174-V183 HydrophobicContact CB-CG2 3.92Å; V174-V183 HydrophobicContact CG1-CG2 3.74Å; V174-V183 HydrophobicContact CG2-CG2 4.43Å
175	K	95.7	Very high	95.1	Very high	96 Å²	96	41.5 Å²	41.5	42%	0.417	23%	0.227	S	C	.	.	H	α-helix	trans	-70.3	-35.8	178.2	-70.6	-59	-165.7	179.7	0	113.2	E171 V172 L177 C178 P179 K181	E171-K175 WeakPolarHBondContact O-CG 3.27Å; E171-K175 PolarHBondContact O-N 2.86Å; V172-K175 PolarHBondContact O-N 3.33Å; K175-L177 VanDerWaalsContact C-N 3.28Å; K175-L177 PolarHBondContact O-N 3.01Å; K175-C178 CarbonylContact O-C 3.54Å; K175-C178 PolarHBondContact O-N 3.35Å; K175-P179 PolarHBondContact NZ-O 3.46Å; K175-K181 WeakPolarHBondContact CE-O 3.27Å; K175-K181 PolarHBondContact NZ-O 3.19Å
176	E	95.2	Very high	95.2	Very high	115 Å²	115	41.3 Å²	41.3	54%	0.537	23%	0.226	S	C	.	.	H	α-helix	trans	-60.9	-37.7	171.9	-75.6	172.1	167.8	0	0	111.7	R91 V172	R91-E176 IonicContact CZ-OE2 3.75Å; R91-E176 IonicContact NE-OE2 3.39Å; R91-E176 PolarHBondContact NE-OE2 3.37Å; R91-E176 IonicContact NH2-OE1 3.77Å; R91-E176 IonicContact NH2-OE2 3.76Å; R91-E176 PolarHBondContact NH2-OE2 2.95Å; V172-E176 HydrophobicContact CG1-CG 4.24Å; V172-E176 WeakPolarHBondContact CG1-OE1 3.33Å; V172-E176 WeakPolarHBondContact O-CB 3.38Å; V172-E176 VanDerWaalsContact O-CG 3.32Å; V172-E176 WeakPolarHBondContact O-CG 3.43Å; V172-E176 PolarHBondContact O-N 2.84Å
177	L	94.2	Very high	95.4	Very high	83 Å²	83	40.5 Å²	40.5	44%	0.435	22%	0.223	S	C	.	.	H	α-helix	trans	-71.3	-42.4	179.1	-176.4	60.9	0	0	0	112.6	M147 E148 A173 V174 K175	M147-L177 HydrophobicContact CB-CD2 4.21Å; E148-L177 HydrophobicContact CB-CD2 4.33Å; E148-L177 HydrophobicContact CG-CD1 4.38Å; E148-L177 HydrophobicContact CG-CD2 3.79Å; A173-L177 PolarHBondContact O-N 3.07Å; V174-L177 PolarHBondContact O-N 3.23Å; K175-L177 VanDerWaalsContact C-N 3.28Å; K175-L177 PolarHBondContact O-N 3.01Å
178	C	94.9	Very high	95.5	Very high	40 Å²	40	39.9 Å²	39.9	27%	0.27	22%	0.22	S	C	.	.			trans	-161.1	119.2	173.9	178.1	0	0	0	0	109.8	V174 K175 D180 K181	V174-C178 PolarHBondContact O-N 3.17Å; V174-C178 VanDerWaalsContact O-N 3.16Å; K175-C178 CarbonylContact O-C 3.54Å; K175-C178 PolarHBondContact O-N 3.35Å; C178-D180 PolarHBondContact O-N 3.19Å; C178-K181 HydrophobicContact CB-CD 3.72Å; C178-K181 VanDerWaalsContact CB-CE 3.47Å; C178-K181 HydrophobicContact CB-CG 3.82Å; C178-K181 WeakPolarHBondContact O-CB 3.34Å; C178-K181 PolarHBondContact O-N 3.29Å; C178-K181 VanDerWaalsContact O-N 3.15Å
179	P	95.7	Very high	95.6	Very high	95 Å²	95	37.7 Å²	37.7	62%	0.617	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.3	-178	-27.9	35.9	0	0	0	114.7	K175 K181	K175-P179 PolarHBondContact NZ-O 3.46Å; P179-K181 VanDerWaalsContact C-N 3.3Å; P179-K181 PolarHBondContact O-N 2.94Å
180	D	95.4	Very high	95.7	Very high	116 Å²	116	36.8 Å²	36.8	62%	0.62	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-14.6	-177.5	-56.9	-30.4	0	0	0	113.3	C178	C178-D180 PolarHBondContact O-N 3.19Å
181	K	96.7	Very high	95.6	Very high	16 Å²	16	39.4 Å²	39.4	7%	0.07	21%	0.211	C	C	.	.			trans	-65.9	137.9	176	-71.9	172.7	-171.7	-91.9	0	109.9	M147 E148 S150 D151 V174 K175 C178 P179	M147-K181 PolarHBondContact O-NZ 3.34Å; E148-K181 PolarHBondContact O-NZ 3.2Å; S150-K181 PolarHBondContact O-NZ 3.09Å; D151-K181 WeakPolarHBondContact O-CA 3.46Å; V174-K181 HydrophobicContact CG1-CB 3.71Å; V174-K181 HydrophobicContact CG1-CD 4.09Å; K175-K181 WeakPolarHBondContact CE-O 3.27Å; K175-K181 PolarHBondContact NZ-O 3.19Å; C178-K181 HydrophobicContact CB-CD 3.72Å; C178-K181 VanDerWaalsContact CB-CE 3.47Å; C178-K181 HydrophobicContact CB-CG 3.82Å; C178-K181 WeakPolarHBondContact O-CB 3.34Å; C178-K181 PolarHBondContact O-N 3.29Å; C178-K181 VanDerWaalsContact O-N 3.15Å; P179-K181 VanDerWaalsContact C-N 3.3Å; P179-K181 PolarHBondContact O-N 2.94Å
182	V	96.4	Very high	95.5	Very high	21 Å²	21	39.8 Å²	39.8	13%	0.127	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	137.1	178.3	179.3	0	0	0	0	109.6	D151 I152 V153 L211 L278 R279	D151-V182 PolarHBondContact O-N 2.8Å; I152-V182 CarbonylContact C-O 3.28Å; I152-V182 WeakPolarHBondContact CA-O 3.15Å; I152-V182 HydrophobicContact CG1-CB 4.38Å; I152-V182 HydrophobicContact CG2-CB 4.37Å; V153-V182 PolarHBondContact N-O 3.33Å; V182-L211 HydrophobicContact CG1-CD1 3.7Å; V182-L278 HydrophobicContact CG1-CB 4.49Å; V182-L278 HydrophobicContact CG1-CD1 4.05Å; V182-R279 HydrophobicContact CG2-CG 4.43Å
183	V	96.7	Very high	95.4	Very high	20 Å²	20	36.8 Å²	36.8	12%	0.121	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.6	170.8	-177	0	0	0	0	107.9	V153 E171 V174	V153-V183 WeakPolarHBondContact O-CA 3.33Å; E171-V183 HydrophobicContact CB-CG1 4.44Å; E171-V183 HydrophobicContact CB-CG2 4.43Å; E171-V183 HydrophobicContact CG-CG1 4.03Å; V174-V183 HydrophobicContact CB-CG2 3.92Å; V174-V183 HydrophobicContact CG1-CG2 3.74Å; V174-V183 HydrophobicContact CG2-CG2 4.43Å
184	F	97.4	Very high	95.3	Very high	5 Å²	5	38.7 Å²	38.7	2%	0.022	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.2	-175.7	-172.7	-87.2	0	0	0	110.4	I152 V153 V154 Q155 L186 L211 A213 L271 I274 L275 L278	I152-F184 HydrophobicContact CG2-CB 4.35Å; V153-F184 PolarHBondContact O-N 2.86Å; V154-F184 CarbonylContact C-O 3.47Å; V154-F184 VanDerWaalsContact CA-O 3.29Å; V154-F184 WeakPolarHBondContact CA-O 3.32Å; V154-F184 HydrophobicContact CG1-CD1 4.35Å; V154-F184 HydrophobicContact CG2-CB 4.34Å; Q155-F184 PolarHBondContact N-O 3Å; F184-L186 HydrophobicContact CE1-CD1 4.18Å; F184-L211 HydrophobicContact CD2-CB 3.93Å; F184-L211 HydrophobicContact CE2-CB 4.43Å; F184-A213 HydrophobicContact CE1-CB 4.01Å; F184-A213 HydrophobicContact CZ-CB 3.65Å; F184-L271 HydrophobicContact CE1-CD1 4.23Å; F184-I274 HydrophobicContact CE2-CG2 4.03Å; F184-I274 HydrophobicContact CZ-CG2 4.3Å; F184-L275 HydrophobicContact CB-CD2 4.36Å; F184-L275 HydrophobicContact CD1-CD2 4.05Å; F184-L275 HydrophobicContact CD2-CD2 4.24Å; F184-L275 HydrophobicContact CE1-CD2 4.43Å; F184-L275 HydrophobicContact CG-CD2 3.95Å; F184-L278 HydrophobicContact CD2-CD1 3.6Å; F184-L278 HydrophobicContact CE2-CD1 4.16Å; F184-L278 HydrophobicContact CG-CD1 4.4Å
185	L	97.8	Very high	95.1	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.026	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	117.2	178.2	-60.1	-178.9	0	0	0	110.6	Q155 L187 F205 D210 L211 F212 A213	Q155-L185 HydrophobicContact CB-CD2 4.06Å; Q155-L185 HydrophobicContact CG-CD2 4.43Å; L185-L187 HydrophobicContact CB-CD1 4.3Å; L185-F205 HydrophobicContact CD1-CD1 4.07Å; L185-F205 HydrophobicContact CD1-CE1 3.91Å; L185-D210 HydrophobicContact CD1-CB 4.21Å; L185-L211 PolarHBondContact N-O 2.83Å; L185-F212 HydrophobicContact CB-CB 3.95Å; L185-F212 CarbonylContact O-C 3.54Å; L185-F212 WeakPolarHBondContact O-CA 3.48Å; L185-A213 PolarHBondContact O-N 2.81Å
186	L	97.8	Very high	95	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	105.8	174.9	-170.6	68.9	0	0	0	109.8	V154 Q155 L156 V157 F184 S188 A213 W215 L271 M293 T304	V154-L186 HydrophobicContact CG1-CB 3.58Å; V154-L186 HydrophobicContact CG1-CD2 4.13Å; V154-L186 HydrophobicContact CG1-CG 4.47Å; Q155-L186 PolarHBondContact O-N 3.25Å; L156-L186 WeakPolarHBondContact CA-O 3.15Å; L156-L186 HydrophobicContact CD2-CD2 4.34Å; L156-L186 HydrophobicContact CG-CB 4.27Å; L156-L186 HydrophobicContact CG-CD2 4.2Å; V157-L186 PolarHBondContact N-O 2.79Å; F184-L186 HydrophobicContact CE1-CD1 4.18Å; L186-S188 PolarHBondContact O-N 2.54Å; L186-A213 HydrophobicContact CD1-CB 4.47Å; L186-W215 HydrophobicContact CD1-CB 3.62Å; L186-W215 HydrophobicContact CD1-CG 4.21Å; L186-W215 HydrophobicContact CD2-CB 4.32Å; L186-W215 HydrophobicContact CD2-CG 4.17Å; L186-W215 HydrophobicContact CG-CB 3.82Å; L186-W215 HydrophobicContact CG-CG 4.22Å; L186-L271 HydrophobicContact CD1-CD1 3.73Å; L186-L271 HydrophobicContact CD1-CD2 4.04Å; L186-L271 HydrophobicContact CD2-CD2 4Å; L186-M293 HydrophobicContact CD2-CE 4.49Å; L186-T304 HydrophobicContact CD2-CG2 3.85Å
187	L	97.7	Very high	95	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	89.2	-179.3	-73.6	81	0	0	0	109.7	V157 A159 P162 L185 F205 F212 A213 F214 W215	V157-L187 HydrophobicContact CG2-CB 4.41Å; V157-L187 HydrophobicContact CG2-CD1 4.23Å; V157-L187 HydrophobicContact CG2-CG 3.78Å; V157-L187 CarbonylContact O-C 3.48Å; A159-L187 HydrophobicContact CB-CB 4.11Å; P162-L187 HydrophobicContact CB-CD2 4.38Å; P162-L187 HydrophobicContact CG-CD2 3.8Å; P162-L187 HydrophobicContact CG-CG 4.47Å; L185-L187 HydrophobicContact CB-CD1 4.3Å; L187-F205 HydrophobicContact CD1-CE2 4.48Å; L187-F205 HydrophobicContact CD2-CD2 4.26Å; L187-F205 HydrophobicContact CD2-CE2 3.74Å; L187-F212 HydrophobicContact CD1-CB 3.79Å; L187-F212 HydrophobicContact CD1-CD2 4.14Å; L187-F212 HydrophobicContact CD1-CG 4.37Å; L187-A213 PolarHBondContact N-O 3.07Å; L187-F214 HydrophobicContact CB-CD1 3.8Å; L187-F214 HydrophobicContact CB-CE1 4.19Å; L187-F214 HydrophobicContact CD2-CD1 3.95Å; L187-F214 HydrophobicContact CD2-CE1 3.43Å; L187-F214 VanDerWaalsContact CD2-CE1 3.43Å; L187-F214 HydrophobicContact CD2-CZ 4.03Å; L187-F214 HydrophobicContact CG-CD1 4.47Å; L187-F214 HydrophobicContact CG-CE1 4.4Å; L187-W215 PolarHBondContact O-N 2.87Å; L187-W215 VanDerWaalsContact O-O 3.13Å
188	S	95.8	Very high	95	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	158.1	178.1	69	0	0	0	0	112.8	V157 A159 L186 A190 W215 V299	V157-S188 PolarHBondContact O-N 3.33Å; V157-S188 PolarHBondContact O-OG 2.85Å; A159-S188 WeakPolarHBondContact CB-O 3.12Å; A159-S188 PolarHBondContact N-O 3.49Å; L186-S188 PolarHBondContact O-N 2.54Å; S188-A190 PolarHBondContact O-N 3.23Å; S188-W215 CarbonylContact C-O 3.37Å; S188-W215 WeakPolarHBondContact CA-O 3.29Å; S188-V299 VanDerWaalsContact CB-O 3.25Å; S188-V299 WeakPolarHBondContact CB-O 3.3Å; S188-V299 PolarHBondContact OG-O 2.71Å
189	K	94	Very high	95.1	Very high	38 Å²	38	35 Å²	35	17%	0.165	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	31.1	-179.5	-46.5	-177.9	-166.2	161.7	0	113	D158 D191 L192 W215 N298	D158-K189 WeakPolarHBondContact OD2-CD 3.49Å; D158-K189 WeakPolarHBondContact OD2-CE 3.35Å; D158-K189 IonicContact OD2-NZ 3.34Å; D158-K189 PolarHBondContact OD2-NZ 2.91Å; K189-D191 WeakPolarHBondContact CA-OD1 3.47Å; K189-D191 PolarHBondContact O-N 2.92Å; K189-D191 VanDerWaalsContact O-N 3.16Å; K189-L192 HydrophobicContact CB-CD1 3.85Å; K189-L192 HydrophobicContact CB-CG 4.22Å; K189-L192 HydrophobicContact CD-CD1 4.14Å; K189-L192 WeakPolarHBondContact O-CB 3.24Å; K189-L192 PolarHBondContact O-N 2.99Å; K189-W215 PolarHBondContact N-O 3.29Å; K189-N298 WeakPolarHBondContact CE-O 3.29Å; K189-N298 PolarHBondContact NZ-O 3.26Å
190	A	94.6	Very high	95.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-63.6	-17.4	178.9	0	0	0	0	0	113.4	A159 S188 L192 L193 F214 W215 I265	A159-A190 HydrophobicContact CB-CB 4.26Å; S188-A190 PolarHBondContact O-N 3.23Å; A190-L192 PolarHBondContact O-N 3.33Å; A190-L193 PolarHBondContact O-N 2.85Å; A190-F214 HydrophobicContact CB-CB 3.72Å; A190-F214 HydrophobicContact CB-CD1 3.78Å; A190-F214 HydrophobicContact CB-CG 4.18Å; A190-W215 WeakPolarHBondContact CB-O 3.39Å; A190-W215 PolarHBondContact N-O 2.96Å; A190-I265 HydrophobicContact CB-CD1 3.97Å; A190-I265 HydrophobicContact CB-CG1 3.8Å
191	D	92	Very high	95.2	Very high	57 Å²	57	27.7 Å²	27.7	31%	0.305	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-68.3	-11.9	172.8	60.6	-53.3	0	0	0	113.9	K189 L193 S216 S218 I265	K189-D191 WeakPolarHBondContact CA-OD1 3.47Å; K189-D191 PolarHBondContact O-N 2.92Å; K189-D191 VanDerWaalsContact O-N 3.16Å; D191-L193 VanDerWaalsContact C-N 3.33Å; D191-S216 WeakPolarHBondContact OD1-CB 3.25Å; D191-S216 PolarHBondContact OD1-OG 2.81Å; D191-S216 PolarHBondContact OD2-OG 2.83Å; D191-S218 VanDerWaalsContact CG-OG 3.3Å; D191-S218 PolarHBondContact OD2-OG 2.77Å; D191-I265 HydrophobicContact CB-CD1 4.43Å
192	L	92.1	Very high	95.2	Very high	51 Å²	51	27 Å²	27	27%	0.267	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-86	-6.3	174.2	-57.1	-179.7	0	0	0	112.8	R160 K189 A190	R160-L192 HydrophobicContact CG-CB 4.13Å; R160-L192 HydrophobicContact CG-CD1 4.28Å; K189-L192 HydrophobicContact CB-CD1 3.85Å; K189-L192 HydrophobicContact CB-CG 4.22Å; K189-L192 HydrophobicContact CD-CD1 4.14Å; K189-L192 WeakPolarHBondContact O-CB 3.24Å; K189-L192 PolarHBondContact O-N 2.99Å; A190-L192 PolarHBondContact O-N 3.33Å
193	L	92.9	Very high	95.2	Very high	8 Å²	8	30.2 Å²	30.2	4%	0.042	15%	0.154	C	C	.	.	S	Bend	trans	-106	147.2	178.4	-78.7	71.6	0	0	0	110.3	A159 R160 A190 D191 Q197 R198	A159-L193 HydrophobicContact CB-CD1 3.68Å; A159-L193 HydrophobicContact CB-CD2 4.3Å; A159-L193 WeakPolarHBondContact O-CD2 3.13Å; R160-L193 HydrophobicContact CG-CD1 3.88Å; A190-L193 PolarHBondContact O-N 2.85Å; D191-L193 VanDerWaalsContact C-N 3.33Å; L193-Q197 HydrophobicContact CB-CB 4.06Å; L193-Q197 HydrophobicContact CD2-CB 4.14Å; L193-Q197 HydrophobicContact CG-CB 4.22Å; L193-R198 HydrophobicContact CB-CG 3.92Å; L193-R198 HydrophobicContact CD2-CG 4.31Å
194	T	92.3	Very high	95.2	Very high	47 Å²	47	31.3 Å²	31.3	29%	0.288	16%	0.156	S	C	.	.			trans	-70.8	163	166.8	71.7	0	0	0	0	110.8	K196 Q197 R198	T194-K196 PolarHBondContact O-N 3.43Å; T194-Q197 VanDerWaalsContact N-OE1 3.1Å; T194-Q197 PolarHBondContact O-N 3.46Å; T194-Q197 WeakPolarHBondContact OG1-CG 3.46Å; T194-Q197 PolarHBondContact OG1-N 3.49Å; T194-R198 PolarHBondContact O-N 3.02Å
195	S	91.7	Very high	95.1	Very high	51 Å²	51	31.1 Å²	31.1	36%	0.357	16%	0.155	S	C	.	.	H	α-helix	trans	-60.8	-36.4	176.3	-53	0	0	0	0	111.7	R198 Q199 D224	S195-R198 PolarHBondContact O-N 3.09Å; S195-R198 PolarHBondContact OG-NH2 2.87Å; S195-Q199 PolarHBondContact O-N 3.32Å; S195-D224 WeakPolarHBondContact CB-OD1 3.46Å; S195-D224 PolarHBondContact OG-OD1 3.03Å
196	K	92.9	Very high	95	Very high	83 Å²	83	34.7 Å²	34.7	36%	0.361	18%	0.178	S	C	.	.	H	α-helix	trans	-63.3	-43.9	173.9	-170.7	-173	-179.1	-161.7	0	112.3	T194 Q199 Y200	T194-K196 PolarHBondContact O-N 3.43Å; K196-Q199 WeakPolarHBondContact O-CB 3.34Å; K196-Q199 PolarHBondContact O-N 3.39Å; K196-Y200 HydrophobicContact CD-CE2 4.15Å; K196-Y200 VanDerWaalsContact CE-OH 3.25Å; K196-Y200 WeakPolarHBondContact CE-OH 3.37Å; K196-Y200 HydrophobicContact CG-CD2 4.32Å; K196-Y200 HydrophobicContact CG-CE2 3.81Å; K196-Y200 VanDerWaalsContact O-CD2 3.29Å; K196-Y200 WeakPolarHBondContact O-CD2 3.26Å; K196-Y200 PolarHBondContact O-N 3.45Å; K196-Y200 VanDerWaalsContact O-N 3.12Å
197	Q	95.3	Very high	94.9	Very high	17 Å²	17	43 Å²	43	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-40.2	176.6	-72.2	176.6	-24.4	0	0	112	L193 T194 Q199 Y200 W201 F459 N460	L193-Q197 HydrophobicContact CB-CB 4.06Å; L193-Q197 HydrophobicContact CD2-CB 4.14Å; L193-Q197 HydrophobicContact CG-CB 4.22Å; T194-Q197 VanDerWaalsContact N-OE1 3.1Å; T194-Q197 PolarHBondContact O-N 3.46Å; T194-Q197 WeakPolarHBondContact OG1-CG 3.46Å; T194-Q197 PolarHBondContact OG1-N 3.49Å; Q197-Q199 VanDerWaalsContact C-N 3.3Å; Q197-Q199 PolarHBondContact O-N 3.04Å; Q197-Y200 PolarHBondContact O-N 3.18Å; Q197-W201 PolarHBondContact O-N 2.8Å; Q197-F459 HydrophobicContact CB-CD2 4.47Å; Q197-F459 HydrophobicContact CB-CE1 4.46Å; Q197-F459 HydrophobicContact CB-CE2 3.66Å; Q197-F459 HydrophobicContact CB-CZ 3.64Å; Q197-F459 HydrophobicContact CG-CD1 4.35Å; Q197-F459 HydrophobicContact CG-CD2 4.09Å; Q197-F459 HydrophobicContact CG-CE1 3.95Å; Q197-F459 HydrophobicContact CG-CE2 3.67Å; Q197-F459 HydrophobicContact CG-CG 4.4Å; Q197-F459 HydrophobicContact CG-CZ 3.58Å; Q197-F459 WeakPolarHBondContact CG-O 3.34Å; Q197-F459 PolarHBondContact NE2-O 3.08Å; Q197-N460 PolarHBondContact NE2-OD1 2.63Å
198	R	95.8	Very high	94.7	Very high	1 Å²	1	49.5 Å²	49.5	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-38.6	172.7	-74.4	-174.6	-79.8	146.2	-3.2	111.7	L193 T194 S195 W201 A202 F214 D224 T263	L193-R198 HydrophobicContact CB-CG 3.92Å; L193-R198 HydrophobicContact CD2-CG 4.31Å; T194-R198 PolarHBondContact O-N 3.02Å; S195-R198 PolarHBondContact O-N 3.09Å; S195-R198 PolarHBondContact OG-NH2 2.87Å; R198-W201 PolarHBondContact O-N 2.87Å; R198-A202 VanDerWaalsContact O-CB 3.29Å; R198-A202 WeakPolarHBondContact O-CB 3.28Å; R198-A202 PolarHBondContact O-N 3.37Å; R198-F214 HydrophobicContact CB-CE1 4.19Å; R198-F214 HydrophobicContact CB-CE2 4.12Å; R198-F214 HydrophobicContact CB-CZ 3.93Å; R198-F214 HydrophobicContact CG-CD1 4.01Å; R198-F214 HydrophobicContact CG-CE1 3.87Å; R198-F214 HydrophobicContact CG-CE2 4.49Å; R198-F214 HydrophobicContact CG-CG 4.37Å; R198-F214 HydrophobicContact CG-CZ 4.14Å; R198-F214 VanDerWaalsContact O-CZ 3.28Å; R198-F214 WeakPolarHBondContact O-CZ 3.15Å; R198-D224 IonicContact CZ-OD1 3.56Å; R198-D224 IonicContact CZ-OD2 3.9Å; R198-D224 IonicContact NH1-OD1 2.71Å; R198-D224 IonicContact NH1-OD2 3.44Å; R198-D224 PolarHBondContact NH1-OD2 3.49Å; R198-D224 IonicContact NH2-OD1 3.56Å; R198-D224 PolarHBondContact NH2-OD1 2.89Å; R198-D224 IonicContact NH2-OD2 3.88Å; R198-T263 PolarHBondContact NH1-O 3.29Å
199	Q	95.4	Very high	94.6	Very high	104 Å²	104	52.5 Å²	52.5	49%	0.486	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-49.6	176.1	-173.3	175.6	6.2	0	0	112.1	S195 K196 Q197 W201 A202 D203 T263	S195-Q199 PolarHBondContact O-N 3.32Å; K196-Q199 WeakPolarHBondContact O-CB 3.34Å; K196-Q199 PolarHBondContact O-N 3.39Å; Q197-Q199 VanDerWaalsContact C-N 3.3Å; Q197-Q199 PolarHBondContact O-N 3.04Å; Q199-W201 VanDerWaalsContact C-N 3.28Å; Q199-W201 PolarHBondContact O-N 3.18Å; Q199-A202 WeakPolarHBondContact O-CB 3.31Å; Q199-A202 PolarHBondContact O-N 2.95Å; Q199-D203 VanDerWaalsContact O-CG 3.26Å; Q199-D203 PolarHBondContact O-N 2.86Å; Q199-T263 HydrophobicContact CB-CG2 4.01Å; Q199-T263 HydrophobicContact CG-CG2 4.48Å
200	Y	96.5	Very high	94.6	Very high	57 Å²	57	52 Å²	52	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-56.5	-41.7	176.9	-73.9	-49.7	0	0	0	113.3	K196 Q197 Y204 I454 F459	K196-Y200 HydrophobicContact CD-CE2 4.15Å; K196-Y200 VanDerWaalsContact CE-OH 3.25Å; K196-Y200 WeakPolarHBondContact CE-OH 3.37Å; K196-Y200 HydrophobicContact CG-CD2 4.32Å; K196-Y200 HydrophobicContact CG-CE2 3.81Å; K196-Y200 VanDerWaalsContact O-CD2 3.29Å; K196-Y200 WeakPolarHBondContact O-CD2 3.26Å; K196-Y200 PolarHBondContact O-N 3.45Å; K196-Y200 VanDerWaalsContact O-N 3.12Å; Q197-Y200 PolarHBondContact O-N 3.18Å; Y200-Y204 WeakPolarHBondContact O-CB 3.42Å; Y200-Y204 PolarHBondContact O-N 3.09Å; Y200-I454 HydrophobicContact CD1-CD1 3.21Å; Y200-I454 HydrophobicContact CD2-CD1 4.5Å; Y200-I454 HydrophobicContact CE1-CD1 3.89Å; Y200-I454 HydrophobicContact CG-CD1 3.56Å; Y200-F459 AromaticContact CD2-CD2 3.65Å; Y200-F459 HydrophobicContact CD2-CD2 3.65Å; Y200-F459 HydrophobicContact CD2-CE2 4.22Å; Y200-F459 HydrophobicContact CE2-CD2 4.44Å; Y200-F459 HydrophobicContact CG-CD2 4.26Å
201	W	97.5	Very high	94.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.5	-39.8	174.5	-82.3	112	0	0	0	112.5	P162 L163 Q197 R198 Q199 D203 Y204 F205 F214 V449 P451 F459	P162-W201 HydrophobicContact CB-CE3 4.49Å; P162-W201 HydrophobicContact CB-CZ3 4.32Å; P162-W201 HydrophobicContact CG-CD2 3.91Å; P162-W201 HydrophobicContact CG-CE3 3.98Å; P162-W201 HydrophobicContact CG-CH2 4.26Å; P162-W201 HydrophobicContact CG-CZ2 4.21Å; P162-W201 HydrophobicContact CG-CZ3 4.15Å; L163-W201 HydrophobicContact CD1-CH2 4.1Å; L163-W201 HydrophobicContact CD1-CZ3 4.34Å; L163-W201 HydrophobicContact CG-CH2 3.9Å; L163-W201 HydrophobicContact CG-CZ3 4.01Å; Q197-W201 PolarHBondContact O-N 2.8Å; R198-W201 PolarHBondContact O-N 2.87Å; Q199-W201 VanDerWaalsContact C-N 3.28Å; Q199-W201 PolarHBondContact O-N 3.18Å; W201-D203 PolarHBondContact O-N 2.85Å; W201-Y204 HydrophobicContact CE3-CD1 4.09Å; W201-Y204 HydrophobicContact CE3-CG 4.49Å; W201-Y204 AromaticContact CZ3-CD1 3.94Å; W201-Y204 HydrophobicContact CZ3-CD1 3.94Å; W201-Y204 HydrophobicContact CZ3-CE1 4.24Å; W201-Y204 HydrophobicContact CZ3-CG 4.48Å; W201-Y204 PolarHBondContact O-N 2.97Å; W201-F205 HydrophobicContact CB-CD2 4.5Å; W201-F205 HydrophobicContact CB-CE2 4.39Å; W201-F205 HydrophobicContact CD2-CE2 4.23Å; W201-F205 HydrophobicContact CE3-CD2 4.2Å; W201-F205 AromaticContact CE3-CE2 3.4Å; W201-F205 HydrophobicContact CE3-CE2 3.4Å; W201-F205 AromaticContact CE3-CZ 3.87Å; W201-F205 HydrophobicContact CE3-CZ 3.87Å; W201-F205 HydrophobicContact CZ3-CE2 4.05Å; W201-F205 HydrophobicContact CZ3-CZ 4.03Å; W201-F205 WeakPolarHBondContact O-CD2 3.04Å; W201-F205 PolarHBondContact O-N 3.08Å; W201-F214 HydrophobicContact CB-CE1 4.38Å; W201-F214 HydrophobicContact CB-CZ 3.96Å; W201-V449 VanDerWaalsContact CZ2-O 3.28Å; W201-V449 WeakPolarHBondContact CZ2-O 2.99Å; W201-V449 PolarHBondContact NE1-O 2.93Å; W201-P451 HydrophobicContact CD2-CB 4.09Å; W201-P451 HydrophobicContact CD2-CG 4.35Å; W201-P451 HydrophobicContact CE3-CB 3.8Å; W201-P451 HydrophobicContact CH2-CB 3.8Å; W201-P451 HydrophobicContact CZ2-CB 4.06Å; W201-P451 HydrophobicContact CZ3-CB 3.67Å; W201-F459 AromaticContact CD1-CE2 3.95Å; W201-F459 AromaticContact CD1-CZ 3.91Å; W201-F459 AromaticContact NE1-CE2 3.89Å; W201-F459 AromaticContact NE1-CZ 3.58Å
202	A	96.7	Very high	94.9	Very high	2 Å²	2	54.8 Å²	54.8	2%	0.017	28%	0.284	C	S	.	.	H	α-helix	trans	-60.6	-45.3	177.5	0	0	0	0	0	111.5	R198 Q199 Y204 F205 T206 F212 F214 P262 T263	R198-A202 VanDerWaalsContact O-CB 3.29Å; R198-A202 WeakPolarHBondContact O-CB 3.28Å; R198-A202 PolarHBondContact O-N 3.37Å; Q199-A202 WeakPolarHBondContact O-CB 3.31Å; Q199-A202 PolarHBondContact O-N 2.95Å; A202-Y204 VanDerWaalsContact C-N 3.35Å; A202-Y204 PolarHBondContact O-N 2.92Å; A202-F205 PolarHBondContact O-N 3.34Å; A202-T206 VanDerWaalsContact O-CB 3.24Å; A202-T206 WeakPolarHBondContact O-CB 3.33Å; A202-T206 PolarHBondContact O-N 3.08Å; A202-T206 PolarHBondContact O-OG1 3.38Å; A202-F212 HydrophobicContact CB-CE2 4.11Å; A202-F212 HydrophobicContact CB-CZ 3.97Å; A202-F214 HydrophobicContact CB-CE2 4.1Å; A202-P262 HydrophobicContact CB-CB 4.08Å; A202-T263 HydrophobicContact CB-CG2 3.98Å
203	D	96	Very high	95.1	Very high	88 Å²	88	52.8 Å²	52.8	47%	0.471	28%	0.275	S	S	.	.	H	α-helix	trans	-60.2	-47.2	177.3	-64.8	-20.6	0	0	0	110.2	Q199 W201 F205 T206 E207	Q199-D203 VanDerWaalsContact O-CG 3.26Å; Q199-D203 PolarHBondContact O-N 2.86Å; W201-D203 PolarHBondContact O-N 2.85Å; D203-F205 PolarHBondContact O-N 2.86Å; D203-T206 PolarHBondContact O-N 2.87Å; D203-E207 WeakPolarHBondContact O-CB 3.19Å; D203-E207 PolarHBondContact O-N 3.02Å
204	Y	96.9	Very high	95.3	Very high	43 Å²	43	52.4 Å²	52.4	17%	0.169	27%	0.273	C	S	.	.	H	α-helix	trans	-58.3	-46.1	178.2	179.8	-92.2	0	0	0	113.4	L163 Y200 W201 A202 R208 P451 P452	L163-Y204 HydrophobicContact CD2-CE1 4.07Å; Y200-Y204 WeakPolarHBondContact O-CB 3.42Å; Y200-Y204 PolarHBondContact O-N 3.09Å; W201-Y204 HydrophobicContact CE3-CD1 4.09Å; W201-Y204 HydrophobicContact CE3-CG 4.49Å; W201-Y204 AromaticContact CZ3-CD1 3.94Å; W201-Y204 HydrophobicContact CZ3-CD1 3.94Å; W201-Y204 HydrophobicContact CZ3-CE1 4.24Å; W201-Y204 HydrophobicContact CZ3-CG 4.48Å; W201-Y204 PolarHBondContact O-N 2.97Å; A202-Y204 VanDerWaalsContact C-N 3.35Å; A202-Y204 PolarHBondContact O-N 2.92Å; Y204-R208 VanDerWaalsContact CE1-CD 3.48Å; Y204-R208 WeakPolarHBondContact O-CD 3.5Å; Y204-R208 VanDerWaalsContact O-CG 3.3Å; Y204-R208 WeakPolarHBondContact O-CG 3.41Å; Y204-P451 HydrophobicContact CD2-CB 3.9Å; Y204-P451 HydrophobicContact CG-CB 3.87Å; Y204-P452 HydrophobicContact CE2-CB 4.28Å; Y204-P452 HydrophobicContact CE2-CG 4.02Å
205	F	96.4	Very high	95.4	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-74.3	-33.6	179.4	-73.2	-63.2	0	0	0	112.7	P162 L185 L187 W201 A202 D203 R208 G209 D210 F212	P162-F205 HydrophobicContact CB-CE2 4.05Å; P162-F205 HydrophobicContact CB-CZ 3.64Å; P162-F205 HydrophobicContact CG-CE2 4.16Å; P162-F205 HydrophobicContact CG-CZ 4.24Å; L185-F205 HydrophobicContact CD1-CD1 4.07Å; L185-F205 HydrophobicContact CD1-CE1 3.91Å; L187-F205 HydrophobicContact CD1-CE2 4.48Å; L187-F205 HydrophobicContact CD2-CD2 4.26Å; L187-F205 HydrophobicContact CD2-CE2 3.74Å; W201-F205 HydrophobicContact CB-CD2 4.5Å; W201-F205 HydrophobicContact CB-CE2 4.39Å; W201-F205 HydrophobicContact CD2-CE2 4.23Å; W201-F205 HydrophobicContact CE3-CD2 4.2Å; W201-F205 AromaticContact CE3-CE2 3.4Å; W201-F205 HydrophobicContact CE3-CE2 3.4Å; W201-F205 AromaticContact CE3-CZ 3.87Å; W201-F205 HydrophobicContact CE3-CZ 3.87Å; W201-F205 HydrophobicContact CZ3-CE2 4.05Å; W201-F205 HydrophobicContact CZ3-CZ 4.03Å; W201-F205 WeakPolarHBondContact O-CD2 3.04Å; W201-F205 PolarHBondContact O-N 3.08Å; A202-F205 PolarHBondContact O-N 3.34Å; D203-F205 PolarHBondContact O-N 2.86Å; F205-R208 PolarHBondContact O-N 2.85Å; F205-G209 PolarHBondContact O-N 3Å; F205-D210 HydrophobicContact CB-CB 4.22Å; F205-D210 HydrophobicContact CD1-CB 4.03Å; F205-D210 WeakPolarHBondContact CD1-OD2 3.46Å; F205-D210 PolarHBondContact O-N 3.14Å; F205-F212 HydrophobicContact CB-CD1 3.35Å; F205-F212 HydrophobicContact CB-CD2 4.44Å; F205-F212 HydrophobicContact CB-CE1 3.43Å; F205-F212 VanDerWaalsContact CB-CE1 3.43Å; F205-F212 HydrophobicContact CB-CG 3.91Å; F205-F212 HydrophobicContact CB-CZ 4.04Å; F205-F212 HydrophobicContact CG-CD1 4.22Å; F205-F212 HydrophobicContact CG-CG 4.33Å
206	T	95.2	Very high	95.6	Very high	81 Å²	81	48.2 Å²	48.2	50%	0.497	25%	0.246	S	C	.	.	H	α-helix	trans	-67.9	-43.6	178.2	-56.6	0	0	0	0	111.3	A202 D203 R208 G209	A202-T206 VanDerWaalsContact O-CB 3.24Å; A202-T206 WeakPolarHBondContact O-CB 3.33Å; A202-T206 PolarHBondContact O-N 3.08Å; A202-T206 PolarHBondContact O-OG1 3.38Å; D203-T206 PolarHBondContact O-N 2.87Å; T206-R208 PolarHBondContact O-N 3.37Å; T206-G209 PolarHBondContact O-N 2.94Å
207	E	95.2	Very high	95.4	Very high	175 Å²	175	46.4 Å²	46.4	82%	0.818	24%	0.24	S	C	*	.	H	α-helix	trans	-59.2	-33.2	177.1	-174.2	-180	180	0	0	112.1	D203 G209	D203-E207 WeakPolarHBondContact O-CB 3.19Å; D203-E207 PolarHBondContact O-N 3.02Å; E207-G209 VanDerWaalsContact C-N 3.33Å
208	R	93.3	Very high	94.8	Very high	135 Å²	135	47.5 Å²	47.5	51%	0.509	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-10.3	177.8	-66.4	173.7	57	75.8	7.7	113.9	Y204 F205 T206 D210	Y204-R208 VanDerWaalsContact CE1-CD 3.48Å; Y204-R208 WeakPolarHBondContact O-CD 3.5Å; Y204-R208 VanDerWaalsContact O-CG 3.3Å; Y204-R208 WeakPolarHBondContact O-CG 3.41Å; F205-R208 PolarHBondContact O-N 2.85Å; T206-R208 PolarHBondContact O-N 3.37Å; R208-D210 VanDerWaalsContact C-N 3.31Å; R208-D210 WeakPolarHBondContact CB-OD2 3.48Å; R208-D210 IonicContact NE-OD2 2.97Å; R208-D210 PolarHBondContact NE-OD2 3.07Å; R208-D210 VanDerWaalsContact NE-OD2 3.14Å
209	G	93	Very high	93.5	Very high	63 Å²	63	54.1 Å²	54.1	65%	0.649	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	24.3	-174.9	0	0	0	0	0	113.9	F205 T206 E207	F205-G209 PolarHBondContact O-N 3Å; T206-G209 PolarHBondContact O-N 2.94Å; E207-G209 VanDerWaalsContact C-N 3.33Å
210	D	94.5	Very high	91.5	Very high	27 Å²	27	57.4 Å²	57.4	14%	0.144	30%	0.297	C	S	.	.			trans	-75.2	140.2	178.6	-67.3	-50	0	0	0	110.5	R166 L185 F205 R208 F212	R166-D210 IonicContact CZ-OD1 3.46Å; R166-D210 IonicContact CZ-OD2 3.8Å; R166-D210 VanDerWaalsContact NH1-CG 3.28Å; R166-D210 IonicContact NH1-OD1 3.3Å; R166-D210 PolarHBondContact NH1-OD1 2.57Å; R166-D210 IonicContact NH1-OD2 3.52Å; R166-D210 PolarHBondContact NH1-OD2 3.01Å; R166-D210 IonicContact NH2-OD1 3.69Å; R166-D210 PolarHBondContact NH2-OD1 3.43Å; R166-D210 IonicContact NH2-OD2 3.61Å; L185-D210 HydrophobicContact CD1-CB 4.21Å; F205-D210 HydrophobicContact CB-CB 4.22Å; F205-D210 HydrophobicContact CD1-CB 4.03Å; F205-D210 WeakPolarHBondContact CD1-OD2 3.46Å; F205-D210 PolarHBondContact O-N 3.14Å; R208-D210 VanDerWaalsContact C-N 3.31Å; R208-D210 WeakPolarHBondContact CB-OD2 3.48Å; R208-D210 IonicContact NE-OD2 2.97Å; R208-D210 PolarHBondContact NE-OD2 3.07Å; R208-D210 VanDerWaalsContact NE-OD2 3.14Å; D210-F212 WeakPolarHBondContact O-CD1 3.37Å
211	L	95.8	Very high	89.1	Confident	84 Å²	84	63.5 Å²	63.5	44%	0.44	32%	0.32	S	S	.	.			trans	-84.8	113.9	171.4	-65.2	177	0	0	0	109.1	V182 F184 L185 L278	V182-L211 HydrophobicContact CG1-CD1 3.7Å; F184-L211 HydrophobicContact CD2-CB 3.93Å; F184-L211 HydrophobicContact CE2-CB 4.43Å; L185-L211 PolarHBondContact N-O 2.83Å; L211-L278 HydrophobicContact CD1-CD2 4.11Å
212	F	96.9	Very high	86.8	Confident	33 Å²	33	66.1 Å²	66.1	15%	0.145	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	163.3	-176	73.8	-82.7	0	0	0	114	L185 L187 A202 F205 D210 F214 P262	L185-F212 HydrophobicContact CB-CB 3.95Å; L185-F212 CarbonylContact O-C 3.54Å; L185-F212 WeakPolarHBondContact O-CA 3.48Å; L187-F212 HydrophobicContact CD1-CB 3.79Å; L187-F212 HydrophobicContact CD1-CD2 4.14Å; L187-F212 HydrophobicContact CD1-CG 4.37Å; A202-F212 HydrophobicContact CB-CE2 4.11Å; A202-F212 HydrophobicContact CB-CZ 3.97Å; F205-F212 HydrophobicContact CB-CD1 3.35Å; F205-F212 HydrophobicContact CB-CD2 4.44Å; F205-F212 HydrophobicContact CB-CE1 3.43Å; F205-F212 VanDerWaalsContact CB-CE1 3.43Å; F205-F212 HydrophobicContact CB-CG 3.91Å; F205-F212 HydrophobicContact CB-CZ 4.04Å; F205-F212 HydrophobicContact CG-CD1 4.22Å; F205-F212 HydrophobicContact CG-CG 4.33Å; D210-F212 WeakPolarHBondContact O-CD1 3.37Å; F212-F214 HydrophobicContact CD2-CE2 4.43Å; F212-F214 HydrophobicContact CE2-CD2 4.45Å; F212-F214 AromaticContact CE2-CE2 3.91Å; F212-F214 HydrophobicContact CE2-CE2 3.91Å; F212-P262 HydrophobicContact CZ-CB 4.14Å
213	A	96.6	Very high	84.1	Confident	8 Å²	8	73.8 Å²	73.8	7%	0.066	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	151.1	163.2	0	0	0	0	0	112.2	F184 L185 L186 L187 L266	F184-A213 HydrophobicContact CE1-CB 4.01Å; F184-A213 HydrophobicContact CZ-CB 3.65Å; L185-A213 PolarHBondContact O-N 2.81Å; L186-A213 HydrophobicContact CD1-CB 4.47Å; L187-A213 PolarHBondContact N-O 3.07Å; A213-L266 HydrophobicContact CB-CD1 3.35Å; A213-L266 HydrophobicContact CB-CG 4.06Å
214	F	97.1	Very high	81.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	139.3	171	-68	-77.5	0	0	0	111.5	L187 A190 R198 W201 A202 F212 P262 I265 L266	L187-F214 HydrophobicContact CB-CD1 3.8Å; L187-F214 HydrophobicContact CB-CE1 4.19Å; L187-F214 HydrophobicContact CD2-CD1 3.95Å; L187-F214 HydrophobicContact CD2-CE1 3.43Å; L187-F214 VanDerWaalsContact CD2-CE1 3.43Å; L187-F214 HydrophobicContact CD2-CZ 4.03Å; L187-F214 HydrophobicContact CG-CD1 4.47Å; L187-F214 HydrophobicContact CG-CE1 4.4Å; A190-F214 HydrophobicContact CB-CB 3.72Å; A190-F214 HydrophobicContact CB-CD1 3.78Å; A190-F214 HydrophobicContact CB-CG 4.18Å; R198-F214 HydrophobicContact CB-CE1 4.19Å; R198-F214 HydrophobicContact CB-CE2 4.12Å; R198-F214 HydrophobicContact CB-CZ 3.93Å; R198-F214 HydrophobicContact CG-CD1 4.01Å; R198-F214 HydrophobicContact CG-CE1 3.87Å; R198-F214 HydrophobicContact CG-CE2 4.49Å; R198-F214 HydrophobicContact CG-CG 4.37Å; R198-F214 HydrophobicContact CG-CZ 4.14Å; R198-F214 VanDerWaalsContact O-CZ 3.28Å; R198-F214 WeakPolarHBondContact O-CZ 3.15Å; W201-F214 HydrophobicContact CB-CE1 4.38Å; W201-F214 HydrophobicContact CB-CZ 3.96Å; A202-F214 HydrophobicContact CB-CE2 4.1Å; F212-F214 HydrophobicContact CD2-CE2 4.43Å; F212-F214 HydrophobicContact CE2-CD2 4.45Å; F212-F214 AromaticContact CE2-CE2 3.91Å; F212-F214 HydrophobicContact CE2-CE2 3.91Å; F214-P262 WeakPolarHBondContact CD2-O 3.39Å; F214-P262 VanDerWaalsContact CE2-O 3.3Å; F214-P262 WeakPolarHBondContact CE2-O 3.49Å; F214-I265 HydrophobicContact CB-CG1 4.26Å; F214-L266 PolarHBondContact O-N 2.83Å
215	W	95.8	Very high	78.1	Confident	1 Å²	1	75.2 Å²	75.2	0%	0.004	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.8	-175.6	176.4	-96.4	0	0	0	111.7	L186 L187 S188 K189 A190 N217 L266 A268 L271 T304 K307 I308	L186-W215 HydrophobicContact CD1-CB 3.62Å; L186-W215 HydrophobicContact CD1-CG 4.21Å; L186-W215 HydrophobicContact CD2-CB 4.32Å; L186-W215 HydrophobicContact CD2-CG 4.17Å; L186-W215 HydrophobicContact CG-CB 3.82Å; L186-W215 HydrophobicContact CG-CG 4.22Å; L187-W215 PolarHBondContact O-N 2.87Å; L187-W215 VanDerWaalsContact O-O 3.13Å; S188-W215 CarbonylContact C-O 3.37Å; S188-W215 WeakPolarHBondContact CA-O 3.29Å; K189-W215 PolarHBondContact N-O 3.29Å; A190-W215 WeakPolarHBondContact CB-O 3.39Å; A190-W215 PolarHBondContact N-O 2.96Å; W215-N217 PolarHBondContact NE1-OD1 2.89Å; W215-L266 HydrophobicContact CE3-CB 4.45Å; W215-L266 VanDerWaalsContact CE3-O 3.32Å; W215-L266 WeakPolarHBondContact CZ3-O 3.41Å; W215-A268 HydrophobicContact CH2-CB 3.89Å; W215-A268 HydrophobicContact CZ3-CB 4.45Å; W215-L271 HydrophobicContact CD2-CD2 4.26Å; W215-L271 HydrophobicContact CE3-CB 4.32Å; W215-L271 HydrophobicContact CE3-CD2 3.71Å; W215-L271 HydrophobicContact CH2-CD2 4.23Å; W215-L271 HydrophobicContact CZ3-CB 3.98Å; W215-L271 HydrophobicContact CZ3-CD2 3.69Å; W215-L271 HydrophobicContact CZ3-CG 4.49Å; W215-T304 HydrophobicContact CZ2-CG2 4.02Å; W215-T304 PolarHBondContact NE1-OG1 3.02Å; W215-T304 VanDerWaalsContact NE1-OG1 3.13Å; W215-K307 HydrophobicContact CH2-CG 3.98Å; W215-K307 HydrophobicContact CZ2-CB 3.91Å; W215-K307 HydrophobicContact CZ2-CG 3.55Å; W215-I308 HydrophobicContact CH2-CG1 4.16Å; W215-I308 HydrophobicContact CZ2-CG1 4.36Å
216	S	94.1	Very high	74.9	Confident	10 Å²	10	80.1 Å²	80.1	7%	0.07	42%	0.416	C	S	.	.			trans	-134.6	150.5	164.5	-170.2	0	0	0	0	112	D191 S218	D191-S216 WeakPolarHBondContact OD1-CB 3.25Å; D191-S216 PolarHBondContact OD1-OG 2.81Å; D191-S216 PolarHBondContact OD2-OG 2.83Å; S216-S218 PolarHBondContact OG-N 2.84Å; S216-S218 VanDerWaalsContact OG-N 3.14Å; S216-S218 PolarHBondContact OG-OG 3.05Å
217	N	90.1	Very high	71.6	Confident	45 Å²	45	81 Å²	81	24%	0.241	43%	0.426	C	S	.	.	S	Bend	trans	-85.7	-13	171.5	-65.5	-44.2	0	0	0	112.1	W215 S303 T304	W215-N217 PolarHBondContact NE1-OD1 2.89Å; N217-S303 VanDerWaalsContact ND2-CB 3.33Å; N217-S303 WeakPolarHBondContact ND2-CB 3.18Å; N217-T304 VanDerWaalsContact OD1-CA 3.26Å; N217-T304 WeakPolarHBondContact OD1-CA 3.47Å; N217-T304 PolarHBondContact OD1-N 2.69Å
218	S	82	Confident	68.2	Low	40 Å²	40	82 Å²	82	28%	0.28	43%	0.427	S	S	.	.	S	Bend	trans	-76.7	142.1	177.7	62.6	0	0	0	0	110.7	D191 S216 K220	D191-S218 VanDerWaalsContact CG-OG 3.3Å; D191-S218 PolarHBondContact OD2-OG 2.77Å; S216-S218 PolarHBondContact OG-N 2.84Å; S216-S218 VanDerWaalsContact OG-N 3.14Å; S216-S218 PolarHBondContact OG-OG 3.05Å; S218-K220 PolarHBondContact O-N 2.85Å
219	D	67.6	Low	64.8	Low	140 Å²	140	82 Å²	82	75%	0.749	44%	0.438	S	S	*	.			trans	-79	2	176.3	-72.2	-60.5	0	0	0	113.2	R221 K307	D219-R221 PolarHBondContact O-N 3.39Å; D219-R221 VanDerWaalsContact O-N 3.08Å; D219-K307 IonicContact OD1-NZ 2.72Å; D219-K307 PolarHBondContact OD1-NZ 3.33Å; D219-K307 IonicContact OD2-NZ 3.74Å; D219-K307 PolarHBondContact OD2-NZ 3.06Å
220	K	54.5	Low	61.6	Low	172 Å²	172	85.5 Å²	85.5	75%	0.748	45%	0.446	S	S	*	.			trans	-74.5	104.1	-178.2	-66.5	-176.2	179.8	-178.3	0	108.2	S218 T222	S218-K220 PolarHBondContact O-N 2.85Å; K220-T222 PolarHBondContact O-N 3.05Å; K220-T222 VanDerWaalsContact O-N 3.11Å
221	R	46.9	Very low	58.3	Low	185 Å²	185	90.2 Å²	90.2	70%	0.698	48%	0.475	S	S	*	.			trans	-59.7	113.7	166.7	-74.3	-174.8	171.1	174.4	-1.7	108.3	D219 E223 E267	D219-R221 PolarHBondContact O-N 3.39Å; D219-R221 VanDerWaalsContact O-N 3.08Å; R221-E223 PolarHBondContact O-N 3.3Å; R221-E267 IonicContact CZ-OE1 3.47Å; R221-E267 IonicContact NE-OE1 3.31Å; R221-E267 PolarHBondContact NE-OE1 2.98Å; R221-E267 IonicContact NH2-OE1 2.71Å; R221-E267 PolarHBondContact NH2-OE1 3.26Å
222	T	47.3	Very low	54.7	Low	55 Å²	55	94.1 Å²	94.1	34%	0.337	49%	0.491	S	S	.	.			trans	-73.6	102.7	158	50	0	0	0	0	105.6	K220 D224 I265	K220-T222 PolarHBondContact O-N 3.05Å; K220-T222 VanDerWaalsContact O-N 3.11Å; T222-D224 VanDerWaalsContact C-N 3.3Å; T222-D224 PolarHBondContact O-N 3.13Å; T222-I265 HydrophobicContact CG2-CD1 4.25Å
223	E	40.6	Very low	51.1	Low	163 Å²	163	100.9 Å²	100.9	76%	0.762	52%	0.524	S	S	*	.			trans	-62.8	97.9	169.5	-70.5	176.2	-179.1	0	0	107	R221 T225	R221-E223 PolarHBondContact O-N 3.3Å; E223-T225 PolarHBondContact O-N 3.4Å
224	D	39.9	Very low	47.6	Very low	47 Å²	47	108.2 Å²	108.2	25%	0.251	56%	0.562	S	S	.	*			trans	-69.9	81.8	162.8	-70.3	-35.6	0	0	0	105.5	S195 R198 T222 V226	S195-D224 WeakPolarHBondContact CB-OD1 3.46Å; S195-D224 PolarHBondContact OG-OD1 3.03Å; R198-D224 IonicContact CZ-OD1 3.56Å; R198-D224 IonicContact CZ-OD2 3.9Å; R198-D224 IonicContact NH1-OD1 2.71Å; R198-D224 IonicContact NH1-OD2 3.44Å; R198-D224 PolarHBondContact NH1-OD2 3.49Å; R198-D224 IonicContact NH2-OD1 3.56Å; R198-D224 PolarHBondContact NH2-OD1 2.89Å; R198-D224 IonicContact NH2-OD2 3.88Å; T222-D224 VanDerWaalsContact C-N 3.3Å; T222-D224 PolarHBondContact O-N 3.13Å; D224-V226 PolarHBondContact O-N 3.24Å
225	T	27.2	Very low	44.2	Very low	115 Å²	115	113.1 Å²	113.1	71%	0.706	60%	0.602	S	S	*	*			trans	-61.9	92.6	167.5	34.3	0	0	0	0	107.3	E223 S227	E223-T225 PolarHBondContact O-N 3.4Å; T225-S227 PolarHBondContact O-N 2.73Å; T225-S227 VanDerWaalsContact O-N 3.15Å
226	V	30.1	Very low	40.7	Very low	104 Å²	104	122.1 Å²	122.1	63%	0.63	64%	0.644	S	S	*	*			trans	-57.1	116	153.6	-177.9	0	0	0	0	104.6	D224 K228 L261	D224-V226 PolarHBondContact O-N 3.24Å; V226-K228 PolarHBondContact O-N 3.08Å; V226-L261 HydrophobicContact CG2-CD1 4.36Å
227	S	25.6	Very low	37.7	Very low	99 Å²	99	127.3 Å²	127.3	69%	0.692	68%	0.677	S	S	*	*			trans	-53.1	88.1	176	-42.9	0	0	0	0	109.5	T225 D229	T225-S227 PolarHBondContact O-N 2.73Å; T225-S227 VanDerWaalsContact O-N 3.15Å; S227-D229 PolarHBondContact O-N 2.74Å; S227-D229 VanDerWaalsContact O-N 3.08Å
228	K	24	Very low	34.6	Very low	195 Å²	195	132.8 Å²	132.8	85%	0.848	71%	0.707	S	S	*	*			trans	-80.4	65	160.1	-80	-171.8	174.5	-176.1	0	106.6	V226	V226-K228 PolarHBondContact O-N 3.08Å
229	D	21.2	Very low	31.7	Very low	137 Å²	137	137.9 Å²	137.9	73%	0.733	73%	0.728	S	S	*	*			trans	-70.2	136.2	151.3	-72.1	-39.6	0	0	0	106.3	S227	S227-D229 PolarHBondContact O-N 2.74Å; S227-D229 VanDerWaalsContact O-N 3.08Å
230	V	25.3	Very low	29.6	Very low	135 Å²	135	137.7 Å²	137.7	82%	0.818	73%	0.726	S	S	*	*			trans	81.6	87.9	178	-158.1	0	0	0	0	114.3
231	V	25	Very low	28.1	Very low	126 Å²	126	138.9 Å²	138.9	76%	0.764	73%	0.732	S	S	*	*				-172.9	127.9	96.1	172.5	0	0	0	0	107.5
232	E	20.3	Very low	26.9	Very low	167 Å²	167	138.1 Å²	138.1	78%	0.78	74%	0.741	S	S	*	*			trans	-18.4	151.6	155	-66.9	164.9	155.5	0	0	115.5
233	E	22.8	Very low	25.7	Very low	175 Å²	175	138.6 Å²	138.6	82%	0.818	76%	0.757	S	S	*	*			cis	-174.7	160.8	49.7	-143.6	168.8	-157	0	0	109.4
234	N	21.4	Very low	24.8	Very low	162 Å²	162	137.6 Å²	137.6	87%	0.866	76%	0.762	S	S	*	*			trans	-56.5	135.9	-175.5	-57.3	-67.3	0	0	0	114.8
235	A	26	Very low	24	Very low	103 Å²	103	140.8 Å²	140.8	85%	0.851	80%	0.795	S	S	*	*			trans	-146.6	114.8	152.3	0	0	0	0	0	110.5
236	E	22.3	Very low	24	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	79%	0.791	S	S	*	*			trans	-69.3	161.7	175.9	-81.1	-159.5	157	0	0	113.2
237	P	31.3	Very low	23.7	Very low	119 Å²	119	141.3 Å²	141.3	77%	0.773	80%	0.802	S	S	*	*			trans	-98.5	129	-160.2	34.5	-27.1	0	0	0	113.2
238	D	25.6	Very low	23.9	Very low	160 Å²	160	140.8 Å²	140.8	86%	0.856	79%	0.791	S	S	*	*			trans	-115.4	110.6	174.2	-136.6	-1.7	0	0	0	112.9
239	M	21.2	Very low	24.2	Very low	147 Å²	147	139.6 Å²	139.6	72%	0.724	79%	0.789	S	S	*	*			trans	7	135.1	147.5	-66.4	-72.5	-94.8	0	0	121.9
240	L	22.8	Very low	24.6	Very low	137 Å²	137	140.5 Å²	140.5	72%	0.717	79%	0.789	S	S	*	*			trans	61.6	111.6	137.6	-72.7	161.2	0	0	0	119.6
241	K	24	Very low	25	Very low	197 Å²	197	139 Å²	139	86%	0.857	78%	0.78	S	S	*	*				169.7	149	106.7	-93.4	168.8	-173.4	175.3	0	114
242	N	20.6	Very low	25.2	Very low	169 Å²	169	135.8 Å²	135.8	90%	0.904	77%	0.766	S	S	*	*			trans	-49.5	148.4	171.8	-55.6	-32.3	0	0	0	114.5
243	G	22.3	Very low	25.5	Very low	64 Å²	64	135.8 Å²	135.8	66%	0.66	76%	0.764	S	S	*	*			trans	151.6	103	153	0	0	0	0	0	116.2
244	T	21.3	Very low	25.9	Very low	143 Å²	143	130.5 Å²	130.5	88%	0.877	75%	0.75	S	S	*	*			trans	58.5	128.7	143.6	30.3	0	0	0	0	121.2	S246	T244-S246 PolarHBondContact O-N 3.38Å
245	A	24.6	Very low	26.7	Very low	113 Å²	113	125.8 Å²	125.8	93%	0.934	73%	0.734	S	S	*	*			trans	-53.9	111.6	172	0	0	0	0	0	113.1
246	S	25.8	Very low	27.2	Very low	89 Å²	89	129.1 Å²	129.1	62%	0.622	73%	0.732	S	S	*	*			trans	-119.2	115.1	148.9	54.9	0	0	0	0	106.8	T244 N248	T244-S246 PolarHBondContact O-N 3.38Å; S246-N248 PolarHBondContact O-N 2.73Å; S246-N248 PolarHBondContact O-OD1 2.81Å; S246-N248 VanDerWaalsContact O-OD1 3.09Å
247	T	24.3	Very low	27.5	Very low	141 Å²	141	128.6 Å²	128.6	87%	0.865	73%	0.729	S	S	*	*			trans	-61.3	103.1	169.7	33.1	0	0	0	0	108.5	E249	T247-E249 PolarHBondContact O-N 2.69Å; T247-E249 VanDerWaalsContact O-N 3.16Å
248	N	30.1	Very low	28.1	Very low	88 Å²	88	131.2 Å²	131.2	47%	0.471	72%	0.724	S	S	.	*			trans	-66.8	110.2	-177.3	-67.7	-11	0	0	0	110.4	S246 E250 T251	S246-N248 PolarHBondContact O-N 2.73Å; S246-N248 PolarHBondContact O-OD1 2.81Å; S246-N248 VanDerWaalsContact O-OD1 3.09Å; N248-E250 PolarHBondContact O-N 3.29Å; N248-T251 PolarHBondContact O-N 2.74Å; N248-T251 PolarHBondContact O-OG1 2.85Å
249	E	31	Very low	29.1	Very low	170 Å²	170	129.9 Å²	129.9	79%	0.794	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-17.6	168.4	-74	179.6	148.5	0	0	112.9	T247 T251 A252	T247-E249 PolarHBondContact O-N 2.69Å; T247-E249 VanDerWaalsContact O-N 3.16Å; E249-T251 VanDerWaalsContact C-N 3.27Å; E249-T251 PolarHBondContact O-N 2.8Å; E249-A252 PolarHBondContact O-N 3.44Å
250	E	28.5	Very low	31.2	Very low	156 Å²	156	126 Å²	126	73%	0.729	71%	0.706	S	S	*	*	H	α-helix	trans	-64.9	-26.7	172.4	-70.7	179.6	155.5	0	0	113.4	N248 A252 A254	N248-E250 PolarHBondContact O-N 3.29Å; E250-A252 VanDerWaalsContact C-N 3.35Å; E250-A254 PolarHBondContact O-N 3.42Å
251	T	33.7	Very low	33.9	Very low	105 Å²	105	123.4 Å²	123.4	64%	0.644	69%	0.692	S	S	*	*	H	α-helix	trans	-73.8	-25.2	175	55.6	0	0	0	0	113.2	N248 E249 A255	N248-T251 PolarHBondContact O-N 2.74Å; N248-T251 PolarHBondContact O-OG1 2.85Å; E249-T251 VanDerWaalsContact C-N 3.27Å; E249-T251 PolarHBondContact O-N 2.8Å; T251-A255 WeakPolarHBondContact O-CB 3.45Å; T251-A255 PolarHBondContact O-N 3.46Å
252	A	30.4	Very low	36.7	Very low	57 Å²	57	117.6 Å²	117.6	47%	0.471	68%	0.675	S	S	.	*	H	α-helix	trans	-76.1	-42	178.6	0	0	0	0	0	111.8	E249 E250 A255 E256	E249-A252 PolarHBondContact O-N 3.44Å; E250-A252 VanDerWaalsContact C-N 3.35Å; A252-A255 PolarHBondContact O-N 3.49Å; A252-E256 PolarHBondContact O-N 2.71Å
253	K	25.9	Very low	40	Very low	167 Å²	167	110.7 Å²	110.7	73%	0.726	64%	0.639	S	S	*	*	H	α-helix	trans	-71.6	-33.8	179.2	-72.3	-177.3	177.3	176.2	0	113.3	A255	K253-A255 PolarHBondContact O-N 3.05Å
254	A	30.9	Very low	43.3	Very low	64 Å²	64	109.3 Å²	109.3	53%	0.529	62%	0.618	S	S	.	*	H	α-helix	trans	-72.8	-15	175.1	0	0	0	0	0	113.7	E250	E250-A254 PolarHBondContact O-N 3.42Å
255	A	37.4	Very low	46.8	Very low	63 Å²	63	104.1 Å²	104.1	52%	0.521	58%	0.584	S	S	.	*	H	α-helix	trans	-88.2	-30.9	179.1	0	0	0	0	0	113.2	T251 A252 K253	T251-A255 WeakPolarHBondContact O-CB 3.45Å; T251-A255 PolarHBondContact O-N 3.46Å; A252-A255 PolarHBondContact O-N 3.49Å; K253-A255 PolarHBondContact O-N 3.05Å
256	E	36.2	Very low	50.1	Low	174 Å²	174	99.2 Å²	99.2	81%	0.813	54%	0.542	S	S	*	.	H	α-helix	trans	-75.1	-24.7	-174.9	-75.6	-178.7	164.9	0	0	114.1	A252	A252-E256 PolarHBondContact O-N 2.71Å
257	E	30.4	Very low	53.2	Low	178 Å²	178	99.3 Å²	99.3	83%	0.832	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	5.2	-174.3	-120.8	178.2	-165.5	0	0	114.6	V259	E257-V259 PolarHBondContact O-N 3.1Å
258	R	43.1	Very low	56.5	Low	174 Å²	174	93.8 Å²	93.8	66%	0.657	50%	0.501	S	S	*	.			trans	-66.1	104.5	172.7	-76	-176.2	179.4	178	-2.1	109	T260	R258-T260 VanDerWaalsContact C-N 3.29Å; R258-T260 PolarHBondContact O-N 3.41Å
259	V	47.6	Very low	59.5	Low	131 Å²	131	92.7 Å²	92.7	79%	0.794	50%	0.504	S	S	*	.			trans	-58	97.6	161.5	-179.7	0	0	0	0	106.7	E257 L261	E257-V259 PolarHBondContact O-N 3.1Å; V259-L261 PolarHBondContact O-N 3.19Å
260	T	65	Low	62.5	Low	67 Å²	67	87.4 Å²	87.4	41%	0.411	48%	0.48	S	S	.	.			trans	-65	108.7	177.3	49.8	0	0	0	0	107.6	R258	R258-T260 VanDerWaalsContact C-N 3.29Å; R258-T260 PolarHBondContact O-N 3.41Å
261	L	78	Confident	65.6	Low	82 Å²	82	80 Å²	80	43%	0.429	45%	0.445	S	S	.	.			trans	-61.3	145.3	176	-62.2	167.6	0	0	0	108.8	V226 V259 T263 T264	V226-L261 HydrophobicContact CG2-CD1 4.36Å; V259-L261 PolarHBondContact O-N 3.19Å; L261-T263 PolarHBondContact O-N 3.28Å; L261-T264 HydrophobicContact CB-CG2 4.01Å; L261-T264 PolarHBondContact O-N 3.32Å; L261-T264 PolarHBondContact O-OG1 3.5Å
262	P	84.7	Confident	68.6	Low	75 Å²	75	76.1 Å²	76.1	49%	0.487	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-18.4	178.4	-27.5	35.7	0	0	0	114.6	A202 F212 F214	A202-P262 HydrophobicContact CB-CB 4.08Å; F212-P262 HydrophobicContact CZ-CB 4.14Å; F214-P262 WeakPolarHBondContact CD2-O 3.39Å; F214-P262 VanDerWaalsContact CE2-O 3.3Å; F214-P262 WeakPolarHBondContact CE2-O 3.49Å
263	T	88.8	Confident	71.7	Confident	24 Å²	24	77.8 Å²	77.8	15%	0.147	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-14.7	-179.8	54.1	0	0	0	0	114.3	R198 Q199 A202 L261	R198-T263 PolarHBondContact NH1-O 3.29Å; Q199-T263 HydrophobicContact CB-CG2 4.01Å; Q199-T263 HydrophobicContact CG-CG2 4.48Å; A202-T263 HydrophobicContact CB-CG2 3.98Å; L261-T263 PolarHBondContact O-N 3.28Å
264	T	92.6	Very high	75	Confident	35 Å²	35	72.1 Å²	72.1	22%	0.215	40%	0.402	C	S	.	.			trans	-67.2	136.6	-174.8	56.9	0	0	0	0	111.7	L261 L266	L261-T264 HydrophobicContact CB-CG2 4.01Å; L261-T264 PolarHBondContact O-N 3.32Å; L261-T264 PolarHBondContact O-OG1 3.5Å; T264-L266 PolarHBondContact O-N 2.75Å
265	I	93.4	Very high	78	Confident	34 Å²	34	69.2 Å²	69.2	17%	0.174	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.9	169.4	-63.3	172.7	0	0	0	107.9	A190 D191 F214 T222	A190-I265 HydrophobicContact CB-CD1 3.97Å; A190-I265 HydrophobicContact CB-CG1 3.8Å; D191-I265 HydrophobicContact CB-CD1 4.43Å; F214-I265 HydrophobicContact CB-CG1 4.26Å; T222-I265 HydrophobicContact CG2-CD1 4.25Å
266	L	93.5	Very high	80.8	Confident	9 Å²	9	68.6 Å²	68.6	5%	0.047	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	143.8	-174.9	-61.2	-175.1	0	0	0	112.9	A213 F214 W215 T264 E270 L271 I274	A213-L266 HydrophobicContact CB-CD1 3.35Å; A213-L266 HydrophobicContact CB-CG 4.06Å; F214-L266 PolarHBondContact O-N 2.83Å; W215-L266 HydrophobicContact CE3-CB 4.45Å; W215-L266 VanDerWaalsContact CE3-O 3.32Å; W215-L266 WeakPolarHBondContact CZ3-O 3.41Å; T264-L266 PolarHBondContact O-N 2.75Å; L266-E270 WeakPolarHBondContact CA-OE2 3.49Å; L266-E270 HydrophobicContact CB-CB 4.39Å; L266-E270 HydrophobicContact CD2-CB 4.25Å; L266-L271 HydrophobicContact CD1-CB 4.33Å; L266-L271 HydrophobicContact CD1-CD1 4.29Å; L266-I274 HydrophobicContact CD1-CD1 3.53Å; L266-I274 HydrophobicContact CD2-CD1 4.25Å
267	E	92.2	Very high	83.6	Confident	92 Å²	92	68.7 Å²	68.7	43%	0.43	36%	0.356	S	S	.	.			trans	-79.3	162.4	163.4	-65.4	-170.9	178.7	0	0	111.3	R221 A269 E270 L271	R221-E267 IonicContact CZ-OE1 3.47Å; R221-E267 IonicContact NE-OE1 3.31Å; R221-E267 PolarHBondContact NE-OE1 2.98Å; R221-E267 IonicContact NH2-OE1 2.71Å; R221-E267 PolarHBondContact NH2-OE1 3.26Å; E267-A269 VanDerWaalsContact C-N 3.27Å; E267-A269 PolarHBondContact O-N 2.82Å; E267-E270 HydrophobicContact CB-CG 4.38Å; E267-E270 PolarHBondContact N-OE2 2.98Å; E267-E270 PolarHBondContact O-N 3.08Å; E267-E270 VanDerWaalsContact O-N 3.17Å; E267-L271 PolarHBondContact O-N 2.99Å
268	A	92.8	Very high	86.7	Confident	24 Å²	24	62.6 Å²	62.6	20%	0.198	33%	0.328	C	S	.	.	H	α-helix	trans	-56.8	-39.4	-177.3	0	0	0	0	0	113.3	W215 L272	W215-A268 HydrophobicContact CH2-CB 3.89Å; W215-A268 HydrophobicContact CZ3-CB 4.45Å; A268-L272 WeakPolarHBondContact O-CG 3.24Å; A268-L272 PolarHBondContact O-N 2.98Å; A268-L272 VanDerWaalsContact O-N 3.12Å
269	A	92.7	Very high	89.1	Confident	65 Å²	65	55.2 Å²	55.2	54%	0.537	30%	0.301	S	S	.	.	H	α-helix	trans	-67.6	-44.1	178.5	0	0	0	0	0	111.6	E267 L271 L272 T273	E267-A269 VanDerWaalsContact C-N 3.27Å; E267-A269 PolarHBondContact O-N 2.82Å; A269-L271 PolarHBondContact O-N 3.42Å; A269-L272 PolarHBondContact O-N 3.12Å; A269-T273 PolarHBondContact O-N 2.85Å; A269-T273 PolarHBondContact O-OG1 3.3Å
270	E	94.3	Very high	91.3	Very high	60 Å²	60	55.8 Å²	55.8	28%	0.28	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-43.8	179	-61.7	172.6	154.6	0	0	111.2	L266 E267 L272 T273 I274	L266-E270 WeakPolarHBondContact CA-OE2 3.49Å; L266-E270 HydrophobicContact CB-CB 4.39Å; L266-E270 HydrophobicContact CD2-CB 4.25Å; E267-E270 HydrophobicContact CB-CG 4.38Å; E267-E270 PolarHBondContact N-OE2 2.98Å; E267-E270 PolarHBondContact O-N 3.08Å; E267-E270 VanDerWaalsContact O-N 3.17Å; E270-L272 PolarHBondContact O-N 3.46Å; E270-T273 PolarHBondContact O-N 2.99Å; E270-I274 WeakPolarHBondContact O-CG1 3.21Å; E270-I274 PolarHBondContact O-N 3.3Å
271	L	94.8	Very high	92.6	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-59.2	-46.9	174.8	177.4	61.7	0	0	0	111.5	F184 L186 W215 L266 E267 A269 T273 I274 L275 I308	F184-L271 HydrophobicContact CE1-CD1 4.23Å; L186-L271 HydrophobicContact CD1-CD1 3.73Å; L186-L271 HydrophobicContact CD1-CD2 4.04Å; L186-L271 HydrophobicContact CD2-CD2 4Å; W215-L271 HydrophobicContact CD2-CD2 4.26Å; W215-L271 HydrophobicContact CE3-CB 4.32Å; W215-L271 HydrophobicContact CE3-CD2 3.71Å; W215-L271 HydrophobicContact CH2-CD2 4.23Å; W215-L271 HydrophobicContact CZ3-CB 3.98Å; W215-L271 HydrophobicContact CZ3-CD2 3.69Å; W215-L271 HydrophobicContact CZ3-CG 4.49Å; L266-L271 HydrophobicContact CD1-CB 4.33Å; L266-L271 HydrophobicContact CD1-CD1 4.29Å; E267-L271 PolarHBondContact O-N 2.99Å; A269-L271 PolarHBondContact O-N 3.42Å; L271-T273 VanDerWaalsContact C-N 3.34Å; L271-T273 PolarHBondContact O-N 3.06Å; L271-I274 PolarHBondContact O-N 3.16Å; L271-L275 HydrophobicContact CD1-CD1 3.94Å; L271-L275 HydrophobicContact CD1-CG 4.11Å; L271-L275 HydrophobicContact CG-CD1 3.96Å; L271-L275 HydrophobicContact CG-CG 4.47Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.45Å; L271-L275 PolarHBondContact O-N 3.2Å; L271-I308 HydrophobicContact CD2-CD1 4.06Å
272	L	95.4	Very high	93.4	Very high	22 Å²	22	56.2 Å²	56.2	12%	0.115	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-40.9	177.8	-74.5	175.3	0	0	0	111.9	A268 A269 E270 I274 L275 K276 I308 V331 V335	A268-L272 WeakPolarHBondContact O-CG 3.24Å; A268-L272 PolarHBondContact O-N 2.98Å; A268-L272 VanDerWaalsContact O-N 3.12Å; A269-L272 PolarHBondContact O-N 3.12Å; E270-L272 PolarHBondContact O-N 3.46Å; L272-I274 PolarHBondContact O-N 2.9Å; L272-L275 PolarHBondContact O-N 3.1Å; L272-K276 WeakPolarHBondContact O-CB 3.4Å; L272-K276 VanDerWaalsContact O-CG 3.26Å; L272-K276 WeakPolarHBondContact O-CG 3.42Å; L272-K276 PolarHBondContact O-N 2.74Å; L272-I308 HydrophobicContact CD1-CG2 4.01Å; L272-I308 HydrophobicContact CD2-CG2 3.96Å; L272-I308 HydrophobicContact CG-CG2 4.14Å; L272-V331 HydrophobicContact CD1-CG1 4Å; L272-V335 HydrophobicContact CD2-CG1 4.26Å
273	T	95.6	Very high	93.7	Very high	93 Å²	93	56.5 Å²	56.5	57%	0.571	29%	0.292	S	S	*	.	H	α-helix	trans	-60	-45.5	176.4	-61.1	0	0	0	0	111.3	A269 E270 L271 K276 R277	A269-T273 PolarHBondContact O-N 2.85Å; A269-T273 PolarHBondContact O-OG1 3.3Å; E270-T273 PolarHBondContact O-N 2.99Å; L271-T273 VanDerWaalsContact C-N 3.34Å; L271-T273 PolarHBondContact O-N 3.06Å; T273-K276 PolarHBondContact O-N 2.96Å; T273-R277 WeakPolarHBondContact O-CB 3.33Å; T273-R277 PolarHBondContact O-N 2.9Å
274	I	94.9	Very high	93.9	Very high	47 Å²	47	57.5 Å²	57.5	24%	0.241	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-48.8	176.5	-70.5	164.6	0	0	0	110.6	F184 L266 E270 L271 L272 K276 R277 L278	F184-I274 HydrophobicContact CE2-CG2 4.03Å; F184-I274 HydrophobicContact CZ-CG2 4.3Å; L266-I274 HydrophobicContact CD1-CD1 3.53Å; L266-I274 HydrophobicContact CD2-CD1 4.25Å; E270-I274 WeakPolarHBondContact O-CG1 3.21Å; E270-I274 PolarHBondContact O-N 3.3Å; L271-I274 PolarHBondContact O-N 3.16Å; L272-I274 PolarHBondContact O-N 2.9Å; I274-K276 PolarHBondContact O-N 3.31Å; I274-R277 WeakPolarHBondContact O-CB 3.19Å; I274-R277 PolarHBondContact O-N 2.94Å; I274-L278 WeakPolarHBondContact O-CG 3.33Å; I274-L278 PolarHBondContact O-N 3.05Å; I274-L278 VanDerWaalsContact O-N 3.08Å
275	L	95.6	Very high	93.8	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-64.6	-39.6	-178.7	-65.5	174.9	0	0	0	112.2	I152 V154 F184 L271 L272 R277 L278 I291	I152-L275 HydrophobicContact CD1-CB 4.31Å; I152-L275 WeakPolarHBondContact CD1-O 3.34Å; I152-L275 HydrophobicContact CG2-CD2 4.22Å; V154-L275 HydrophobicContact CG2-CD1 4.2Å; V154-L275 HydrophobicContact CG2-CD2 4Å; F184-L275 HydrophobicContact CB-CD2 4.36Å; F184-L275 HydrophobicContact CD1-CD2 4.05Å; F184-L275 HydrophobicContact CD2-CD2 4.24Å; F184-L275 HydrophobicContact CE1-CD2 4.43Å; F184-L275 HydrophobicContact CG-CD2 3.95Å; L271-L275 HydrophobicContact CD1-CD1 3.94Å; L271-L275 HydrophobicContact CD1-CG 4.11Å; L271-L275 HydrophobicContact CG-CD1 3.96Å; L271-L275 HydrophobicContact CG-CG 4.47Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.45Å; L271-L275 PolarHBondContact O-N 3.2Å; L272-L275 PolarHBondContact O-N 3.1Å; L275-R277 VanDerWaalsContact C-N 3.34Å; L275-R277 PolarHBondContact O-N 3.01Å; L275-L278 HydrophobicContact CD2-CD1 4.1Å; L275-L278 PolarHBondContact O-N 2.74Å; L275-I291 HydrophobicContact CB-CD1 3.93Å; L275-I291 HydrophobicContact CD1-CD1 3.9Å; L275-I291 HydrophobicContact CD1-CG2 4.33Å
276	K	95.6	Very high	93.7	Very high	49 Å²	49	69.4 Å²	69.4	21%	0.213	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-43.6	173.2	-74.2	178.2	-176.8	-165.4	0	111.2	L272 T273 I274 L278 R279 Q280 D332 E334 V335	L272-K276 WeakPolarHBondContact O-CB 3.4Å; L272-K276 VanDerWaalsContact O-CG 3.26Å; L272-K276 WeakPolarHBondContact O-CG 3.42Å; L272-K276 PolarHBondContact O-N 2.74Å; T273-K276 PolarHBondContact O-N 2.96Å; I274-K276 PolarHBondContact O-N 3.31Å; K276-L278 VanDerWaalsContact C-N 3.28Å; K276-L278 PolarHBondContact O-N 3.06Å; K276-R279 CarbonylContact O-C 3.59Å; K276-R279 PolarHBondContact O-N 3.26Å; K276-R279 VanDerWaalsContact O-N 3.16Å; K276-Q280 PolarHBondContact O-N 3.28Å; K276-Q280 VanDerWaalsContact O-N 3.1Å; K276-D332 IonicContact NZ-OD1 4Å; K276-D332 IonicContact NZ-OD2 3.58Å; K276-D332 PolarHBondContact NZ-OD2 3.29Å; K276-E334 WeakPolarHBondContact CE-OE2 3.25Å; K276-E334 IonicContact NZ-OE2 2.83Å; K276-E334 PolarHBondContact NZ-OE2 3.11Å; K276-V335 HydrophobicContact CD-CG2 4.2Å; K276-V335 VanDerWaalsContact CE-CG2 3.41Å; K276-V335 HydrophobicContact CG-CG2 3.74Å
277	R	95	Very high	93.7	Very high	177 Å²	177	74.6 Å²	74.6	67%	0.668	38%	0.375	S	S	*	.	H	α-helix	trans	-62.7	-31.9	178.3	-171	175.9	-179.7	175.6	1.1	112.9	T273 I274 L275 R279 Q280	T273-R277 WeakPolarHBondContact O-CB 3.33Å; T273-R277 PolarHBondContact O-N 2.9Å; I274-R277 WeakPolarHBondContact O-CB 3.19Å; I274-R277 PolarHBondContact O-N 2.94Å; L275-R277 VanDerWaalsContact C-N 3.34Å; L275-R277 PolarHBondContact O-N 3.01Å; R277-R279 VanDerWaalsContact C-N 3.25Å; R277-R279 PolarHBondContact O-N 2.92Å; R277-Q280 WeakPolarHBondContact O-CG 3.47Å; R277-Q280 PolarHBondContact O-NE2 3.07Å
278	L	95	Very high	93.9	Very high	49 Å²	49	72.2 Å²	72.2	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-28.8	177	-68.5	172.6	0	0	0	113.1	I152 V182 F184 L211 I274 L275 K276	I152-L278 HydrophobicContact CD1-CB 4.23Å; V182-L278 HydrophobicContact CG1-CB 4.49Å; V182-L278 HydrophobicContact CG1-CD1 4.05Å; F184-L278 HydrophobicContact CD2-CD1 3.6Å; F184-L278 HydrophobicContact CE2-CD1 4.16Å; F184-L278 HydrophobicContact CG-CD1 4.4Å; L211-L278 HydrophobicContact CD1-CD2 4.11Å; I274-L278 WeakPolarHBondContact O-CG 3.33Å; I274-L278 PolarHBondContact O-N 3.05Å; I274-L278 VanDerWaalsContact O-N 3.08Å; L275-L278 HydrophobicContact CD2-CD1 4.1Å; L275-L278 PolarHBondContact O-N 2.74Å; K276-L278 VanDerWaalsContact C-N 3.28Å; K276-L278 PolarHBondContact O-N 3.06Å
279	R	94.3	Very high	94.1	Very high	19 Å²	19	71.2 Å²	71.2	7%	0.072	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125	38.3	179.5	-67.6	-55.7	-50.5	-90.7	9.4	113.5	D151 I152 V182 K276 R277 D281 L282 I289	D151-R279 PolarHBondContact O-NH1 3.47Å; I152-R279 HydrophobicContact CD1-CB 4.15Å; I152-R279 HydrophobicContact CD1-CG 3.71Å; I152-R279 HydrophobicContact CG1-CB 4.37Å; I152-R279 HydrophobicContact CG1-CG 3.45Å; I152-R279 VanDerWaalsContact CG1-CG 3.45Å; V182-R279 HydrophobicContact CG2-CG 4.43Å; K276-R279 CarbonylContact O-C 3.59Å; K276-R279 PolarHBondContact O-N 3.26Å; K276-R279 VanDerWaalsContact O-N 3.16Å; R277-R279 VanDerWaalsContact C-N 3.25Å; R277-R279 PolarHBondContact O-N 2.92Å; R279-D281 VanDerWaalsContact C-OD1 3.23Å; R279-D281 WeakPolarHBondContact CA-OD1 3.45Å; R279-D281 IonicContact CZ-OD1 3.87Å; R279-D281 IonicContact CZ-OD2 2.74Å; R279-D281 IonicContact NE-OD1 3.82Å; R279-D281 PolarHBondContact NE-OD1 3.19Å; R279-D281 IonicContact NE-OD2 3.06Å; R279-D281 PolarHBondContact NE-OD2 3.33Å; R279-D281 IonicContact NH2-OD1 2.96Å; R279-D281 IonicContact NH2-OD2 2.85Å; R279-D281 PolarHBondContact NH2-OD2 2.7Å; R279-D281 PolarHBondContact O-N 3.16Å; R279-L282 HydrophobicContact CB-CD1 4.06Å; R279-L282 HydrophobicContact CB-CG 4.37Å; R279-L282 VanDerWaalsContact NH2-CG 3.33Å; R279-L282 WeakPolarHBondContact O-CB 3.39Å; R279-L282 PolarHBondContact O-N 3.39Å; R279-L282 VanDerWaalsContact O-N 3.14Å; R279-I289 HydrophobicContact CB-CD1 4.25Å; R279-I289 HydrophobicContact CB-CG2 4.31Å
280	Q	92.4	Very high	94.4	Very high	143 Å²	143	68.9 Å²	68.9	67%	0.668	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-10.4	175.4	60.3	-168.9	-36.3	0	0	113.3	K276 R277 L282	K276-Q280 PolarHBondContact O-N 3.28Å; K276-Q280 VanDerWaalsContact O-N 3.1Å; R277-Q280 WeakPolarHBondContact O-CG 3.47Å; R277-Q280 PolarHBondContact O-NE2 3.07Å; Q280-L282 PolarHBondContact O-N 3Å
281	D	93.2	Very high	94.5	Very high	107 Å²	107	66 Å²	66	57%	0.572	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.8	169.2	60.9	-65.6	0	0	0	113.4	R279	R279-D281 VanDerWaalsContact C-OD1 3.23Å; R279-D281 WeakPolarHBondContact CA-OD1 3.45Å; R279-D281 IonicContact CZ-OD1 3.87Å; R279-D281 IonicContact CZ-OD2 2.74Å; R279-D281 IonicContact NE-OD1 3.82Å; R279-D281 PolarHBondContact NE-OD1 3.19Å; R279-D281 IonicContact NE-OD2 3.06Å; R279-D281 PolarHBondContact NE-OD2 3.33Å; R279-D281 IonicContact NH2-OD1 2.96Å; R279-D281 IonicContact NH2-OD2 2.85Å; R279-D281 PolarHBondContact NH2-OD2 2.7Å; R279-D281 PolarHBondContact O-N 3.16Å
282	L	93.7	Very high	94.7	Very high	52 Å²	52	66 Å²	66	27%	0.272	32%	0.324	S	S	.	.	S	Bend	trans	-83.6	135.6	-177.7	-68.1	-179.2	0	0	0	112.3	D151 R279 Q280 T284 I289	D151-L282 HydrophobicContact CB-CD1 3.88Å; R279-L282 HydrophobicContact CB-CD1 4.06Å; R279-L282 HydrophobicContact CB-CG 4.37Å; R279-L282 VanDerWaalsContact NH2-CG 3.33Å; R279-L282 WeakPolarHBondContact O-CB 3.39Å; R279-L282 PolarHBondContact O-N 3.39Å; R279-L282 VanDerWaalsContact O-N 3.14Å; Q280-L282 PolarHBondContact O-N 3Å; L282-T284 PolarHBondContact O-N 3.4Å; L282-I289 HydrophobicContact CB-CG1 4.45Å; L282-I289 HydrophobicContact CD1-CG1 4.2Å
283	D	92.8	Very high	94.8	Very high	80 Å²	80	65 Å²	65	43%	0.428	32%	0.319	S	S	.	.			trans	-75.6	90.6	172.1	-178.1	8.9	0	0	0	111.1	S285 R286 K287	D283-S285 VanDerWaalsContact CG-OG 3.29Å; D283-S285 PolarHBondContact O-N 2.81Å; D283-S285 VanDerWaalsContact OD1-CB 3.28Å; D283-S285 WeakPolarHBondContact OD1-CB 3.43Å; D283-S285 PolarHBondContact OD1-N 3.23Å; D283-S285 VanDerWaalsContact OD1-N 3.13Å; D283-S285 PolarHBondContact OD1-OG 2.88Å; D283-S285 PolarHBondContact OD2-OG 3.22Å; D283-R286 PolarHBondContact O-N 3.08Å; D283-R286 VanDerWaalsContact OD2-CD 3.3Å; D283-R286 WeakPolarHBondContact OD2-CD 3.16Å; D283-R286 WeakPolarHBondContact OD2-CG 3.11Å; D283-R286 IonicContact OD2-NE 3.22Å; D283-R286 PolarHBondContact OD2-NE 3.12Å; D283-K287 PolarHBondContact O-N 2.78Å
284	T	91.6	Very high	94.8	Very high	45 Å²	45	60.7 Å²	60.7	28%	0.276	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.6	179.1	55.5	0	0	0	0	113.7	L282 R286 K287 I289 E334	L282-T284 PolarHBondContact O-N 3.4Å; T284-R286 VanDerWaalsContact C-N 3.28Å; T284-R286 PolarHBondContact O-N 2.8Å; T284-K287 WeakPolarHBondContact CA-O 3.33Å; T284-I289 HydrophobicContact CG2-CD1 3.91Å; T284-I289 HydrophobicContact CG2-CG1 3.91Å; T284-E334 HydrophobicContact CG2-CB 4.13Å; T284-E334 HydrophobicContact CG2-CG 4.42Å
285	S	91.3	Very high	94.8	Very high	101 Å²	101	58.6 Å²	58.6	71%	0.706	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-27.8	176.9	78.3	0	0	0	0	112.6	D283	D283-S285 VanDerWaalsContact CG-OG 3.29Å; D283-S285 PolarHBondContact O-N 2.81Å; D283-S285 VanDerWaalsContact OD1-CB 3.28Å; D283-S285 WeakPolarHBondContact OD1-CB 3.43Å; D283-S285 PolarHBondContact OD1-N 3.23Å; D283-S285 VanDerWaalsContact OD1-N 3.13Å; D283-S285 PolarHBondContact OD1-OG 2.88Å; D283-S285 PolarHBondContact OD2-OG 3.22Å
286	R	90.7	Very high	94.8	Very high	219 Å²	219	59 Å²	59	83%	0.826	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-44.4	178.6	-68.7	179.7	-174.9	-160	-2.4	112.5	D283 T284	D283-R286 PolarHBondContact O-N 3.08Å; D283-R286 VanDerWaalsContact OD2-CD 3.3Å; D283-R286 WeakPolarHBondContact OD2-CD 3.16Å; D283-R286 WeakPolarHBondContact OD2-CG 3.11Å; D283-R286 IonicContact OD2-NE 3.22Å; D283-R286 PolarHBondContact OD2-NE 3.12Å; T284-R286 VanDerWaalsContact C-N 3.28Å; T284-R286 PolarHBondContact O-N 2.8Å
287	K	94	Very high	94.7	Very high	117 Å²	117	57.2 Å²	57.2	51%	0.509	28%	0.277	S	S	.	.	S	Bend	trans	-146.9	131.6	-175.1	-174.7	-169.1	169	-156.4	0	109.8	D283 T284	D283-K287 PolarHBondContact O-N 2.78Å; T284-K287 WeakPolarHBondContact CA-O 3.33Å
288	P	96.2	Very high	94.5	Very high	42 Å²	42	50.5 Å²	50.5	27%	0.273	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-65.9	148	175.1	28.6	-34.9	0	0	0	111.3	V290 E334	P288-V290 PolarHBondContact O-N 3.29Å; P288-E334 CarbonylContact C-O 3.6Å; P288-E334 VanDerWaalsContact CA-O 3.25Å; P288-E334 WeakPolarHBondContact CA-O 2.92Å; P288-E334 WeakPolarHBondContact CB-O 3.03Å
289	I	97.4	Very high	94.5	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	122.8	168	-59.3	168.1	0	0	0	108	D151 I152 R279 L282 T284 I291 E334 V335 T336	D151-I289 HydrophobicContact CB-CG2 4.25Å; I152-I289 HydrophobicContact CD1-CG2 4.06Å; I152-I289 HydrophobicContact CG1-CG2 4.45Å; R279-I289 HydrophobicContact CB-CD1 4.25Å; R279-I289 HydrophobicContact CB-CG2 4.31Å; L282-I289 HydrophobicContact CB-CG1 4.45Å; L282-I289 HydrophobicContact CD1-CG1 4.2Å; T284-I289 HydrophobicContact CG2-CD1 3.91Å; T284-I289 HydrophobicContact CG2-CG1 3.91Å; I289-I291 HydrophobicContact CG2-CG1 4.2Å; I289-E334 PolarHBondContact N-O 3.11Å; I289-V335 WeakPolarHBondContact O-CA 3.44Å; I289-T336 PolarHBondContact O-N 3.01Å
290	V	97.9	Very high	94.4	Very high	16 Å²	16	48.1 Å²	48.1	10%	0.097	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	118.6	178.4	-175.5	0	0	0	0	109.4	R149 S150 D151 I152 P288 T336 C338	R149-V290 HydrophobicContact CB-CG1 4.5Å; R149-V290 WeakPolarHBondContact O-CB 3.4Å; R149-V290 WeakPolarHBondContact O-CG1 3.41Å; S150-V290 CarbonylContact C-O 3.5Å; S150-V290 WeakPolarHBondContact CA-O 3.42Å; D151-V290 PolarHBondContact N-O 2.91Å; D151-V290 PolarHBondContact OD2-N 3.15Å; I152-V290 PolarHBondContact N-O 2.98Å; P288-V290 PolarHBondContact O-N 3.29Å; V290-T336 CarbonylContact C-O 3.43Å; V290-T336 WeakPolarHBondContact CA-O 3.46Å; V290-C338 VanDerWaalsContact CG1-SG 3.58Å
291	I	98.2	Very high	94.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	113.9	179.5	-53.6	177.1	0	0	0	108.6	I152 V154 L275 I289 M293 V335 T336 L337 C338	I152-I291 HydrophobicContact CD1-CG1 4.47Å; I152-I291 CarbonylContact O-C 3.52Å; I152-I291 WeakPolarHBondContact O-CA 3.48Å; V154-I291 HydrophobicContact CB-CG2 4.43Å; V154-I291 HydrophobicContact CG2-CG2 3.5Å; V154-I291 VanDerWaalsContact CG2-CG2 3.5Å; L275-I291 HydrophobicContact CB-CD1 3.93Å; L275-I291 HydrophobicContact CD1-CD1 3.9Å; L275-I291 HydrophobicContact CD1-CG2 4.33Å; I289-I291 HydrophobicContact CG2-CG1 4.2Å; I291-M293 HydrophobicContact CG2-SD 4.2Å; I291-V335 HydrophobicContact CD1-CG1 3.51Å; I291-V335 HydrophobicContact CG1-CG1 4.14Å; I291-T336 PolarHBondContact N-O 3.06Å; I291-L337 HydrophobicContact CB-CD2 3.74Å; I291-L337 HydrophobicContact CD1-CD2 4.17Å; I291-L337 HydrophobicContact CG1-CD2 4.43Å; I291-L337 HydrophobicContact CG2-CD2 4.07Å; I291-L337 CarbonylContact O-C 3.53Å; I291-L337 WeakPolarHBondContact O-CA 3.25Å; I291-C338 PolarHBondContact O-N 3.02Å
292	G	97.8	Very high	94.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.3	178.8	0	0	0	0	0	111.7	V146 I152 V153 V154	V146-G292 VanDerWaalsContact CG1-CA 3.49Å; I152-G292 PolarHBondContact O-N 3.09Å; V153-G292 CarbonylContact C-O 3.56Å; V154-G292 PolarHBondContact N-O 3.32Å
293	M	97.2	Very high	94.6	Very high	2 Å²	2	37 Å²	37	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.2	177.2	-53	-64.6	-83.5	0	0	109.5	V154 L156 L186 I291 K301 T304 I305 C338	V154-M293 HydrophobicContact CB-SD 3.79Å; V154-M293 HydrophobicContact CG1-CE 4.36Å; V154-M293 HydrophobicContact CG1-SD 4.11Å; V154-M293 HydrophobicContact CG2-SD 4.23Å; L156-M293 HydrophobicContact CD1-CB 4.26Å; L156-M293 HydrophobicContact CD1-CE 3.55Å; L156-M293 HydrophobicContact CD1-SD 4.24Å; L156-M293 HydrophobicContact CD2-CE 4.38Å; L156-M293 HydrophobicContact CG-CE 4.45Å; L186-M293 HydrophobicContact CD2-CE 4.49Å; I291-M293 HydrophobicContact CG2-SD 4.2Å; M293-K301 HydrophobicContact CB-CD 3.79Å; M293-K301 HydrophobicContact CB-CG 3.79Å; M293-K301 WeakPolarHBondContact O-CD 3.28Å; M293-T304 HydrophobicContact CE-CG2 3.79Å; M293-I305 HydrophobicContact CB-CD1 4.38Å; M293-I305 HydrophobicContact CE-CG1 4.49Å; M293-I305 HydrophobicContact CG-CD1 4.13Å; M293-I305 HydrophobicContact CG-CG1 4.2Å; M293-C338 WeakPolarHBondContact CB-O 3.43Å; M293-C338 PolarHBondContact N-O 3.24Å
294	V	96.5	Very high	94.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	158.7	-178.1	-61	0	0	0	0	111	L143 V146 V153 V154 Q155 L156 L170	L143-V294 HydrophobicContact CD1-CB 4.12Å; L143-V294 HydrophobicContact CD1-CG1 3.63Å; V146-V294 HydrophobicContact CB-CG1 4.3Å; V146-V294 HydrophobicContact CG1-CG1 3.66Å; V153-V294 HydrophobicContact CG1-CG1 4.34Å; V153-V294 HydrophobicContact CG1-CG2 3.44Å; V153-V294 VanDerWaalsContact CG1-CG2 3.44Å; V154-V294 PolarHBondContact O-N 3.17Å; Q155-V294 WeakPolarHBondContact CA-O 3.48Å; Q155-V294 HydrophobicContact CB-CG2 4.18Å; L156-V294 PolarHBondContact N-O 3.4Å; L170-V294 HydrophobicContact CD2-CG2 3.69Å
295	G	94.6	Very high	94.9	Very high	4 Å²	4	31 Å²	31	4%	0.041	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.8	177.7	179.2	0	0	0	0	0	112.7	G342 L343	G295-G342 WeakPolarHBondContact O-CA 3.19Å; G295-L343 PolarHBondContact O-N 2.8Å
296	Y	94.8	Very high	95.1	Very high	13 Å²	13	27 Å²	27	5%	0.051	13%	0.134	C	C	.	.			trans	-70.5	167.1	176.4	-72.2	-100.5	0	0	0	112.4	F165 V167 V299 L343 V344 F345 M360	F165-Y296 HydrophobicContact CB-CD2 4.23Å; F165-Y296 HydrophobicContact CD1-CD2 4.07Å; F165-Y296 HydrophobicContact CD1-CG 4.12Å; F165-Y296 VanDerWaalsContact O-CD2 3.28Å; F165-Y296 WeakPolarHBondContact O-CD2 3.44Å; F165-Y296 WeakPolarHBondContact O-CE2 3.46Å; V167-Y296 HydrophobicContact CG2-CE2 3.56Å; Y296-V299 VanDerWaalsContact O-CG2 3.24Å; Y296-V299 WeakPolarHBondContact O-CG2 3.37Å; Y296-L343 WeakPolarHBondContact CA-O 3.22Å; Y296-L343 WeakPolarHBondContact CD1-O 3.44Å; Y296-V344 HydrophobicContact CD1-CG1 4.48Å; Y296-V344 HydrophobicContact CE1-CG1 4.3Å; Y296-F345 HydrophobicContact CD1-CD2 4.34Å; Y296-F345 HydrophobicContact CD2-CD2 4.34Å; Y296-F345 HydrophobicContact CE1-CB 4.37Å; Y296-F345 AromaticContact CE1-CD2 3.87Å; Y296-F345 HydrophobicContact CE1-CD2 3.87Å; Y296-F345 AromaticContact CE2-CD2 3.85Å; Y296-F345 HydrophobicContact CE2-CD2 3.85Å; Y296-F345 HydrophobicContact CE2-CE2 4.38Å; Y296-F345 AromaticContact CZ-CD2 3.6Å; Y296-M360 HydrophobicContact CD1-CE 3.8Å; Y296-M360 HydrophobicContact CD1-CG 4.06Å; Y296-M360 HydrophobicContact CD1-SD 3.72Å; Y296-M360 HydrophobicContact CD2-CE 4.13Å; Y296-M360 HydrophobicContact CE1-CE 4.08Å; Y296-M360 HydrophobicContact CE1-SD 3.97Å; Y296-M360 HydrophobicContact CE2-CE 4.4Å; Y296-M360 HydrophobicContact CG-CE 3.82Å; Y296-M360 HydrophobicContact CG-CG 4.41Å; Y296-M360 HydrophobicContact CG-SD 4.3Å
297	P	93.4	Very high	95.3	Very high	10 Å²	10	19.5 Å²	19.5	7%	0.065	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	151.9	167.6	-24.4	35.2	0	0	0	112.7	V299 P320 V344	P297-V299 PolarHBondContact O-N 2.76Å; P297-P320 HydrophobicContact CB-CB 3.79Å; P297-P320 HydrophobicContact CB-CG 4.1Å; P297-P320 HydrophobicContact CG-CB 4.31Å; P297-V344 HydrophobicContact CG-CG2 3.88Å
298	N	91.9	Very high	95.3	Very high	36 Å²	36	14.6 Å²	14.6	19%	0.193	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	11.2	172.6	-69.3	-20.7	0	0	0	118.1	K189 G300 A318 G359	K189-N298 WeakPolarHBondContact CE-O 3.29Å; K189-N298 PolarHBondContact NZ-O 3.26Å; N298-G300 PolarHBondContact O-N 3.11Å; N298-A318 VanDerWaalsContact CG-O 3.25Å; N298-A318 PolarHBondContact ND2-O 2.91Å; N298-A318 PolarHBondContact OD1-O 3.22Å; N298-A318 VanDerWaalsContact OD1-O 3.08Å; N298-G359 WeakPolarHBondContact CB-O 3.33Å; N298-G359 PolarHBondContact ND2-O 2.97Å
299	V	94.1	Very high	95.2	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.006	8%	0.083	C	C	.	.	S	Bend	trans	-74.2	2.1	167.5	-57.3	0	0	0	0	113.7	L156 F165 S188 Y296 P297 K301	L156-V299 HydrophobicContact CB-CB 4.27Å; L156-V299 HydrophobicContact CB-CG2 3.65Å; F165-V299 HydrophobicContact CD1-CG1 3.19Å; F165-V299 HydrophobicContact CE1-CG1 3.39Å; F165-V299 HydrophobicContact CG-CG1 4.03Å; F165-V299 HydrophobicContact CZ-CG1 4.37Å; S188-V299 VanDerWaalsContact CB-O 3.25Å; S188-V299 WeakPolarHBondContact CB-O 3.3Å; S188-V299 PolarHBondContact OG-O 2.71Å; Y296-V299 VanDerWaalsContact O-CG2 3.24Å; Y296-V299 WeakPolarHBondContact O-CG2 3.37Å; P297-V299 PolarHBondContact O-N 2.76Å; V299-K301 HydrophobicContact CG2-CB 4.25Å
300	G	92.6	Very high	94.9	Very high	17 Å²	17	17.8 Å²	17.8	18%	0.175	12%	0.119	C	C	.	.	S	Bend	trans	82.5	12.2	176.4	0	0	0	0	0	116	N298 S302 S303 T304	N298-G300 PolarHBondContact O-N 3.11Å; G300-S302 PolarHBondContact O-N 3.19Å; G300-S303 CarbonylContact O-C 3.59Å; G300-S303 WeakPolarHBondContact O-CA 3.41Å; G300-S303 WeakPolarHBondContact O-CB 3.38Å; G300-S303 PolarHBondContact O-N 3.39Å; G300-T304 PolarHBondContact O-N 3.42Å; G300-T304 PolarHBondContact O-OG1 2.84Å
301	K	94.7	Very high	94.6	Very high	11 Å²	11	19 Å²	19	5%	0.048	13%	0.131	C	C	.	.	H	α-helix	trans	-45.8	-57.3	178.9	-176.9	177.2	50.8	52.2	0	116	L156 M293 V299 S303 T304 I305 D339 A340	L156-K301 HydrophobicContact CD1-CG 4.26Å; L156-K301 VanDerWaalsContact CD2-CA 3.48Å; L156-K301 HydrophobicContact CD2-CB 3.98Å; L156-K301 HydrophobicContact CD2-CG 4.44Å; M293-K301 HydrophobicContact CB-CD 3.79Å; M293-K301 HydrophobicContact CB-CG 3.79Å; M293-K301 WeakPolarHBondContact O-CD 3.28Å; V299-K301 HydrophobicContact CG2-CB 4.25Å; K301-S303 PolarHBondContact O-N 3.44Å; K301-T304 WeakPolarHBondContact O-CB 3.41Å; K301-T304 PolarHBondContact O-N 3.2Å; K301-I305 HydrophobicContact CG-CD1 4.39Å; K301-I305 WeakPolarHBondContact O-CG1 3.3Å; K301-I305 PolarHBondContact O-N 3Å; K301-D339 WeakPolarHBondContact CD-OD1 3.34Å; K301-D339 WeakPolarHBondContact CE-OD1 3.42Å; K301-D339 VanDerWaalsContact CG-OD1 3.27Å; K301-D339 WeakPolarHBondContact CG-OD1 3.41Å; K301-D339 IonicContact NZ-OD1 2.7Å; K301-D339 PolarHBondContact NZ-OD1 3.46Å; K301-D339 IonicContact NZ-OD2 3.45Å; K301-D339 PolarHBondContact NZ-OD2 3.35Å; K301-A340 WeakPolarHBondContact CE-O 3.44Å; K301-A340 PolarHBondContact NZ-O 3.37Å
302	S	94.4	Very high	94.3	Very high	13 Å²	13	27.2 Å²	27.2	9%	0.091	17%	0.166	C	C	.	.	H	α-helix	trans	-71.9	-20.6	-178.8	-51.8	0	0	0	0	112.7	G300 N306 T323 D339	G300-S302 PolarHBondContact O-N 3.19Å; S302-N306 PolarHBondContact O-N 2.98Å; S302-N306 PolarHBondContact O-ND2 2.99Å; S302-T323 PolarHBondContact OG-OG1 3.34Å; S302-D339 PolarHBondContact OG-OD2 3.19Å
303	S	94	Very high	93.9	Very high	44 Å²	44	36.3 Å²	36.3	31%	0.308	20%	0.2	S	C	.	.	H	α-helix	trans	-73.4	-43.4	170.5	-59.4	0	0	0	0	111.3	N217 G300 K301 I305 N306 K307 V316	N217-S303 VanDerWaalsContact ND2-CB 3.33Å; N217-S303 WeakPolarHBondContact ND2-CB 3.18Å; G300-S303 CarbonylContact O-C 3.59Å; G300-S303 WeakPolarHBondContact O-CA 3.41Å; G300-S303 WeakPolarHBondContact O-CB 3.38Å; G300-S303 PolarHBondContact O-N 3.39Å; K301-S303 PolarHBondContact O-N 3.44Å; S303-I305 VanDerWaalsContact C-N 3.28Å; S303-I305 PolarHBondContact O-N 3.02Å; S303-N306 PolarHBondContact O-N 3.16Å; S303-K307 WeakPolarHBondContact O-CB 3.48Å; S303-K307 PolarHBondContact O-N 2.97Å; S303-V316 WeakPolarHBondContact OG-CG1 3.32Å
304	T	96	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.1	-44	172.7	-63.1	0	0	0	0	111.1	L156 L186 W215 N217 M293 G300 K301 N306 K307 I308	L156-T304 HydrophobicContact CD2-CG2 4.43Å; L186-T304 HydrophobicContact CD2-CG2 3.85Å; W215-T304 HydrophobicContact CZ2-CG2 4.02Å; W215-T304 PolarHBondContact NE1-OG1 3.02Å; W215-T304 VanDerWaalsContact NE1-OG1 3.13Å; N217-T304 VanDerWaalsContact OD1-CA 3.26Å; N217-T304 WeakPolarHBondContact OD1-CA 3.47Å; N217-T304 PolarHBondContact OD1-N 2.69Å; M293-T304 HydrophobicContact CE-CG2 3.79Å; G300-T304 PolarHBondContact O-N 3.42Å; G300-T304 PolarHBondContact O-OG1 2.84Å; K301-T304 WeakPolarHBondContact O-CB 3.41Å; K301-T304 PolarHBondContact O-N 3.2Å; T304-N306 PolarHBondContact O-N 3.28Å; T304-K307 WeakPolarHBondContact O-CB 3.36Å; T304-K307 PolarHBondContact O-N 2.85Å; T304-I308 HydrophobicContact CG2-CD1 3.82Å; T304-I308 HydrophobicContact CG2-CG1 4.42Å; T304-I308 WeakPolarHBondContact O-CG1 3.32Å; T304-I308 PolarHBondContact O-N 3.11Å
305	I	95.1	Very high	93.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-47.8	176.6	-70.9	164.4	0	0	0	112	M293 K301 S303 K307 I308 L309 V314 L329 L337 D339	M293-I305 HydrophobicContact CB-CD1 4.38Å; M293-I305 HydrophobicContact CE-CG1 4.49Å; M293-I305 HydrophobicContact CG-CD1 4.13Å; M293-I305 HydrophobicContact CG-CG1 4.2Å; K301-I305 HydrophobicContact CG-CD1 4.39Å; K301-I305 WeakPolarHBondContact O-CG1 3.3Å; K301-I305 PolarHBondContact O-N 3Å; S303-I305 VanDerWaalsContact C-N 3.28Å; S303-I305 PolarHBondContact O-N 3.02Å; I305-K307 PolarHBondContact O-N 3.39Å; I305-I308 PolarHBondContact O-N 3.47Å; I305-L309 HydrophobicContact CG2-CD1 3.7Å; I305-L309 HydrophobicContact CG2-CG 4.41Å; I305-L309 WeakPolarHBondContact O-CB 3.2Å; I305-L309 VanDerWaalsContact O-CG 3.28Å; I305-L309 WeakPolarHBondContact O-CG 3.28Å; I305-L309 PolarHBondContact O-N 2.84Å; I305-V314 HydrophobicContact CG2-CG2 4.11Å; I305-L329 HydrophobicContact CG2-CD1 3.35Å; I305-L337 HydrophobicContact CG1-CD1 4.27Å; I305-L337 HydrophobicContact CG2-CD1 4.38Å; I305-D339 HydrophobicContact CD1-CB 3.48Å; I305-D339 VanDerWaalsContact CD1-CB 3.48Å; I305-D339 VanDerWaalsContact CD1-OD1 3.24Å; I305-D339 WeakPolarHBondContact CD1-OD1 3.36Å
306	N	94.9	Very high	93.1	Very high	18 Å²	18	41.6 Å²	41.6	10%	0.096	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-34.6	177.1	-75.4	-32.5	0	0	0	112.2	S302 S303 T304 G310 A311 R313 V314	S302-N306 PolarHBondContact O-N 2.98Å; S302-N306 PolarHBondContact O-ND2 2.99Å; S303-N306 PolarHBondContact O-N 3.16Å; T304-N306 PolarHBondContact O-N 3.28Å; N306-G310 PolarHBondContact O-N 3.5Å; N306-G310 VanDerWaalsContact O-N 3.12Å; N306-A311 WeakPolarHBondContact CA-O 3.43Å; N306-A311 PolarHBondContact O-N 3.23Å; N306-A311 VanDerWaalsContact O-N 3.16Å; N306-A311 PolarHBondContact OD1-O 3.25Å; N306-R313 PolarHBondContact OD1-N 3.08Å; N306-V314 PolarHBondContact ND2-O 3.45Å; N306-V314 PolarHBondContact OD1-N 2.98Å
307	K	94.8	Very high	92.7	Very high	60 Å²	60	43.7 Å²	43.7	26%	0.261	25%	0.253	S	S	.	.	H	α-helix	trans	-68.1	-46.8	176.9	-175.1	67.7	173.8	-168.4	0	111.4	W215 D219 S303 T304 I305 L309 G310	W215-K307 HydrophobicContact CH2-CG 3.98Å; W215-K307 HydrophobicContact CZ2-CB 3.91Å; W215-K307 HydrophobicContact CZ2-CG 3.55Å; D219-K307 IonicContact OD1-NZ 2.72Å; D219-K307 PolarHBondContact OD1-NZ 3.33Å; D219-K307 IonicContact OD2-NZ 3.74Å; D219-K307 PolarHBondContact OD2-NZ 3.06Å; S303-K307 WeakPolarHBondContact O-CB 3.48Å; S303-K307 PolarHBondContact O-N 2.97Å; T304-K307 WeakPolarHBondContact O-CB 3.36Å; T304-K307 PolarHBondContact O-N 2.85Å; I305-K307 PolarHBondContact O-N 3.39Å; K307-L309 VanDerWaalsContact C-N 3.33Å; K307-L309 PolarHBondContact O-N 3.02Å; K307-G310 PolarHBondContact O-N 3.21Å; K307-G310 VanDerWaalsContact O-N 3.15Å
308	I	94.6	Very high	92.3	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.077	28%	0.284	C	S	.	.	H	α-helix	trans	-60.5	-42.7	175.2	-67	167.5	0	0	0	111	W215 L271 L272 T304 I305 G310 V331 L337	W215-I308 HydrophobicContact CH2-CG1 4.16Å; W215-I308 HydrophobicContact CZ2-CG1 4.36Å; L271-I308 HydrophobicContact CD2-CD1 4.06Å; L272-I308 HydrophobicContact CD1-CG2 4.01Å; L272-I308 HydrophobicContact CD2-CG2 3.96Å; L272-I308 HydrophobicContact CG-CG2 4.14Å; T304-I308 HydrophobicContact CG2-CD1 3.82Å; T304-I308 HydrophobicContact CG2-CG1 4.42Å; T304-I308 WeakPolarHBondContact O-CG1 3.32Å; T304-I308 PolarHBondContact O-N 3.11Å; I305-I308 PolarHBondContact O-N 3.47Å; I308-G310 PolarHBondContact O-N 3.02Å; I308-V331 HydrophobicContact CG2-CG1 4.3Å; I308-V331 HydrophobicContact CG2-CG2 4.28Å; I308-L337 HydrophobicContact CB-CD1 4.29Å; I308-L337 HydrophobicContact CD1-CD1 4.2Å; I308-L337 HydrophobicContact CG2-CD1 3.99Å
309	L	93.9	Very high	91.9	Very high	39 Å²	39	49.2 Å²	49.2	20%	0.204	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.2	179.3	-66.4	172.1	0	0	0	113.8	I305 K307 A311 R313 L329 V331	I305-L309 HydrophobicContact CG2-CD1 3.7Å; I305-L309 HydrophobicContact CG2-CG 4.41Å; I305-L309 WeakPolarHBondContact O-CB 3.2Å; I305-L309 VanDerWaalsContact O-CG 3.28Å; I305-L309 WeakPolarHBondContact O-CG 3.28Å; I305-L309 PolarHBondContact O-N 2.84Å; K307-L309 VanDerWaalsContact C-N 3.33Å; K307-L309 PolarHBondContact O-N 3.02Å; L309-A311 PolarHBondContact O-N 2.89Å; L309-R313 HydrophobicContact CB-CG 4.48Å; L309-R313 HydrophobicContact CD1-CB 3.97Å; L309-R313 HydrophobicContact CD1-CG 3.86Å; L309-L329 HydrophobicContact CD1-CB 4.17Å; L309-L329 HydrophobicContact CD1-CD1 4.18Å; L309-V331 HydrophobicContact CD2-CB 4.3Å; L309-V331 HydrophobicContact CD2-CG2 3.82Å
310	G	91.8	Very high	91.4	Very high	74 Å²	74	50.9 Å²	50.9	76%	0.763	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	10	-174.9	0	0	0	0	0	114.7	N306 K307 I308	N306-G310 PolarHBondContact O-N 3.5Å; N306-G310 VanDerWaalsContact O-N 3.12Å; K307-G310 PolarHBondContact O-N 3.21Å; K307-G310 VanDerWaalsContact O-N 3.15Å; I308-G310 PolarHBondContact O-N 3.02Å
311	A	91.1	Very high	91	Very high	42 Å²	42	51.9 Å²	51.9	35%	0.347	32%	0.318	S	S	.	.	S	Bend	trans	-152.1	147.8	-173.6	0	0	0	0	0	111.3	N306 L309 R313	N306-A311 WeakPolarHBondContact CA-O 3.43Å; N306-A311 PolarHBondContact O-N 3.23Å; N306-A311 VanDerWaalsContact O-N 3.16Å; N306-A311 PolarHBondContact OD1-O 3.25Å; L309-A311 PolarHBondContact O-N 2.89Å; A311-R313 HydrophobicContact CB-CG 4.46Å; A311-R313 PolarHBondContact O-N 3.13Å
312	K	91.4	Very high	90.6	Very high	172 Å²	172	56.6 Å²	56.6	75%	0.748	34%	0.339	S	S	*	.			trans	-75.9	84	177.1	-169.7	178.2	-177.5	175.5	0	111.2
313	R	91	Very high	90.3	Very high	191 Å²	191	56.7 Å²	56.7	72%	0.721	34%	0.339	S	S	*	.			trans	-90.9	-33.3	177.5	-64.5	-69.4	-170.2	146.9	2.8	112.6	N306 L309 A311	N306-R313 PolarHBondContact OD1-N 3.08Å; L309-R313 HydrophobicContact CB-CG 4.48Å; L309-R313 HydrophobicContact CD1-CB 3.97Å; L309-R313 HydrophobicContact CD1-CG 3.86Å; A311-R313 HydrophobicContact CB-CG 4.46Å; A311-R313 PolarHBondContact O-N 3.13Å
314	V	90.7	Very high	89.9	Confident	6 Å²	6	58 Å²	58	4%	0.036	34%	0.339	C	S	.	.	S	Bend	trans	-113.3	144.6	-177.1	-173.8	0	0	0	0	110.4	I305 N306 Q327 L329	I305-V314 HydrophobicContact CG2-CG2 4.11Å; N306-V314 PolarHBondContact ND2-O 3.45Å; N306-V314 PolarHBondContact OD1-N 2.98Å; V314-Q327 VanDerWaalsContact CG1-OE1 3.23Å; V314-Q327 VanDerWaalsContact CG2-OE1 3.32Å; V314-L329 HydrophobicContact CG2-CD1 3.5Å; V314-L329 VanDerWaalsContact CG2-CD1 3.5Å; V314-L329 HydrophobicContact CG2-CD2 4.39Å
315	A	90.3	Very high	89.6	Confident	49 Å²	49	63.2 Å²	63.2	41%	0.405	36%	0.363	S	S	.	.			trans	-76	136	175.3	0	0	0	0	0	111.2
316	V	90	Very high	89.4	Confident	62 Å²	62	64.7 Å²	64.7	38%	0.376	37%	0.371	S	S	.	.			trans	-117.2	150.6	179.5	-62.8	0	0	0	0	110.5	S303	S303-V316 WeakPolarHBondContact OG-CG1 3.32Å
317	S	87	Confident	89.3	Confident	57 Å²	57	67.1 Å²	67.1	40%	0.399	38%	0.382	S	S	.	.			trans	-154.5	148.6	179.7	177	0	0	0	0	109.2	T319	S317-T319 VanDerWaalsContact C-N 3.34Å; S317-T319 PolarHBondContact OG-N 3.15Å; S317-T319 PolarHBondContact OG-O 2.9Å
318	A	84.2	Confident	89.4	Confident	87 Å²	87	68 Å²	68	72%	0.719	39%	0.392	S	S	*	.	S	Bend	trans	-83.9	-12.2	168.5	0	0	0	0	0	112.5	N298	N298-A318 VanDerWaalsContact CG-O 3.25Å; N298-A318 PolarHBondContact ND2-O 2.91Å; N298-A318 PolarHBondContact OD1-O 3.22Å; N298-A318 VanDerWaalsContact OD1-O 3.08Å
319	T	83.3	Confident	89.5	Confident	75 Å²	75	68.8 Å²	68.8	46%	0.46	40%	0.396	S	S	.	.	S	Bend	trans	-84.9	130.6	170.5	-51.2	0	0	0	0	109.3	S317	S317-T319 VanDerWaalsContact C-N 3.34Å; S317-T319 PolarHBondContact OG-N 3.15Å; S317-T319 PolarHBondContact OG-O 2.9Å
320	P	83.7	Confident	89.5	Confident	36 Å²	36	71.9 Å²	71.9	23%	0.234	42%	0.417	C	S	.	.	S	Bend	trans	-52.4	155.5	174.1	-29.7	37.6	0	0	0	114.1	P297	P297-P320 HydrophobicContact CB-CB 3.79Å; P297-P320 HydrophobicContact CB-CG 4.1Å; P297-P320 HydrophobicContact CG-CB 4.31Å
321	G	84.3	Confident	89.7	Confident	38 Å²	38	70.1 Å²	70.1	39%	0.392	39%	0.391	S	S	.	.			trans	84.1	15.5	173.3	0	0	0	0	0	116.3
322	K	86.2	Confident	89.8	Confident	111 Å²	111	70.7 Å²	70.7	48%	0.483	39%	0.388	S	S	.	.			trans	-70.4	-44.2	-178.4	-178	57.4	-174.2	160.3	0	113.9
323	T	88	Confident	89.9	Confident	15 Å²	15	73.7 Å²	73.7	9%	0.092	40%	0.395	C	S	.	.			trans	-86.4	123.1	173.9	-54.7	0	0	0	0	108.2	S302 P341	S302-T323 PolarHBondContact OG-OG1 3.34Å; T323-P341 WeakPolarHBondContact O-CA 3.25Å; T323-P341 VanDerWaalsContact O-CB 3.26Å; T323-P341 WeakPolarHBondContact O-CB 3.25Å
324	K	85.5	Confident	90	Very high	71 Å²	71	68.4 Å²	68.4	31%	0.309	38%	0.378	S	S	.	.			trans	-114.6	-29.3	-172.8	-64.6	-172	173.3	-151.2	0	114.4	L29 P341	L29-K324 HydrophobicContact CB-CB 4.42Å; L29-K324 VanDerWaalsContact CD1-O 3.31Å; L29-K324 WeakPolarHBondContact CD1-O 3.48Å; L29-K324 WeakPolarHBondContact O-CD 3.3Å; L29-K324 WeakPolarHBondContact O-CE 3.48Å; L29-K324 PolarHBondContact O-NZ 2.67Å; K324-P341 WeakPolarHBondContact O-CG 3.23Å
325	H	89.2	Confident	90.3	Very high	110 Å²	110	68.1 Å²	68.1	51%	0.509	38%	0.377	S	S	.	.	S	Bend	trans	-125.8	151.5	-177.5	-58.4	-72.9	0	0	0	109.1	L29 Q327	L29-H325 WeakPolarHBondContact CD1-CE1 3.36Å; L29-H325 VanDerWaalsContact CD1-ND1 3.32Å; L29-H325 WeakPolarHBondContact CD1-ND1 3.06Å; H325-Q327 PolarHBondContact O-N 2.99Å
326	L	92.5	Very high	90.7	Very high	30 Å²	30	66.3 Å²	66.3	16%	0.157	36%	0.361	C	S	.	.			trans	-53.1	130.8	168.8	176.9	61.8	0	0	0	110.8	Q142 R145 V146 C338 D339	Q142-L326 VanDerWaalsContact OE1-CB 3.3Å; R145-L326 HydrophobicContact CB-CD2 3.98Å; V146-L326 HydrophobicContact CG2-CD1 3.33Å; L326-C338 HydrophobicContact CD1-CB 4.16Å; L326-D339 CarbonylContact C-O 3.55Å; L326-D339 VanDerWaalsContact CA-O 3.29Å; L326-D339 WeakPolarHBondContact CA-O 3.5Å; L326-D339 WeakPolarHBondContact CD1-O 3.22Å
327	Q	93.1	Very high	91	Very high	70 Å²	70	63.4 Å²	63.4	33%	0.327	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.1	174.3	-57	-176.4	-25.3	0	0	109.7	V314 H325 C338 D339	V314-Q327 VanDerWaalsContact CG1-OE1 3.23Å; V314-Q327 VanDerWaalsContact CG2-OE1 3.32Å; H325-Q327 PolarHBondContact O-N 2.99Å; Q327-C338 CarbonylContact O-C 3.5Å; Q327-C338 VanDerWaalsContact O-CA 3.27Å; Q327-C338 WeakPolarHBondContact O-CA 3.43Å; Q327-D339 HydrophobicContact CB-CB 4.18Å; Q327-D339 PolarHBondContact N-O 2.89Å; Q327-D339 PolarHBondContact O-N 3.13Å
328	T	95.9	Very high	91.4	Very high	78 Å²	78	60.8 Å²	60.8	48%	0.479	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.8	174.8	-59.1	0	0	0	0	108.5	T336 L337	T328-T336 HydrophobicContact CG2-CG2 3.37Å; T328-L337 CarbonylContact C-O 3.35Å; T328-L337 WeakPolarHBondContact CA-O 3.47Å
329	L	96	Very high	91.9	Very high	31 Å²	31	56.7 Å²	56.7	16%	0.162	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	110.4	-168.4	-61.7	166.4	0	0	0	108.8	I305 L309 V314 V331 L337	I305-L329 HydrophobicContact CG2-CD1 3.35Å; L309-L329 HydrophobicContact CD1-CB 4.17Å; L309-L329 HydrophobicContact CD1-CD1 4.18Å; V314-L329 HydrophobicContact CG2-CD1 3.5Å; V314-L329 VanDerWaalsContact CG2-CD1 3.5Å; V314-L329 HydrophobicContact CG2-CD2 4.39Å; L329-V331 PolarHBondContact O-N 3.34Å; L329-L337 HydrophobicContact CB-CB 4.41Å; L329-L337 PolarHBondContact N-O 3.44Å; L329-L337 PolarHBondContact O-N 3.26Å
330	V	95.4	Very high	92.2	Very high	104 Å²	104	53.2 Å²	53.2	63%	0.63	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	123.9	178	-177.6	0	0	0	0	108.7	D332	V330-D332 VanDerWaalsContact CG1-O 3.28Å; V330-D332 WeakPolarHBondContact CG1-O 3.48Å
331	V	94.5	Very high	92.5	Very high	38 Å²	38	52 Å²	52	23%	0.23	26%	0.262	C	S	.	.			trans	-87.5	-57.3	175.2	-179.5	0	0	0	0	108.8	L272 I308 L309 L329 V335 L337	L272-V331 HydrophobicContact CD1-CG1 4Å; I308-V331 HydrophobicContact CG2-CG1 4.3Å; I308-V331 HydrophobicContact CG2-CG2 4.28Å; L309-V331 HydrophobicContact CD2-CB 4.3Å; L309-V331 HydrophobicContact CD2-CG2 3.82Å; L329-V331 PolarHBondContact O-N 3.34Å; V331-V335 HydrophobicContact CB-CB 4.43Å; V331-V335 HydrophobicContact CB-CG1 4.32Å; V331-V335 HydrophobicContact CG2-CG1 4.19Å; V331-V335 PolarHBondContact N-O 3.17Å; V331-L337 HydrophobicContact CG2-CD1 3.72Å; V331-L337 HydrophobicContact CG2-CD2 4.35Å; V331-L337 HydrophobicContact CG2-CG 3.53Å
332	D	93.1	Very high	92.8	Very high	54 Å²	54	51.1 Å²	51.1	29%	0.289	25%	0.252	S	S	.	.	S	Bend	trans	-146.5	-167.3	177.9	62.4	33	0	0	0	109.7	K276 V330 E334 V335	K276-D332 IonicContact NZ-OD1 4Å; K276-D332 IonicContact NZ-OD2 3.58Å; K276-D332 PolarHBondContact NZ-OD2 3.29Å; V330-D332 VanDerWaalsContact CG1-O 3.28Å; V330-D332 WeakPolarHBondContact CG1-O 3.48Å; D332-E334 PolarHBondContact O-N 3.48Å; D332-E334 WeakPolarHBondContact OD1-CA 3.45Å; D332-E334 WeakPolarHBondContact OD1-CB 3.36Å; D332-E334 PolarHBondContact OD1-N 3.39Å; D332-V335 PolarHBondContact N-O 3.07Å; D332-V335 PolarHBondContact OD1-N 3.3Å
333	R	93.2	Very high	93	Very high	235 Å²	235	46 Å²	46	89%	0.887	23%	0.23	S	C	*	.	S	Bend	trans	-69.3	-22.7	179.8	-64.8	-173.5	-178.5	-165.8	1.3	113.3
334	E	95	Very high	93.2	Very high	79 Å²	79	45.3 Å²	45.3	37%	0.369	23%	0.226	S	C	.	.	S	Bend	trans	-99.2	-26.1	-173.9	-59.8	177.5	154.8	0	0	112.1	K276 T284 P288 I289 D332	K276-E334 WeakPolarHBondContact CE-OE2 3.25Å; K276-E334 IonicContact NZ-OE2 2.83Å; K276-E334 PolarHBondContact NZ-OE2 3.11Å; T284-E334 HydrophobicContact CG2-CB 4.13Å; T284-E334 HydrophobicContact CG2-CG 4.42Å; P288-E334 CarbonylContact C-O 3.6Å; P288-E334 VanDerWaalsContact CA-O 3.25Å; P288-E334 WeakPolarHBondContact CA-O 2.92Å; P288-E334 WeakPolarHBondContact CB-O 3.03Å; I289-E334 PolarHBondContact N-O 3.11Å; D332-E334 PolarHBondContact O-N 3.48Å; D332-E334 WeakPolarHBondContact OD1-CA 3.45Å; D332-E334 WeakPolarHBondContact OD1-CB 3.36Å; D332-E334 PolarHBondContact OD1-N 3.39Å
335	V	96.8	Very high	93.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.1	-170.3	175	0	0	0	0	112.3	L272 K276 I289 I291 V331 D332 L337	L272-V335 HydrophobicContact CD2-CG1 4.26Å; K276-V335 HydrophobicContact CD-CG2 4.2Å; K276-V335 VanDerWaalsContact CE-CG2 3.41Å; K276-V335 HydrophobicContact CG-CG2 3.74Å; I289-V335 WeakPolarHBondContact O-CA 3.44Å; I291-V335 HydrophobicContact CD1-CG1 3.51Å; I291-V335 HydrophobicContact CG1-CG1 4.14Å; V331-V335 HydrophobicContact CB-CB 4.43Å; V331-V335 HydrophobicContact CB-CG1 4.32Å; V331-V335 HydrophobicContact CG2-CG1 4.19Å; V331-V335 PolarHBondContact N-O 3.17Å; D332-V335 PolarHBondContact N-O 3.07Å; D332-V335 PolarHBondContact OD1-N 3.3Å; V335-L337 HydrophobicContact CG1-CD2 4.46Å
336	T	97.5	Very high	93.4	Very high	12 Å²	12	37.6 Å²	37.6	7%	0.074	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.4	171.5	-64.2	0	0	0	0	110.1	I289 V290 I291 T328	I289-T336 PolarHBondContact O-N 3.01Å; V290-T336 CarbonylContact C-O 3.43Å; V290-T336 WeakPolarHBondContact CA-O 3.46Å; I291-T336 PolarHBondContact N-O 3.06Å; T328-T336 HydrophobicContact CG2-CG2 3.37Å
337	L	97.5	Very high	93.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	144	173.8	-59.8	177.9	0	0	0	111	I291 I305 I308 T328 L329 V331 V335	I291-L337 HydrophobicContact CB-CD2 3.74Å; I291-L337 HydrophobicContact CD1-CD2 4.17Å; I291-L337 HydrophobicContact CG1-CD2 4.43Å; I291-L337 HydrophobicContact CG2-CD2 4.07Å; I291-L337 CarbonylContact O-C 3.53Å; I291-L337 WeakPolarHBondContact O-CA 3.25Å; I305-L337 HydrophobicContact CG1-CD1 4.27Å; I305-L337 HydrophobicContact CG2-CD1 4.38Å; I308-L337 HydrophobicContact CB-CD1 4.29Å; I308-L337 HydrophobicContact CD1-CD1 4.2Å; I308-L337 HydrophobicContact CG2-CD1 3.99Å; T328-L337 CarbonylContact C-O 3.35Å; T328-L337 WeakPolarHBondContact CA-O 3.47Å; L329-L337 HydrophobicContact CB-CB 4.41Å; L329-L337 PolarHBondContact N-O 3.44Å; L329-L337 PolarHBondContact O-N 3.26Å; V331-L337 HydrophobicContact CG2-CD1 3.72Å; V331-L337 HydrophobicContact CG2-CD2 4.35Å; V331-L337 HydrophobicContact CG2-CG 3.53Å; V335-L337 HydrophobicContact CG1-CD2 4.46Å
338	C	95.2	Very high	92.5	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.014	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.5	169.9	-76.4	0	0	0	0	109.9	V290 I291 M293 L326 Q327	V290-C338 VanDerWaalsContact CG1-SG 3.58Å; I291-C338 PolarHBondContact O-N 3.02Å; M293-C338 WeakPolarHBondContact CB-O 3.43Å; M293-C338 PolarHBondContact N-O 3.24Å; L326-C338 HydrophobicContact CD1-CB 4.16Å; Q327-C338 CarbonylContact O-C 3.5Å; Q327-C338 VanDerWaalsContact O-CA 3.27Å; Q327-C338 WeakPolarHBondContact O-CA 3.43Å
339	D	94.2	Very high	91.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.8	176.7	-158.9	23.2	0	0	0	111.3	K301 S302 I305 L326 Q327	K301-D339 WeakPolarHBondContact CD-OD1 3.34Å; K301-D339 WeakPolarHBondContact CE-OD1 3.42Å; K301-D339 VanDerWaalsContact CG-OD1 3.27Å; K301-D339 WeakPolarHBondContact CG-OD1 3.41Å; K301-D339 IonicContact NZ-OD1 2.7Å; K301-D339 PolarHBondContact NZ-OD1 3.46Å; K301-D339 IonicContact NZ-OD2 3.45Å; K301-D339 PolarHBondContact NZ-OD2 3.35Å; S302-D339 PolarHBondContact OG-OD2 3.19Å; I305-D339 HydrophobicContact CD1-CB 3.48Å; I305-D339 VanDerWaalsContact CD1-CB 3.48Å; I305-D339 VanDerWaalsContact CD1-OD1 3.24Å; I305-D339 WeakPolarHBondContact CD1-OD1 3.36Å; L326-D339 CarbonylContact C-O 3.55Å; L326-D339 VanDerWaalsContact CA-O 3.29Å; L326-D339 WeakPolarHBondContact CA-O 3.5Å; L326-D339 WeakPolarHBondContact CD1-O 3.22Å; Q327-D339 HydrophobicContact CB-CB 4.18Å; Q327-D339 PolarHBondContact N-O 2.89Å; Q327-D339 PolarHBondContact O-N 3.13Å
340	A	89.1	Confident	90.9	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.017	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-102.6	164.1	169.7	0	0	0	0	0	112.4	V146 K301	V146-A340 HydrophobicContact CB-CB 4.47Å; V146-A340 HydrophobicContact CG2-CB 3.48Å; V146-A340 VanDerWaalsContact CG2-CB 3.48Å; K301-A340 WeakPolarHBondContact CE-O 3.44Å; K301-A340 PolarHBondContact NZ-O 3.37Å
341	P	90.2	Very high	90.4	Very high	12 Å²	12	34.1 Å²	34.1	8%	0.078	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-52.1	147.5	160.5	-25.5	36.5	0	0	0	112	I139 Q142 T323 K324	I139-P341 HydrophobicContact CG2-CB 3.8Å; I139-P341 HydrophobicContact CG2-CG 4.26Å; Q142-P341 HydrophobicContact CB-CG 4.17Å; Q142-P341 HydrophobicContact CG-CG 4.01Å; T323-P341 WeakPolarHBondContact O-CA 3.25Å; T323-P341 VanDerWaalsContact O-CB 3.26Å; T323-P341 WeakPolarHBondContact O-CB 3.25Å; K324-P341 WeakPolarHBondContact O-CG 3.23Å
342	G	90	Very high	90	Very high	18 Å²	18	35.3 Å²	35.3	19%	0.186	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-69.9	134.4	166.4	0	0	0	0	0	109.4	G295	G295-G342 WeakPolarHBondContact O-CA 3.19Å
343	L	91.3	Very high	89.8	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	17%	0.173	C	C	.	.			trans	-118.3	137.6	-175	-168	79	0	0	0	110.4	E134 I139 W140 L143 G295 Y296 F345	E134-L343 HydrophobicContact CB-CD1 3.47Å; E134-L343 VanDerWaalsContact CB-CD1 3.47Å; E134-L343 HydrophobicContact CB-CG 4.1Å; E134-L343 HydrophobicContact CG-CD1 3.46Å; E134-L343 VanDerWaalsContact CG-CD1 3.46Å; I139-L343 HydrophobicContact CB-CD1 4.04Å; I139-L343 HydrophobicContact CG2-CD1 3.42Å; I139-L343 VanDerWaalsContact CG2-CD1 3.42Å; W140-L343 HydrophobicContact CD2-CD1 4.39Å; W140-L343 HydrophobicContact CD2-CD2 3.69Å; W140-L343 HydrophobicContact CE3-CD2 3.39Å; W140-L343 HydrophobicContact CH2-CD2 3.45Å; W140-L343 VanDerWaalsContact CH2-CD2 3.45Å; W140-L343 HydrophobicContact CH2-CG 4.42Å; W140-L343 HydrophobicContact CZ2-CD2 3.75Å; W140-L343 HydrophobicContact CZ2-CG 4.39Å; W140-L343 HydrophobicContact CZ3-CD2 3.21Å; L143-L343 HydrophobicContact CD2-CD2 3.64Å; G295-L343 PolarHBondContact O-N 2.8Å; Y296-L343 WeakPolarHBondContact CA-O 3.22Å; Y296-L343 WeakPolarHBondContact CD1-O 3.44Å; L343-F345 HydrophobicContact CB-CE2 3.96Å; L343-F345 HydrophobicContact CB-CZ 4.15Å; L343-F345 HydrophobicContact CD2-CD1 4.27Å; L343-F345 HydrophobicContact CD2-CE1 3.8Å; L343-F345 HydrophobicContact CD2-CE2 4.23Å; L343-F345 HydrophobicContact CD2-CZ 3.77Å; L343-F345 HydrophobicContact CG-CE2 4.41Å; L343-F345 HydrophobicContact CG-CZ 4.41Å; L343-F345 WeakPolarHBondContact O-CD2 3.09Å; L343-F345 WeakPolarHBondContact O-CE2 3.45Å
344	V	91	Very high	89.6	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.006	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-96	119.6	173.1	-173.9	0	0	0	0	108.7	T33 P132 E134 Y296 P297 M355	T33-V344 HydrophobicContact CG2-CB 4.12Å; T33-V344 HydrophobicContact CG2-CG2 3.95Å; P132-V344 WeakPolarHBondContact O-CG1 3.28Å; E134-V344 PolarHBondContact N-O 3.07Å; Y296-V344 HydrophobicContact CD1-CG1 4.48Å; Y296-V344 HydrophobicContact CE1-CG1 4.3Å; P297-V344 HydrophobicContact CG-CG2 3.88Å; V344-M355 HydrophobicContact CG1-CE 3.21Å
345	F	91.7	Very high	89.4	Confident	7 Å²	7	22 Å²	22	3%	0.031	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-94.7	151.3	-178.3	-57.9	-104.1	0	0	0	110.7	M89 W140 L143 V167 Y296 L343 A347	M89-F345 HydrophobicContact CB-CD1 4.36Å; M89-F345 HydrophobicContact SD-CE1 4.11Å; W140-F345 AromaticContact CH2-CD1 3.65Å; W140-F345 HydrophobicContact CH2-CD1 3.65Å; W140-F345 HydrophobicContact CH2-CE1 4.01Å; W140-F345 HydrophobicContact CH2-CG 4.43Å; W140-F345 AromaticContact CZ3-CD1 3.97Å; W140-F345 HydrophobicContact CZ3-CD1 3.97Å; W140-F345 AromaticContact CZ3-CE1 3.85Å; W140-F345 HydrophobicContact CZ3-CE1 3.85Å; L143-F345 HydrophobicContact CD2-CE1 3.81Å; L143-F345 HydrophobicContact CD2-CZ 3.86Å; V167-F345 HydrophobicContact CG1-CD1 3.9Å; V167-F345 HydrophobicContact CG1-CE1 4.22Å; V167-F345 HydrophobicContact CG1-CG 4.22Å; V167-F345 HydrophobicContact CG2-CB 4.33Å; V167-F345 HydrophobicContact CG2-CD1 4.14Å; V167-F345 HydrophobicContact CG2-CD2 3.61Å; V167-F345 HydrophobicContact CG2-CE1 4.35Å; V167-F345 HydrophobicContact CG2-CE2 3.86Å; V167-F345 HydrophobicContact CG2-CG 3.78Å; V167-F345 HydrophobicContact CG2-CZ 4.22Å; Y296-F345 HydrophobicContact CD1-CD2 4.34Å; Y296-F345 HydrophobicContact CD2-CD2 4.34Å; Y296-F345 HydrophobicContact CE1-CB 4.37Å; Y296-F345 AromaticContact CE1-CD2 3.87Å; Y296-F345 HydrophobicContact CE1-CD2 3.87Å; Y296-F345 AromaticContact CE2-CD2 3.85Å; Y296-F345 HydrophobicContact CE2-CD2 3.85Å; Y296-F345 HydrophobicContact CE2-CE2 4.38Å; Y296-F345 AromaticContact CZ-CD2 3.6Å; L343-F345 HydrophobicContact CB-CE2 3.96Å; L343-F345 HydrophobicContact CB-CZ 4.15Å; L343-F345 HydrophobicContact CD2-CD1 4.27Å; L343-F345 HydrophobicContact CD2-CE1 3.8Å; L343-F345 HydrophobicContact CD2-CE2 4.23Å; L343-F345 HydrophobicContact CD2-CZ 3.77Å; L343-F345 HydrophobicContact CG-CE2 4.41Å; L343-F345 HydrophobicContact CG-CZ 4.41Å; L343-F345 WeakPolarHBondContact O-CD2 3.09Å; L343-F345 WeakPolarHBondContact O-CE2 3.45Å; F345-A347 PolarHBondContact O-N 2.9Å
346	P	88.2	Confident	89.1	Confident	12 Å²	12	22.4 Å²	22.4	8%	0.078	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-66.5	131.8	173.4	29.8	-35.8	0	0	0	110.4	W115 L119 F133	W115-P346 HydrophobicContact CZ2-CG 3.92Å; L119-P346 HydrophobicContact CD1-CB 4.25Å; L119-P346 HydrophobicContact CD1-CG 4.19Å; F133-P346 HydrophobicContact CB-CB 4Å; F133-P346 HydrophobicContact CD1-CB 4.01Å; F133-P346 HydrophobicContact CG-CB 4.01Å
347	A	85.2	Confident	88.8	Confident	8 Å²	8	22 Å²	22	7%	0.066	12%	0.122	C	C	.	.			trans	-137.5	156.1	174	0	0	0	0	0	109.6	T131 F345 F350	T131-A347 HydrophobicContact CG2-CB 4.36Å; T131-A347 WeakPolarHBondContact CG2-O 3.38Å; T131-A347 PolarHBondContact N-O 3.43Å; T131-A347 PolarHBondContact OG1-N 3.43Å; T131-A347 PolarHBondContact OG1-O 3.29Å; T131-A347 VanDerWaalsContact OG1-O 3.08Å; F345-A347 PolarHBondContact O-N 2.9Å; A347-F350 HydrophobicContact CB-CD2 4.41Å
348	A	81.8	Confident	88.5	Confident	25 Å²	25	22.4 Å²	22.4	21%	0.207	13%	0.125	C	C	.	.	S	Bend	trans	-123.7	-11.6	178.1	0	0	0	0	0	113.8	L83 L87 C128 L130	L83-A348 HydrophobicContact CD1-CB 4.25Å; L83-A348 HydrophobicContact CD2-CB 3.7Å; L83-A348 HydrophobicContact CG-CB 4.22Å; L87-A348 HydrophobicContact CD1-CB 3.47Å; L87-A348 VanDerWaalsContact CD1-CB 3.47Å; C128-A348 WeakPolarHBondContact SG-CB 3.29Å; L130-A348 HydrophobicContact CD2-CB 4.29Å
349	H	78.7	Confident	88.3	Confident	123 Å²	123	22.4 Å²	22.4	57%	0.569	13%	0.126	S	C	*	.	S	Bend	trans	-94.8	-0.4	-173.8	58.7	-73	0	0	0	113
350	F	79.4	Confident	88.1	Confident	42 Å²	42	22.7 Å²	22.7	18%	0.184	13%	0.127	C	C	.	.	S	Bend	trans	-131.5	157.7	175.8	-52.6	-66.4	0	0	0	110	T131 I164 A347	T131-F350 WeakPolarHBondContact CG2-O 3.43Å; I164-F350 VanDerWaalsContact CA-CE2 3.41Å; I164-F350 VanDerWaalsContact CA-CZ 3.47Å; I164-F350 HydrophobicContact CB-CD2 4.33Å; I164-F350 HydrophobicContact CB-CE1 4.22Å; I164-F350 HydrophobicContact CB-CE2 3.88Å; I164-F350 HydrophobicContact CB-CZ 3.84Å; I164-F350 HydrophobicContact CD1-CB 4.28Å; I164-F350 HydrophobicContact CD1-CD1 4.31Å; I164-F350 HydrophobicContact CD1-CD2 4.33Å; I164-F350 HydrophobicContact CD1-CG 4.07Å; I164-F350 HydrophobicContact CG1-CB 4.39Å; I164-F350 HydrophobicContact CG1-CD1 4.13Å; I164-F350 HydrophobicContact CG1-CD2 3.56Å; I164-F350 HydrophobicContact CG1-CE1 4.24Å; I164-F350 HydrophobicContact CG1-CE2 3.61Å; I164-F350 HydrophobicContact CG1-CG 3.78Å; I164-F350 HydrophobicContact CG1-CZ 3.98Å; A347-F350 HydrophobicContact CB-CD2 4.41Å
351	S	85.4	Confident	88.1	Confident	42 Å²	42	23.3 Å²	23.3	29%	0.294	13%	0.13	S	C	.	.			trans	-98	167.8	179.3	76.2	0	0	0	0	112	E353 H354	S351-E353 WeakPolarHBondContact CB-OE2 3.24Å; S351-E353 PolarHBondContact O-N 2.92Å; S351-E353 PolarHBondContact OG-OE2 3.17Å; S351-H354 PolarHBondContact O-N 3.41Å; S351-H354 PolarHBondContact OG-CD2 3.3Å; S351-H354 VanDerWaalsContact OG-CD2 3.29Å
352	L	85.1	Confident	87.9	Confident	62 Å²	62	23.9 Å²	23.9	33%	0.325	14%	0.135	S	C	.	.	H	α-helix	trans	-57.8	-36.3	177.6	-179.5	68	0	0	0	111.9	P132 H354 M355 L356 L361	P132-L352 HydrophobicContact CG-CD1 3.62Å; L352-H354 VanDerWaalsContact C-N 3.34Å; L352-H354 PolarHBondContact O-N 2.98Å; L352-M355 PolarHBondContact O-N 3.35Å; L352-L356 HydrophobicContact CG-CD1 4.04Å; L352-L356 WeakPolarHBondContact O-CG 3.49Å; L352-L356 PolarHBondContact O-N 3.25Å; L352-L356 VanDerWaalsContact O-N 3.13Å; L352-L361 HydrophobicContact CD1-CD1 3.4Å; L352-L361 VanDerWaalsContact CD1-CD1 3.4Å
353	E	88.4	Confident	87.6	Confident	46 Å²	46	23.5 Å²	23.5	22%	0.215	13%	0.129	C	C	.	.	H	α-helix	trans	-59.1	-45.9	-179	-63	71.8	-147.8	0	0	111.2	S351 M355 L356 L357 A371 P372	S351-E353 WeakPolarHBondContact CB-OE2 3.24Å; S351-E353 PolarHBondContact O-N 2.92Å; S351-E353 PolarHBondContact OG-OE2 3.17Å; E353-M355 VanDerWaalsContact C-N 3.32Å; E353-M355 PolarHBondContact O-N 3.11Å; E353-L356 PolarHBondContact O-N 3.36Å; E353-L357 WeakPolarHBondContact O-CG 3.42Å; E353-L357 PolarHBondContact O-N 2.85Å; E353-A371 HydrophobicContact CG-CB 3.74Å; E353-A371 WeakPolarHBondContact OE1-CB 3.39Å; E353-P372 HydrophobicContact CB-CB 4.02Å; E353-P372 HydrophobicContact CG-CB 4.1Å
354	H	89.2	Confident	87	Confident	39 Å²	39	26 Å²	26	18%	0.181	14%	0.142	C	C	.	.	H	α-helix	trans	-62.7	-40.2	178.4	-74.1	-79.9	0	0	0	112	I164 S351 L352 L356 L357 A358 F375	I164-H354 HydrophobicContact CD1-CB 3.45Å; I164-H354 VanDerWaalsContact CD1-CB 3.45Å; S351-H354 PolarHBondContact O-N 3.41Å; S351-H354 PolarHBondContact OG-CD2 3.3Å; S351-H354 VanDerWaalsContact OG-CD2 3.29Å; L352-H354 VanDerWaalsContact C-N 3.34Å; L352-H354 PolarHBondContact O-N 2.98Å; H354-L356 VanDerWaalsContact C-N 3.3Å; H354-L356 PolarHBondContact O-N 3.05Å; H354-L357 PolarHBondContact O-N 2.87Å; H354-A358 WeakPolarHBondContact O-CB 3.3Å; H354-A358 PolarHBondContact O-N 2.64Å; H354-F375 AromaticContact CE1-CE1 3.72Å; H354-F375 AromaticContact CE1-CE2 3.47Å; H354-F375 VanDerWaalsContact CE1-CE2 3.47Å; H354-F375 WeakPolarHBondContact CE1-CE2 3.49Å; H354-F375 AromaticContact CE1-CZ 3.05Å; H354-F375 WeakPolarHBondContact CE1-CZ 3.45Å; H354-F375 AromaticContact ND1-CE1 3.93Å; H354-F375 AromaticContact ND1-CZ 3.73Å; H354-F375 AromaticContact NE2-CE2 3.55Å; H354-F375 AromaticContact NE2-CZ 3.65Å
355	M	90.5	Very high	86.2	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-65	-34.9	178.3	-62.3	-178.2	77.6	0	0	112.7	T131 P132 V344 L352 E353 G359 M360 L361	T131-M355 WeakPolarHBondContact CB-SD 3.41Å; T131-M355 HydrophobicContact CG2-SD 3.76Å; P132-M355 WeakPolarHBondContact O-CE 3.08Å; V344-M355 HydrophobicContact CG1-CE 3.21Å; L352-M355 PolarHBondContact O-N 3.35Å; E353-M355 VanDerWaalsContact C-N 3.32Å; E353-M355 PolarHBondContact O-N 3.11Å; M355-G359 PolarHBondContact O-N 2.94Å; M355-G359 VanDerWaalsContact O-N 3.11Å; M355-M360 HydrophobicContact CB-CB 4.24Å; M355-M360 HydrophobicContact CB-SD 4.21Å; M355-M360 HydrophobicContact CE-CB 4.33Å; M355-M360 HydrophobicContact CE-SD 4.18Å; M355-M360 HydrophobicContact CG-SD 4.03Å; M355-M360 WeakPolarHBondContact O-CB 3.33Å; M355-M360 PolarHBondContact O-N 3.19Å; M355-L361 HydrophobicContact CB-CD1 3.87Å; M355-L361 HydrophobicContact CB-CG 4.07Å; M355-L361 HydrophobicContact CE-CD1 4.17Å; M355-L361 HydrophobicContact CE-CD2 4.33Å; M355-L361 HydrophobicContact CE-CG 4.13Å; M355-L361 PolarHBondContact O-N 3.36Å; M355-L361 HydrophobicContact SD-CD1 4.09Å
356	L	90.9	Very high	85.6	Confident	8 Å²	8	34.8 Å²	34.8	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-70	-46.3	175.7	-71.3	158.8	0	0	0	111.4	L352 E353 H354 A358 G359 L361 L366 P372 T441	L352-L356 HydrophobicContact CG-CD1 4.04Å; L352-L356 WeakPolarHBondContact O-CG 3.49Å; L352-L356 PolarHBondContact O-N 3.25Å; L352-L356 VanDerWaalsContact O-N 3.13Å; E353-L356 PolarHBondContact O-N 3.36Å; H354-L356 VanDerWaalsContact C-N 3.3Å; H354-L356 PolarHBondContact O-N 3.05Å; L356-A358 VanDerWaalsContact C-N 3.3Å; L356-A358 PolarHBondContact O-N 2.8Å; L356-G359 PolarHBondContact O-N 2.99Å; L356-L361 HydrophobicContact CD2-CB 3.9Å; L356-L361 HydrophobicContact CG-CB 4.42Å; L356-L366 HydrophobicContact CD1-CD1 3.32Å; L356-L366 HydrophobicContact CD2-CD1 4.16Å; L356-L366 HydrophobicContact CG-CD1 4.37Å; L356-P372 HydrophobicContact CD1-CG 4.45Å; L356-T441 VanDerWaalsContact O-CG2 3.3Å; L356-T441 WeakPolarHBondContact O-CG2 3.39Å
357	L	91.9	Very high	85.1	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-32.1	177.6	-66.8	173.2	0	0	0	112.4	E353 H354 G359 P372 F375 L376 I437 C440 T441	E353-L357 WeakPolarHBondContact O-CG 3.42Å; E353-L357 PolarHBondContact O-N 2.85Å; H354-L357 PolarHBondContact O-N 2.87Å; L357-G359 VanDerWaalsContact C-N 3.27Å; L357-P372 HydrophobicContact CG-CB 4.49Å; L357-F375 HydrophobicContact CD1-CD1 3.56Å; L357-F375 HydrophobicContact CD1-CE1 4.1Å; L357-L376 HydrophobicContact CD1-CB 4.43Å; L357-L376 HydrophobicContact CD2-CD2 4.25Å; L357-I437 HydrophobicContact CD2-CG1 4.15Å; L357-C440 HydrophobicContact CD2-CB 4.36Å; L357-T441 VanDerWaalsContact O-CG2 3.23Å; L357-T441 WeakPolarHBondContact O-CG2 3.43Å
358	A	91.2	Very high	85.1	Confident	10 Å²	10	42.7 Å²	42.7	8%	0.083	22%	0.221	C	C	.	.	H	α-helix	trans	-72.6	-19	171.6	0	0	0	0	0	113.1	F165 H354 L356 M360	F165-A358 HydrophobicContact CE1-CB 4.39Å; F165-A358 HydrophobicContact CE2-CB 4.02Å; F165-A358 HydrophobicContact CZ-CB 3.57Å; H354-A358 WeakPolarHBondContact O-CB 3.3Å; H354-A358 PolarHBondContact O-N 2.64Å; L356-A358 VanDerWaalsContact C-N 3.3Å; L356-A358 PolarHBondContact O-N 2.8Å; A358-M360 VanDerWaalsContact C-N 3.33Å; A358-M360 HydrophobicContact CB-CE 4.35Å; A358-M360 HydrophobicContact CB-CG 4.07Å; A358-M360 HydrophobicContact CB-SD 4.38Å
359	G	90.4	Very high	85.5	Confident	2 Å²	2	42.4 Å²	42.4	2%	0.021	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	15.7	-178.8	0	0	0	0	0	113.6	N298 M355 L356 L357 T441	N298-G359 WeakPolarHBondContact CB-O 3.33Å; N298-G359 PolarHBondContact ND2-O 2.97Å; M355-G359 PolarHBondContact O-N 2.94Å; M355-G359 VanDerWaalsContact O-N 3.11Å; L356-G359 PolarHBondContact O-N 2.99Å; L357-G359 VanDerWaalsContact C-N 3.27Å; G359-T441 VanDerWaalsContact CA-CG2 3.46Å
360	M	90.7	Very high	86.1	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.025	20%	0.197	C	C	.	.	S	Bend	trans	-65.7	-34.7	172.9	-61.5	173.9	171	0	0	111	I164 F165 Y296 M355 A358	I164-M360 HydrophobicContact CB-CE 4.38Å; I164-M360 HydrophobicContact CD1-CE 4.43Å; I164-M360 HydrophobicContact CG1-CE 3.92Å; I164-M360 HydrophobicContact CG2-CE 3.89Å; I164-M360 WeakPolarHBondContact O-CE 3.5Å; F165-M360 HydrophobicContact CB-CE 4.48Å; F165-M360 HydrophobicContact CD1-CE 3.24Å; F165-M360 HydrophobicContact CD2-CE 4.15Å; F165-M360 HydrophobicContact CE1-CE 3.32Å; F165-M360 HydrophobicContact CE1-CG 3.9Å; F165-M360 HydrophobicContact CE2-CE 4.16Å; F165-M360 HydrophobicContact CG-CE 3.71Å; F165-M360 HydrophobicContact CZ-CE 3.82Å; F165-M360 HydrophobicContact CZ-CG 4.47Å; Y296-M360 HydrophobicContact CD1-CE 3.8Å; Y296-M360 HydrophobicContact CD1-CG 4.06Å; Y296-M360 HydrophobicContact CD1-SD 3.72Å; Y296-M360 HydrophobicContact CD2-CE 4.13Å; Y296-M360 HydrophobicContact CE1-CE 4.08Å; Y296-M360 HydrophobicContact CE1-SD 3.97Å; Y296-M360 HydrophobicContact CE2-CE 4.4Å; Y296-M360 HydrophobicContact CG-CE 3.82Å; Y296-M360 HydrophobicContact CG-CG 4.41Å; Y296-M360 HydrophobicContact CG-SD 4.3Å; M355-M360 HydrophobicContact CB-CB 4.24Å; M355-M360 HydrophobicContact CB-SD 4.21Å; M355-M360 HydrophobicContact CE-CB 4.33Å; M355-M360 HydrophobicContact CE-SD 4.18Å; M355-M360 HydrophobicContact CG-SD 4.03Å; M355-M360 WeakPolarHBondContact O-CB 3.33Å; M355-M360 PolarHBondContact O-N 3.19Å; A358-M360 VanDerWaalsContact C-N 3.33Å; A358-M360 HydrophobicContact CB-CE 4.35Å; A358-M360 HydrophobicContact CB-CG 4.07Å; A358-M360 HydrophobicContact CB-SD 4.38Å
361	L	88.4	Confident	86.7	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.079	20%	0.199	C	C	.	.	S	Bend	trans	-111.1	150.9	176.8	-59	176.5	0	0	0	110.4	T33 P132 L352 M355 L356	T33-L361 HydrophobicContact CG2-CD2 4.06Å; P132-L361 HydrophobicContact CB-CD1 4.26Å; P132-L361 HydrophobicContact CB-CD2 4.38Å; P132-L361 HydrophobicContact CG-CD1 4.05Å; L352-L361 HydrophobicContact CD1-CD1 3.4Å; L352-L361 VanDerWaalsContact CD1-CD1 3.4Å; M355-L361 HydrophobicContact CB-CD1 3.87Å; M355-L361 HydrophobicContact CB-CG 4.07Å; M355-L361 HydrophobicContact CE-CD1 4.17Å; M355-L361 HydrophobicContact CE-CD2 4.33Å; M355-L361 HydrophobicContact CE-CG 4.13Å; M355-L361 PolarHBondContact O-N 3.36Å; M355-L361 HydrophobicContact SD-CD1 4.09Å; L356-L361 HydrophobicContact CD2-CB 3.9Å; L356-L361 HydrophobicContact CG-CB 4.42Å
362	S	86.3	Confident	87	Confident	25 Å²	25	35.8 Å²	35.8	18%	0.175	19%	0.186	C	C	.	.			trans	-78.2	127.6	176.6	-177	0	0	0	0	111	D364 Y365	S362-D364 PolarHBondContact O-N 3.39Å; S362-D364 VanDerWaalsContact O-N 3.1Å; S362-D364 PolarHBondContact OG-N 2.81Å; S362-D364 PolarHBondContact OG-OD2 2.67Å; S362-Y365 PolarHBondContact O-N 2.9Å
363	S	83.4	Confident	87.5	Confident	9 Å²	9	32.9 Å²	32.9	6%	0.063	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-63.4	-12.3	172.6	63.4	0	0	0	0	113.9	Y365 L366 R434 K438	S363-Y365 VanDerWaalsContact C-N 3.28Å; S363-Y365 PolarHBondContact O-N 3.3Å; S363-L366 WeakPolarHBondContact O-CB 3.47Å; S363-L366 PolarHBondContact O-N 3.05Å; S363-R434 WeakPolarHBondContact O-CD 3.47Å; S363-R434 PolarHBondContact O-NE 3.48Å; S363-K438 WeakPolarHBondContact OG-CE 3.45Å
364	D	79.1	Confident	87.8	Confident	58 Å²	58	35.3 Å²	35.3	31%	0.31	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-72.8	-23.3	-175.4	-61.8	-24.3	0	0	0	112.4	S362 K438	S362-D364 PolarHBondContact O-N 3.39Å; S362-D364 VanDerWaalsContact O-N 3.1Å; S362-D364 PolarHBondContact OG-N 2.81Å; S362-D364 PolarHBondContact OG-OD2 2.67Å; D364-K438 IonicContact OD1-NZ 3.46Å; D364-K438 PolarHBondContact OD1-NZ 3.15Å
365	Y	74.3	Confident	88	Confident	182 Å²	182	36.3 Å²	36.3	71%	0.714	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-97.9	9.3	175.9	-55	-71.4	0	0	0	113.1	S362 S363 T367	S362-Y365 PolarHBondContact O-N 2.9Å; S363-Y365 VanDerWaalsContact C-N 3.28Å; S363-Y365 PolarHBondContact O-N 3.3Å; Y365-T367 PolarHBondContact O-N 3.5Å
366	L	78.4	Confident	88.1	Confident	9 Å²	9	36.1 Å²	36.1	5%	0.047	18%	0.18	C	C	.	.			trans	-70.5	110.9	-177.1	-172.3	60.8	0	0	0	111.1	L356 S363 D368 P372 R434 I437 F505	L356-L366 HydrophobicContact CD1-CD1 3.32Å; L356-L366 HydrophobicContact CD2-CD1 4.16Å; L356-L366 HydrophobicContact CG-CD1 4.37Å; S363-L366 WeakPolarHBondContact O-CB 3.47Å; S363-L366 PolarHBondContact O-N 3.05Å; L366-D368 WeakPolarHBondContact CD1-O 3.29Å; L366-D368 WeakPolarHBondContact CG-O 3.34Å; L366-P372 HydrophobicContact CD2-CG 4.09Å; L366-R434 PolarHBondContact O-NH2 3.42Å; L366-I437 HydrophobicContact CD2-CD1 3.33Å; L366-F505 VanDerWaalsContact O-CZ 3.22Å; L366-F505 WeakPolarHBondContact O-CZ 3.49Å
367	T	78.3	Confident	88.3	Confident	99 Å²	99	35.7 Å²	35.7	61%	0.607	18%	0.178	S	C	*	.	S	Bend	trans	-84	-51.8	175.4	51.4	0	0	0	0	111.2	Y365 F505	Y365-T367 PolarHBondContact O-N 3.5Å; T367-F505 HydrophobicContact CG2-CD1 4.39Å; T367-F505 HydrophobicContact CG2-CD2 4.3Å; T367-F505 HydrophobicContact CG2-CE1 4.17Å; T367-F505 HydrophobicContact CG2-CE2 4.1Å; T367-F505 HydrophobicContact CG2-CG 4.48Å; T367-F505 HydrophobicContact CG2-CZ 4.04Å
368	D	84.8	Confident	88.3	Confident	87 Å²	87	38.8 Å²	38.8	47%	0.465	20%	0.195	S	C	.	.			trans	-95.6	100.3	171.1	-177.4	10.4	0	0	0	110.8	L366 M370 A371	L366-D368 WeakPolarHBondContact CD1-O 3.29Å; L366-D368 WeakPolarHBondContact CG-O 3.34Å; D368-M370 WeakPolarHBondContact OD1-CB 2.95Å; D368-M370 PolarHBondContact OD1-N 3.41Å; D368-A371 PolarHBondContact OD1-N 2.94Å
369	Y	89.9	Confident	88.2	Confident	19 Å²	19	40.2 Å²	40.2	8%	0.075	21%	0.207	C	C	.	.			trans	-89.4	-9.1	175.1	64.6	-92.8	0	0	0	113.4	I373 L411 R429 A433 D501	Y369-I373 WeakPolarHBondContact O-CG1 3.47Å; Y369-L411 HydrophobicContact CD2-CD1 3.84Å; Y369-L411 HydrophobicContact CE2-CD1 3.73Å; Y369-R429 HydrophobicContact CE2-CB 3.98Å; Y369-A433 HydrophobicContact CD2-CB 3.54Å; Y369-A433 HydrophobicContact CG-CB 3.82Å; Y369-D501 WeakPolarHBondContact CE1-OD2 3.44Å
370	M	93.1	Very high	88.3	Confident	40 Å²	40	40.9 Å²	40.9	20%	0.197	21%	0.21	C	C	.	.	H	α-helix	trans	-75	-47.7	-175.2	-173.6	55.9	59.4	0	0	110.9	D368 I373 R374 P407 H408 L411	D368-M370 WeakPolarHBondContact OD1-CB 2.95Å; D368-M370 PolarHBondContact OD1-N 3.41Å; M370-I373 PolarHBondContact O-N 3.24Å; M370-R374 WeakPolarHBondContact O-CB 3.43Å; M370-R374 PolarHBondContact O-N 3.14Å; M370-P407 HydrophobicContact SD-CB 3.69Å; M370-P407 HydrophobicContact SD-CG 4.48Å; M370-H408 WeakPolarHBondContact CE-CE1 3.39Å; M370-H408 WeakPolarHBondContact CE-ND1 3.44Å; M370-L411 HydrophobicContact CE-CD1 4.07Å
371	A	90.4	Very high	88.2	Confident	28 Å²	28	43.1 Å²	43.1	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-52.6	-51.9	179.7	0	0	0	0	0	114	E353 D368 I373 R374 F375	E353-A371 HydrophobicContact CG-CB 3.74Å; E353-A371 WeakPolarHBondContact OE1-CB 3.39Å; D368-A371 PolarHBondContact OD1-N 2.94Å; A371-I373 VanDerWaalsContact C-N 3.32Å; A371-I373 PolarHBondContact O-N 3.32Å; A371-R374 PolarHBondContact O-N 2.71Å; A371-F375 PolarHBondContact O-N 2.99Å
372	P	92.7	Very high	88.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-67.7	-30.6	180	24.3	-33.7	0	0	0	113.6	E353 L356 L357 L366 L376 I437	E353-P372 HydrophobicContact CB-CB 4.02Å; E353-P372 HydrophobicContact CG-CB 4.1Å; L356-P372 HydrophobicContact CD1-CG 4.45Å; L357-P372 HydrophobicContact CG-CB 4.49Å; L366-P372 HydrophobicContact CD2-CG 4.09Å; P372-L376 WeakPolarHBondContact O-CB 3.49Å; P372-L376 PolarHBondContact O-N 3.25Å; P372-L376 VanDerWaalsContact O-N 3.15Å; P372-I437 HydrophobicContact CB-CD1 4.34Å; P372-I437 HydrophobicContact CG-CD1 4.07Å
373	I	95.8	Very high	88.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-75.9	-38.5	177.1	-60.9	-63.2	0	0	0	110.8	Y369 M370 A371 L376 C377 P407 L410 L411 A433 I436 I437	Y369-I373 WeakPolarHBondContact O-CG1 3.47Å; M370-I373 PolarHBondContact O-N 3.24Å; A371-I373 VanDerWaalsContact C-N 3.32Å; A371-I373 PolarHBondContact O-N 3.32Å; I373-L376 PolarHBondContact O-N 3.39Å; I373-C377 PolarHBondContact O-N 3.5Å; I373-C377 PolarHBondContact O-SG 3.01Å; I373-P407 HydrophobicContact CG2-CB 4.1Å; I373-L410 HydrophobicContact CG2-CD2 4.33Å; I373-L411 HydrophobicContact CB-CD1 4.48Å; I373-L411 HydrophobicContact CD1-CD2 4.48Å; I373-L411 HydrophobicContact CG1-CD1 4.46Å; I373-L411 HydrophobicContact CG1-CD2 4.21Å; I373-L411 HydrophobicContact CG2-CD1 4.17Å; I373-L411 HydrophobicContact CG2-CD2 4.05Å; I373-L411 HydrophobicContact CG2-CG 4.03Å; I373-A433 HydrophobicContact CD1-CB 4.05Å; I373-A433 HydrophobicContact CG1-CB 3.71Å; I373-I436 HydrophobicContact CD1-CB 3.87Å; I373-I436 HydrophobicContact CD1-CD1 4.28Å; I373-I436 HydrophobicContact CD1-CG2 3.83Å; I373-I437 HydrophobicContact CD1-CD1 4.48Å; I373-I437 HydrophobicContact CD1-CG1 4.07Å
374	R	94.8	Very high	88.6	Confident	98 Å²	98	50 Å²	50	37%	0.37	25%	0.25	S	C	.	.	H	α-helix	trans	-58.1	-52.3	173.8	179.4	66.1	-163.4	-162.3	21.2	110.6	M370 A371 L376 C377 D378 P407	M370-R374 WeakPolarHBondContact O-CB 3.43Å; M370-R374 PolarHBondContact O-N 3.14Å; A371-R374 PolarHBondContact O-N 2.71Å; R374-L376 VanDerWaalsContact C-N 3.26Å; R374-L376 PolarHBondContact O-N 3.18Å; R374-C377 PolarHBondContact O-N 2.82Å; R374-D378 WeakPolarHBondContact CG-OD2 3.35Å; R374-D378 IonicContact CZ-OD1 3.34Å; R374-D378 IonicContact CZ-OD2 2.67Å; R374-D378 IonicContact NE-OD1 3.07Å; R374-D378 PolarHBondContact NE-OD1 3.15Å; R374-D378 IonicContact NE-OD2 3.85Å; R374-D378 PolarHBondContact NE-OD2 2.92Å; R374-D378 IonicContact NH2-OD1 2.87Å; R374-D378 PolarHBondContact NH2-OD1 2.85Å; R374-D378 IonicContact NH2-OD2 3.68Å; R374-D378 PolarHBondContact O-N 3.13Å; R374-P407 HydrophobicContact CB-CG 3.96Å; R374-P407 HydrophobicContact CG-CG 4.27Å
375	F	92.7	Very high	89.2	Confident	59 Å²	59	47.2 Å²	47.2	26%	0.259	24%	0.235	S	C	.	.	H	α-helix	trans	-52.1	-46.8	175.5	177.7	-87.4	0	0	0	111.8	H354 L357 A371 C377 D378 A379 Y447	H354-F375 AromaticContact CE1-CE1 3.72Å; H354-F375 AromaticContact CE1-CE2 3.47Å; H354-F375 VanDerWaalsContact CE1-CE2 3.47Å; H354-F375 WeakPolarHBondContact CE1-CE2 3.49Å; H354-F375 AromaticContact CE1-CZ 3.05Å; H354-F375 WeakPolarHBondContact CE1-CZ 3.45Å; H354-F375 AromaticContact ND1-CE1 3.93Å; H354-F375 AromaticContact ND1-CZ 3.73Å; H354-F375 AromaticContact NE2-CE2 3.55Å; H354-F375 AromaticContact NE2-CZ 3.65Å; L357-F375 HydrophobicContact CD1-CD1 3.56Å; L357-F375 HydrophobicContact CD1-CE1 4.1Å; A371-F375 PolarHBondContact O-N 2.99Å; F375-C377 PolarHBondContact O-N 3.44Å; F375-D378 PolarHBondContact O-N 2.74Å; F375-A379 HydrophobicContact CE1-CB 4.35Å; F375-A379 WeakPolarHBondContact O-CB 3.1Å; F375-A379 PolarHBondContact O-N 3Å; F375-Y447 HydrophobicContact CE1-CE2 4.43Å; F375-Y447 AromaticContact CE1-CZ 3.85Å; F375-Y447 VanDerWaalsContact CE1-OH 3.24Å; F375-Y447 WeakPolarHBondContact CE1-OH 3.31Å; F375-Y447 WeakPolarHBondContact CZ-OH 3.47Å
376	L	93.8	Very high	89.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.5	-36	179.3	-170	67	0	0	0	113.2	L357 P372 I373 R374 A379 L380 F385 I436 L445 Y447	L357-L376 HydrophobicContact CD1-CB 4.43Å; L357-L376 HydrophobicContact CD2-CD2 4.25Å; P372-L376 WeakPolarHBondContact O-CB 3.49Å; P372-L376 PolarHBondContact O-N 3.25Å; P372-L376 VanDerWaalsContact O-N 3.15Å; I373-L376 PolarHBondContact O-N 3.39Å; R374-L376 VanDerWaalsContact C-N 3.26Å; R374-L376 PolarHBondContact O-N 3.18Å; L376-A379 PolarHBondContact O-N 3.15Å; L376-L380 HydrophobicContact CD1-CD1 3.65Å; L376-L380 HydrophobicContact CD1-CG 4.24Å; L376-L380 HydrophobicContact CG-CD1 4.03Å; L376-L380 WeakPolarHBondContact O-CB 3.44Å; L376-L380 PolarHBondContact O-N 3.38Å; L376-L380 VanDerWaalsContact O-N 3.08Å; L376-F385 HydrophobicContact CD2-CE1 4.2Å; L376-F385 HydrophobicContact CD2-CZ 4.46Å; L376-F385 HydrophobicContact CG-CE1 4.32Å; L376-F385 HydrophobicContact CG-CZ 4.08Å; L376-I436 HydrophobicContact CD2-CG2 3.48Å; L376-I436 VanDerWaalsContact CD2-CG2 3.48Å; L376-L445 HydrophobicContact CD2-CD2 3.74Å; L376-L445 HydrophobicContact CG-CD2 4.45Å; L376-Y447 HydrophobicContact CD1-CD2 4.28Å; L376-Y447 HydrophobicContact CD1-CG 4.13Å
377	C	94.2	Very high	90.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69.1	-36.1	176.3	-65.5	0	0	0	0	112	I373 R374 F375 A379 H404 V405 P407 L410	I373-C377 PolarHBondContact O-N 3.5Å; I373-C377 PolarHBondContact O-SG 3.01Å; R374-C377 PolarHBondContact O-N 2.82Å; F375-C377 PolarHBondContact O-N 3.44Å; C377-A379 VanDerWaalsContact C-N 3.35Å; C377-H404 WeakPolarHBondContact O-CB 3.34Å; C377-H404 PolarHBondContact O-ND1 3.36Å; C377-V405 HydrophobicContact CB-CG1 4.31Å; C377-V405 WeakPolarHBondContact CB-O 3.34Å; C377-P407 HydrophobicContact CB-CG 4.18Å; C377-L410 WeakPolarHBondContact SG-CD2 3.44Å
378	D	91.6	Very high	90.7	Very high	68 Å²	68	43.6 Å²	43.6	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-74.9	-26.9	176.2	-62.2	-30	0	0	0	111.3	R374 F375 H404	R374-D378 WeakPolarHBondContact CG-OD2 3.35Å; R374-D378 IonicContact CZ-OD1 3.34Å; R374-D378 IonicContact CZ-OD2 2.67Å; R374-D378 IonicContact NE-OD1 3.07Å; R374-D378 PolarHBondContact NE-OD1 3.15Å; R374-D378 IonicContact NE-OD2 3.85Å; R374-D378 PolarHBondContact NE-OD2 2.92Å; R374-D378 IonicContact NH2-OD1 2.87Å; R374-D378 PolarHBondContact NH2-OD1 2.85Å; R374-D378 IonicContact NH2-OD2 3.68Å; R374-D378 PolarHBondContact O-N 3.13Å; F375-D378 PolarHBondContact O-N 2.74Å; D378-H404 PolarHBondContact O-CE1 3.31Å; D378-H404 PolarHBondContact O-ND1 3.36Å
379	A	89.8	Confident	90.9	Very high	41 Å²	41	39.5 Å²	39.5	34%	0.339	19%	0.189	S	C	.	.	H	α-helix	trans	-85.1	-24.2	178.7	0	0	0	0	0	114.4	F375 L376 C377 Y447	F375-A379 HydrophobicContact CE1-CB 4.35Å; F375-A379 WeakPolarHBondContact O-CB 3.1Å; F375-A379 PolarHBondContact O-N 3Å; L376-A379 PolarHBondContact O-N 3.15Å; C377-A379 VanDerWaalsContact C-N 3.35Å; A379-Y447 HydrophobicContact CB-CD2 4.43Å; A379-Y447 HydrophobicContact CB-CE2 3.83Å
380	L	91	Very high	90.7	Very high	15 Å²	15	39 Å²	39	8%	0.079	19%	0.19	C	C	.	.	S	Bend	trans	-118.9	142.6	-175.3	-65.3	177.9	0	0	0	111.9	L376 A384 F385 H404 L445 Y447	L376-L380 HydrophobicContact CD1-CD1 3.65Å; L376-L380 HydrophobicContact CD1-CG 4.24Å; L376-L380 HydrophobicContact CG-CD1 4.03Å; L376-L380 WeakPolarHBondContact O-CB 3.44Å; L376-L380 PolarHBondContact O-N 3.38Å; L376-L380 VanDerWaalsContact O-N 3.08Å; L380-A384 HydrophobicContact CB-CB 4.44Å; L380-F385 HydrophobicContact CB-CE2 3.76Å; L380-F385 HydrophobicContact CB-CZ 4.03Å; L380-F385 HydrophobicContact CD1-CZ 4.07Å; L380-H404 PolarHBondContact O-ND1 3.41Å; L380-H404 VanDerWaalsContact O-ND1 3.09Å; L380-L445 HydrophobicContact CD1-CD1 4.4Å; L380-L445 HydrophobicContact CD1-CD2 4.14Å; L380-L445 HydrophobicContact CD1-CG 4.14Å; L380-Y447 HydrophobicContact CD2-CD2 4.14Å; L380-Y447 HydrophobicContact CG-CD2 4.38Å
381	P	90.3	Very high	90.3	Very high	52 Å²	52	37.2 Å²	37.2	34%	0.338	18%	0.181	S	C	.	.			trans	-66	146.9	173	28.3	-34.3	0	0	0	110.7	R383 A384 N403	P381-R383 PolarHBondContact O-N 3.12Å; P381-A384 HydrophobicContact CG-CB 4.43Å; P381-A384 VanDerWaalsContact O-CB 3.31Å; P381-A384 WeakPolarHBondContact O-CB 3.4Å; P381-A384 PolarHBondContact O-N 3.21Å; P381-N403 WeakPolarHBondContact CA-O 3.28Å
382	Y	88.9	Confident	89.9	Confident	30 Å²	30	39.3 Å²	39.3	12%	0.118	19%	0.188	C	C	.	.	H	α-helix	trans	-54.5	-31	-179.1	76.8	-90.3	0	0	0	113.1	A384 F385 E386 F393 V399 N403	Y382-A384 VanDerWaalsContact C-N 3.25Å; Y382-A384 PolarHBondContact O-N 2.67Å; Y382-F385 WeakPolarHBondContact O-CB 3.26Å; Y382-F385 PolarHBondContact O-N 3.32Å; Y382-F385 VanDerWaalsContact O-N 3.09Å; Y382-E386 HydrophobicContact CD2-CG 3.97Å; Y382-E386 HydrophobicContact CE2-CG 4.43Å; Y382-E386 PolarHBondContact O-N 2.95Å; Y382-F393 HydrophobicContact CD2-CB 4.21Å; Y382-F393 AromaticContact CD2-CD2 3.92Å; Y382-F393 HydrophobicContact CD2-CD2 3.92Å; Y382-V399 HydrophobicContact CD1-CB 4.45Å; Y382-V399 HydrophobicContact CD1-CG1 3.44Å; Y382-V399 VanDerWaalsContact CD1-CG1 3.44Å; Y382-V399 HydrophobicContact CD1-CG2 4.11Å; Y382-V399 HydrophobicContact CD2-CG2 4.13Å; Y382-V399 HydrophobicContact CE1-CG1 3.74Å; Y382-V399 HydrophobicContact CE1-CG2 4.44Å; Y382-V399 HydrophobicContact CE2-CG2 4.43Å; Y382-V399 HydrophobicContact CG-CG1 4.05Å; Y382-V399 HydrophobicContact CG-CG2 3.93Å; Y382-N403 HydrophobicContact CD1-CB 4Å; Y382-N403 VanDerWaalsContact CD1-O 3.31Å; Y382-N403 WeakPolarHBondContact CD1-O 3.4Å; Y382-N403 HydrophobicContact CE1-CB 4.11Å; Y382-N403 PolarHBondContact N-O 3.35Å
383	R	87.8	Confident	89.3	Confident	141 Å²	141	39.6 Å²	39.6	53%	0.532	19%	0.189	S	C	.	.	H	α-helix	trans	-59.7	-31.5	177.8	-65.4	-59.8	-170.5	-176.4	-2.7	113.2	P381 F385 E386 R387	P381-R383 PolarHBondContact O-N 3.12Å; R383-F385 VanDerWaalsContact C-N 3.32Å; R383-F385 PolarHBondContact O-N 3.02Å; R383-E386 WeakPolarHBondContact CD-OE2 3.43Å; R383-E386 IonicContact CZ-OE2 3.89Å; R383-E386 IonicContact NE-OE2 3.44Å; R383-E386 IonicContact NH1-OE1 3.88Å; R383-E386 IonicContact NH1-OE2 2.72Å; R383-E386 PolarHBondContact NH1-OE2 2.91Å; R383-E386 PolarHBondContact O-N 3.06Å; R383-R387 WeakPolarHBondContact O-CB 3.11Å; R383-R387 PolarHBondContact O-N 2.8Å
384	A	89.3	Confident	87.9	Confident	23 Å²	23	42.3 Å²	42.3	19%	0.19	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-44.8	174.7	0	0	0	0	0	110.6	L380 P381 Y382 H388	L380-A384 HydrophobicContact CB-CB 4.44Å; P381-A384 HydrophobicContact CG-CB 4.43Å; P381-A384 VanDerWaalsContact O-CB 3.31Å; P381-A384 WeakPolarHBondContact O-CB 3.4Å; P381-A384 PolarHBondContact O-N 3.21Å; Y382-A384 VanDerWaalsContact C-N 3.25Å; Y382-A384 PolarHBondContact O-N 2.67Å; A384-H388 VanDerWaalsContact O-CB 3.24Å; A384-H388 WeakPolarHBondContact O-CB 3.44Å; A384-H388 PolarHBondContact O-N 2.95Å
385	F	91	Very high	86.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-69.4	-39.5	176.9	-57.7	-84.7	0	0	0	112.4	L376 L380 Y382 R383 Y389 F393 V405 L410 L445	L376-F385 HydrophobicContact CD2-CE1 4.2Å; L376-F385 HydrophobicContact CD2-CZ 4.46Å; L376-F385 HydrophobicContact CG-CE1 4.32Å; L376-F385 HydrophobicContact CG-CZ 4.08Å; L380-F385 HydrophobicContact CB-CE2 3.76Å; L380-F385 HydrophobicContact CB-CZ 4.03Å; L380-F385 HydrophobicContact CD1-CZ 4.07Å; Y382-F385 WeakPolarHBondContact O-CB 3.26Å; Y382-F385 PolarHBondContact O-N 3.32Å; Y382-F385 VanDerWaalsContact O-N 3.09Å; R383-F385 VanDerWaalsContact C-N 3.32Å; R383-F385 PolarHBondContact O-N 3.02Å; F385-Y389 HydrophobicContact CB-CD2 4.15Å; F385-Y389 HydrophobicContact CD1-CD2 4.17Å; F385-Y389 AromaticContact CD1-CE2 3.81Å; F385-Y389 HydrophobicContact CD1-CE2 3.81Å; F385-Y389 WeakPolarHBondContact O-CB 3.42Å; F385-Y389 WeakPolarHBondContact O-CD2 3.45Å; F385-Y389 PolarHBondContact O-N 3.06Å; F385-F393 HydrophobicContact CB-CE2 4.06Å; F385-F393 HydrophobicContact CB-CZ 4.45Å; F385-V405 HydrophobicContact CD2-CG1 3.96Å; F385-V405 HydrophobicContact CE2-CG1 4.17Å; F385-L410 HydrophobicContact CB-CD1 3.85Å; F385-L410 HydrophobicContact CD1-CD1 3.8Å; F385-L410 HydrophobicContact CD1-CD2 3.5Å; F385-L410 VanDerWaalsContact CD1-CD2 3.5Å; F385-L410 HydrophobicContact CD1-CG 4.31Å; F385-L410 HydrophobicContact CE1-CD2 3.54Å; F385-L410 HydrophobicContact CG-CD1 3.98Å; F385-L410 HydrophobicContact CG-CD2 4.09Å; F385-L410 HydrophobicContact CZ-CD2 4.12Å; F385-L445 HydrophobicContact CD1-CD2 4.44Å; F385-L445 HydrophobicContact CE1-CD2 3.97Å
386	E	88.3	Confident	85.1	Confident	17 Å²	17	44.1 Å²	44.1	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-51.5	176.2	-68.2	-165.3	138.9	0	0	111.9	Y382 R383 G390 I391 I392 F393	Y382-E386 HydrophobicContact CD2-CG 3.97Å; Y382-E386 HydrophobicContact CE2-CG 4.43Å; Y382-E386 PolarHBondContact O-N 2.95Å; R383-E386 WeakPolarHBondContact CD-OE2 3.43Å; R383-E386 IonicContact CZ-OE2 3.89Å; R383-E386 IonicContact NE-OE2 3.44Å; R383-E386 IonicContact NH1-OE1 3.88Å; R383-E386 IonicContact NH1-OE2 2.72Å; R383-E386 PolarHBondContact NH1-OE2 2.91Å; R383-E386 PolarHBondContact O-N 3.06Å; E386-G390 WeakPolarHBondContact O-CA 3.18Å; E386-G390 PolarHBondContact O-N 3.29Å; E386-I391 WeakPolarHBondContact CA-O 3.32Å; E386-I391 WeakPolarHBondContact CB-O 3.31Å; E386-I391 WeakPolarHBondContact CG-O 3.1Å; E386-I391 PolarHBondContact O-N 3.46Å; E386-I392 WeakPolarHBondContact OE1-CA 3.47Å; E386-F393 HydrophobicContact CG-CD2 3.32Å; E386-F393 HydrophobicContact CG-CE2 3.68Å; E386-F393 HydrophobicContact CG-CG 4.43Å; E386-F393 PolarHBondContact OE1-N 3.36Å
387	R	86	Confident	84.3	Confident	135 Å²	135	48.2 Å²	48.2	51%	0.509	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-46.3	-178.2	-170.2	-175.4	-114.1	160.7	-5	110.7	R383	R383-R387 WeakPolarHBondContact O-CB 3.11Å; R383-R387 PolarHBondContact O-N 2.8Å
388	H	88.2	Confident	83.6	Confident	61 Å²	61	49.1 Å²	49.1	28%	0.282	28%	0.278	S	S	.	.	H	α-helix	trans	-73.8	-41.6	-175.5	-172.6	-90.8	0	0	0	113.2	A384 D439 R444 L445	A384-H388 VanDerWaalsContact O-CB 3.24Å; A384-H388 WeakPolarHBondContact O-CB 3.44Å; A384-H388 PolarHBondContact O-N 2.95Å; H388-D439 IonicContact CE1-OD2 3.54Å; H388-D439 PolarHBondContact CE1-OD2 3.12Å; H388-R444 PolarHBondContact CD2-O 3.32Å; H388-R444 VanDerWaalsContact NE2-C 3.35Å; H388-R444 PolarHBondContact NE2-O 3.11Å; H388-L445 HydrophobicContact CB-CD1 4.11Å
389	Y	89.6	Confident	83.2	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-99.2	-9.5	-174.6	-61.7	-62.7	0	0	0	114.4	F385 L414 Y435 I436 L445	F385-Y389 HydrophobicContact CB-CD2 4.15Å; F385-Y389 HydrophobicContact CD1-CD2 4.17Å; F385-Y389 AromaticContact CD1-CE2 3.81Å; F385-Y389 HydrophobicContact CD1-CE2 3.81Å; F385-Y389 WeakPolarHBondContact O-CB 3.42Å; F385-Y389 WeakPolarHBondContact O-CD2 3.45Å; F385-Y389 PolarHBondContact O-N 3.06Å; Y389-L414 HydrophobicContact CD1-CD1 3.58Å; Y389-L414 HydrophobicContact CD1-CD2 4.21Å; Y389-L414 HydrophobicContact CE1-CD1 4.33Å; Y389-L414 HydrophobicContact CE1-CD2 4.2Å; Y389-L414 HydrophobicContact CG-CD1 3.78Å; Y389-L414 HydrophobicContact CG-CD2 4.49Å; Y389-Y435 HydrophobicContact CD1-CE1 4.37Å; Y389-Y435 HydrophobicContact CE1-CD1 4.27Å; Y389-Y435 AromaticContact CE1-CE1 3.84Å; Y389-Y435 HydrophobicContact CE1-CE1 3.84Å; Y389-I436 HydrophobicContact CE2-CG1 4.24Å; Y389-L445 HydrophobicContact CE2-CD1 4.44Å; Y389-L445 HydrophobicContact CE2-CD2 4.41Å
390	G	84.7	Confident	83	Confident	9 Å²	9	48.3 Å²	48.3	9%	0.093	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	37.4	-175.4	0	0	0	0	0	112.5	E386	E386-G390 WeakPolarHBondContact O-CA 3.18Å; E386-G390 PolarHBondContact O-N 3.29Å
391	I	84.6	Confident	82.6	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	31%	0.309	C	S	.	.			trans	-100.3	146.9	175.8	-59	169.7	0	0	0	107.4	E386 F393 L410 A413 L414 V417	E386-I391 WeakPolarHBondContact CA-O 3.32Å; E386-I391 WeakPolarHBondContact CB-O 3.31Å; E386-I391 WeakPolarHBondContact CG-O 3.1Å; E386-I391 PolarHBondContact O-N 3.46Å; I391-F393 HydrophobicContact CB-CE2 4.26Å; I391-F393 HydrophobicContact CB-CZ 4.04Å; I391-F393 HydrophobicContact CD1-CZ 4.37Å; I391-F393 HydrophobicContact CG2-CD1 4.1Å; I391-F393 HydrophobicContact CG2-CD2 4.43Å; I391-F393 HydrophobicContact CG2-CE1 3.56Å; I391-F393 HydrophobicContact CG2-CE2 3.97Å; I391-F393 HydrophobicContact CG2-CG 4.5Å; I391-F393 HydrophobicContact CG2-CZ 3.5Å; I391-F393 VanDerWaalsContact CG2-CZ 3.5Å; I391-L410 HydrophobicContact CD1-CD1 4.24Å; I391-A413 HydrophobicContact CD1-CB 4.11Å; I391-A413 HydrophobicContact CG2-CB 3.9Å; I391-L414 HydrophobicContact CD1-CB 3.94Å; I391-L414 HydrophobicContact CD1-CD1 4.26Å; I391-V417 HydrophobicContact CG1-CG2 4.4Å
392	I	82.5	Confident	82.2	Confident	71 Å²	71	53.3 Å²	53.3	36%	0.364	31%	0.313	S	S	.	.			trans	-116.2	116.1	170.2	-67.2	-169.1	0	0	0	108	E386 G394 L479 L482	E386-I392 WeakPolarHBondContact OE1-CA 3.47Å; I392-G394 VanDerWaalsContact C-N 3.28Å; I392-G394 PolarHBondContact O-N 2.81Å; I392-L479 HydrophobicContact CD1-CD2 3.13Å; I392-L479 HydrophobicContact CD1-CG 4.36Å; I392-L479 HydrophobicContact CG1-CD2 3.98Å; I392-L482 WeakPolarHBondContact O-CD1 3.2Å
393	F	81.6	Confident	82.2	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.035	33%	0.331	C	S	.	.			trans	-89.3	72.4	168.9	-53	-73.2	0	0	0	107.3	Y382 F385 E386 I391 N395 V399 V405 V409 L410 L482	Y382-F393 HydrophobicContact CD2-CB 4.21Å; Y382-F393 AromaticContact CD2-CD2 3.92Å; Y382-F393 HydrophobicContact CD2-CD2 3.92Å; F385-F393 HydrophobicContact CB-CE2 4.06Å; F385-F393 HydrophobicContact CB-CZ 4.45Å; E386-F393 HydrophobicContact CG-CD2 3.32Å; E386-F393 HydrophobicContact CG-CE2 3.68Å; E386-F393 HydrophobicContact CG-CG 4.43Å; E386-F393 PolarHBondContact OE1-N 3.36Å; I391-F393 HydrophobicContact CB-CE2 4.26Å; I391-F393 HydrophobicContact CB-CZ 4.04Å; I391-F393 HydrophobicContact CD1-CZ 4.37Å; I391-F393 HydrophobicContact CG2-CD1 4.1Å; I391-F393 HydrophobicContact CG2-CD2 4.43Å; I391-F393 HydrophobicContact CG2-CE1 3.56Å; I391-F393 HydrophobicContact CG2-CE2 3.97Å; I391-F393 HydrophobicContact CG2-CG 4.5Å; I391-F393 HydrophobicContact CG2-CZ 3.5Å; I391-F393 VanDerWaalsContact CG2-CZ 3.5Å; F393-N395 PolarHBondContact O-N 3.42Å; F393-V399 HydrophobicContact CB-CG2 3.82Å; F393-V405 HydrophobicContact CD1-CG2 3.65Å; F393-V405 HydrophobicContact CD2-CG2 4.34Å; F393-V405 HydrophobicContact CE1-CG2 3.52Å; F393-V405 HydrophobicContact CE2-CG2 4.24Å; F393-V405 HydrophobicContact CG-CG2 4.08Å; F393-V405 HydrophobicContact CZ-CG2 3.84Å; F393-V409 HydrophobicContact CD1-CG1 4.15Å; F393-V409 HydrophobicContact CE1-CG1 4.21Å; F393-L410 HydrophobicContact CZ-CD1 3.81Å; F393-L482 HydrophobicContact CD1-CD1 3.9Å
394	G	64.7	Low	82.3	Confident	57 Å²	57	51.8 Å²	51.8	59%	0.588	32%	0.316	S	S	*	.			trans	-72.5	-6.5	-168.7	0	0	0	0	0	115.7	I392	I392-G394 VanDerWaalsContact C-N 3.28Å; I392-G394 PolarHBondContact O-N 2.81Å
395	N	66.6	Low	82.5	Confident	78 Å²	78	50.8 Å²	50.8	42%	0.417	31%	0.308	S	S	.	.	S	Bend	trans	-124.9	140.5	-172.5	-58.8	-11.7	0	0	0	111	F393 S397 H398 E486	F393-N395 PolarHBondContact O-N 3.42Å; N395-S397 PolarHBondContact O-N 3.21Å; N395-S397 VanDerWaalsContact O-N 3.1Å; N395-H398 PolarHBondContact O-N 3.44Å; N395-E486 PolarHBondContact ND2-OE1 2.94Å
396	S	63.8	Low	82.5	Confident	116 Å²	116	53.5 Å²	53.5	81%	0.811	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-8.1	172.6	55.6	0	0	0	0	114.4	H398	S396-H398 VanDerWaalsContact C-N 3.33Å
397	S	76.4	Confident	82.7	Confident	87 Å²	87	52.8 Å²	52.8	61%	0.608	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-21	174.6	58	0	0	0	0	113.5	N395	N395-S397 PolarHBondContact O-N 3.21Å; N395-S397 VanDerWaalsContact O-N 3.1Å
398	H	79.4	Confident	83	Confident	18 Å²	18	49.3 Å²	49.3	8%	0.083	31%	0.308	C	S	.	.	S	Bend	trans	-102.8	-11.1	-174.5	-61.9	-50.8	0	0	0	113.4	N395 S396 D406 V409 E486	N395-H398 PolarHBondContact O-N 3.44Å; S396-H398 VanDerWaalsContact C-N 3.33Å; H398-D406 PolarHBondContact O-N 3.14Å; H398-D406 VanDerWaalsContact O-N 3.16Å; H398-V409 HydrophobicContact CB-CG1 4.04Å; H398-V409 HydrophobicContact CB-CG2 4.48Å; H398-E486 IonicContact CD2-OE1 3.61Å; H398-E486 IonicContact CE1-OE1 2.69Å; H398-E486 PolarHBondContact CE1-OE1 3.3Å; H398-E486 IonicContact NE2-OE1 3.38Å; H398-E486 PolarHBondContact NE2-OE1 3.29Å
399	V	83.3	Confident	83.2	Confident	19 Å²	19	46.8 Å²	46.8	12%	0.115	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-124.2	130.4	-177.4	-177.9	0	0	0	0	107.2	Y382 F393 H404	Y382-V399 HydrophobicContact CD1-CB 4.45Å; Y382-V399 HydrophobicContact CD1-CG1 3.44Å; Y382-V399 VanDerWaalsContact CD1-CG1 3.44Å; Y382-V399 HydrophobicContact CD1-CG2 4.11Å; Y382-V399 HydrophobicContact CD2-CG2 4.13Å; Y382-V399 HydrophobicContact CE1-CG1 3.74Å; Y382-V399 HydrophobicContact CE1-CG2 4.44Å; Y382-V399 HydrophobicContact CE2-CG2 4.43Å; Y382-V399 HydrophobicContact CG-CG1 4.05Å; Y382-V399 HydrophobicContact CG-CG2 3.93Å; F393-V399 HydrophobicContact CB-CG2 3.82Å; V399-H404 CarbonylContact C-O 3.32Å; V399-H404 VanDerWaalsContact CA-O 3.25Å; V399-H404 WeakPolarHBondContact CA-O 2.89Å; V399-H404 WeakPolarHBondContact CG1-O 3.37Å
400	D	85	Confident	83.4	Confident	73 Å²	73	46.7 Å²	46.7	39%	0.39	30%	0.297	S	S	.	.			trans	-79.3	174.1	177.3	67.6	19.5	0	0	0	112.5	G402 N403 H404	D400-G402 PolarHBondContact O-N 2.89Å; D400-G402 VanDerWaalsContact O-N 3.1Å; D400-G402 VanDerWaalsContact OD1-CA 3.32Å; D400-G402 WeakPolarHBondContact OD1-CA 3.38Å; D400-G402 PolarHBondContact OD1-N 3.46Å; D400-N403 PolarHBondContact O-N 3.25Å; D400-N403 PolarHBondContact OD1-N 3.12Å; D400-H404 PolarHBondContact N-O 3.25Å; D400-H404 WeakPolarHBondContact OD1-CB 3.14Å; D400-H404 IonicContact OD1-CD2 3.48Å; D400-H404 PolarHBondContact OD1-N 2.86Å
401	S	82	Confident	83.9	Confident	132 Å²	132	46.3 Å²	46.3	92%	0.923	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.4	177.5	-54.7	0	0	0	0	113.7	N403	S401-N403 VanDerWaalsContact C-N 3.31Å
402	G	83.6	Confident	84.2	Confident	41 Å²	41	46.2 Å²	46.2	42%	0.423	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	2.9	177.3	0	0	0	0	0	113.8	D400 H404	D400-G402 PolarHBondContact O-N 2.89Å; D400-G402 VanDerWaalsContact O-N 3.1Å; D400-G402 VanDerWaalsContact OD1-CA 3.32Å; D400-G402 WeakPolarHBondContact OD1-CA 3.38Å; D400-G402 PolarHBondContact OD1-N 3.46Å; G402-H404 VanDerWaalsContact C-N 3.3Å; G402-H404 PolarHBondContact O-CD2 2.92Å; G402-H404 VanDerWaalsContact O-CD2 3.27Å; G402-H404 PolarHBondContact O-NE2 3.17Å
403	N	87.7	Confident	84.6	Confident	93 Å²	93	42.9 Å²	42.9	50%	0.497	28%	0.275	S	S	.	.	S	Bend	trans	63.2	32.2	-170.4	-58.2	-52.4	0	0	0	113.4	P381 Y382 D400 S401	P381-N403 WeakPolarHBondContact CA-O 3.28Å; Y382-N403 HydrophobicContact CD1-CB 4Å; Y382-N403 VanDerWaalsContact CD1-O 3.31Å; Y382-N403 WeakPolarHBondContact CD1-O 3.4Å; Y382-N403 HydrophobicContact CE1-CB 4.11Å; Y382-N403 PolarHBondContact N-O 3.35Å; D400-N403 PolarHBondContact O-N 3.25Å; D400-N403 PolarHBondContact OD1-N 3.12Å; S401-N403 VanDerWaalsContact C-N 3.31Å
404	H	91	Very high	85.1	Confident	46 Å²	46	42.5 Å²	42.5	21%	0.213	27%	0.273	C	S	.	.			trans	-105.8	146.6	172.6	-60.1	-73.6	0	0	0	110.9	C377 D378 L380 V399 D400 G402	C377-H404 WeakPolarHBondContact O-CB 3.34Å; C377-H404 PolarHBondContact O-ND1 3.36Å; D378-H404 PolarHBondContact O-CE1 3.31Å; D378-H404 PolarHBondContact O-ND1 3.36Å; L380-H404 PolarHBondContact O-ND1 3.41Å; L380-H404 VanDerWaalsContact O-ND1 3.09Å; V399-H404 CarbonylContact C-O 3.32Å; V399-H404 VanDerWaalsContact CA-O 3.25Å; V399-H404 WeakPolarHBondContact CA-O 2.89Å; V399-H404 WeakPolarHBondContact CG1-O 3.37Å; D400-H404 PolarHBondContact N-O 3.25Å; D400-H404 WeakPolarHBondContact OD1-CB 3.14Å; D400-H404 IonicContact OD1-CD2 3.48Å; D400-H404 PolarHBondContact OD1-N 2.86Å; G402-H404 VanDerWaalsContact C-N 3.3Å; G402-H404 PolarHBondContact O-CD2 2.92Å; G402-H404 VanDerWaalsContact O-CD2 3.27Å; G402-H404 PolarHBondContact O-NE2 3.17Å
405	V	91.7	Very high	86.4	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.012	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-92.8	142.3	-179.7	62.6	0	0	0	0	110.6	C377 F385 F393 L410	C377-V405 HydrophobicContact CB-CG1 4.31Å; C377-V405 WeakPolarHBondContact CB-O 3.34Å; F385-V405 HydrophobicContact CD2-CG1 3.96Å; F385-V405 HydrophobicContact CE2-CG1 4.17Å; F393-V405 HydrophobicContact CD1-CG2 3.65Å; F393-V405 HydrophobicContact CD2-CG2 4.34Å; F393-V405 HydrophobicContact CE1-CG2 3.52Å; F393-V405 HydrophobicContact CE2-CG2 4.24Å; F393-V405 HydrophobicContact CG-CG2 4.08Å; F393-V405 HydrophobicContact CZ-CG2 3.84Å; V405-L410 HydrophobicContact CG1-CB 4.17Å; V405-L410 HydrophobicContact CG1-CD2 4.29Å; V405-L410 HydrophobicContact CG2-CB 4.31Å
406	D	91.7	Very high	87.4	Confident	56 Å²	56	38.2 Å²	38.2	30%	0.299	24%	0.235	S	C	.	.			trans	-63.4	129.2	170.2	-178.2	94.2	0	0	0	111.1	H398 H408 V409 L410	H398-D406 PolarHBondContact O-N 3.14Å; H398-D406 VanDerWaalsContact O-N 3.16Å; D406-H408 VanDerWaalsContact C-N 3.31Å; D406-H408 PolarHBondContact O-N 3.33Å; D406-H408 WeakPolarHBondContact OD2-CA 3.29Å; D406-H408 WeakPolarHBondContact OD2-CB 3.38Å; D406-H408 IonicContact OD2-CD2 2.85Å; D406-H408 IonicContact OD2-CG 3.34Å; D406-H408 PolarHBondContact OD2-N 3.03Å; D406-V409 HydrophobicContact CB-CB 4.31Å; D406-V409 HydrophobicContact CB-CG2 3.93Å; D406-V409 WeakPolarHBondContact O-CB 3.5Å; D406-V409 PolarHBondContact O-N 3.2Å; D406-V409 VanDerWaalsContact O-N 3.11Å; D406-V409 PolarHBondContact OD2-N 3.49Å; D406-L410 PolarHBondContact O-N 2.55Å
407	P	93.8	Very high	88.5	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.013	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-37	-177.9	-27.2	35.2	0	0	0	114.4	M370 I373 R374 C377 V409 L410 L411	M370-P407 HydrophobicContact SD-CB 3.69Å; M370-P407 HydrophobicContact SD-CG 4.48Å; I373-P407 HydrophobicContact CG2-CB 4.1Å; R374-P407 HydrophobicContact CB-CG 3.96Å; R374-P407 HydrophobicContact CG-CG 4.27Å; C377-P407 HydrophobicContact CB-CG 4.18Å; P407-V409 VanDerWaalsContact C-N 3.3Å; P407-V409 PolarHBondContact O-N 3.49Å; P407-L410 PolarHBondContact O-N 3.38Å; P407-L411 WeakPolarHBondContact O-CB 3.14Å; P407-L411 VanDerWaalsContact O-CG 3.25Å; P407-L411 WeakPolarHBondContact O-CG 3.35Å; P407-L411 PolarHBondContact O-N 2.92Å
408	H	92	Very high	89.1	Confident	62 Å²	62	31.8 Å²	31.8	29%	0.287	18%	0.182	S	C	.	.	H	α-helix	trans	-66.1	-39	179.2	-64.4	-83.2	0	0	0	110.6	M370 D406 T412	M370-H408 WeakPolarHBondContact CE-CE1 3.39Å; M370-H408 WeakPolarHBondContact CE-ND1 3.44Å; D406-H408 VanDerWaalsContact C-N 3.31Å; D406-H408 PolarHBondContact O-N 3.33Å; D406-H408 WeakPolarHBondContact OD2-CA 3.29Å; D406-H408 WeakPolarHBondContact OD2-CB 3.38Å; D406-H408 IonicContact OD2-CD2 2.85Å; D406-H408 IonicContact OD2-CG 3.34Å; D406-H408 PolarHBondContact OD2-N 3.03Å; H408-T412 VanDerWaalsContact O-CB 3.23Å; H408-T412 WeakPolarHBondContact O-CB 3.25Å; H408-T412 PolarHBondContact O-N 3.36Å; H408-T412 PolarHBondContact O-OG1 3.12Å
409	V	91.5	Very high	89.5	Confident	9 Å²	9	31.5 Å²	31.5	6%	0.055	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-49.3	176	-179.4	0	0	0	0	110.1	F393 H398 D406 P407 L411 T412 A413 L482 I491	F393-V409 HydrophobicContact CD1-CG1 4.15Å; F393-V409 HydrophobicContact CE1-CG1 4.21Å; H398-V409 HydrophobicContact CB-CG1 4.04Å; H398-V409 HydrophobicContact CB-CG2 4.48Å; D406-V409 HydrophobicContact CB-CB 4.31Å; D406-V409 HydrophobicContact CB-CG2 3.93Å; D406-V409 WeakPolarHBondContact O-CB 3.5Å; D406-V409 PolarHBondContact O-N 3.2Å; D406-V409 VanDerWaalsContact O-N 3.11Å; D406-V409 PolarHBondContact OD2-N 3.49Å; P407-V409 VanDerWaalsContact C-N 3.3Å; P407-V409 PolarHBondContact O-N 3.49Å; V409-L411 PolarHBondContact O-N 3.24Å; V409-T412 PolarHBondContact O-N 3.36Å; V409-A413 WeakPolarHBondContact O-CB 3.21Å; V409-A413 PolarHBondContact O-N 3.2Å; V409-L482 HydrophobicContact CG1-CD1 4.4Å; V409-L482 HydrophobicContact CG1-CD2 3.94Å; V409-I491 HydrophobicContact CG2-CG2 4.12Å
410	L	93.8	Very high	89.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-55	-52.4	177.4	173.2	63	0	0	0	111.8	I373 C377 F385 I391 F393 V405 D406 P407 A413 L414 I436	I373-L410 HydrophobicContact CG2-CD2 4.33Å; C377-L410 WeakPolarHBondContact SG-CD2 3.44Å; F385-L410 HydrophobicContact CB-CD1 3.85Å; F385-L410 HydrophobicContact CD1-CD1 3.8Å; F385-L410 HydrophobicContact CD1-CD2 3.5Å; F385-L410 VanDerWaalsContact CD1-CD2 3.5Å; F385-L410 HydrophobicContact CD1-CG 4.31Å; F385-L410 HydrophobicContact CE1-CD2 3.54Å; F385-L410 HydrophobicContact CG-CD1 3.98Å; F385-L410 HydrophobicContact CG-CD2 4.09Å; F385-L410 HydrophobicContact CZ-CD2 4.12Å; I391-L410 HydrophobicContact CD1-CD1 4.24Å; F393-L410 HydrophobicContact CZ-CD1 3.81Å; V405-L410 HydrophobicContact CG1-CB 4.17Å; V405-L410 HydrophobicContact CG1-CD2 4.29Å; V405-L410 HydrophobicContact CG2-CB 4.31Å; D406-L410 PolarHBondContact O-N 2.55Å; P407-L410 PolarHBondContact O-N 3.38Å; L410-A413 PolarHBondContact O-N 2.83Å; L410-L414 VanDerWaalsContact O-CB 3.3Å; L410-L414 WeakPolarHBondContact O-CB 3.4Å; L410-L414 PolarHBondContact O-N 3Å; L410-I436 HydrophobicContact CD1-CD1 4.49Å; L410-I436 HydrophobicContact CD2-CD1 3.89Å; L410-I436 HydrophobicContact CG-CD1 4.01Å
411	L	94.5	Very high	90.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65	-42.9	-177	-69.4	177.7	0	0	0	112.2	Y369 M370 I373 P407 V409 A415 R429 A432 A433 I436	Y369-L411 HydrophobicContact CD2-CD1 3.84Å; Y369-L411 HydrophobicContact CE2-CD1 3.73Å; M370-L411 HydrophobicContact CE-CD1 4.07Å; I373-L411 HydrophobicContact CB-CD1 4.48Å; I373-L411 HydrophobicContact CD1-CD2 4.48Å; I373-L411 HydrophobicContact CG1-CD1 4.46Å; I373-L411 HydrophobicContact CG1-CD2 4.21Å; I373-L411 HydrophobicContact CG2-CD1 4.17Å; I373-L411 HydrophobicContact CG2-CD2 4.05Å; I373-L411 HydrophobicContact CG2-CG 4.03Å; P407-L411 WeakPolarHBondContact O-CB 3.14Å; P407-L411 VanDerWaalsContact O-CG 3.25Å; P407-L411 WeakPolarHBondContact O-CG 3.35Å; P407-L411 PolarHBondContact O-N 2.92Å; V409-L411 PolarHBondContact O-N 3.24Å; L411-A415 WeakPolarHBondContact O-CB 3.48Å; L411-A415 PolarHBondContact O-N 2.84Å; L411-R429 HydrophobicContact CB-CB 4.07Å; L411-R429 HydrophobicContact CB-CG 4.1Å; L411-R429 HydrophobicContact CD1-CB 4.37Å; L411-A432 HydrophobicContact CD2-CB 4.1Å; L411-A433 HydrophobicContact CD1-CB 4.29Å; L411-A433 HydrophobicContact CD2-CB 3.71Å; L411-I436 HydrophobicContact CD2-CD1 3.85Å
412	T	92.1	Very high	90.3	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-44	178.8	-54.3	0	0	0	0	110.8	H408 V409 F416 P427 R429 L485 I491	H408-T412 VanDerWaalsContact O-CB 3.23Å; H408-T412 WeakPolarHBondContact O-CB 3.25Å; H408-T412 PolarHBondContact O-N 3.36Å; H408-T412 PolarHBondContact O-OG1 3.12Å; V409-T412 PolarHBondContact O-N 3.36Å; T412-F416 WeakPolarHBondContact O-CB 3.45Å; T412-F416 PolarHBondContact O-N 3.01Å; T412-P427 HydrophobicContact CG2-CB 4.13Å; T412-P427 HydrophobicContact CG2-CG 4.03Å; T412-R429 PolarHBondContact OG1-NE 3.45Å; T412-R429 PolarHBondContact OG1-NH2 2.58Å; T412-L485 HydrophobicContact CG2-CD1 4.16Å; T412-L485 HydrophobicContact CG2-CD2 4.09Å; T412-I491 HydrophobicContact CG2-CG1 4.47Å
413	A	90.4	Very high	90.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-47.6	177.4	0	0	0	0	0	111.8	I391 V409 L410 F416 V417 L482 L485	I391-A413 HydrophobicContact CD1-CB 4.11Å; I391-A413 HydrophobicContact CG2-CB 3.9Å; V409-A413 WeakPolarHBondContact O-CB 3.21Å; V409-A413 PolarHBondContact O-N 3.2Å; L410-A413 PolarHBondContact O-N 2.83Å; A413-F416 PolarHBondContact O-N 3.36Å; A413-V417 WeakPolarHBondContact O-CB 3.28Å; A413-V417 VanDerWaalsContact O-CG2 3.25Å; A413-V417 WeakPolarHBondContact O-CG2 3.45Å; A413-V417 PolarHBondContact O-N 3.26Å; A413-L482 HydrophobicContact CB-CD2 3.6Å; A413-L482 HydrophobicContact CB-CG 4.49Å; A413-L485 HydrophobicContact CB-CD1 4.44Å
414	L	91.7	Very high	90	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.4	-46.5	179.9	-178.4	62.5	0	0	0	111.6	Y389 I391 L410 F416 V417 R418 A432 Y435 I436	Y389-L414 HydrophobicContact CD1-CD1 3.58Å; Y389-L414 HydrophobicContact CD1-CD2 4.21Å; Y389-L414 HydrophobicContact CE1-CD1 4.33Å; Y389-L414 HydrophobicContact CE1-CD2 4.2Å; Y389-L414 HydrophobicContact CG-CD1 3.78Å; Y389-L414 HydrophobicContact CG-CD2 4.49Å; I391-L414 HydrophobicContact CD1-CB 3.94Å; I391-L414 HydrophobicContact CD1-CD1 4.26Å; L410-L414 VanDerWaalsContact O-CB 3.3Å; L410-L414 WeakPolarHBondContact O-CB 3.4Å; L410-L414 PolarHBondContact O-N 3Å; L414-F416 PolarHBondContact O-N 3.36Å; L414-V417 PolarHBondContact O-N 3.17Å; L414-R418 HydrophobicContact CD1-CG 3.8Å; L414-R418 HydrophobicContact CG-CG 4.35Å; L414-R418 WeakPolarHBondContact O-CB 3.2Å; L414-R418 WeakPolarHBondContact O-CG 3.34Å; L414-R418 PolarHBondContact O-N 3.47Å; L414-A432 HydrophobicContact CB-CB 4.4Å; L414-A432 HydrophobicContact CD2-CB 4.28Å; L414-A432 HydrophobicContact CG-CB 4.38Å; L414-Y435 HydrophobicContact CD2-CD1 4.12Å; L414-I436 HydrophobicContact CD2-CD1 3.58Å; L414-I436 HydrophobicContact CD2-CG1 3.33Å
415	A	91.7	Very high	89.7	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-55	-44.6	175.7	0	0	0	0	0	110.8	L411 G419 F420 P427 D428 A432	L411-A415 WeakPolarHBondContact O-CB 3.48Å; L411-A415 PolarHBondContact O-N 2.84Å; A415-G419 CarbonylContact O-C 3.55Å; A415-G419 WeakPolarHBondContact O-CA 3.42Å; A415-G419 PolarHBondContact O-N 3.04Å; A415-F420 HydrophobicContact CB-CB 4.18Å; A415-F420 PolarHBondContact O-N 3.03Å; A415-P427 HydrophobicContact CB-CB 3.66Å; A415-D428 WeakPolarHBondContact CB-O 3.45Å; A415-A432 HydrophobicContact CB-CB 3.95Å
416	F	88.7	Confident	89.5	Confident	46 Å²	46	30.4 Å²	30.4	20%	0.202	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-49.1	176.9	-174.4	-90.9	0	0	0	113	T412 A413 L414 R418 G419 M421 I484 L485	T412-F416 WeakPolarHBondContact O-CB 3.45Å; T412-F416 PolarHBondContact O-N 3.01Å; A413-F416 PolarHBondContact O-N 3.36Å; L414-F416 PolarHBondContact O-N 3.36Å; F416-R418 VanDerWaalsContact C-N 3.29Å; F416-R418 PolarHBondContact O-N 2.68Å; F416-G419 PolarHBondContact O-N 3.08Å; F416-M421 HydrophobicContact CB-CE 4.29Å; F416-M421 HydrophobicContact CD2-CE 3.54Å; F416-M421 HydrophobicContact CE2-CE 4.11Å; F416-M421 HydrophobicContact CG-CE 4.13Å; F416-I484 HydrophobicContact CE1-CG2 4.38Å; F416-I484 HydrophobicContact CE2-CG2 4.28Å; F416-I484 HydrophobicContact CZ-CB 4.39Å; F416-I484 HydrophobicContact CZ-CG2 3.69Å; F416-L485 HydrophobicContact CB-CD1 3.87Å; F416-L485 HydrophobicContact CB-CD2 3.89Å; F416-L485 HydrophobicContact CB-CG 4.18Å; F416-L485 HydrophobicContact CD1-CG 4.41Å; F416-L485 HydrophobicContact CD2-CD2 3.49Å; F416-L485 VanDerWaalsContact CD2-CD2 3.49Å; F416-L485 HydrophobicContact CD2-CG 4.08Å; F416-L485 HydrophobicContact CE2-CD2 4.22Å; F416-L485 HydrophobicContact CG-CD1 4.13Å; F416-L485 HydrophobicContact CG-CD2 3.76Å; F416-L485 HydrophobicContact CG-CG 3.96Å
417	V	87.1	Confident	89.4	Confident	22 Å²	22	28 Å²	28	13%	0.133	15%	0.151	C	C	.	.	H	α-helix	trans	-62.2	-36.4	-178.6	168.9	0	0	0	0	112	I391 A413 L414 K478	I391-V417 HydrophobicContact CG1-CG2 4.4Å; A413-V417 WeakPolarHBondContact O-CB 3.28Å; A413-V417 VanDerWaalsContact O-CG2 3.25Å; A413-V417 WeakPolarHBondContact O-CG2 3.45Å; A413-V417 PolarHBondContact O-N 3.26Å; L414-V417 PolarHBondContact O-N 3.17Å; V417-K478 HydrophobicContact CG1-CD 3.84Å; V417-K478 HydrophobicContact CG1-CG 4.47Å
418	R	88.1	Confident	89.3	Confident	45 Å²	45	28.6 Å²	28.6	17%	0.17	15%	0.154	C	C	.	.	H	α-helix	trans	-86.8	-6.2	176.6	-60.1	-54.8	-178.7	94.5	2.5	113.5	L414 F416 F420 Y435	L414-R418 HydrophobicContact CD1-CG 3.8Å; L414-R418 HydrophobicContact CG-CG 4.35Å; L414-R418 WeakPolarHBondContact O-CB 3.2Å; L414-R418 WeakPolarHBondContact O-CG 3.34Å; L414-R418 PolarHBondContact O-N 3.47Å; F416-R418 VanDerWaalsContact C-N 3.29Å; F416-R418 PolarHBondContact O-N 2.68Å; R418-F420 VanDerWaalsContact C-N 3.25Å; R418-F420 HydrophobicContact CB-CD1 4.01Å; R418-F420 HydrophobicContact CB-CD2 4.02Å; R418-F420 HydrophobicContact CB-CE1 3.78Å; R418-F420 HydrophobicContact CB-CE2 3.8Å; R418-F420 HydrophobicContact CB-CG 4.11Å; R418-F420 HydrophobicContact CB-CZ 3.67Å; R418-F420 HydrophobicContact CG-CE2 4.22Å; R418-F420 HydrophobicContact CG-CZ 4.21Å; R418-F420 PolarHBondContact O-N 3.07Å; R418-Y435 PolarHBondContact NH1-OH 3.05Å
419	G	88	Confident	89.3	Confident	13 Å²	13	26.1 Å²	26.1	13%	0.134	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	26.6	-178	0	0	0	0	0	113.2	A415 F416 M421	A415-G419 CarbonylContact O-C 3.55Å; A415-G419 WeakPolarHBondContact O-CA 3.42Å; A415-G419 PolarHBondContact O-N 3.04Å; F416-G419 PolarHBondContact O-N 3.08Å; G419-M421 PolarHBondContact O-N 3.15Å; G419-M421 VanDerWaalsContact O-N 3.12Å
420	F	91.6	Very high	89.3	Confident	20 Å²	20	25.9 Å²	25.9	9%	0.088	14%	0.141	C	C	.	.			trans	-73.2	97.6	168.3	-57.4	-22.4	0	0	0	107.3	A415 R418 P427 D428 R431 A432 Y435	A415-F420 HydrophobicContact CB-CB 4.18Å; A415-F420 PolarHBondContact O-N 3.03Å; R418-F420 VanDerWaalsContact C-N 3.25Å; R418-F420 HydrophobicContact CB-CD1 4.01Å; R418-F420 HydrophobicContact CB-CD2 4.02Å; R418-F420 HydrophobicContact CB-CE1 3.78Å; R418-F420 HydrophobicContact CB-CE2 3.8Å; R418-F420 HydrophobicContact CB-CG 4.11Å; R418-F420 HydrophobicContact CB-CZ 3.67Å; R418-F420 HydrophobicContact CG-CE2 4.22Å; R418-F420 HydrophobicContact CG-CZ 4.21Å; R418-F420 PolarHBondContact O-N 3.07Å; F420-P427 WeakPolarHBondContact O-CA 3.24Å; F420-D428 HydrophobicContact CB-CB 4.08Å; F420-D428 PolarHBondContact O-N 2.68Å; F420-R431 HydrophobicContact CB-CG 4.47Å; F420-R431 HydrophobicContact CD1-CG 4.4Å; F420-R431 HydrophobicContact CD2-CB 4.36Å; F420-R431 HydrophobicContact CD2-CG 3.94Å; F420-R431 HydrophobicContact CE2-CG 4.25Å; F420-R431 HydrophobicContact CG-CG 4.03Å; F420-A432 HydrophobicContact CD2-CB 4.22Å; F420-Y435 HydrophobicContact CE2-CD2 4.26Å; F420-Y435 HydrophobicContact CE2-CG 4.03Å; F420-Y435 AromaticContact CZ-CD2 4Å; F420-Y435 HydrophobicContact CZ-CD2 4Å; F420-Y435 HydrophobicContact CZ-CG 4.25Å
421	M	89.7	Confident	89.2	Confident	33 Å²	33	29.5 Å²	29.5	16%	0.163	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-123.3	142.5	-178.1	-57	-65.6	176.2	0	0	109.5	F416 G419 I426 P427 L515	F416-M421 HydrophobicContact CB-CE 4.29Å; F416-M421 HydrophobicContact CD2-CE 3.54Å; F416-M421 HydrophobicContact CE2-CE 4.11Å; F416-M421 HydrophobicContact CG-CE 4.13Å; G419-M421 PolarHBondContact O-N 3.15Å; G419-M421 VanDerWaalsContact O-N 3.12Å; M421-I426 CarbonylContact C-O 3.6Å; M421-I426 WeakPolarHBondContact CA-O 3.19Å; M421-P427 HydrophobicContact SD-CB 4.4Å; M421-P427 HydrophobicContact SD-CG 4.19Å; M421-L515 HydrophobicContact CB-CB 4.09Å; M421-L515 HydrophobicContact CB-CD1 4.23Å; M421-L515 WeakPolarHBondContact O-CB 3.45Å; M421-L515 PolarHBondContact O-N 3.21Å
422	S	85.7	Confident	89.1	Confident	4 Å²	4	29.5 Å²	29.5	3%	0.028	15%	0.154	C	C	.	.			trans	-69.1	168.5	165	73.3	0	0	0	0	110.6	K424 G425 I426 L515	S422-K424 PolarHBondContact O-N 3.26Å; S422-K424 VanDerWaalsContact O-N 3.12Å; S422-K424 PolarHBondContact OG-N 2.61Å; S422-G425 PolarHBondContact O-N 3.21Å; S422-I426 PolarHBondContact N-O 2.97Å; S422-I426 PolarHBondContact OG-N 3.2Å; S422-I426 PolarHBondContact OG-O 3.46Å; S422-L515 WeakPolarHBondContact O-CD1 3.4Å
423	T	82.8	Confident	89.3	Confident	97 Å²	97	29.4 Å²	29.4	60%	0.595	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.5	173.4	52.9	0	0	0	0	113.2	G425	T423-G425 VanDerWaalsContact C-N 3.34Å
424	K	82.9	Confident	89.4	Confident	155 Å²	155	30.4 Å²	30.4	67%	0.674	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	1.7	176.1	-61.1	-177.3	-176.7	171.2	0	113.6	S422 I426 F500	S422-K424 PolarHBondContact O-N 3.26Å; S422-K424 VanDerWaalsContact O-N 3.12Å; S422-K424 PolarHBondContact OG-N 2.61Å; K424-I426 VanDerWaalsContact C-N 3.35Å; K424-I426 HydrophobicContact CB-CD1 4.36Å; K424-I426 HydrophobicContact CB-CG1 4.4Å; K424-F500 HydrophobicContact CD-CZ 4.24Å
425	G	83.8	Confident	89.5	Confident	41 Å²	41	32.9 Å²	32.9	42%	0.423	17%	0.168	S	C	.	.	S	Bend	trans	78.6	14.8	-179.4	0	0	0	0	0	114.8	S422 T423	S422-G425 PolarHBondContact O-N 3.21Å; T423-G425 VanDerWaalsContact C-N 3.34Å
426	I	87.4	Confident	89.7	Confident	33 Å²	33	32.9 Å²	32.9	17%	0.169	17%	0.168	C	C	.	.			trans	-88.7	136.8	177.5	-58.2	172.6	0	0	0	108.6	M421 S422 K424 D428 S496	M421-I426 CarbonylContact C-O 3.6Å; M421-I426 WeakPolarHBondContact CA-O 3.19Å; S422-I426 PolarHBondContact N-O 2.97Å; S422-I426 PolarHBondContact OG-N 3.2Å; S422-I426 PolarHBondContact OG-O 3.46Å; K424-I426 VanDerWaalsContact C-N 3.35Å; K424-I426 HydrophobicContact CB-CD1 4.36Å; K424-I426 HydrophobicContact CB-CG1 4.4Å; I426-D428 PolarHBondContact O-N 3.38Å; I426-S496 WeakPolarHBondContact CD1-OG 3.29Å
427	P	90.3	Very high	89.9	Confident	6 Å²	6	30.8 Å²	30.8	4%	0.039	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-57.7	127.8	176.1	-24.1	34	0	0	0	112.5	T412 A415 F420 M421 R429 L485 L490	T412-P427 HydrophobicContact CG2-CB 4.13Å; T412-P427 HydrophobicContact CG2-CG 4.03Å; A415-P427 HydrophobicContact CB-CB 3.66Å; F420-P427 WeakPolarHBondContact O-CA 3.24Å; M421-P427 HydrophobicContact SD-CB 4.4Å; M421-P427 HydrophobicContact SD-CG 4.19Å; P427-R429 PolarHBondContact O-N 3.28Å; P427-L485 HydrophobicContact CG-CD2 4.02Å; P427-L490 HydrophobicContact CG-CB 4.5Å; P427-L490 HydrophobicContact CG-CD1 4.26Å
428	D	92.1	Very high	90.2	Very high	13 Å²	13	34.1 Å²	34.1	7%	0.07	17%	0.171	C	C	.	.			trans	-85.7	92.9	-176.5	178.8	-3.1	0	0	0	111.1	A415 F420 I426 S430 R431 A432 H513	A415-D428 WeakPolarHBondContact CB-O 3.45Å; F420-D428 HydrophobicContact CB-CB 4.08Å; F420-D428 PolarHBondContact O-N 2.68Å; I426-D428 PolarHBondContact O-N 3.38Å; D428-S430 PolarHBondContact OD1-N 2.87Å; D428-R431 HydrophobicContact CB-CB 4.29Å; D428-R431 WeakPolarHBondContact OD1-CB 3.24Å; D428-R431 PolarHBondContact OD1-N 3.43Å; D428-R431 VanDerWaalsContact OD2-CB 3.25Å; D428-R431 WeakPolarHBondContact OD2-CB 3.25Å; D428-A432 PolarHBondContact O-N 3.12Å; D428-A432 VanDerWaalsContact O-N 3.14Å; D428-H513 VanDerWaalsContact CG-ND1 3.29Å; D428-H513 IonicContact OD1-CE1 2.87Å; D428-H513 IonicContact OD1-ND1 3.33Å; D428-H513 PolarHBondContact OD1-ND1 3.26Å; D428-H513 IonicContact OD2-CE1 3.14Å; D428-H513 IonicContact OD2-CG 3.57Å; D428-H513 IonicContact OD2-ND1 3.73Å; D428-H513 PolarHBondContact OD2-ND1 3.4Å
429	R	91.8	Very high	90.4	Very high	11 Å²	11	32.2 Å²	32.2	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-66.4	-39.5	-176.9	-64.4	177.6	-178	147.7	1.1	112.7	Y369 L411 T412 P427 R431 A432 A433 I491 T493	Y369-R429 HydrophobicContact CE2-CB 3.98Å; L411-R429 HydrophobicContact CB-CB 4.07Å; L411-R429 HydrophobicContact CB-CG 4.1Å; L411-R429 HydrophobicContact CD1-CB 4.37Å; T412-R429 PolarHBondContact OG1-NE 3.45Å; T412-R429 PolarHBondContact OG1-NH2 2.58Å; P427-R429 PolarHBondContact O-N 3.28Å; R429-R431 PolarHBondContact O-N 3.5Å; R429-A432 WeakPolarHBondContact O-CB 3.46Å; R429-A432 PolarHBondContact O-N 3.19Å; R429-A433 WeakPolarHBondContact O-CB 3.43Å; R429-A433 PolarHBondContact O-N 3.2Å; R429-I491 PolarHBondContact NH2-O 3.37Å; R429-T493 PolarHBondContact NH1-O 2.98Å; R429-T493 PolarHBondContact NH2-O 2.88Å
430	S	91.3	Very high	90.6	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-59.8	-46.9	178.8	176.4	0	0	0	0	111.3	D428 A433 R434 D501	D428-S430 PolarHBondContact OD1-N 2.87Å; S430-A433 PolarHBondContact O-N 3.2Å; S430-R434 WeakPolarHBondContact O-CG 3.05Å; S430-R434 PolarHBondContact O-N 3.49Å; S430-R434 PolarHBondContact OG-NH1 2.8Å; S430-R434 PolarHBondContact OG-NH2 3.21Å; S430-R434 VanDerWaalsContact OG-NH2 3.11Å; S430-D501 WeakPolarHBondContact CB-OD1 3.31Å; S430-D501 VanDerWaalsContact CB-OD2 3.31Å; S430-D501 WeakPolarHBondContact CB-OD2 3.09Å; S430-D501 PolarHBondContact OG-OD1 2.95Å; S430-D501 PolarHBondContact OG-OD2 2.67Å
431	R	90.7	Very high	90.6	Very high	76 Å²	76	32 Å²	32	29%	0.287	16%	0.162	S	C	.	.	H	α-helix	trans	-65.3	-40.2	174.4	-173.8	175.4	-178.8	166	4.8	112.8	F420 D428 R429 A433 Y435 H513	F420-R431 HydrophobicContact CB-CG 4.47Å; F420-R431 HydrophobicContact CD1-CG 4.4Å; F420-R431 HydrophobicContact CD2-CB 4.36Å; F420-R431 HydrophobicContact CD2-CG 3.94Å; F420-R431 HydrophobicContact CE2-CG 4.25Å; F420-R431 HydrophobicContact CG-CG 4.03Å; D428-R431 HydrophobicContact CB-CB 4.29Å; D428-R431 WeakPolarHBondContact OD1-CB 3.24Å; D428-R431 PolarHBondContact OD1-N 3.43Å; D428-R431 VanDerWaalsContact OD2-CB 3.25Å; D428-R431 WeakPolarHBondContact OD2-CB 3.25Å; R429-R431 PolarHBondContact O-N 3.5Å; R431-A433 VanDerWaalsContact C-N 3.32Å; R431-Y435 WeakPolarHBondContact O-CB 3.36Å; R431-Y435 PolarHBondContact O-N 3.43Å; R431-H513 PolarHBondContact NH1-O 3.04Å
432	A	93.8	Very high	90.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-40.6	174.5	0	0	0	0	0	111.8	L411 L414 A415 F420 D428 R429 Y435 I436	L411-A432 HydrophobicContact CD2-CB 4.1Å; L414-A432 HydrophobicContact CB-CB 4.4Å; L414-A432 HydrophobicContact CD2-CB 4.28Å; L414-A432 HydrophobicContact CG-CB 4.38Å; A415-A432 HydrophobicContact CB-CB 3.95Å; F420-A432 HydrophobicContact CD2-CB 4.22Å; D428-A432 PolarHBondContact O-N 3.12Å; D428-A432 VanDerWaalsContact O-N 3.14Å; R429-A432 WeakPolarHBondContact O-CB 3.46Å; R429-A432 PolarHBondContact O-N 3.19Å; A432-Y435 WeakPolarHBondContact O-CB 3.3Å; A432-Y435 PolarHBondContact O-N 3.15Å; A432-I436 WeakPolarHBondContact O-CG1 3.18Å; A432-I436 PolarHBondContact O-N 3.32Å
433	A	95.2	Very high	90.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.8	-48.6	178.6	0	0	0	0	0	111.9	Y369 I373 L411 R429 S430 R431 Y435 I436 I437	Y369-A433 HydrophobicContact CD2-CB 3.54Å; Y369-A433 HydrophobicContact CG-CB 3.82Å; I373-A433 HydrophobicContact CD1-CB 4.05Å; I373-A433 HydrophobicContact CG1-CB 3.71Å; L411-A433 HydrophobicContact CD1-CB 4.29Å; L411-A433 HydrophobicContact CD2-CB 3.71Å; R429-A433 WeakPolarHBondContact O-CB 3.43Å; R429-A433 PolarHBondContact O-N 3.2Å; S430-A433 PolarHBondContact O-N 3.2Å; R431-A433 VanDerWaalsContact C-N 3.32Å; A433-Y435 PolarHBondContact O-N 2.93Å; A433-I436 PolarHBondContact O-N 2.94Å; A433-I436 VanDerWaalsContact O-N 3.12Å; A433-I437 WeakPolarHBondContact O-CG1 3.18Å; A433-I437 PolarHBondContact O-N 2.83Å
434	R	93.9	Very high	90.8	Very high	20 Å²	20	36.9 Å²	36.9	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-58.4	-34.9	173.9	-65.6	-177.1	-167.6	109.5	6.5	111.9	S363 L366 S430 K438 D501	S363-R434 WeakPolarHBondContact O-CD 3.47Å; S363-R434 PolarHBondContact O-NE 3.48Å; L366-R434 PolarHBondContact O-NH2 3.42Å; S430-R434 WeakPolarHBondContact O-CG 3.05Å; S430-R434 PolarHBondContact O-N 3.49Å; S430-R434 PolarHBondContact OG-NH1 2.8Å; S430-R434 PolarHBondContact OG-NH2 3.21Å; S430-R434 VanDerWaalsContact OG-NH2 3.11Å; R434-K438 WeakPolarHBondContact O-CB 3.15Å; R434-K438 VanDerWaalsContact O-CG 3.25Å; R434-K438 WeakPolarHBondContact O-CG 3.33Å; R434-K438 PolarHBondContact O-N 3.05Å; R434-D501 IonicContact NH2-OD1 3.45Å
435	Y	93.4	Very high	91.1	Very high	53 Å²	53	29.5 Å²	29.5	21%	0.208	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-46.7	175.7	-176.9	-86.5	0	0	0	111.7	Y389 L414 R418 F420 R431 A432 A433 K438 D439	Y389-Y435 HydrophobicContact CD1-CE1 4.37Å; Y389-Y435 HydrophobicContact CE1-CD1 4.27Å; Y389-Y435 AromaticContact CE1-CE1 3.84Å; Y389-Y435 HydrophobicContact CE1-CE1 3.84Å; L414-Y435 HydrophobicContact CD2-CD1 4.12Å; R418-Y435 PolarHBondContact NH1-OH 3.05Å; F420-Y435 HydrophobicContact CE2-CD2 4.26Å; F420-Y435 HydrophobicContact CE2-CG 4.03Å; F420-Y435 AromaticContact CZ-CD2 4Å; F420-Y435 HydrophobicContact CZ-CD2 4Å; F420-Y435 HydrophobicContact CZ-CG 4.25Å; R431-Y435 WeakPolarHBondContact O-CB 3.36Å; R431-Y435 PolarHBondContact O-N 3.43Å; A432-Y435 WeakPolarHBondContact O-CB 3.3Å; A432-Y435 PolarHBondContact O-N 3.15Å; A433-Y435 PolarHBondContact O-N 2.93Å; Y435-K438 PolarHBondContact O-N 3.33Å; Y435-D439 WeakPolarHBondContact CE1-OD2 3.46Å; Y435-D439 PolarHBondContact O-N 3.25Å; Y435-D439 PolarHBondContact OH-OD2 2.86Å
436	I	95	Very high	91.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-45.2	175.9	-65.1	175.7	0	0	0	111.3	I373 L376 Y389 L410 L411 L414 A432 A433 K438 D439 C440 L445	I373-I436 HydrophobicContact CD1-CB 3.87Å; I373-I436 HydrophobicContact CD1-CD1 4.28Å; I373-I436 HydrophobicContact CD1-CG2 3.83Å; L376-I436 HydrophobicContact CD2-CG2 3.48Å; L376-I436 VanDerWaalsContact CD2-CG2 3.48Å; Y389-I436 HydrophobicContact CE2-CG1 4.24Å; L410-I436 HydrophobicContact CD1-CD1 4.49Å; L410-I436 HydrophobicContact CD2-CD1 3.89Å; L410-I436 HydrophobicContact CG-CD1 4.01Å; L411-I436 HydrophobicContact CD2-CD1 3.85Å; L414-I436 HydrophobicContact CD2-CD1 3.58Å; L414-I436 HydrophobicContact CD2-CG1 3.33Å; A432-I436 WeakPolarHBondContact O-CG1 3.18Å; A432-I436 PolarHBondContact O-N 3.32Å; A433-I436 PolarHBondContact O-N 2.94Å; A433-I436 VanDerWaalsContact O-N 3.12Å; I436-K438 VanDerWaalsContact C-N 3.3Å; I436-K438 PolarHBondContact O-N 3.27Å; I436-D439 PolarHBondContact O-N 3.29Å; I436-D439 VanDerWaalsContact O-N 3.16Å; I436-C440 PolarHBondContact O-N 3.16Å; I436-L445 HydrophobicContact CG2-CD2 4.12Å
437	I	93.9	Very high	91.2	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-40.7	178.2	-65.3	166.5	0	0	0	110.5	L357 L366 P372 I373 A433 C440 T441	L357-I437 HydrophobicContact CD2-CG1 4.15Å; L366-I437 HydrophobicContact CD2-CD1 3.33Å; P372-I437 HydrophobicContact CB-CD1 4.34Å; P372-I437 HydrophobicContact CG-CD1 4.07Å; I373-I437 HydrophobicContact CD1-CD1 4.48Å; I373-I437 HydrophobicContact CD1-CG1 4.07Å; A433-I437 WeakPolarHBondContact O-CG1 3.18Å; A433-I437 PolarHBondContact O-N 2.83Å; I437-C440 PolarHBondContact O-N 2.88Å; I437-T441 HydrophobicContact CG2-CG2 4.25Å; I437-T441 WeakPolarHBondContact O-CB 2.92Å; I437-T441 VanDerWaalsContact O-CG2 3.25Å; I437-T441 WeakPolarHBondContact O-CG2 3.46Å; I437-T441 PolarHBondContact O-N 3.23Å; I437-T441 PolarHBondContact O-OG1 3.33Å
438	K	92.7	Very high	91.3	Very high	93 Å²	93	31.2 Å²	31.2	40%	0.404	15%	0.152	S	C	.	.	H	α-helix	trans	-65.2	-38.7	175	-74.2	175.7	-173.3	-175.8	0	112.7	S363 D364 R434 Y435 I436 T441 S442	S363-K438 WeakPolarHBondContact OG-CE 3.45Å; D364-K438 IonicContact OD1-NZ 3.46Å; D364-K438 PolarHBondContact OD1-NZ 3.15Å; R434-K438 WeakPolarHBondContact O-CB 3.15Å; R434-K438 VanDerWaalsContact O-CG 3.25Å; R434-K438 WeakPolarHBondContact O-CG 3.33Å; R434-K438 PolarHBondContact O-N 3.05Å; Y435-K438 PolarHBondContact O-N 3.33Å; I436-K438 VanDerWaalsContact C-N 3.3Å; I436-K438 PolarHBondContact O-N 3.27Å; K438-T441 WeakPolarHBondContact CA-OG1 3.33Å; K438-T441 PolarHBondContact O-OG1 3.01Å; K438-S442 WeakPolarHBondContact O-CB 3.25Å; K438-S442 PolarHBondContact O-N 3.33Å; K438-S442 VanDerWaalsContact O-N 3.11Å; K438-S442 PolarHBondContact O-OG 2.89Å
439	D	92.8	Very high	91.4	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-69.2	-35.5	175	-81.1	-13.5	0	0	0	111.8	H388 Y435 I436 S442 G443 R444 L445	H388-D439 IonicContact CE1-OD2 3.54Å; H388-D439 PolarHBondContact CE1-OD2 3.12Å; Y435-D439 WeakPolarHBondContact CE1-OD2 3.46Å; Y435-D439 PolarHBondContact O-N 3.25Å; Y435-D439 PolarHBondContact OH-OD2 2.86Å; I436-D439 PolarHBondContact O-N 3.29Å; I436-D439 VanDerWaalsContact O-N 3.16Å; D439-S442 PolarHBondContact O-OG 3.42Å; D439-G443 PolarHBondContact O-N 2.92Å; D439-R444 HydrophobicContact CB-CB 4.24Å; D439-R444 PolarHBondContact O-N 2.8Å; D439-R444 VanDerWaalsContact OD1-CD 3.3Å; D439-R444 WeakPolarHBondContact OD1-CD 3.37Å; D439-R444 IonicContact OD1-NH1 2.62Å; D439-R444 PolarHBondContact OD1-NH1 3.2Å; D439-R444 VanDerWaalsContact OD1-NH1 3.15Å; D439-L445 PolarHBondContact O-N 3.36Å; D439-L445 VanDerWaalsContact O-N 3.13Å
440	C	92.2	Very high	91.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67	-50.7	172.7	-176.7	0	0	0	0	112	R160 L357 I436 I437 S442 G443	R160-C440 PolarHBondContact NH1-O 2.91Å; L357-C440 HydrophobicContact CD2-CB 4.36Å; I436-C440 PolarHBondContact O-N 3.16Å; I437-C440 PolarHBondContact O-N 2.88Å; C440-S442 VanDerWaalsContact C-N 3.27Å; C440-S442 PolarHBondContact O-N 2.9Å; C440-G443 PolarHBondContact O-N 3.45Å
441	T	90.5	Very high	91.8	Very high	29 Å²	29	31.4 Å²	31.4	18%	0.178	16%	0.155	C	C	.	.	H	α-helix	trans	-60.6	-34.3	179.7	51.4	0	0	0	0	113.4	L356 L357 G359 I437 K438 G443	L356-T441 VanDerWaalsContact O-CG2 3.3Å; L356-T441 WeakPolarHBondContact O-CG2 3.39Å; L357-T441 VanDerWaalsContact O-CG2 3.23Å; L357-T441 WeakPolarHBondContact O-CG2 3.43Å; G359-T441 VanDerWaalsContact CA-CG2 3.46Å; I437-T441 HydrophobicContact CG2-CG2 4.25Å; I437-T441 WeakPolarHBondContact O-CB 2.92Å; I437-T441 VanDerWaalsContact O-CG2 3.25Å; I437-T441 WeakPolarHBondContact O-CG2 3.46Å; I437-T441 PolarHBondContact O-N 3.23Å; I437-T441 PolarHBondContact O-OG1 3.33Å; K438-T441 WeakPolarHBondContact CA-OG1 3.33Å; K438-T441 PolarHBondContact O-OG1 3.01Å; T441-G443 VanDerWaalsContact C-N 3.3Å
442	S	87.6	Confident	91.9	Very high	66 Å²	66	31.5 Å²	31.5	46%	0.462	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-6.6	176	61	0	0	0	0	114.4	K438 D439 C440 R444	K438-S442 WeakPolarHBondContact O-CB 3.25Å; K438-S442 PolarHBondContact O-N 3.33Å; K438-S442 VanDerWaalsContact O-N 3.11Å; K438-S442 PolarHBondContact O-OG 2.89Å; D439-S442 PolarHBondContact O-OG 3.42Å; C440-S442 VanDerWaalsContact C-N 3.27Å; C440-S442 PolarHBondContact O-N 2.9Å; S442-R444 VanDerWaalsContact C-N 3.34Å
443	G	86.9	Confident	91.9	Very high	13 Å²	13	35.8 Å²	35.8	13%	0.134	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	9.1	-179.8	0	0	0	0	0	114.9	D439 C440 T441	D439-G443 PolarHBondContact O-N 2.92Å; C440-G443 PolarHBondContact O-N 3.45Å; T441-G443 VanDerWaalsContact C-N 3.3Å
444	R	87.8	Confident	91.8	Very high	157 Å²	157	38.2 Å²	38.2	59%	0.592	22%	0.222	S	C	*	.	S	Bend	trans	-72.4	-42.4	177	-69.5	175.5	174.1	175.1	-2.9	112	H388 D439 S442 P446	H388-R444 PolarHBondContact CD2-O 3.32Å; H388-R444 VanDerWaalsContact NE2-C 3.35Å; H388-R444 PolarHBondContact NE2-O 3.11Å; D439-R444 HydrophobicContact CB-CB 4.24Å; D439-R444 PolarHBondContact O-N 2.8Å; D439-R444 VanDerWaalsContact OD1-CD 3.3Å; D439-R444 WeakPolarHBondContact OD1-CD 3.37Å; D439-R444 IonicContact OD1-NH1 2.62Å; D439-R444 PolarHBondContact OD1-NH1 3.2Å; D439-R444 VanDerWaalsContact OD1-NH1 3.15Å; S442-R444 VanDerWaalsContact C-N 3.34Å; R444-P446 WeakPolarHBondContact O-CD 3.4Å
445	L	89.8	Confident	91.8	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-87.9	109	166.2	-177.4	66.7	0	0	0	107.3	L376 L380 F385 H388 Y389 I436 D439 Y447	L376-L445 HydrophobicContact CD2-CD2 3.74Å; L376-L445 HydrophobicContact CG-CD2 4.45Å; L380-L445 HydrophobicContact CD1-CD1 4.4Å; L380-L445 HydrophobicContact CD1-CD2 4.14Å; L380-L445 HydrophobicContact CD1-CG 4.14Å; F385-L445 HydrophobicContact CD1-CD2 4.44Å; F385-L445 HydrophobicContact CE1-CD2 3.97Å; H388-L445 HydrophobicContact CB-CD1 4.11Å; Y389-L445 HydrophobicContact CE2-CD1 4.44Å; Y389-L445 HydrophobicContact CE2-CD2 4.41Å; I436-L445 HydrophobicContact CG2-CD2 4.12Å; D439-L445 PolarHBondContact O-N 3.36Å; D439-L445 VanDerWaalsContact O-N 3.13Å; L445-Y447 PolarHBondContact O-N 3.01Å
446	P	84.7	Confident	91.6	Very high	82 Å²	82	43.1 Å²	43.1	53%	0.532	25%	0.251	S	S	.	.			trans	-66.3	127.3	-178.3	26.9	-34.1	0	0	0	109.9	R444	R444-P446 WeakPolarHBondContact O-CD 3.4Å
447	Y	89.4	Confident	91.3	Very high	28 Å²	28	46.3 Å²	46.3	11%	0.11	28%	0.278	C	S	.	.			trans	-150.6	115.8	175.6	170	-114.4	0	0	0	107.5	R160 F375 L376 A379 L380 L445 V449	R160-Y447 WeakPolarHBondContact CD-O 3.47Å; F375-Y447 HydrophobicContact CE1-CE2 4.43Å; F375-Y447 AromaticContact CE1-CZ 3.85Å; F375-Y447 VanDerWaalsContact CE1-OH 3.24Å; F375-Y447 WeakPolarHBondContact CE1-OH 3.31Å; F375-Y447 WeakPolarHBondContact CZ-OH 3.47Å; L376-Y447 HydrophobicContact CD1-CD2 4.28Å; L376-Y447 HydrophobicContact CD1-CG 4.13Å; A379-Y447 HydrophobicContact CB-CD2 4.43Å; A379-Y447 HydrophobicContact CB-CE2 3.83Å; L380-Y447 HydrophobicContact CD2-CD2 4.14Å; L380-Y447 HydrophobicContact CG-CD2 4.38Å; L445-Y447 PolarHBondContact O-N 3.01Å; Y447-V449 HydrophobicContact CE1-CG2 4.08Å; Y447-V449 HydrophobicContact CE2-CG2 4.25Å; Y447-V449 WeakPolarHBondContact OH-CG2 3.19Å
448	C	92.6	Very high	91.1	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.041	30%	0.297	C	S	.	.			trans	-130.9	148.8	179.6	-59.8	0	0	0	0	108.7	R160 F459 N460	R160-C448 WeakPolarHBondContact O-CA 3.35Å; C448-F459 HydrophobicContact CB-CE1 3.72Å; C448-F459 HydrophobicContact CB-CZ 4.41Å; C448-N460 PolarHBondContact O-ND2 2.53Å; C448-N460 PolarHBondContact O-OD1 3.06Å
449	V	93.1	Very high	91.1	Very high	21 Å²	21	45.1 Å²	45.1	13%	0.127	28%	0.278	C	S	.	.			trans	-112.3	136.1	-179.8	178.4	0	0	0	0	107.8	R160 N161 W201 Y447 E456 F459	R160-V449 PolarHBondContact O-N 3.36Å; N161-V449 HydrophobicContact CB-CB 3.99Å; N161-V449 HydrophobicContact CB-CG2 4.01Å; W201-V449 VanDerWaalsContact CZ2-O 3.28Å; W201-V449 WeakPolarHBondContact CZ2-O 2.99Å; W201-V449 PolarHBondContact NE1-O 2.93Å; Y447-V449 HydrophobicContact CE1-CG2 4.08Å; Y447-V449 HydrophobicContact CE2-CG2 4.25Å; Y447-V449 WeakPolarHBondContact OH-CG2 3.19Å; V449-E456 VanDerWaalsContact CG1-OE1 3.29Å; V449-E456 WeakPolarHBondContact CG1-OE1 3.06Å; V449-F459 WeakPolarHBondContact O-CE1 3.21Å
450	A	95.1	Very high	90.9	Very high	9 Å²	9	47.5 Å²	47.5	7%	0.074	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-72.5	151.3	178.9	0	0	0	0	0	111.4	I454 E456 F459	A450-I454 HydrophobicContact CB-CB 4.31Å; A450-I454 HydrophobicContact CB-CG2 4.49Å; A450-E456 HydrophobicContact CB-CG 4.25Å; A450-E456 VanDerWaalsContact N-CD 3.31Å; A450-E456 PolarHBondContact N-OE1 2.76Å; A450-E456 PolarHBondContact N-OE2 3Å; A450-E456 VanDerWaalsContact N-OE2 3.15Å; A450-F459 HydrophobicContact CB-CB 3.57Å; A450-F459 HydrophobicContact CB-CD1 3.78Å; A450-F459 HydrophobicContact CB-CD2 4.03Å; A450-F459 HydrophobicContact CB-CE1 4.5Å; A450-F459 HydrophobicContact CB-CG 3.52Å
451	P	95.7	Very high	90.5	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.013	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-64.9	153.7	167.7	28.1	-33.3	0	0	0	110.8	W201 Y204 G453 I454	W201-P451 HydrophobicContact CD2-CB 4.09Å; W201-P451 HydrophobicContact CD2-CG 4.35Å; W201-P451 HydrophobicContact CE3-CB 3.8Å; W201-P451 HydrophobicContact CH2-CB 3.8Å; W201-P451 HydrophobicContact CZ2-CB 4.06Å; W201-P451 HydrophobicContact CZ3-CB 3.67Å; Y204-P451 HydrophobicContact CD2-CB 3.9Å; Y204-P451 HydrophobicContact CG-CB 3.87Å; P451-G453 PolarHBondContact O-N 2.85Å; P451-I454 HydrophobicContact CG-CB 4.32Å; P451-I454 HydrophobicContact CG-CD1 3.51Å; P451-I454 HydrophobicContact CG-CG1 3.92Å; P451-I454 PolarHBondContact O-N 3.49Å
452	P	93.8	Very high	89.4	Confident	77 Å²	77	54.8 Å²	54.8	50%	0.5	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	135.4	176.7	-26	33.4	0	0	0	112.5	L163 Y204	L163-P452 HydrophobicContact CD1-CG 3.66Å; Y204-P452 HydrophobicContact CE2-CB 4.28Å; Y204-P452 HydrophobicContact CE2-CG 4.02Å
453	G	92.9	Very high	87.9	Confident	91 Å²	91	56.5 Å²	56.5	94%	0.938	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	-9.4	-179.2	0	0	0	0	0	114.4	P451	P451-G453 PolarHBondContact O-N 2.85Å
454	I	94.6	Very high	85.8	Confident	50 Å²	50	61.9 Å²	61.9	26%	0.256	37%	0.37	S	S	.	.	S	Bend	trans	-105.7	135	175.7	-52.6	-165.4	0	0	0	109.5	Y200 A450 P451 E456 F459	Y200-I454 HydrophobicContact CD1-CD1 3.21Å; Y200-I454 HydrophobicContact CD2-CD1 4.5Å; Y200-I454 HydrophobicContact CE1-CD1 3.89Å; Y200-I454 HydrophobicContact CG-CD1 3.56Å; A450-I454 HydrophobicContact CB-CB 4.31Å; A450-I454 HydrophobicContact CB-CG2 4.49Å; P451-I454 HydrophobicContact CG-CB 4.32Å; P451-I454 HydrophobicContact CG-CD1 3.51Å; P451-I454 HydrophobicContact CG-CG1 3.92Å; P451-I454 PolarHBondContact O-N 3.49Å; I454-E456 PolarHBondContact O-N 3.39Å; I454-F459 HydrophobicContact CG2-CB 4.14Å
455	D	93.1	Very high	84	Confident	99 Å²	99	57.3 Å²	57.3	53%	0.529	36%	0.359	S	S	.	.			trans	-67.5	126.3	174.7	-176.7	0.4	0	0	0	110.5	A457 V458 F459	D455-A457 PolarHBondContact O-N 2.97Å; D455-A457 PolarHBondContact OD1-N 3Å; D455-V458 HydrophobicContact CB-CB 4.24Å; D455-V458 HydrophobicContact CB-CG2 3.94Å; D455-V458 PolarHBondContact O-N 3.22Å; D455-F459 WeakPolarHBondContact O-CB 3.15Å; D455-F459 PolarHBondContact O-N 3.15Å
456	E	90.1	Very high	81.4	Confident	77 Å²	77	64.3 Å²	64.3	36%	0.36	40%	0.397	S	S	.	.	H	α-helix	trans	-54.3	-36.4	175.9	-74.6	-72.8	-179.7	0	0	112	V449 A450 I454 V458 F459 N460	V449-E456 VanDerWaalsContact CG1-OE1 3.29Å; V449-E456 WeakPolarHBondContact CG1-OE1 3.06Å; A450-E456 HydrophobicContact CB-CG 4.25Å; A450-E456 VanDerWaalsContact N-CD 3.31Å; A450-E456 PolarHBondContact N-OE1 2.76Å; A450-E456 PolarHBondContact N-OE2 3Å; A450-E456 VanDerWaalsContact N-OE2 3.15Å; I454-E456 PolarHBondContact O-N 3.39Å; E456-V458 VanDerWaalsContact C-N 3.33Å; E456-V458 PolarHBondContact O-N 3.38Å; E456-F459 PolarHBondContact O-N 2.92Å; E456-N460 VanDerWaalsContact O-CB 3.31Å; E456-N460 WeakPolarHBondContact O-CB 3.31Å; E456-N460 PolarHBondContact O-N 2.64Å; E456-N460 PolarHBondContact O-ND2 3.01Å; E456-N460 PolarHBondContact OE2-ND2 3.13Å
457	A	87.4	Confident	79.2	Confident	68 Å²	68	70.8 Å²	70.8	56%	0.562	42%	0.416	S	S	*	.	H	α-helix	trans	-68.5	-32.4	178.6	0	0	0	0	0	112.6	D455 A461	D455-A457 PolarHBondContact O-N 2.97Å; D455-A457 PolarHBondContact OD1-N 3Å; A457-A461 WeakPolarHBondContact O-CA 3.46Å; A457-A461 WeakPolarHBondContact O-CB 3.44Å; A457-A461 PolarHBondContact O-N 3.45Å
458	V	90.6	Very high	76.7	Confident	65 Å²	65	73.8 Å²	73.8	39%	0.394	45%	0.447	S	S	.	.	H	α-helix	trans	-79.5	-36.8	177.6	177.6	0	0	0	0	111.1	D455 E456	D455-V458 HydrophobicContact CB-CB 4.24Å; D455-V458 HydrophobicContact CB-CG2 3.94Å; D455-V458 PolarHBondContact O-N 3.22Å; E456-V458 VanDerWaalsContact C-N 3.33Å; E456-V458 PolarHBondContact O-N 3.38Å
459	F	92.3	Very high	74.2	Confident	4 Å²	4	77 Å²	77	2%	0.018	47%	0.469	C	S	.	.	H	α-helix	trans	-71	-41.1	178.5	178.4	-96.4	0	0	0	112.5	Q197 Y200 W201 C448 V449 A450 I454 D455 E456	Q197-F459 HydrophobicContact CB-CD2 4.47Å; Q197-F459 HydrophobicContact CB-CE1 4.46Å; Q197-F459 HydrophobicContact CB-CE2 3.66Å; Q197-F459 HydrophobicContact CB-CZ 3.64Å; Q197-F459 HydrophobicContact CG-CD1 4.35Å; Q197-F459 HydrophobicContact CG-CD2 4.09Å; Q197-F459 HydrophobicContact CG-CE1 3.95Å; Q197-F459 HydrophobicContact CG-CE2 3.67Å; Q197-F459 HydrophobicContact CG-CG 4.4Å; Q197-F459 HydrophobicContact CG-CZ 3.58Å; Q197-F459 WeakPolarHBondContact CG-O 3.34Å; Q197-F459 PolarHBondContact NE2-O 3.08Å; Y200-F459 AromaticContact CD2-CD2 3.65Å; Y200-F459 HydrophobicContact CD2-CD2 3.65Å; Y200-F459 HydrophobicContact CD2-CE2 4.22Å; Y200-F459 HydrophobicContact CE2-CD2 4.44Å; Y200-F459 HydrophobicContact CG-CD2 4.26Å; W201-F459 AromaticContact CD1-CE2 3.95Å; W201-F459 AromaticContact CD1-CZ 3.91Å; W201-F459 AromaticContact NE1-CE2 3.89Å; W201-F459 AromaticContact NE1-CZ 3.58Å; C448-F459 HydrophobicContact CB-CE1 3.72Å; C448-F459 HydrophobicContact CB-CZ 4.41Å; V449-F459 WeakPolarHBondContact O-CE1 3.21Å; A450-F459 HydrophobicContact CB-CB 3.57Å; A450-F459 HydrophobicContact CB-CD1 3.78Å; A450-F459 HydrophobicContact CB-CD2 4.03Å; A450-F459 HydrophobicContact CB-CE1 4.5Å; A450-F459 HydrophobicContact CB-CG 3.52Å; I454-F459 HydrophobicContact CG2-CB 4.14Å; D455-F459 WeakPolarHBondContact O-CB 3.15Å; D455-F459 PolarHBondContact O-N 3.15Å; E456-F459 PolarHBondContact O-N 2.92Å
460	N	88.5	Confident	71.6	Confident	53 Å²	53	81.5 Å²	81.5	28%	0.283	50%	0.497	S	S	.	.	S	Bend	trans	-99.1	14.1	177.9	-66.8	-49.3	0	0	0	113.1	Q197 C448 E456 D462	Q197-N460 PolarHBondContact NE2-OD1 2.63Å; C448-N460 PolarHBondContact O-ND2 2.53Å; C448-N460 PolarHBondContact O-OD1 3.06Å; E456-N460 VanDerWaalsContact O-CB 3.31Å; E456-N460 WeakPolarHBondContact O-CB 3.31Å; E456-N460 PolarHBondContact O-N 2.64Å; E456-N460 PolarHBondContact O-ND2 3.01Å; E456-N460 PolarHBondContact OE2-ND2 3.13Å; N460-D462 PolarHBondContact O-N 2.93Å; N460-D462 VanDerWaalsContact O-N 3.13Å
461	A	83.4	Confident	68.9	Low	56 Å²	56	85.2 Å²	85.2	46%	0.463	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-54.4	123.8	172.3	0	0	0	0	0	108.6	A457 E463	A457-A461 WeakPolarHBondContact O-CA 3.46Å; A457-A461 WeakPolarHBondContact O-CB 3.44Å; A457-A461 PolarHBondContact O-N 3.45Å; A461-E463 PolarHBondContact O-N 2.96Å
462	D	67.2	Low	66.3	Low	127 Å²	127	90.7 Å²	90.7	68%	0.679	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-53.7	116.3	175.2	-78.6	-37.3	0	0	0	108	N460	N460-D462 PolarHBondContact O-N 2.93Å; N460-D462 VanDerWaalsContact O-N 3.13Å
463	E	56	Low	63.7	Low	102 Å²	102	91.9 Å²	91.9	48%	0.477	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-56.9	141.4	156.8	-76.5	-176.4	-175.7	0	0	106.6	A461 V465	A461-E463 PolarHBondContact O-N 2.96Å; E463-V465 PolarHBondContact O-N 3.46Å
464	P	44.5	Very low	61.3	Low	126 Å²	126	95.3 Å²	95.3	82%	0.818	55%	0.547	S	S	*	.			trans	-61.8	90.5	172.7	25.5	-31.6	0	0	0	107.5	D466	P464-D466 PolarHBondContact O-N 2.86Å
465	V	48.4	Very low	58.7	Low	60 Å²	60	94.7 Å²	94.7	36%	0.364	55%	0.545	S	S	.	.			trans	-59.3	108.8	175.5	174.1	0	0	0	0	105.3	E463 K467 S469	E463-V465 PolarHBondContact O-N 3.46Å; V465-K467 PolarHBondContact O-N 3.47Å; V465-K467 VanDerWaalsContact O-N 3.15Å; V465-S469 WeakPolarHBondContact CG1-OG 3.44Å
466	D	36.4	Very low	56.3	Low	148 Å²	148	92.3 Å²	92.3	79%	0.791	54%	0.539	S	S	*	.			trans	-41.9	127.5	161.7	-88.3	-32.5	0	0	0	106.6	P464 A468	P464-D466 PolarHBondContact O-N 2.86Å; D466-A468 PolarHBondContact O-N 3.42Å
467	K	37.9	Very low	54	Low	217 Å²	217	92.5 Å²	92.5	94%	0.943	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	19.7	-165	-66.4	172	176.3	169.3	0	115.3	V465	V465-K467 PolarHBondContact O-N 3.47Å; V465-K467 VanDerWaalsContact O-N 3.15Å
468	A	38.2	Very low	52.1	Low	91 Å²	91	93.8 Å²	93.8	75%	0.752	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-13.1	-171.2	0	0	0	0	0	116.1	D466 T470	D466-A468 PolarHBondContact O-N 3.42Å; A468-T470 PolarHBondContact O-N 3.03Å
469	S	39.2	Very low	50.2	Low	73 Å²	73	95 Å²	95	51%	0.51	56%	0.559	S	S	.	*	S	Bend	trans	-88.9	96.3	176.3	58.4	0	0	0	0	112.4	V465	V465-S469 WeakPolarHBondContact CG1-OG 3.44Å
470	T	39.4	Very low	48.4	Very low	117 Å²	117	103.9 Å²	103.9	72%	0.718	59%	0.592	S	S	*	*	S	Bend	trans	63.7	105.9	176	38.4	0	0	0	0	116.6	A468	A468-T470 PolarHBondContact O-N 3.03Å
471	P	37.3	Very low	47.2	Very low	86 Å²	86	101.7 Å²	101.7	56%	0.558	58%	0.581	S	S	*	*			trans	-74.1	135.9	-178.4	32.8	-34.7	0	0	0	110.4	T473	P471-T473 HydrophobicContact CB-CG2 4.27Å; P471-T473 WeakPolarHBondContact CB-OG1 3.33Å; P471-T473 VanDerWaalsContact CG-OG1 3.25Å; P471-T473 WeakPolarHBondContact CG-OG1 3.2Å; P471-T473 PolarHBondContact O-N 3.4Å
472	L	40.3	Very low	46.4	Very low	117 Å²	117	99.6 Å²	99.6	61%	0.613	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.2	-7.6	163.9	-83.6	131.9	0	0	0	114	T475 A476	L472-T475 PolarHBondContact O-N 2.97Å; L472-T475 PolarHBondContact O-OG1 3.25Å; L472-A476 PolarHBondContact O-N 3.18Å
473	T	39.4	Very low	46.5	Very low	103 Å²	103	96 Å²	96	63%	0.632	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-30.2	-173.3	52.1	0	0	0	0	114.3	P471 T475	P471-T473 HydrophobicContact CB-CG2 4.27Å; P471-T473 WeakPolarHBondContact CB-OG1 3.33Å; P471-T473 VanDerWaalsContact CG-OG1 3.25Å; P471-T473 WeakPolarHBondContact CG-OG1 3.2Å; P471-T473 PolarHBondContact O-N 3.4Å; T473-T475 VanDerWaalsContact C-N 3.31Å; T473-T475 PolarHBondContact O-N 3.37Å
474	E	42.4	Very low	47.3	Very low	163 Å²	163	94 Å²	94	76%	0.762	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-23.9	176.6	-72.5	-165.3	165.6	0	0	112.7
475	T	41.6	Very low	48.7	Very low	37 Å²	37	88 Å²	88	23%	0.227	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-7.8	179.5	26.5	0	0	0	0	114	L472 T473 G477 K478	L472-T475 PolarHBondContact O-N 2.97Å; L472-T475 PolarHBondContact O-OG1 3.25Å; T473-T475 VanDerWaalsContact C-N 3.31Å; T473-T475 PolarHBondContact O-N 3.37Å; T475-G477 PolarHBondContact O-N 3.35Å; T475-K478 HydrophobicContact CG2-CD 4.28Å; T475-K478 WeakPolarHBondContact O-CB 3.12Å; T475-K478 PolarHBondContact O-N 3.04Å
476	A	41.9	Very low	49.8	Very low	48 Å²	48	88.3 Å²	88.3	40%	0.397	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-54.7	-18.9	175.5	0	0	0	0	0	114.1	L472 K478 L479	L472-A476 PolarHBondContact O-N 3.18Å; A476-K478 PolarHBondContact O-N 3.49Å; A476-L479 HydrophobicContact CB-CD1 3.98Å; A476-L479 HydrophobicContact CB-CG 4.48Å; A476-L479 WeakPolarHBondContact O-CD1 3.27Å; A476-L479 WeakPolarHBondContact O-CG 3.42Å
477	G	42.8	Very low	51.5	Low	82 Å²	82	89.9 Å²	89.9	85%	0.845	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-70.9	-10.7	171.3	0	0	0	0	0	115.4	T475	T475-G477 PolarHBondContact O-N 3.35Å
478	K	46.9	Very low	53.2	Low	94 Å²	94	86.9 Å²	86.9	41%	0.409	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-110.2	3.7	-171.8	-70	162.3	168.1	179	0	114	V417 T475 A476 R480 S481	V417-K478 HydrophobicContact CG1-CD 3.84Å; V417-K478 HydrophobicContact CG1-CG 4.47Å; T475-K478 HydrophobicContact CG2-CD 4.28Å; T475-K478 WeakPolarHBondContact O-CB 3.12Å; T475-K478 PolarHBondContact O-N 3.04Å; A476-K478 PolarHBondContact O-N 3.49Å; K478-R480 PolarHBondContact O-N 3.31Å; K478-S481 PolarHBondContact O-N 3.09Å
479	L	49.6	Very low	54.8	Low	92 Å²	92	87.9 Å²	87.9	48%	0.482	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	2.2	-168.4	-63.7	168.6	0	0	0	117.5	I392 A476	I392-L479 HydrophobicContact CD1-CD2 3.13Å; I392-L479 HydrophobicContact CD1-CG 4.36Å; I392-L479 HydrophobicContact CG1-CD2 3.98Å; A476-L479 HydrophobicContact CB-CD1 3.98Å; A476-L479 HydrophobicContact CB-CG 4.48Å; A476-L479 WeakPolarHBondContact O-CD1 3.27Å; A476-L479 WeakPolarHBondContact O-CG 3.42Å
480	R	55.5	Low	56.6	Low	190 Å²	190	85.7 Å²	85.7	72%	0.717	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	20.1	-176.2	-62.5	-174.3	-177.2	175.7	0.7	113.9	K478 S483 I484	K478-R480 PolarHBondContact O-N 3.31Å; R480-S483 PolarHBondContact O-OG 2.94Å; R480-I484 HydrophobicContact CB-CD1 4.09Å; R480-I484 HydrophobicContact CB-CG1 4.49Å; R480-I484 WeakPolarHBondContact O-CB 3.38Å; R480-I484 WeakPolarHBondContact O-CD1 3.48Å; R480-I484 WeakPolarHBondContact O-CG1 3.36Å; R480-I484 PolarHBondContact O-N 3Å
481	S	63.5	Low	57.9	Low	6 Å²	6	81.4 Å²	81.4	4%	0.042	43%	0.427	C	S	.	.	H	α-helix	trans	-61.1	-50.9	-177.1	52.9	0	0	0	0	112.7	K478 I484 L485	K478-S481 PolarHBondContact O-N 3.09Å; S481-I484 PolarHBondContact O-N 3.09Å; S481-L485 VanDerWaalsContact O-CG 3.27Å; S481-L485 WeakPolarHBondContact O-CG 3.16Å; S481-L485 PolarHBondContact O-N 3.08Å
482	L	65.8	Low	58.9	Low	13 Å²	13	85.1 Å²	85.1	7%	0.068	44%	0.437	C	S	.	.	H	α-helix	trans	-65.7	-46.3	-175.8	-71.8	-173	0	0	0	113.2	I392 F393 V409 A413 I484 L485 E486 I491	I392-L482 WeakPolarHBondContact O-CD1 3.2Å; F393-L482 HydrophobicContact CD1-CD1 3.9Å; V409-L482 HydrophobicContact CG1-CD1 4.4Å; V409-L482 HydrophobicContact CG1-CD2 3.94Å; A413-L482 HydrophobicContact CB-CD2 3.6Å; A413-L482 HydrophobicContact CB-CG 4.49Å; L482-I484 PolarHBondContact O-N 2.87Å; L482-L485 HydrophobicContact CD2-CD1 4.19Å; L482-L485 WeakPolarHBondContact O-CA 3.25Å; L482-L485 WeakPolarHBondContact O-CB 3.39Å; L482-L485 PolarHBondContact O-N 2.82Å; L482-E486 WeakPolarHBondContact O-CG 3.48Å; L482-E486 PolarHBondContact O-N 3.41Å; L482-I491 HydrophobicContact CD2-CD1 4.46Å
483	S	70.2	Confident	59.6	Low	51 Å²	51	82 Å²	82	36%	0.357	42%	0.423	S	S	.	.	H	α-helix	trans	-63.5	-29.4	178.3	58.1	0	0	0	0	113	R480 K487	R480-S483 PolarHBondContact O-OG 2.94Å; S483-K487 WeakPolarHBondContact O-CB 3.23Å; S483-K487 WeakPolarHBondContact O-CG 3.21Å; S483-K487 PolarHBondContact O-N 2.94Å
484	I	72.2	Confident	60.2	Low	61 Å²	61	84.1 Å²	84.1	31%	0.313	42%	0.423	S	S	.	.	H	α-helix	trans	-73.1	-36.9	172.1	-67.3	167.6	0	0	0	111.2	F416 R480 S481 L482 R488	F416-I484 HydrophobicContact CE1-CG2 4.38Å; F416-I484 HydrophobicContact CE2-CG2 4.28Å; F416-I484 HydrophobicContact CZ-CB 4.39Å; F416-I484 HydrophobicContact CZ-CG2 3.69Å; R480-I484 HydrophobicContact CB-CD1 4.09Å; R480-I484 HydrophobicContact CB-CG1 4.49Å; R480-I484 WeakPolarHBondContact O-CB 3.38Å; R480-I484 WeakPolarHBondContact O-CD1 3.48Å; R480-I484 WeakPolarHBondContact O-CG1 3.36Å; R480-I484 PolarHBondContact O-N 3Å; S481-I484 PolarHBondContact O-N 3.09Å; L482-I484 PolarHBondContact O-N 2.87Å; I484-R488 WeakPolarHBondContact O-CB 3.46Å; I484-R488 WeakPolarHBondContact O-CG 3.39Å; I484-R488 PolarHBondContact O-N 2.89Å
485	L	73.9	Confident	60.6	Low	0 Å²	0	80.7 Å²	80.7	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-69.1	-43.5	178	-75.4	168.7	0	0	0	112.1	T412 A413 F416 P427 S481 L482 R488 N489 L490 I491	T412-L485 HydrophobicContact CG2-CD1 4.16Å; T412-L485 HydrophobicContact CG2-CD2 4.09Å; A413-L485 HydrophobicContact CB-CD1 4.44Å; F416-L485 HydrophobicContact CB-CD1 3.87Å; F416-L485 HydrophobicContact CB-CD2 3.89Å; F416-L485 HydrophobicContact CB-CG 4.18Å; F416-L485 HydrophobicContact CD1-CG 4.41Å; F416-L485 HydrophobicContact CD2-CD2 3.49Å; F416-L485 VanDerWaalsContact CD2-CD2 3.49Å; F416-L485 HydrophobicContact CD2-CG 4.08Å; F416-L485 HydrophobicContact CE2-CD2 4.22Å; F416-L485 HydrophobicContact CG-CD1 4.13Å; F416-L485 HydrophobicContact CG-CD2 3.76Å; F416-L485 HydrophobicContact CG-CG 3.96Å; P427-L485 HydrophobicContact CG-CD2 4.02Å; S481-L485 VanDerWaalsContact O-CG 3.27Å; S481-L485 WeakPolarHBondContact O-CG 3.16Å; S481-L485 PolarHBondContact O-N 3.08Å; L482-L485 HydrophobicContact CD2-CD1 4.19Å; L482-L485 WeakPolarHBondContact O-CA 3.25Å; L482-L485 WeakPolarHBondContact O-CB 3.39Å; L482-L485 PolarHBondContact O-N 2.82Å; L485-R488 CarbonylContact O-C 3.59Å; L485-R488 PolarHBondContact O-N 3.05Å; L485-N489 PolarHBondContact O-N 3.47Å; L485-N489 VanDerWaalsContact O-N 3.1Å; L485-L490 HydrophobicContact CD2-CB 3.74Å; L485-L490 HydrophobicContact CD2-CD1 3.77Å; L485-L490 HydrophobicContact CD2-CG 4.41Å; L485-L490 PolarHBondContact O-N 3.43Å; L485-I491 HydrophobicContact CB-CD1 4.23Å; L485-I491 HydrophobicContact CB-CG1 4.02Å
486	E	71.9	Confident	61.2	Low	66 Å²	66	79.8 Å²	79.8	31%	0.308	41%	0.413	S	S	.	.	H	α-helix	trans	-59.3	-49.9	173.1	-72.4	172.5	172.7	0	0	110.6	N395 H398 L482 R488 N489 I491	N395-E486 PolarHBondContact ND2-OE1 2.94Å; H398-E486 IonicContact CD2-OE1 3.61Å; H398-E486 IonicContact CE1-OE1 2.69Å; H398-E486 PolarHBondContact CE1-OE1 3.3Å; H398-E486 IonicContact NE2-OE1 3.38Å; H398-E486 PolarHBondContact NE2-OE1 3.29Å; L482-E486 WeakPolarHBondContact O-CG 3.48Å; L482-E486 PolarHBondContact O-N 3.41Å; E486-R488 PolarHBondContact O-N 3.32Å; E486-R488 VanDerWaalsContact O-N 3.07Å; E486-N489 PolarHBondContact O-N 2.93Å; E486-N489 PolarHBondContact O-OD1 3.27Å; E486-N489 VanDerWaalsContact O-OD1 3.11Å; E486-I491 HydrophobicContact CG-CD1 3.73Å
487	K	71.9	Confident	61.9	Low	180 Å²	180	78 Å²	78	78%	0.783	40%	0.398	S	S	*	.	H	α-helix	trans	-58.9	-23.5	176.2	-77.2	177.2	-177.2	-174.1	0	114.2	S483	S483-K487 WeakPolarHBondContact O-CB 3.23Å; S483-K487 WeakPolarHBondContact O-CG 3.21Å; S483-K487 PolarHBondContact O-N 2.94Å
488	R	72.9	Confident	62.8	Low	154 Å²	154	80.8 Å²	80.8	58%	0.581	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	4	178	-71.2	-176.9	172.1	139.9	-0.4	113	I484 L485 E486 L490	I484-R488 WeakPolarHBondContact O-CB 3.46Å; I484-R488 WeakPolarHBondContact O-CG 3.39Å; I484-R488 PolarHBondContact O-N 2.89Å; L485-R488 CarbonylContact O-C 3.59Å; L485-R488 PolarHBondContact O-N 3.05Å; E486-R488 PolarHBondContact O-N 3.32Å; E486-R488 VanDerWaalsContact O-N 3.07Å; R488-L490 HydrophobicContact CB-CD1 3.79Å; R488-L490 HydrophobicContact CB-CG 3.81Å; R488-L490 PolarHBondContact O-N 3.34Å
489	N	72.9	Confident	63.6	Low	112 Å²	112	80.9 Å²	80.9	60%	0.599	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	32.9	-175	-64	-8.4	0	0	0	113.7	L485 E486	L485-N489 PolarHBondContact O-N 3.47Å; L485-N489 VanDerWaalsContact O-N 3.1Å; E486-N489 PolarHBondContact O-N 2.93Å; E486-N489 PolarHBondContact O-OD1 3.27Å; E486-N489 VanDerWaalsContact O-OD1 3.11Å
490	L	75.4	Confident	64.1	Low	27 Å²	27	77.7 Å²	77.7	14%	0.141	38%	0.376	C	S	.	.			trans	-85.9	-10.6	-175.4	-72	172.9	0	0	0	114	P427 L485 R488 T493	P427-L490 HydrophobicContact CG-CB 4.5Å; P427-L490 HydrophobicContact CG-CD1 4.26Å; L485-L490 HydrophobicContact CD2-CB 3.74Å; L485-L490 HydrophobicContact CD2-CD1 3.77Å; L485-L490 HydrophobicContact CD2-CG 4.41Å; L485-L490 PolarHBondContact O-N 3.43Å; R488-L490 HydrophobicContact CB-CD1 3.79Å; R488-L490 HydrophobicContact CB-CG 3.81Å; R488-L490 PolarHBondContact O-N 3.34Å; L490-T493 PolarHBondContact O-OG1 3.41Å
491	I	66.9	Low	64.5	Low	27 Å²	27	69.2 Å²	69.2	14%	0.138	35%	0.345	C	S	.	.	S	Bend	trans	-78.6	-44	178.9	-59.3	178.3	0	0	0	110.2	V409 T412 R429 L482 L485 E486 T493	V409-I491 HydrophobicContact CG2-CG2 4.12Å; T412-I491 HydrophobicContact CG2-CG1 4.47Å; R429-I491 PolarHBondContact NH2-O 3.37Å; L482-I491 HydrophobicContact CD2-CD1 4.46Å; L485-I491 HydrophobicContact CB-CD1 4.23Å; L485-I491 HydrophobicContact CB-CG1 4.02Å; E486-I491 HydrophobicContact CG-CD1 3.73Å; I491-T493 PolarHBondContact O-N 3.33Å
492	E	59	Low	64.7	Low	164 Å²	164	71.5 Å²	71.5	77%	0.766	36%	0.364	S	S	*	.	S	Bend	trans	-79.9	-13.8	-171.7	-64.4	-178.8	173.4	0	0	114.9	K494	E492-K494 PolarHBondContact O-N 3.41Å
493	T	55.5	Low	64.4	Low	51 Å²	51	75.8 Å²	75.8	31%	0.313	39%	0.386	S	S	.	.			trans	-69.6	94.3	179.9	48.3	0	0	0	0	111	R429 L490 I491	R429-T493 PolarHBondContact NH1-O 2.98Å; R429-T493 PolarHBondContact NH2-O 2.88Å; L490-T493 PolarHBondContact O-OG1 3.41Å; I491-T493 PolarHBondContact O-N 3.33Å
494	K	51.8	Low	64	Low	148 Å²	148	77.3 Å²	77.3	64%	0.643	38%	0.384	S	S	*	.			trans	-77.7	-40.8	176.6	-69.9	-174.6	177.3	-176	0	112.9	E492 S496	E492-K494 PolarHBondContact O-N 3.41Å; K494-S496 PolarHBondContact O-N 3Å
495	S	50.1	Low	63.7	Low	91 Å²	91	78.2 Å²	78.2	64%	0.636	39%	0.386	S	S	*	.	H	α-helix	trans	-70.1	-29.6	-164	52	0	0	0	0	116.7
496	S	54.7	Low	63.2	Low	19 Å²	19	81.8 Å²	81.8	13%	0.133	41%	0.41	C	S	.	.	H	α-helix	trans	-82	-21.1	-169.9	68.6	0	0	0	0	115.4	I426 K494 F500	I426-S496 WeakPolarHBondContact CD1-OG 3.29Å; K494-S496 PolarHBondContact O-N 3Å; S496-F500 WeakPolarHBondContact O-CD2 3.4Å; S496-F500 WeakPolarHBondContact O-CE2 3.09Å
497	A	57.4	Low	62.2	Low	11 Å²	11	81.8 Å²	81.8	9%	0.091	43%	0.428	C	S	.	.	H	α-helix	trans	-72.4	-40.5	-174.4	0	0	0	0	0	112	D499 F500 D501	A497-D499 VanDerWaalsContact C-N 3.34Å; A497-D499 PolarHBondContact O-N 3.48Å; A497-F500 PolarHBondContact O-N 3.11Å; A497-D501 PolarHBondContact O-N 2.97Å
498	E	61.6	Low	61.1	Low	139 Å²	139	78.7 Å²	78.7	65%	0.65	42%	0.416	S	S	*	.	H	α-helix	trans	-62.9	-39.6	179.9	-66.8	170	-172.6	0	0	111.8	F500 D501 A502	E498-F500 PolarHBondContact O-N 3.27Å; E498-D501 PolarHBondContact O-N 3.21Å; E498-A502 WeakPolarHBondContact O-CB 3.4Å; E498-A502 PolarHBondContact O-N 3.3Å
499	D	62.6	Low	59.6	Low	96 Å²	96	74.4 Å²	74.4	51%	0.513	41%	0.407	S	S	.	.	H	α-helix	trans	-57.9	-35.2	175.4	-71	-20.9	0	0	0	112.4	A497 M503	A497-D499 VanDerWaalsContact C-N 3.34Å; A497-D499 PolarHBondContact O-N 3.48Å; D499-M503 WeakPolarHBondContact O-CG 2.92Å; D499-M503 PolarHBondContact O-N 3.18Å
500	F	60.7	Low	58.5	Low	25 Å²	25	75.2 Å²	75.2	11%	0.11	42%	0.421	C	S	.	.	H	α-helix	trans	-75.6	-42.3	-178.4	-66.9	-63.5	0	0	0	112.5	K424 S496 A497 E498 A502 M503 Y504	K424-F500 HydrophobicContact CD-CZ 4.24Å; S496-F500 WeakPolarHBondContact O-CD2 3.4Å; S496-F500 WeakPolarHBondContact O-CE2 3.09Å; A497-F500 PolarHBondContact O-N 3.11Å; E498-F500 PolarHBondContact O-N 3.27Å; F500-A502 VanDerWaalsContact C-N 3.29Å; F500-M503 PolarHBondContact O-N 3.35Å; F500-Y504 PolarHBondContact O-N 2.96Å
501	D	63.7	Low	57.2	Low	13 Å²	13	76.4 Å²	76.4	7%	0.07	44%	0.435	C	S	.	.	H	α-helix	trans	-63.3	-41.1	174.3	-77.7	-51.6	0	0	0	110.1	Y369 S430 R434 A497 E498 M503 Y504 F505	Y369-D501 WeakPolarHBondContact CE1-OD2 3.44Å; S430-D501 WeakPolarHBondContact CB-OD1 3.31Å; S430-D501 VanDerWaalsContact CB-OD2 3.31Å; S430-D501 WeakPolarHBondContact CB-OD2 3.09Å; S430-D501 PolarHBondContact OG-OD1 2.95Å; S430-D501 PolarHBondContact OG-OD2 2.67Å; R434-D501 IonicContact NH2-OD1 3.45Å; A497-D501 PolarHBondContact O-N 2.97Å; E498-D501 PolarHBondContact O-N 3.21Å; D501-M503 VanDerWaalsContact C-N 3.32Å; D501-M503 PolarHBondContact O-N 3.19Å; D501-Y504 PolarHBondContact O-N 3.45Å; D501-Y504 VanDerWaalsContact O-N 3.13Å; D501-F505 HydrophobicContact CB-CD2 4.22Å; D501-F505 HydrophobicContact CB-CE2 4.21Å; D501-F505 WeakPolarHBondContact O-CD2 3.42Å; D501-F505 PolarHBondContact O-N 3.39Å
502	A	68.3	Low	56.5	Low	53 Å²	53	75.6 Å²	75.6	44%	0.438	43%	0.432	S	S	.	.	H	α-helix	trans	-55.3	-46.2	171.9	0	0	0	0	0	111.7	E498 F500 Y504 F505 C506	E498-A502 WeakPolarHBondContact O-CB 3.4Å; E498-A502 PolarHBondContact O-N 3.3Å; F500-A502 VanDerWaalsContact C-N 3.29Å; A502-Y504 PolarHBondContact O-N 3.04Å; A502-F505 PolarHBondContact O-N 2.88Å; A502-C506 VanDerWaalsContact O-CB 3.28Å; A502-C506 WeakPolarHBondContact O-CB 3.25Å; A502-C506 PolarHBondContact O-N 3.27Å; A502-C506 PolarHBondContact O-SG 2.79Å
503	M	59.6	Low	56.5	Low	104 Å²	104	69.3 Å²	69.3	51%	0.512	40%	0.403	S	S	.	.	H	α-helix	trans	-65.7	-34.4	176.4	-73.7	-174.4	-173.3	0	0	114.3	D499 F500 D501	D499-M503 WeakPolarHBondContact O-CG 2.92Å; D499-M503 PolarHBondContact O-N 3.18Å; F500-M503 PolarHBondContact O-N 3.35Å; D501-M503 VanDerWaalsContact C-N 3.32Å; D501-M503 PolarHBondContact O-N 3.19Å
504	Y	61.6	Low	56.2	Low	83 Å²	83	70.6 Å²	70.6	33%	0.325	41%	0.411	S	S	.	.	H	α-helix	trans	-68.1	-44.4	176.5	177.5	-101.2	0	0	0	111.1	F500 D501 A502 H513	F500-Y504 PolarHBondContact O-N 2.96Å; D501-Y504 PolarHBondContact O-N 3.45Å; D501-Y504 VanDerWaalsContact O-N 3.13Å; A502-Y504 PolarHBondContact O-N 3.04Å; Y504-H513 AromaticContact CD2-CD2 3.56Å; Y504-H513 AromaticContact CD2-NE2 3.69Å; Y504-H513 AromaticContact CE2-CD2 3.93Å; Y504-H513 AromaticContact CG-NE2 3.74Å
505	F	65.1	Low	55.7	Low	79 Å²	79	67.5 Å²	67.5	35%	0.346	40%	0.4	S	S	.	.	H	α-helix	trans	-79.1	-25.1	-178.9	-70.1	-66.5	0	0	0	113.9	L366 T367 D501 A502 G507	L366-F505 VanDerWaalsContact O-CZ 3.22Å; L366-F505 WeakPolarHBondContact O-CZ 3.49Å; T367-F505 HydrophobicContact CG2-CD1 4.39Å; T367-F505 HydrophobicContact CG2-CD2 4.3Å; T367-F505 HydrophobicContact CG2-CE1 4.17Å; T367-F505 HydrophobicContact CG2-CE2 4.1Å; T367-F505 HydrophobicContact CG2-CG 4.48Å; T367-F505 HydrophobicContact CG2-CZ 4.04Å; D501-F505 HydrophobicContact CB-CD2 4.22Å; D501-F505 HydrophobicContact CB-CE2 4.21Å; D501-F505 WeakPolarHBondContact O-CD2 3.42Å; D501-F505 PolarHBondContact O-N 3.39Å; A502-F505 PolarHBondContact O-N 2.88Å; F505-G507 PolarHBondContact O-N 2.75Å
506	C	63.8	Low	55.5	Low	76 Å²	76	66.8 Å²	66.8	51%	0.514	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	5.9	173	-70.5	0	0	0	0	114.2	A502 H508	A502-C506 VanDerWaalsContact O-CB 3.28Å; A502-C506 WeakPolarHBondContact O-CB 3.25Å; A502-C506 PolarHBondContact O-N 3.27Å; A502-C506 PolarHBondContact O-SG 2.79Å; C506-H508 PolarHBondContact O-N 3.29Å
507	G	51.4	Low	54.8	Low	66 Å²	66	75.9 Å²	75.9	68%	0.68	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	-0.8	173.5	0	0	0	0	0	115.9	F505 T509	F505-G507 PolarHBondContact O-N 2.75Å; G507-T509 PolarHBondContact O-N 3Å
508	H	48.7	Very low	53.6	Low	115 Å²	115	84.6 Å²	84.6	53%	0.532	46%	0.463	S	S	.	.	S	Bend	trans	-70.6	-27.3	-175.5	-71.2	-45.2	0	0	0	114.3	E16 C506	E16-H508 IonicContact OE1-CE1 3.91Å; E16-H508 PolarHBondContact OE1-CE1 2.67Å; E16-H508 IonicContact OE1-NE2 3.25Å; E16-H508 PolarHBondContact OE1-NE2 2.93Å; E16-H508 IonicContact OE2-CE1 2.93Å; E16-H508 IonicContact OE2-NE2 3.87Å; C506-H508 PolarHBondContact O-N 3.29Å
509	T	41.7	Very low	52.3	Low	63 Å²	63	85.2 Å²	85.2	39%	0.387	47%	0.466	S	S	.	.			trans	-152.3	117	179.1	51.8	0	0	0	0	112.7	G507 A511 A512	G507-T509 PolarHBondContact O-N 3Å; T509-A511 PolarHBondContact O-N 2.67Å; T509-A512 PolarHBondContact O-N 2.76Å
510	S	48.6	Very low	50.6	Low	130 Å²	130	89.7 Å²	89.7	91%	0.909	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-2.8	162.9	-27.5	0	0	0	0	112.8
511	A	48.9	Very low	49	Very low	52 Å²	52	94.1 Å²	94.1	43%	0.43	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	11.3	-171.8	0	0	0	0	0	113.5	T509 H513 V514	T509-A511 PolarHBondContact O-N 2.67Å; A511-H513 PolarHBondContact O-N 2.88Å; A511-V514 VanDerWaalsContact C-CG2 3.49Å; A511-V514 VanDerWaalsContact CA-CG2 3.43Å; A511-V514 HydrophobicContact CB-CG2 3.6Å; A511-V514 WeakPolarHBondContact O-CG2 3.48Å
512	A	52.2	Low	47.6	Very low	9 Å²	9	98.8 Å²	98.8	7%	0.074	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-34.3	175.5	0	0	0	0	0	112.2	T509	T509-A512 PolarHBondContact O-N 2.76Å
513	H	57.7	Low	45.5	Very low	32 Å²	32	105.5 Å²	105.5	15%	0.148	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-106.7	64.1	-177.1	-55.1	-73.4	0	0	0	112.9	D428 R431 Y504 A511	D428-H513 VanDerWaalsContact CG-ND1 3.29Å; D428-H513 IonicContact OD1-CE1 2.87Å; D428-H513 IonicContact OD1-ND1 3.33Å; D428-H513 PolarHBondContact OD1-ND1 3.26Å; D428-H513 IonicContact OD2-CE1 3.14Å; D428-H513 IonicContact OD2-CG 3.57Å; D428-H513 IonicContact OD2-ND1 3.73Å; D428-H513 PolarHBondContact OD2-ND1 3.4Å; R431-H513 PolarHBondContact NH1-O 3.04Å; Y504-H513 AromaticContact CD2-CD2 3.56Å; Y504-H513 AromaticContact CD2-NE2 3.69Å; Y504-H513 AromaticContact CE2-CD2 3.93Å; Y504-H513 AromaticContact CG-NE2 3.74Å; A511-H513 PolarHBondContact O-N 2.88Å
514	V	51	Low	44	Very low	79 Å²	79	109.2 Å²	109.2	48%	0.479	58%	0.581	S	S	.	*			trans	-95.3	-18.1	-164.1	161.5	0	0	0	0	117.7	A511	A511-V514 VanDerWaalsContact C-CG2 3.49Å; A511-V514 VanDerWaalsContact CA-CG2 3.43Å; A511-V514 HydrophobicContact CB-CG2 3.6Å; A511-V514 WeakPolarHBondContact O-CG2 3.48Å
515	L	41.3	Very low	42.5	Very low	82 Å²	82	116.9 Å²	116.9	43%	0.429	61%	0.61	S	S	.	*	B	Isolated β-bridge	trans	-100.5	124.4	-175	-60.7	172.6	0	0	0	111.9	M421 S422	M421-L515 HydrophobicContact CB-CB 4.09Å; M421-L515 HydrophobicContact CB-CD1 4.23Å; M421-L515 WeakPolarHBondContact O-CB 3.45Å; M421-L515 PolarHBondContact O-N 3.21Å; S422-L515 WeakPolarHBondContact O-CD1 3.4Å
516	S	45.4	Very low	40.9	Very low	76 Å²	76	124.4 Å²	124.4	53%	0.531	64%	0.636	S	S	.	*			trans	-131.1	139.1	165.3	65.4	0	0	0	0	109.3	K518	S516-K518 PolarHBondContact O-N 2.9Å
517	R	38.6	Very low	39.3	Very low	210 Å²	210	131 Å²	131	79%	0.792	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-79.1	118.5	164.7	-156.9	174.1	-172.2	-179.6	2.4	106.1	E519	R517-E519 PolarHBondContact O-N 2.85Å
518	K	34	Very low	38.4	Very low	194 Å²	194	136.8 Å²	136.8	84%	0.843	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-48.6	118.2	172.9	-77.3	-178.8	178.4	174	0	108.2	S516 K520	S516-K518 PolarHBondContact O-N 2.9Å; K518-K520 PolarHBondContact O-N 3.25Å
519	E	33.5	Very low	37.7	Very low	153 Å²	153	139.9 Å²	139.9	72%	0.715	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-52.7	124.6	171.7	-71.6	-178.8	157.7	0	0	107.6	R517 P521	R517-E519 PolarHBondContact O-N 2.85Å; E519-P521 WeakPolarHBondContact O-CD 3.47Å
520	K	27.3	Very low	37.4	Very low	189 Å²	189	146.9 Å²	146.9	82%	0.822	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-65.1	123.8	168.8	-72.3	-175.4	177.3	-176.7	0	105.5	K518 V522	K518-K520 PolarHBondContact O-N 3.25Å; K520-V522 PolarHBondContact O-N 2.84Å
521	P	27.4	Very low	36.8	Very low	118 Å²	118	149.8 Å²	149.8	77%	0.766	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-58.1	132.4	177.7	22.6	-30.4	0	0	0	108.7	E519 M523	E519-P521 WeakPolarHBondContact O-CD 3.47Å; P521-M523 PolarHBondContact O-N 2.99Å
522	V	32.7	Very low	36.4	Very low	112 Å²	112	152.3 Å²	152.3	68%	0.679	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-46.7	134.7	162.9	176.2	0	0	0	0	106.8	K520 E524	K520-V522 PolarHBondContact O-N 2.84Å; V522-E524 VanDerWaalsContact C-N 3.26Å; V522-E524 PolarHBondContact O-N 2.72Å
523	M	25	Very low	36	Very low	193 Å²	193	161.5 Å²	161.5	95%	0.951	76%	0.756	S	S	*	*			trans	-63.5	78	-163.6	-157.6	-179.3	-153.6	0	0	111.7	P521	P521-M523 PolarHBondContact O-N 2.99Å
524	E	29	Very low	35.5	Very low	182 Å²	182	172.1 Å²	172.1	85%	0.85	80%	0.795	S	S	*	*			trans	-85.1	124.1	174.8	-93.8	-173.7	161.5	0	0	111	V522	V522-E524 VanDerWaalsContact C-N 3.26Å; V522-E524 PolarHBondContact O-N 2.72Å
525	R	29.5	Very low	35.9	Very low	244 Å²	244	174.2 Å²	174.2	92%	0.921	80%	0.8	S	S	*	*	S	Bend	trans	-23.9	127.5	167.9	-69.3	172.1	156.5	-174	-6.9	114.2
526	R	30.5	Very low	37.1	Very low	238 Å²	238	178.6 Å²	178.6	90%	0.898	82%	0.816	S	S	*	*	S	Bend	trans	37.1	93.7	158.2	-72.5	-176	165.2	178	-4	116.2	Q528	R526-Q528 PolarHBondContact O-N 3.44Å
527	K	30.6	Very low	38.4	Very low	213 Å²	213	181 Å²	181	93%	0.926	82%	0.821	S	S	*	*			trans	11.4	80.6	149.9	-70.1	-179	177.5	175.7	0	114.8
528	Q	32	Very low	40	Very low	189 Å²	189	181.2 Å²	181.2	88%	0.883	82%	0.822	S	S	*	*			trans	-74.4	125.1	152.7	-80.7	-175.5	-11.4	0	0	108.2	R526 K530	R526-Q528 PolarHBondContact O-N 3.44Å; Q528-K530 PolarHBondContact O-N 3.16Å
529	Q	35.6	Very low	42	Very low	180 Å²	180	181 Å²	181	84%	0.841	82%	0.816	S	S	*	*			trans	-53.9	132.9	-179	-74.1	172.6	-27.8	0	0	110	H531	Q529-H531 PolarHBondContact O-N 3.07Å
530	K	35.3	Very low	44	Very low	209 Å²	209	177.2 Å²	177.2	91%	0.909	80%	0.803	S	S	*	*			trans	-48.9	107.2	174.6	-82.8	175.5	173	172.5	0	109.7	Q528 S532	Q528-K530 PolarHBondContact O-N 3.16Å; K530-S532 PolarHBondContact O-N 2.87Å; K530-S532 VanDerWaalsContact O-N 3.14Å
531	H	35.8	Very low	46.6	Very low	191 Å²	191	173 Å²	173	88%	0.884	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-57.9	119.2	159.4	-82.1	-72.5	0	0	0	107.7	Q529 K533	Q529-H531 PolarHBondContact O-N 3.07Å; H531-K533 PolarHBondContact O-N 3.19Å
532	S	40.3	Very low	49.1	Very low	106 Å²	106	170 Å²	170	74%	0.741	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-54.7	140	174.3	63.3	0	0	0	0	108.9	K530 R534	K530-S532 PolarHBondContact O-N 2.87Å; K530-S532 VanDerWaalsContact O-N 3.14Å; S532-R534 PolarHBondContact O-N 3.02Å; S532-R534 VanDerWaalsContact O-N 3.1Å
533	K	44.2	Very low	51.5	Low	201 Å²	201	170.7 Å²	170.7	87%	0.874	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-50.1	121.9	177.9	-83.2	176.8	171.9	178.6	0	108.6	H531 E535	H531-K533 PolarHBondContact O-N 3.19Å; K533-E535 PolarHBondContact O-N 3.1Å
534	R	45.6	Very low	54.2	Low	255 Å²	255	167.2 Å²	167.2	96%	0.962	75%	0.75	S	S	*	*			trans	-54.7	98.8	170.4	-88.5	176.3	149.9	169.9	-6.6	109.1	S532	S532-R534 PolarHBondContact O-N 3.02Å; S532-R534 VanDerWaalsContact O-N 3.1Å
535	E	60.3	Low	56.5	Low	124 Å²	124	165 Å²	165	58%	0.579	75%	0.745	S	S	*	*			trans	-72.9	138.1	170	-170.6	146.8	-147.7	0	0	108.7	K533 L537 R539	K533-E535 PolarHBondContact O-N 3.1Å; E535-L537 PolarHBondContact O-N 3.07Å; E535-R539 HydrophobicContact CG-CB 4.25Å; E535-R539 IonicContact OE1-NH1 2.74Å
536	K	66.6	Low	58.3	Low	174 Å²	174	160.1 Å²	160.1	76%	0.757	76%	0.756	S	S	*	*			trans	-63.5	127.9	-178	-72.6	-178.1	176.9	180	0	108.9	R538 R539	K536-R538 PolarHBondContact O-N 3.38Å; K536-R539 PolarHBondContact O-N 3.18Å
537	L	73.3	Confident	59.6	Low	125 Å²	125	156.3 Å²	156.3	65%	0.654	75%	0.749	S	S	*	*	H	α-helix	trans	-48.9	-35.4	-177.3	-71	163.5	0	0	0	113.8	E535 R539 V540 F541	E535-L537 PolarHBondContact O-N 3.07Å; L537-R539 PolarHBondContact O-N 3.11Å; L537-V540 WeakPolarHBondContact O-CB 3.2Å; L537-V540 PolarHBondContact O-N 2.93Å; L537-F541 HydrophobicContact CB-CD2 4.44Å; L537-F541 HydrophobicContact CD2-CE2 3.91Å; L537-F541 VanDerWaalsContact O-CD2 3.3Å; L537-F541 WeakPolarHBondContact O-CD2 3.4Å; L537-F541 PolarHBondContact O-N 3.1Å
538	R	72.2	Confident	61.2	Low	215 Å²	215	153.3 Å²	153.3	81%	0.811	74%	0.74	S	S	*	*	H	α-helix	trans	-58.5	-29.1	174.8	-81.8	-169.7	-171.5	-177.4	1.3	114.6	K536 A542	K536-R538 PolarHBondContact O-N 3.38Å; R538-A542 PolarHBondContact O-N 3.24Å
539	R	74.5	Confident	62.8	Low	191 Å²	191	151.3 Å²	151.3	72%	0.721	73%	0.732	S	S	*	*	H	α-helix	trans	-76.4	-36.6	173	-85.2	-172.6	-172.9	164.2	0.4	112.4	E535 K536 L537 F541	E535-R539 HydrophobicContact CG-CB 4.25Å; E535-R539 IonicContact OE1-NH1 2.74Å; K536-R539 PolarHBondContact O-N 3.18Å; L537-R539 PolarHBondContact O-N 3.11Å; R539-F541 VanDerWaalsContact C-N 3.3Å; R539-F541 PolarHBondContact O-N 3.21Å
540	V	75.6	Confident	64.4	Low	73 Å²	73	149.6 Å²	149.6	44%	0.442	73%	0.726	S	S	.	*	H	α-helix	trans	-65.1	-38.9	179.5	-178	0	0	0	0	110.4	L537 H543	L537-V540 WeakPolarHBondContact O-CB 3.2Å; L537-V540 PolarHBondContact O-N 2.93Å; V540-H543 PolarHBondContact O-CE1 2.93Å; V540-H543 PolarHBondContact O-ND1 3.27Å
541	F	81.7	Confident	66.2	Low	99 Å²	99	145.9 Å²	145.9	43%	0.434	71%	0.714	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.8	17	-177.4	-61.5	-68.4	0	0	0	114.4	L537 R539 H543 L544	L537-F541 HydrophobicContact CB-CD2 4.44Å; L537-F541 HydrophobicContact CD2-CE2 3.91Å; L537-F541 VanDerWaalsContact O-CD2 3.3Å; L537-F541 WeakPolarHBondContact O-CD2 3.4Å; L537-F541 PolarHBondContact O-N 3.1Å; R539-F541 VanDerWaalsContact C-N 3.3Å; R539-F541 PolarHBondContact O-N 3.21Å; F541-H543 PolarHBondContact O-N 3.06Å; F541-L544 HydrophobicContact CB-CD1 4.17Å; F541-L544 HydrophobicContact CD1-CD1 3.66Å; F541-L544 HydrophobicContact CD1-CG 4.49Å; F541-L544 HydrophobicContact CG-CD1 4.26Å; F541-L544 WeakPolarHBondContact O-CB 3.32Å; F541-L544 PolarHBondContact O-N 3.1Å
542	A	81.7	Confident	68.2	Low	55 Å²	55	142.9 Å²	142.9	46%	0.455	70%	0.703	S	S	.	*	G	3₁₀ helix	trans	-58.6	-22.5	179.2	0	0	0	0	0	113.5	R538 L544 D545	R538-A542 PolarHBondContact O-N 3.24Å; A542-L544 VanDerWaalsContact C-N 3.3Å; A542-D545 PolarHBondContact O-N 3.48Å
543	H	83	Confident	70.2	Confident	128 Å²	128	145.5 Å²	145.5	59%	0.593	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-76.8	-12.2	175.6	66.7	-84.7	0	0	0	114.1	V540 F541	V540-H543 PolarHBondContact O-CE1 2.93Å; V540-H543 PolarHBondContact O-ND1 3.27Å; F541-H543 PolarHBondContact O-N 3.06Å
544	L	81	Confident	72.2	Confident	119 Å²	119	141.2 Å²	141.2	62%	0.623	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-92.2	-12.8	173.7	-62.2	178	0	0	0	112.3	F541 A542	F541-L544 HydrophobicContact CB-CD1 4.17Å; F541-L544 HydrophobicContact CD1-CD1 3.66Å; F541-L544 HydrophobicContact CD1-CG 4.49Å; F541-L544 HydrophobicContact CG-CD1 4.26Å; F541-L544 WeakPolarHBondContact O-CB 3.32Å; F541-L544 PolarHBondContact O-N 3.1Å; A542-L544 VanDerWaalsContact C-N 3.3Å
545	D	77.3	Confident	74.5	Confident	137 Å²	137	131.8 Å²	131.8	73%	0.733	66%	0.664	S	S	*	*			trans	-90	-7.3	176.5	-72.7	-24.3	0	0	0	112.5	A542	A542-D545 PolarHBondContact O-N 3.48Å
546	A	66.4	Low	75.7	Confident	141 Å²	141	132.5 Å²	132.5	100%	1.165	67%	0.672	S	S	*	*			trans	-100	0	172.9	0	0	0	0	0	109.8

Retrieved 546 of 546 residues in 677.8 ms (Link to these results)

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