A0A096MLA9_PAPAN Loading...

T-complex protein 1 subunit gamma

Component of the chaperonin-containing T-complex (TRiC), a molecular chaperone complex that assists the folding of actin, tubulin and other proteins upon ATP hydrolysis. The TRiC complex mediates the folding of WRAP53/TCAB1, thereby regulating telomere maintenance. As part of the TRiC complex may play a role in the assembly of BBSome, a complex involved in ciliogenesis regulating transports vesicles to the cilia.

AlphaFold DB (A0A0D9S4W9), UniProt , Accession A0A096MLA9, Species PAPAN (Papio anubis, Olive baboon), Gene CCT3, Length 545 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	40.1	Very low	55.4	Low	246 Å²	246	143.8 Å²	143.8	100%	1.212	78%	0.777	S	S	*	*				0	102.8	0	-75	176.6	175.4	0	0	107.9	G3	M1-G3 PolarHBondContact O-N 2.94Å
2	M	40.6	Very low	56.2	Low	194 Å²	194	147.1 Å²	147.1	96%	0.956	78%	0.783	S	S	*	*			trans	-68.8	115.6	172.9	-85.4	-179.3	166.3	0	0	108.3	H4	M2-H4 PolarHBondContact O-N 2.75Å
3	G	48.7	Very low	57.1	Low	70 Å²	70	142.8 Å²	142.8	72%	0.722	76%	0.761	S	S	*	*			trans	-67.5	119.3	171	0	0	0	0	0	109.5	M1 R5	M1-G3 PolarHBondContact O-N 2.94Å; G3-R5 PolarHBondContact O-N 3.26Å
4	H	50.2	Low	58.3	Low	191 Å²	191	134.9 Å²	134.9	88%	0.884	72%	0.72	S	S	*	*			trans	-58.7	111.2	168.9	-86.2	-59.1	0	0	0	109	M2	M2-H4 PolarHBondContact O-N 2.75Å
5	R	56.3	Low	59.5	Low	229 Å²	229	137 Å²	137	86%	0.864	72%	0.72	S	S	*	*			trans	-60.4	126.5	163.1	-79.7	179.8	168.5	177.3	-3.7	107.4	G3 V7	G3-R5 PolarHBondContact O-N 3.26Å; R5-V7 PolarHBondContact O-N 3.36Å; R5-V7 VanDerWaalsContact O-N 3.14Å
6	P	54.4	Low	60.9	Low	116 Å²	116	137.3 Å²	137.3	75%	0.753	71%	0.709	S	S	*	*			trans	-61.8	120.5	176.4	23.6	-30.7	0	0	0	108.9	L8	P6-L8 PolarHBondContact O-N 3.44Å
7	V	61.4	Low	62.2	Low	126 Å²	126	136 Å²	136	76%	0.764	70%	0.699	S	S	*	*			trans	-67.2	114.8	173	178	0	0	0	0	107.2	R5 V9	R5-V7 PolarHBondContact O-N 3.36Å; R5-V7 VanDerWaalsContact O-N 3.14Å; V7-V9 PolarHBondContact O-N 3.36Å; V7-V9 VanDerWaalsContact O-N 3.15Å
8	L	56.1	Low	63.5	Low	131 Å²	131	131.4 Å²	131.4	69%	0.686	68%	0.681	S	S	*	*			trans	-69.5	108.4	171.6	-111.4	95.8	0	0	0	108.5	P6 Q12	P6-L8 PolarHBondContact O-N 3.44Å; L8-Q12 HydrophobicContact CD2-CG 4.49Å
9	V	65.6	Low	64.7	Low	132 Å²	132	126.1 Å²	126.1	80%	0.8	66%	0.661	S	S	*	*			trans	-80.7	-19.6	-179.7	179.8	0	0	0	0	112.3	V7	V7-V9 PolarHBondContact O-N 3.36Å; V7-V9 VanDerWaalsContact O-N 3.15Å
10	L	66.8	Low	65.6	Low	71 Å²	71	124.6 Å²	124.6	37%	0.372	65%	0.646	S	S	.	*	S	Bend	trans	-119.7	139.7	-179.3	-64.7	172.5	0	0	0	110.6	T14 R16	L10-T14 HydrophobicContact CD2-CG2 4.28Å; L10-R16 HydrophobicContact CD1-CB 4.09Å
11	S	69.5	Low	66.6	Low	76 Å²	76	127.4 Å²	127.4	53%	0.531	65%	0.653	S	S	.	*			trans	-63.6	147.2	172.7	69.7	0	0	0	0	110	N13 T14	S11-N13 PolarHBondContact O-N 2.81Å; S11-T14 WeakPolarHBondContact O-CB 3.47Å; S11-T14 PolarHBondContact O-N 3.48Å; S11-T14 PolarHBondContact O-OG1 3.26Å; S11-T14 PolarHBondContact OG-OG1 3.35Å
12	Q	65.2	Low	68.9	Low	183 Å²	183	115.8 Å²	115.8	86%	0.855	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-18.2	-176.8	-73.9	-179.6	-11.4	0	0	114.3	L8	L8-Q12 HydrophobicContact CD2-CG 4.49Å
13	N	67.6	Low	71.2	Confident	92 Å²	92	107.2 Å²	107.2	49%	0.492	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.7	0.8	-180	-63.6	-24	0	0	0	113.9	S11	S11-N13 PolarHBondContact O-N 2.81Å
14	T	74.4	Confident	73.2	Confident	31 Å²	31	105.6 Å²	105.6	19%	0.19	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.1	-178.8	-52	0	0	0	0	109.9	L10 S11 V523 S524	L10-T14 HydrophobicContact CD2-CG2 4.28Å; S11-T14 WeakPolarHBondContact O-CB 3.47Å; S11-T14 PolarHBondContact O-N 3.48Å; S11-T14 PolarHBondContact O-OG1 3.26Å; S11-T14 PolarHBondContact OG-OG1 3.35Å; T14-V523 HydrophobicContact CG2-CG1 3.33Å; T14-S524 WeakPolarHBondContact CA-O 3.34Å
15	K	75.9	Confident	75.2	Confident	167 Å²	167	97.7 Å²	97.7	73%	0.726	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.4	168.9	-70.2	-175	179.4	-178.8	0	108.3	S524	K15-S524 PolarHBondContact N-O 3.14Å; K15-S524 VanDerWaalsContact N-O 3.11Å; K15-S524 PolarHBondContact O-N 2.91Å
16	R	81.8	Confident	77	Confident	142 Å²	142	86.9 Å²	86.9	54%	0.536	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.3	172.9	-179.6	177.1	180	-167.1	-0.2	108.6	L10 S18 D521 I522 V523	L10-R16 HydrophobicContact CD1-CB 4.09Å; R16-S18 WeakPolarHBondContact CG-OG 3.38Å; R16-S18 PolarHBondContact NE-OG 3.45Å; R16-D521 IonicContact CZ-OD2 3.24Å; R16-D521 VanDerWaalsContact CZ-OD2 3.24Å; R16-D521 IonicContact NE-OD2 3.05Å; R16-D521 PolarHBondContact NE-OD2 3.23Å; R16-D521 IonicContact NH2-OD2 2.64Å; R16-D521 PolarHBondContact NH2-OD2 2.96Å; R16-I522 WeakPolarHBondContact CA-O 3.48Å; R16-V523 HydrophobicContact CG-CG2 4.31Å
17	E	83	Confident	78.9	Confident	115 Å²	115	81.4 Å²	81.4	54%	0.537	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	138.6	164.1	-65.4	-179.7	-177.3	0	0	107.3	V22 D521 I522	E17-V22 HydrophobicContact CB-CG2 3.54Å; E17-V22 VanDerWaalsContact O-CG2 3.31Å; E17-V22 WeakPolarHBondContact O-CG2 3.31Å; E17-D521 WeakPolarHBondContact O-CA 3.48Å; E17-I522 PolarHBondContact N-O 3.37Å; E17-I522 PolarHBondContact O-N 2.64Å
18	S	85.6	Confident	80.5	Confident	53 Å²	53	79 Å²	79	37%	0.371	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151.9	-170.7	-78.2	0	0	0	0	114.5	R16 D520 D521	R16-S18 WeakPolarHBondContact CG-OG 3.38Å; R16-S18 PolarHBondContact NE-OG 3.45Å; S18-D520 CarbonylContact C-O 3.59Å; S18-D521 WeakPolarHBondContact CA-OD1 3.41Å; S18-D521 WeakPolarHBondContact CB-OD1 3.38Å; S18-D521 PolarHBondContact OG-OD1 3.01Å; S18-D521 PolarHBondContact OG-OD2 2.88Å
19	G	85.9	Confident	82.3	Confident	30 Å²	30	73.4 Å²	73.4	31%	0.309	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	-142.8	173.1	0	0	0	0	0	113.3	K21 V22 Q23 D520 D521	G19-K21 VanDerWaalsContact C-N 3.28Å; G19-K21 PolarHBondContact O-N 3.13Å; G19-V22 WeakPolarHBondContact O-CB 3.43Å; G19-V22 PolarHBondContact O-N 3.29Å; G19-V22 VanDerWaalsContact O-N 3.14Å; G19-Q23 PolarHBondContact O-N 2.95Å; G19-D520 PolarHBondContact N-O 2.91Å; G19-D521 PolarHBondContact N-OD1 3.38Å
20	R	82.8	Confident	83.6	Confident	97 Å²	97	67.1 Å²	67.1	37%	0.366	34%	0.343	S	S	.	.	H	α-helix	trans	-66.2	-27	-169.5	-66.5	-168.6	-178.2	169.4	14.7	115	V22 Q23 S24 L113	R20-V22 PolarHBondContact O-N 3.24Å; R20-Q23 PolarHBondContact O-N 3.16Å; R20-Q23 VanDerWaalsContact O-N 3.16Å; R20-S24 PolarHBondContact O-N 3.38Å; R20-S24 PolarHBondContact O-OG 3.37Å; R20-L113 PolarHBondContact NH1-O 2.71Å
21	K	86.1	Confident	85	Confident	183 Å²	183	66.8 Å²	66.8	80%	0.796	34%	0.338	S	S	*	.	H	α-helix	trans	-61.1	-38	176.5	-68.2	-176.2	178.8	-178.7	0	111.1	G19 G25	G19-K21 VanDerWaalsContact C-N 3.28Å; G19-K21 PolarHBondContact O-N 3.13Å; K21-G25 PolarHBondContact O-N 2.87Å
22	V	89.6	Confident	86.1	Confident	2 Å²	2	67 Å²	67	1%	0.012	34%	0.336	C	S	.	.	H	α-helix	trans	-67.8	-44.3	174.1	168.8	0	0	0	0	110.7	E17 G19 R20 G25 N26 I519 D520 I522	E17-V22 HydrophobicContact CB-CG2 3.54Å; E17-V22 VanDerWaalsContact O-CG2 3.31Å; E17-V22 WeakPolarHBondContact O-CG2 3.31Å; G19-V22 WeakPolarHBondContact O-CB 3.43Å; G19-V22 PolarHBondContact O-N 3.29Å; G19-V22 VanDerWaalsContact O-N 3.14Å; R20-V22 PolarHBondContact O-N 3.24Å; V22-G25 CarbonylContact O-C 3.58Å; V22-G25 WeakPolarHBondContact O-CA 3.02Å; V22-G25 PolarHBondContact O-N 3.26Å; V22-G25 VanDerWaalsContact O-N 3.17Å; V22-N26 WeakPolarHBondContact O-CB 3.44Å; V22-N26 PolarHBondContact O-N 3.08Å; V22-N26 PolarHBondContact O-ND2 2.93Å; V22-I519 HydrophobicContact CG1-CG2 4.19Å; V22-D520 WeakPolarHBondContact CB-O 3.38Å; V22-I522 HydrophobicContact CG1-CD1 3.75Å; V22-I522 HydrophobicContact CG1-CG1 3.65Å; V22-I522 HydrophobicContact CG2-CG1 4.43Å
23	Q	88.8	Confident	87.5	Confident	15 Å²	15	58.6 Å²	58.6	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-61.3	-48.8	179.2	-69.2	174.5	-18.8	0	0	111.9	G19 R20 G25 N26 I27 L113 I519	G19-Q23 PolarHBondContact O-N 2.95Å; R20-Q23 PolarHBondContact O-N 3.16Å; R20-Q23 VanDerWaalsContact O-N 3.16Å; Q23-G25 VanDerWaalsContact C-N 3.31Å; Q23-G25 PolarHBondContact O-N 2.88Å; Q23-N26 WeakPolarHBondContact O-CB 3.1Å; Q23-N26 PolarHBondContact O-N 2.87Å; Q23-I27 VanDerWaalsContact O-CG1 3.27Å; Q23-I27 WeakPolarHBondContact O-CG1 3.43Å; Q23-I27 PolarHBondContact O-N 3.35Å; Q23-L113 HydrophobicContact CB-CD1 4.23Å; Q23-I519 WeakPolarHBondContact CG-O 3.47Å
24	S	90.8	Very high	88.8	Confident	36 Å²	36	54.2 Å²	54.2	25%	0.252	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-36.1	173.6	-63.5	0	0	0	0	112	R20 I27 N28	R20-S24 PolarHBondContact O-N 3.38Å; R20-S24 PolarHBondContact O-OG 3.37Å; S24-I27 PolarHBondContact O-N 3.3Å; S24-N28 WeakPolarHBondContact O-CB 3.22Å; S24-N28 PolarHBondContact O-N 2.84Å; S24-N28 PolarHBondContact O-ND2 3.1Å
25	G	92.1	Very high	89.6	Confident	24 Å²	24	55.7 Å²	55.7	25%	0.247	28%	0.28	C	S	.	.	H	α-helix	trans	-60.9	-45.8	173.2	0	0	0	0	0	112.7	K21 V22 Q23 N28 A29	K21-G25 PolarHBondContact O-N 2.87Å; V22-G25 CarbonylContact O-C 3.58Å; V22-G25 WeakPolarHBondContact O-CA 3.02Å; V22-G25 PolarHBondContact O-N 3.26Å; V22-G25 VanDerWaalsContact O-N 3.17Å; Q23-G25 VanDerWaalsContact C-N 3.31Å; Q23-G25 PolarHBondContact O-N 2.88Å; G25-N28 PolarHBondContact O-N 3.16Å; G25-A29 WeakPolarHBondContact O-CB 3.4Å; G25-A29 PolarHBondContact O-N 3.13Å
26	N	93.6	Very high	90.4	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.011	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-46.7	175.5	-67.9	-23.4	0	0	0	111.4	V22 Q23 A29 A30 H74 A76	V22-N26 WeakPolarHBondContact O-CB 3.44Å; V22-N26 PolarHBondContact O-N 3.08Å; V22-N26 PolarHBondContact O-ND2 2.93Å; Q23-N26 WeakPolarHBondContact O-CB 3.1Å; Q23-N26 PolarHBondContact O-N 2.87Å; N26-A29 PolarHBondContact O-N 3.19Å; N26-A30 WeakPolarHBondContact O-CB 3.09Å; N26-A30 PolarHBondContact O-N 3.28Å; N26-H74 PolarHBondContact OD1-CE1 3.1Å; N26-A76 HydrophobicContact CB-CB 3.99Å
27	I	94.4	Very high	90.9	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-47.9	178.6	-67.4	165.5	0	0	0	110.3	Q23 S24 A29 A30 K31 L106 E110 L113 L517	Q23-I27 VanDerWaalsContact O-CG1 3.27Å; Q23-I27 WeakPolarHBondContact O-CG1 3.43Å; Q23-I27 PolarHBondContact O-N 3.35Å; S24-I27 PolarHBondContact O-N 3.3Å; I27-A29 VanDerWaalsContact C-N 3.35Å; I27-A29 PolarHBondContact O-N 3.22Å; I27-A30 PolarHBondContact O-N 3.02Å; I27-K31 VanDerWaalsContact O-CB 3.29Å; I27-K31 WeakPolarHBondContact O-CB 3.46Å; I27-K31 PolarHBondContact O-N 3.09Å; I27-L106 HydrophobicContact CG1-CB 4.18Å; I27-L106 HydrophobicContact CG1-CD2 4.2Å; I27-L106 HydrophobicContact CG2-CB 4.14Å; I27-L106 WeakPolarHBondContact CG2-O 3.47Å; I27-E110 HydrophobicContact CD1-CB 4.15Å; I27-E110 HydrophobicContact CG2-CB 4.46Å; I27-L113 HydrophobicContact CD1-CD1 3.73Å; I27-L517 HydrophobicContact CD1-CD2 4.24Å
28	N	94.4	Very high	91.3	Very high	74 Å²	74	41 Å²	41	40%	0.396	22%	0.22	S	C	.	.	H	α-helix	trans	-63	-40.3	179.3	-79.1	-50.3	0	0	0	112.4	S24 G25 K31 T32	S24-N28 WeakPolarHBondContact O-CB 3.22Å; S24-N28 PolarHBondContact O-N 2.84Å; S24-N28 PolarHBondContact O-ND2 3.1Å; G25-N28 PolarHBondContact O-N 3.16Å; N28-K31 PolarHBondContact O-N 2.87Å; N28-T32 WeakPolarHBondContact O-CB 3.44Å; N28-T32 PolarHBondContact O-N 3.49Å; N28-T32 PolarHBondContact O-OG1 3.24Å
29	A	94.1	Very high	91.6	Very high	14 Å²	14	39.9 Å²	39.9	12%	0.116	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-46.4	175.5	0	0	0	0	0	111.6	G25 N26 I27 T32 I33 H74 A77	G25-A29 WeakPolarHBondContact O-CB 3.4Å; G25-A29 PolarHBondContact O-N 3.13Å; N26-A29 PolarHBondContact O-N 3.19Å; I27-A29 VanDerWaalsContact C-N 3.35Å; I27-A29 PolarHBondContact O-N 3.22Å; A29-T32 PolarHBondContact O-N 3.25Å; A29-I33 WeakPolarHBondContact O-CG1 3.24Å; A29-I33 PolarHBondContact O-N 3.06Å; A29-H74 HydrophobicContact CB-CB 4.12Å; A29-H74 WeakPolarHBondContact CB-ND1 3.23Å; A29-A77 HydrophobicContact CB-CB 4.3Å
30	A	94.3	Very high	91.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-43	177.7	0	0	0	0	0	112.2	N26 I27 T32 I33 A34 M80 L106 L516	N26-A30 WeakPolarHBondContact O-CB 3.09Å; N26-A30 PolarHBondContact O-N 3.28Å; I27-A30 PolarHBondContact O-N 3.02Å; A30-T32 PolarHBondContact O-N 3.04Å; A30-I33 PolarHBondContact O-N 2.79Å; A30-A34 PolarHBondContact O-N 2.93Å; A30-M80 HydrophobicContact CB-CE 4.1Å; A30-M80 HydrophobicContact CB-CG 3.92Å; A30-M80 HydrophobicContact CB-SD 4.08Å; A30-L106 HydrophobicContact CB-CD1 3.54Å; A30-L516 HydrophobicContact CB-CD1 4.1Å
31	K	94.6	Very high	92.1	Very high	65 Å²	65	35.2 Å²	35.2	28%	0.283	19%	0.187	S	C	.	.	H	α-helix	trans	-60.6	-43.8	176	-178.1	175.2	-179.3	167.1	0	112.1	I27 N28 I33 A34 D35 S107	I27-K31 VanDerWaalsContact O-CB 3.29Å; I27-K31 WeakPolarHBondContact O-CB 3.46Å; I27-K31 PolarHBondContact O-N 3.09Å; N28-K31 PolarHBondContact O-N 2.87Å; K31-I33 VanDerWaalsContact C-N 3.32Å; K31-I33 PolarHBondContact O-N 3.4Å; K31-A34 PolarHBondContact O-N 3.45Å; K31-D35 WeakPolarHBondContact O-CB 3.36Å; K31-D35 PolarHBondContact O-N 2.88Å; K31-S107 PolarHBondContact NZ-OG 3.27Å
32	T	93.9	Very high	92.1	Very high	79 Å²	79	27.4 Å²	27.4	49%	0.485	16%	0.158	S	C	.	.	H	α-helix	trans	-60.4	-42.5	178.3	-56.2	0	0	0	0	111.3	N28 A29 A30 D35 I36	N28-T32 WeakPolarHBondContact O-CB 3.44Å; N28-T32 PolarHBondContact O-N 3.49Å; N28-T32 PolarHBondContact O-OG1 3.24Å; A29-T32 PolarHBondContact O-N 3.25Å; A30-T32 PolarHBondContact O-N 3.04Å; T32-D35 PolarHBondContact O-N 2.73Å; T32-I36 HydrophobicContact CG2-CD1 4.46Å; T32-I36 VanDerWaalsContact O-CG1 3.31Å; T32-I36 WeakPolarHBondContact O-CG1 3.32Å; T32-I36 PolarHBondContact O-N 3.42Å; T32-I36 VanDerWaalsContact O-N 3.16Å
33	I	93.7	Very high	91.8	Very high	7 Å²	7	29.3 Å²	29.3	4%	0.036	17%	0.171	C	C	.	.	H	α-helix	trans	-64.7	-43.5	176.1	-65	-63.4	0	0	0	111.5	A29 A30 K31 D35 I36 L67 V72 A77 M80 I99	A29-I33 WeakPolarHBondContact O-CG1 3.24Å; A29-I33 PolarHBondContact O-N 3.06Å; A30-I33 PolarHBondContact O-N 2.79Å; K31-I33 VanDerWaalsContact C-N 3.32Å; K31-I33 PolarHBondContact O-N 3.4Å; I33-D35 VanDerWaalsContact C-N 3.35Å; I33-D35 PolarHBondContact O-N 3.35Å; I33-I36 HydrophobicContact CD1-CD1 4.46Å; I33-I36 PolarHBondContact O-N 2.87Å; I33-L67 HydrophobicContact CG2-CD2 3.59Å; I33-V72 HydrophobicContact CD1-CG2 3.78Å; I33-A77 HydrophobicContact CD1-CB 4.19Å; I33-A77 HydrophobicContact CG1-CB 3.67Å; I33-M80 HydrophobicContact CG2-CB 4.39Å; I33-I99 HydrophobicContact CG2-CG2 4.06Å
34	A	94.2	Very high	91.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-41.3	175.4	0	0	0	0	0	112.6	A30 K31 I36 I37 R38 I99	A30-A34 PolarHBondContact O-N 2.93Å; K31-A34 PolarHBondContact O-N 3.45Å; A34-I36 PolarHBondContact O-N 3Å; A34-I37 PolarHBondContact O-N 2.97Å; A34-R38 WeakPolarHBondContact O-CB 3.42Å; A34-R38 PolarHBondContact O-N 2.94Å; A34-I99 HydrophobicContact CB-CG2 4.24Å
35	D	92.6	Very high	91.3	Very high	62 Å²	62	33 Å²	33	33%	0.332	19%	0.185	S	C	.	.	H	α-helix	trans	-63.6	-38.5	179.6	-70.8	-13.2	0	0	0	112.1	K31 T32 I33 I37 R38	K31-D35 WeakPolarHBondContact O-CB 3.36Å; K31-D35 PolarHBondContact O-N 2.88Å; T32-D35 PolarHBondContact O-N 2.73Å; I33-D35 VanDerWaalsContact C-N 3.35Å; I33-D35 PolarHBondContact O-N 3.35Å; D35-I37 VanDerWaalsContact C-N 3.34Å; D35-I37 PolarHBondContact O-N 2.89Å; D35-R38 PolarHBondContact O-N 2.84Å; D35-R38 IonicContact OD1-CZ 2.99Å; D35-R38 IonicContact OD1-NH1 3.89Å; D35-R38 PolarHBondContact OD1-NH1 3.48Å; D35-R38 IonicContact OD1-NH2 2.98Å; D35-R38 PolarHBondContact OD1-NH2 3.23Å
36	I	91.9	Very high	90.9	Very high	67 Å²	67	36.9 Å²	36.9	34%	0.344	20%	0.197	S	C	.	.	H	α-helix	trans	-58.8	-46.2	178.6	-71.5	164.7	0	0	0	111.1	T32 I33 A34 K48 I70	T32-I36 HydrophobicContact CG2-CD1 4.46Å; T32-I36 VanDerWaalsContact O-CG1 3.31Å; T32-I36 WeakPolarHBondContact O-CG1 3.32Å; T32-I36 PolarHBondContact O-N 3.42Å; T32-I36 VanDerWaalsContact O-N 3.16Å; I33-I36 HydrophobicContact CD1-CD1 4.46Å; I33-I36 PolarHBondContact O-N 2.87Å; A34-I36 PolarHBondContact O-N 3Å; I36-K48 WeakPolarHBondContact O-CE 3.29Å; I36-I70 HydrophobicContact CG2-CD1 4.1Å
37	I	92.8	Very high	90.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-94.4	-7.9	-175.1	70.4	168.9	0	0	0	113.7	A34 D35 T39 C40 I66 L67 T96 I99	A34-I37 PolarHBondContact O-N 2.97Å; D35-I37 VanDerWaalsContact C-N 3.34Å; D35-I37 PolarHBondContact O-N 2.89Å; I37-T39 PolarHBondContact O-N 2.95Å; I37-T39 VanDerWaalsContact O-N 3.12Å; I37-C40 WeakPolarHBondContact O-CA 3.39Å; I37-C40 VanDerWaalsContact O-CB 3.22Å; I37-C40 WeakPolarHBondContact O-CB 3.32Å; I37-C40 PolarHBondContact O-N 2.9Å; I37-C40 PolarHBondContact O-SG 3.43Å; I37-I66 HydrophobicContact CG2-CG2 4.14Å; I37-L67 HydrophobicContact CD1-CD1 4.11Å; I37-L67 HydrophobicContact CG2-CD2 4.08Å; I37-L67 HydrophobicContact CG2-CG 4.28Å; I37-T96 HydrophobicContact CD1-CG2 4.05Å; I37-T96 HydrophobicContact CG1-CG2 4.25Å; I37-I99 HydrophobicContact CD1-CB 3.63Å; I37-I99 HydrophobicContact CD1-CG1 3.97Å; I37-I99 HydrophobicContact CD1-CG2 3.56Å; I37-I99 HydrophobicContact CG1-CG2 4.14Å
38	R	92.3	Very high	90.2	Very high	49 Å²	49	44.2 Å²	44.2	19%	0.185	23%	0.232	C	C	.	.	H	α-helix	trans	-50.7	-41.2	-179.6	-174.6	179.4	-68.6	124.2	3.9	112.9	A34 D35 C40 L41 I100 T450 N454	A34-R38 WeakPolarHBondContact O-CB 3.42Å; A34-R38 PolarHBondContact O-N 2.94Å; D35-R38 PolarHBondContact O-N 2.84Å; D35-R38 IonicContact OD1-CZ 2.99Å; D35-R38 IonicContact OD1-NH1 3.89Å; D35-R38 PolarHBondContact OD1-NH1 3.48Å; D35-R38 IonicContact OD1-NH2 2.98Å; D35-R38 PolarHBondContact OD1-NH2 3.23Å; R38-C40 PolarHBondContact O-N 2.86Å; R38-L41 PolarHBondContact O-N 3.17Å; R38-I100 HydrophobicContact CB-CD1 4.45Å; R38-I100 HydrophobicContact CG-CD1 4.4Å; R38-T450 HydrophobicContact CG-CG2 3.43Å; R38-T450 VanDerWaalsContact CG-CG2 3.43Å; R38-T450 WeakPolarHBondContact O-CG2 3.36Å; R38-N454 PolarHBondContact O-ND2 2.92Å
39	T	91.4	Very high	89.9	Confident	30 Å²	30	46.9 Å²	46.9	18%	0.184	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-5.7	178.4	53.6	0	0	0	0	115.4	I37 M46 K48	I37-T39 PolarHBondContact O-N 2.95Å; I37-T39 VanDerWaalsContact O-N 3.12Å; T39-M46 VanDerWaalsContact CB-CE 3.48Å; T39-M46 HydrophobicContact CG2-CE 3.44Å; T39-M46 VanDerWaalsContact CG2-CE 3.44Å; T39-M46 PolarHBondContact O-N 2.88Å; T39-K48 WeakPolarHBondContact OG1-CE 3.04Å; T39-K48 PolarHBondContact OG1-NZ 3.02Å
40	C	88.7	Confident	89.6	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.061	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-5.2	177.6	-48.2	0	0	0	0	112.2	I37 R38 S45 K48 N61	I37-C40 WeakPolarHBondContact O-CA 3.39Å; I37-C40 VanDerWaalsContact O-CB 3.22Å; I37-C40 WeakPolarHBondContact O-CB 3.32Å; I37-C40 PolarHBondContact O-N 2.9Å; I37-C40 PolarHBondContact O-SG 3.43Å; R38-C40 PolarHBondContact O-N 2.86Å; C40-S45 WeakPolarHBondContact O-CB 3.35Å; C40-K48 VanDerWaalsContact SG-CE 3.58Å; C40-N61 WeakPolarHBondContact CB-O 3.49Å
41	L	89.8	Confident	89.3	Confident	20 Å²	20	53.9 Å²	53.9	11%	0.105	28%	0.278	C	S	.	.			trans	-83.1	131.7	-178.6	-173.7	74.4	0	0	0	112.3	R38 T96 S97 I100 I447 T450 N454	R38-L41 PolarHBondContact O-N 3.17Å; L41-T96 HydrophobicContact CB-CG2 4.2Å; L41-T96 HydrophobicContact CD1-CG2 4.32Å; L41-S97 WeakPolarHBondContact CD1-OG 3.21Å; L41-I100 HydrophobicContact CB-CD1 3.97Å; L41-I100 HydrophobicContact CD2-CD1 3.97Å; L41-I100 HydrophobicContact CG-CD1 4.38Å; L41-I447 HydrophobicContact CD2-CD1 3.89Å; L41-I447 HydrophobicContact CD2-CG2 4.33Å; L41-T450 HydrophobicContact CB-CG2 4.01Å; L41-T450 HydrophobicContact CD2-CG2 3.83Å; L41-N454 PolarHBondContact O-ND2 3.39Å
42	G	87.3	Confident	88.8	Confident	19 Å²	19	52.7 Å²	52.7	20%	0.196	28%	0.275	C	S	.	.	S	Bend	trans	96.2	174.5	171.4	0	0	0	0	0	114.7	K44 S45	G42-K44 VanDerWaalsContact C-N 3.31Å; G42-K44 PolarHBondContact O-N 3.12Å; G42-S45 VanDerWaalsContact O-CB 3.3Å; G42-S45 WeakPolarHBondContact O-CB 3.41Å; G42-S45 PolarHBondContact O-N 3.36Å; G42-S45 VanDerWaalsContact O-N 3.11Å
43	P	81.4	Confident	88.4	Confident	42 Å²	42	54.6 Å²	54.6	27%	0.273	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-29.2	-172.3	23.3	-33.1	0	0	0	114.3	S45 T162	P43-S45 VanDerWaalsContact C-N 3.29Å; P43-S45 PolarHBondContact O-N 3.17Å; P43-T162 HydrophobicContact CB-CG2 3.91Å
44	K	84.8	Confident	88.1	Confident	106 Å²	106	63 Å²	63	46%	0.461	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	40	173.6	-67.8	-174.3	170.2	173.8	0	111.4	G42 E483	G42-K44 VanDerWaalsContact C-N 3.31Å; G42-K44 PolarHBondContact O-N 3.12Å; K44-E483 WeakPolarHBondContact CE-O 3.15Å; K44-E483 PolarHBondContact NZ-O 3.44Å
45	S	84.8	Confident	87.6	Confident	22 Å²	22	65.5 Å²	65.5	15%	0.154	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-60.6	138.4	175.3	61.9	0	0	0	0	111	C40 G42 P43 N61	C40-S45 WeakPolarHBondContact O-CB 3.35Å; G42-S45 VanDerWaalsContact O-CB 3.3Å; G42-S45 WeakPolarHBondContact O-CB 3.41Å; G42-S45 PolarHBondContact O-N 3.36Å; G42-S45 VanDerWaalsContact O-N 3.11Å; P43-S45 VanDerWaalsContact C-N 3.29Å; P43-S45 PolarHBondContact O-N 3.17Å; S45-N61 PolarHBondContact OG-ND2 3.39Å; S45-N61 VanDerWaalsContact OG-ND2 3.1Å
46	M	84.7	Confident	87.3	Confident	105 Å²	105	64 Å²	64	52%	0.517	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-85.4	134	172	-65.5	-170.6	-73.2	0	0	110.3	T39	T39-M46 VanDerWaalsContact CB-CE 3.48Å; T39-M46 HydrophobicContact CG2-CE 3.44Å; T39-M46 VanDerWaalsContact CG2-CE 3.44Å; T39-M46 PolarHBondContact O-N 2.88Å
47	M	84.8	Confident	86.9	Confident	104 Å²	104	65.9 Å²	65.9	51%	0.512	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-68.6	146.6	174.9	-68.3	178	174.8	0	0	111.2	M59 N61	M47-M59 HydrophobicContact CB-CG 4.19Å; M47-M59 HydrophobicContact SD-CG 4.08Å; M47-M59 HydrophobicContact SD-SD 3.79Å; M47-N61 HydrophobicContact CG-CB 4.46Å
48	K	88.4	Confident	86.4	Confident	55 Å²	55	67.5 Å²	67.5	24%	0.239	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.9	171.2	-57.4	-58.3	-179.9	177.5	0	109.3	I36 T39 C40 M59 T60 I66	I36-K48 WeakPolarHBondContact O-CE 3.29Å; T39-K48 WeakPolarHBondContact OG1-CE 3.04Å; T39-K48 PolarHBondContact OG1-NZ 3.02Å; C40-K48 VanDerWaalsContact SG-CE 3.58Å; K48-M59 WeakPolarHBondContact O-CA 3.26Å; K48-T60 PolarHBondContact N-O 3.1Å; K48-T60 PolarHBondContact O-N 3.27Å; K48-I66 HydrophobicContact CB-CD1 3.89Å; K48-I66 HydrophobicContact CB-CG1 4.14Å; K48-I66 HydrophobicContact CG-CD1 3.57Å; K48-I66 HydrophobicContact CG-CG1 4.31Å
49	M	87.9	Confident	85.9	Confident	130 Å²	130	70.3 Å²	70.3	64%	0.64	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.7	171.5	-175.7	179.8	-73.1	0	0	107.8	I57 M59	M49-I57 HydrophobicContact CG-CG2 3.74Å; M49-I57 HydrophobicContact SD-CG2 4.24Å; M49-M59 HydrophobicContact CE-CE 3.56Å
50	L	87.8	Confident	85.5	Confident	27 Å²	27	69.2 Å²	69.2	14%	0.141	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.5	179.8	-59.4	166.1	0	0	0	108.5	I57 V58 I66 E69	L50-I57 WeakPolarHBondContact O-CA 3.21Å; L50-V58 HydrophobicContact CB-CB 4.41Å; L50-V58 PolarHBondContact N-O 3.19Å; L50-V58 PolarHBondContact O-N 3.09Å; L50-I66 HydrophobicContact CD1-CB 4.17Å; L50-I66 HydrophobicContact CD1-CG1 4.06Å; L50-I66 HydrophobicContact CD1-CG2 4.18Å; L50-I66 HydrophobicContact CD2-CG2 4.32Å; L50-E69 HydrophobicContact CD1-CB 4.13Å; L50-E69 HydrophobicContact CD1-CG 4.32Å
51	L	87.2	Confident	85.2	Confident	134 Å²	134	69.6 Å²	69.6	70%	0.702	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.3	176.5	-174	74.4	0	0	0	108.3	I57	L51-I57 HydrophobicContact CD1-CG1 4.01Å
52	D	84.9	Confident	84.9	Confident	40 Å²	40	69.7 Å²	69.7	21%	0.214	39%	0.386	C	S	.	.			trans	-69.2	153.4	175.8	-66	-12.9	0	0	0	109.9	M54 G55 G56	D52-M54 PolarHBondContact O-N 3.08Å; D52-G55 PolarHBondContact O-N 2.91Å; D52-G56 PolarHBondContact N-O 3.31Å
53	P	84.8	Confident	84.8	Confident	119 Å²	119	68.8 Å²	68.8	77%	0.773	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.6	174.9	25.2	-34.6	0	0	0	113.3
54	M	87.6	Confident	85	Confident	184 Å²	184	67 Å²	67	91%	0.906	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	1.3	174.7	-56.9	-167.8	81.5	0	0	113.5	D52	D52-M54 PolarHBondContact O-N 3.08Å
55	G	84.8	Confident	85	Confident	52 Å²	52	62.3 Å²	62.3	54%	0.536	35%	0.346	S	S	.	.	S	Bend	trans	83.8	7.4	-178.8	0	0	0	0	0	115.1	D52	D52-G55 PolarHBondContact O-N 2.91Å
56	G	84.7	Confident	85.2	Confident	30 Å²	30	61.3 Å²	61.3	31%	0.309	34%	0.339	S	S	.	.			trans	-67.4	139.4	168.5	0	0	0	0	0	110.8	D52	D52-G56 PolarHBondContact N-O 3.31Å
57	I	84.4	Confident	85.4	Confident	107 Å²	107	56.4 Å²	56.4	55%	0.549	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120	174.8	-59.4	175.1	0	0	0	107.7	M49 L50 L51	M49-I57 HydrophobicContact CG-CG2 3.74Å; M49-I57 HydrophobicContact SD-CG2 4.24Å; L50-I57 WeakPolarHBondContact O-CA 3.21Å; L51-I57 HydrophobicContact CD1-CG1 4.01Å
58	V	81.3	Confident	85.6	Confident	33 Å²	33	57.6 Å²	57.6	20%	0.2	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118	173.5	-177.8	0	0	0	0	108.1	L50 T60	L50-V58 HydrophobicContact CB-CB 4.41Å; L50-V58 PolarHBondContact N-O 3.19Å; L50-V58 PolarHBondContact O-N 3.09Å; V58-T60 HydrophobicContact CG1-CG2 4.3Å
59	M	82.7	Confident	85.5	Confident	109 Å²	109	59.1 Å²	59.1	54%	0.537	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.4	172.6	-169.5	179	-60.9	0	0	108.8	M47 K48 M49	M47-M59 HydrophobicContact CB-CG 4.19Å; M47-M59 HydrophobicContact SD-CG 4.08Å; M47-M59 HydrophobicContact SD-SD 3.79Å; K48-M59 WeakPolarHBondContact O-CA 3.26Å; M49-M59 HydrophobicContact CE-CE 3.56Å
60	T	81.9	Confident	85.4	Confident	6 Å²	6	54.9 Å²	54.9	4%	0.037	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	154.9	-180	-170.2	0	0	0	0	111.5	K48 V58 D62 A65 I66	K48-T60 PolarHBondContact N-O 3.1Å; K48-T60 PolarHBondContact O-N 3.27Å; V58-T60 HydrophobicContact CG1-CG2 4.3Å; T60-D62 PolarHBondContact OG1-N 3.48Å; T60-A65 HydrophobicContact CG2-CB 3.95Å; T60-I66 HydrophobicContact CG2-CG1 3.77Å
61	N	82.4	Confident	85.4	Confident	18 Å²	18	61.6 Å²	61.6	10%	0.096	33%	0.332	C	S	.	.			trans	-107	-2.9	170.2	65.9	-21.4	0	0	0	112.5	C40 S45 M47 G63	C40-N61 WeakPolarHBondContact CB-O 3.49Å; S45-N61 PolarHBondContact OG-ND2 3.39Å; S45-N61 VanDerWaalsContact OG-ND2 3.1Å; M47-N61 HydrophobicContact CG-CB 4.46Å; N61-G63 PolarHBondContact O-N 3.14Å
62	D	83.6	Confident	85.5	Confident	22 Å²	22	56.9 Å²	56.9	12%	0.118	31%	0.308	C	S	.	.			trans	-75.7	118.1	176.9	170.8	24.3	0	0	0	110.4	T60 N64 A65 I66	T60-D62 PolarHBondContact OG1-N 3.48Å; D62-N64 VanDerWaalsContact C-N 3.29Å; D62-N64 PolarHBondContact O-N 3.2Å; D62-N64 PolarHBondContact OD1-N 3.03Å; D62-A65 HydrophobicContact CB-CB 4.07Å; D62-A65 PolarHBondContact O-N 2.86Å; D62-A65 WeakPolarHBondContact OD2-CB 3.33Å; D62-A65 PolarHBondContact OD2-N 3.16Å; D62-I66 WeakPolarHBondContact O-CD1 3.47Å; D62-I66 VanDerWaalsContact O-CG1 3.26Å; D62-I66 WeakPolarHBondContact O-CG1 3.47Å; D62-I66 PolarHBondContact O-N 3.33Å
63	G	85.4	Confident	85.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-57.1	-38.8	-179.8	0	0	0	0	0	113.3	N61 I66 L67 T96	N61-G63 PolarHBondContact O-N 3.14Å; G63-I66 PolarHBondContact O-N 3.49Å; G63-L67 WeakPolarHBondContact O-CB 3.49Å; G63-L67 VanDerWaalsContact O-CG 3.25Å; G63-L67 WeakPolarHBondContact O-CG 3.41Å; G63-L67 PolarHBondContact O-N 2.83Å; G63-T96 WeakPolarHBondContact CA-OG1 3.39Å
64	N	86.6	Confident	85.9	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.027	31%	0.314	C	S	.	.	H	α-helix	trans	-70.2	-43.2	-179.5	169.2	57.6	0	0	0	111.5	D62 I66 L67 R68 S84 D88 T95	D62-N64 VanDerWaalsContact C-N 3.29Å; D62-N64 PolarHBondContact O-N 3.2Å; D62-N64 PolarHBondContact OD1-N 3.03Å; N64-I66 VanDerWaalsContact C-N 3.29Å; N64-I66 PolarHBondContact O-N 2.98Å; N64-L67 PolarHBondContact O-N 3.39Å; N64-R68 VanDerWaalsContact ND2-CZ 3.27Å; N64-R68 PolarHBondContact ND2-NE 3.26Å; N64-R68 PolarHBondContact ND2-NH2 3.48Å; N64-R68 WeakPolarHBondContact O-CG 3.45Å; N64-R68 PolarHBondContact O-N 3.31Å; N64-R68 VanDerWaalsContact O-N 3.12Å; N64-R68 PolarHBondContact OD1-NE 3.33Å; N64-R68 VanDerWaalsContact OD1-NE 3.16Å; N64-R68 PolarHBondContact OD1-NH2 3.4Å; N64-S84 WeakPolarHBondContact CB-OG 3.32Å; N64-D88 PolarHBondContact ND2-OD1 3.49Å; N64-D88 VanDerWaalsContact ND2-OD1 3.09Å; N64-D88 PolarHBondContact ND2-OD2 3.44Å; N64-T95 HydrophobicContact CB-CG2 3.87Å
65	A	84	Confident	86.1	Confident	7 Å²	7	55.2 Å²	55.2	6%	0.058	29%	0.293	C	S	.	.	H	α-helix	trans	-58.8	-40.9	171.8	0	0	0	0	0	112.4	T60 D62 R68	T60-A65 HydrophobicContact CG2-CB 3.95Å; D62-A65 HydrophobicContact CB-CB 4.07Å; D62-A65 PolarHBondContact O-N 2.86Å; D62-A65 WeakPolarHBondContact OD2-CB 3.33Å; D62-A65 PolarHBondContact OD2-N 3.16Å; A65-R68 PolarHBondContact O-N 2.9Å
66	I	89.6	Confident	86.4	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-48.2	177.1	-65.7	158.7	0	0	0	111.2	I37 K48 L50 T60 D62 G63 N64 R68 E69 I70	I37-I66 HydrophobicContact CG2-CG2 4.14Å; K48-I66 HydrophobicContact CB-CD1 3.89Å; K48-I66 HydrophobicContact CB-CG1 4.14Å; K48-I66 HydrophobicContact CG-CD1 3.57Å; K48-I66 HydrophobicContact CG-CG1 4.31Å; L50-I66 HydrophobicContact CD1-CB 4.17Å; L50-I66 HydrophobicContact CD1-CG1 4.06Å; L50-I66 HydrophobicContact CD1-CG2 4.18Å; L50-I66 HydrophobicContact CD2-CG2 4.32Å; T60-I66 HydrophobicContact CG2-CG1 3.77Å; D62-I66 WeakPolarHBondContact O-CD1 3.47Å; D62-I66 VanDerWaalsContact O-CG1 3.26Å; D62-I66 WeakPolarHBondContact O-CG1 3.47Å; D62-I66 PolarHBondContact O-N 3.33Å; G63-I66 PolarHBondContact O-N 3.49Å; N64-I66 VanDerWaalsContact C-N 3.29Å; N64-I66 PolarHBondContact O-N 2.98Å; I66-R68 VanDerWaalsContact C-N 3.25Å; I66-R68 PolarHBondContact O-N 3.05Å; I66-E69 PolarHBondContact O-N 3.27Å; I66-I70 HydrophobicContact CG2-CD1 3.62Å; I66-I70 HydrophobicContact CG2-CG1 4.4Å; I66-I70 WeakPolarHBondContact O-CG1 3.2Å; I66-I70 PolarHBondContact O-N 3.03Å
67	L	89.9	Confident	86.8	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-23.7	-177.1	-70.9	178.8	0	0	0	113.6	I33 I37 G63 N64 I81 I99	I33-L67 HydrophobicContact CG2-CD2 3.59Å; I37-L67 HydrophobicContact CD1-CD1 4.11Å; I37-L67 HydrophobicContact CG2-CD2 4.08Å; I37-L67 HydrophobicContact CG2-CG 4.28Å; G63-L67 WeakPolarHBondContact O-CB 3.49Å; G63-L67 VanDerWaalsContact O-CG 3.25Å; G63-L67 WeakPolarHBondContact O-CG 3.41Å; G63-L67 PolarHBondContact O-N 2.83Å; N64-L67 PolarHBondContact O-N 3.39Å; L67-I81 HydrophobicContact CB-CG1 4.2Å; L67-I81 HydrophobicContact CB-CG2 4.25Å; L67-I81 HydrophobicContact CD2-CG1 4.22Å; L67-I81 WeakPolarHBondContact O-CG2 3.49Å; L67-I99 HydrophobicContact CD1-CD1 4.01Å; L67-I99 HydrophobicContact CD1-CG1 3.88Å
68	R	87	Confident	87.2	Confident	128 Å²	128	51.4 Å²	51.4	48%	0.483	25%	0.25	S	C	.	.	H	α-helix	trans	-70.8	-33.8	176	-75	174.4	-169.3	-168.6	0.5	113.2	N64 A65 I66 D88	N64-R68 VanDerWaalsContact ND2-CZ 3.27Å; N64-R68 PolarHBondContact ND2-NE 3.26Å; N64-R68 PolarHBondContact ND2-NH2 3.48Å; N64-R68 WeakPolarHBondContact O-CG 3.45Å; N64-R68 PolarHBondContact O-N 3.31Å; N64-R68 VanDerWaalsContact O-N 3.12Å; N64-R68 PolarHBondContact OD1-NE 3.33Å; N64-R68 VanDerWaalsContact OD1-NE 3.16Å; N64-R68 PolarHBondContact OD1-NH2 3.4Å; A65-R68 PolarHBondContact O-N 2.9Å; I66-R68 VanDerWaalsContact C-N 3.25Å; I66-R68 PolarHBondContact O-N 3.05Å; R68-D88 IonicContact CZ-OD2 3.96Å; R68-D88 IonicContact NH2-OD2 2.99Å; R68-D88 PolarHBondContact NH2-OD2 3.45Å
69	E	86.8	Confident	87.7	Confident	87 Å²	87	51.4 Å²	51.4	41%	0.407	25%	0.251	S	S	.	.	H	α-helix	trans	-86.2	-21.9	-179.5	-58.8	-54.1	154.3	0	0	112.8	L50 I66 Q71	L50-E69 HydrophobicContact CD1-CB 4.13Å; L50-E69 HydrophobicContact CD1-CG 4.32Å; I66-E69 PolarHBondContact O-N 3.27Å; E69-Q71 PolarHBondContact O-N 3.07Å
70	I	87.3	Confident	88.2	Confident	42 Å²	42	46.2 Å²	46.2	22%	0.215	23%	0.226	C	C	.	.			trans	-73.7	121	179.6	-65.9	170	0	0	0	110.5	I36 I66 V72	I36-I70 HydrophobicContact CG2-CD1 4.1Å; I66-I70 HydrophobicContact CG2-CD1 3.62Å; I66-I70 HydrophobicContact CG2-CG1 4.4Å; I66-I70 WeakPolarHBondContact O-CG1 3.2Å; I66-I70 PolarHBondContact O-N 3.03Å; I70-V72 HydrophobicContact CG2-CG2 3.69Å
71	Q	87.1	Confident	88.7	Confident	167 Å²	167	47.4 Å²	47.4	78%	0.78	23%	0.231	S	C	*	.			trans	-87	118.3	171.8	-63.6	-176.6	2	0	0	110.8	E69	E69-Q71 PolarHBondContact O-N 3.07Å
72	V	88.9	Confident	89.1	Confident	36 Å²	36	52.5 Å²	52.5	22%	0.218	26%	0.255	C	S	.	.			trans	-117.3	137.2	178.8	-164.6	0	0	0	0	112	I33 I70 H74 A77 K78 I81	I33-V72 HydrophobicContact CD1-CG2 3.78Å; I70-V72 HydrophobicContact CG2-CG2 3.69Å; V72-H74 HydrophobicContact CG1-CB 4.45Å; V72-A77 HydrophobicContact CB-CB 4.19Å; V72-A77 HydrophobicContact CG1-CB 3.39Å; V72-A77 HydrophobicContact CG2-CB 4.49Å; V72-K78 WeakPolarHBondContact O-CE 3.05Å; V72-I81 HydrophobicContact CB-CD1 4.37Å; V72-I81 HydrophobicContact CG2-CD1 3.57Å
73	Q	88.1	Confident	89.4	Confident	185 Å²	185	52.7 Å²	52.7	86%	0.864	26%	0.255	S	S	*	.			trans	-84.1	-39.3	178.8	-63.2	-177	-5	0	0	112.4
74	H	90.2	Very high	89.7	Confident	53 Å²	53	52.7 Å²	52.7	25%	0.245	26%	0.255	C	S	.	.	S	Bend	trans	-71.8	127.5	-173.4	-166.1	-77.7	0	0	0	112.2	N26 A29 V72 A76 A77 K78	N26-H74 PolarHBondContact OD1-CE1 3.1Å; A29-H74 HydrophobicContact CB-CB 4.12Å; A29-H74 WeakPolarHBondContact CB-ND1 3.23Å; V72-H74 HydrophobicContact CG1-CB 4.45Å; H74-A76 WeakPolarHBondContact ND1-CB 3.14Å; H74-A76 PolarHBondContact ND1-N 3.35Å; H74-A76 VanDerWaalsContact ND1-N 3.18Å; H74-A76 PolarHBondContact O-N 3.32Å; H74-A77 HydrophobicContact CB-CB 4.4Å; H74-A77 PolarHBondContact O-N 3.19Å; H74-A77 VanDerWaalsContact O-N 3.14Å; H74-K78 PolarHBondContact O-N 3.3Å
75	P	91.1	Very high	89.8	Confident	70 Å²	70	59.3 Å²	59.3	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-58.1	-42.6	-176.4	-25.8	34.3	0	0	0	114.3	A77 K78 S79	P75-A77 PolarHBondContact O-N 3.41Å; P75-K78 WeakPolarHBondContact O-CA 3.47Å; P75-K78 WeakPolarHBondContact O-CB 3.28Å; P75-K78 PolarHBondContact O-N 2.67Å; P75-S79 PolarHBondContact O-N 3.32Å; P75-S79 PolarHBondContact O-OG 3.25Å
76	A	92.1	Very high	90.1	Very high	2 Å²	2	62.3 Å²	62.3	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-58.9	-36.6	178.5	0	0	0	0	0	112.9	N26 H74 S79 M80 L516	N26-A76 HydrophobicContact CB-CB 3.99Å; H74-A76 WeakPolarHBondContact ND1-CB 3.14Å; H74-A76 PolarHBondContact ND1-N 3.35Å; H74-A76 VanDerWaalsContact ND1-N 3.18Å; H74-A76 PolarHBondContact O-N 3.32Å; A76-S79 PolarHBondContact O-N 3.1Å; A76-M80 WeakPolarHBondContact O-CG 3.39Å; A76-M80 PolarHBondContact O-N 2.75Å; A76-L516 HydrophobicContact CB-CD1 4.3Å; A76-L516 HydrophobicContact CB-CD2 3.64Å
77	A	92.8	Very high	90.2	Very high	2 Å²	2	62.2 Å²	62.2	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-73.6	-30.4	176.8	0	0	0	0	0	112.3	A29 I33 V72 H74 P75 M80 I81	A29-A77 HydrophobicContact CB-CB 4.3Å; I33-A77 HydrophobicContact CD1-CB 4.19Å; I33-A77 HydrophobicContact CG1-CB 3.67Å; V72-A77 HydrophobicContact CB-CB 4.19Å; V72-A77 HydrophobicContact CG1-CB 3.39Å; V72-A77 HydrophobicContact CG2-CB 4.49Å; H74-A77 HydrophobicContact CB-CB 4.4Å; H74-A77 PolarHBondContact O-N 3.19Å; H74-A77 VanDerWaalsContact O-N 3.14Å; P75-A77 PolarHBondContact O-N 3.41Å; A77-M80 WeakPolarHBondContact O-CB 3.39Å; A77-M80 PolarHBondContact O-N 3.29Å; A77-I81 WeakPolarHBondContact O-CG1 3.21Å; A77-I81 PolarHBondContact O-N 2.99Å
78	K	92.4	Very high	90.1	Very high	105 Å²	105	63.7 Å²	63.7	46%	0.457	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-43.8	169.9	-65.1	-177.3	178.7	-177.9	0	111.4	V72 H74 P75 M80 I81 E82	V72-K78 WeakPolarHBondContact O-CE 3.05Å; H74-K78 PolarHBondContact O-N 3.3Å; P75-K78 WeakPolarHBondContact O-CA 3.47Å; P75-K78 WeakPolarHBondContact O-CB 3.28Å; P75-K78 PolarHBondContact O-N 2.67Å; K78-M80 VanDerWaalsContact C-N 3.27Å; K78-M80 PolarHBondContact O-N 3.38Å; K78-I81 PolarHBondContact O-N 2.92Å; K78-E82 WeakPolarHBondContact O-CG 3.2Å; K78-E82 PolarHBondContact O-N 2.94Å
79	S	92.1	Very high	90.1	Very high	33 Å²	33	61.9 Å²	61.9	23%	0.231	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-38.5	173.7	-56.6	0	0	0	0	111.8	P75 A76 I81 E82 I83	P75-S79 PolarHBondContact O-N 3.32Å; P75-S79 PolarHBondContact O-OG 3.25Å; A76-S79 PolarHBondContact O-N 3.1Å; S79-I81 VanDerWaalsContact C-N 3.34Å; S79-I81 PolarHBondContact O-N 2.89Å; S79-E82 PolarHBondContact O-N 2.87Å; S79-I83 WeakPolarHBondContact O-CG2 3.43Å; S79-I83 PolarHBondContact O-N 2.77Å; S79-I83 VanDerWaalsContact O-N 3.12Å
80	M	92	Very high	90	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-36.3	172.4	-69.2	-73.8	-75	0	0	112.7	A30 I33 A76 A77 K78 I83 I99 A102 T512 L516	A30-M80 HydrophobicContact CB-CE 4.1Å; A30-M80 HydrophobicContact CB-CG 3.92Å; A30-M80 HydrophobicContact CB-SD 4.08Å; I33-M80 HydrophobicContact CG2-CB 4.39Å; A76-M80 WeakPolarHBondContact O-CG 3.39Å; A76-M80 PolarHBondContact O-N 2.75Å; A77-M80 WeakPolarHBondContact O-CB 3.39Å; A77-M80 PolarHBondContact O-N 3.29Å; K78-M80 VanDerWaalsContact C-N 3.27Å; K78-M80 PolarHBondContact O-N 3.38Å; M80-I83 WeakPolarHBondContact O-CG1 3.24Å; M80-I83 HydrophobicContact SD-CD1 3.88Å; M80-I99 HydrophobicContact CB-CD1 4.49Å; M80-I99 HydrophobicContact CE-CD1 4.39Å; M80-I99 HydrophobicContact CE-CG2 3.85Å; M80-I99 WeakPolarHBondContact O-CD1 3.34Å; M80-A102 HydrophobicContact CE-CB 3.95Å; M80-A102 HydrophobicContact SD-CB 4.05Å; M80-T512 HydrophobicContact SD-CG2 3.66Å; M80-L516 HydrophobicContact CG-CD1 4.27Å; M80-L516 HydrophobicContact SD-CD1 4.26Å
81	I	92.4	Very high	89.9	Confident	31 Å²	31	61.4 Å²	61.4	16%	0.159	30%	0.299	C	S	.	.	H	α-helix	trans	-70.4	-41	176.1	-67.3	167.5	0	0	0	110.9	L67 V72 A77 K78 S79 I83 S84 R85	L67-I81 HydrophobicContact CB-CG1 4.2Å; L67-I81 HydrophobicContact CB-CG2 4.25Å; L67-I81 HydrophobicContact CD2-CG1 4.22Å; L67-I81 WeakPolarHBondContact O-CG2 3.49Å; V72-I81 HydrophobicContact CB-CD1 4.37Å; V72-I81 HydrophobicContact CG2-CD1 3.57Å; A77-I81 WeakPolarHBondContact O-CG1 3.21Å; A77-I81 PolarHBondContact O-N 2.99Å; K78-I81 PolarHBondContact O-N 2.92Å; S79-I81 VanDerWaalsContact C-N 3.34Å; S79-I81 PolarHBondContact O-N 2.89Å; I81-I83 VanDerWaalsContact C-N 3.32Å; I81-I83 PolarHBondContact O-N 3.18Å; I81-S84 WeakPolarHBondContact O-CB 3.39Å; I81-S84 PolarHBondContact O-N 3.48Å; I81-R85 PolarHBondContact O-N 3.02Å
82	E	90.9	Very high	89.7	Confident	125 Å²	125	53.6 Å²	53.6	58%	0.584	26%	0.264	S	S	*	.	H	α-helix	trans	-61.3	-39	179.3	-73.4	172.8	-179.3	0	0	112.3	K78 S79 S84 R85 T86	K78-E82 WeakPolarHBondContact O-CG 3.2Å; K78-E82 PolarHBondContact O-N 2.94Å; S79-E82 PolarHBondContact O-N 2.87Å; E82-S84 VanDerWaalsContact C-N 3.35Å; E82-S84 PolarHBondContact O-N 3.44Å; E82-R85 WeakPolarHBondContact O-CB 3.45Å; E82-R85 PolarHBondContact O-N 3.11Å; E82-R85 VanDerWaalsContact O-N 3.15Å; E82-T86 PolarHBondContact O-N 2.83Å
83	I	90.9	Very high	89.5	Confident	26 Å²	26	53.9 Å²	53.9	13%	0.133	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-36.5	177.8	60.1	171.7	0	0	0	112.6	S79 M80 I81 R85 T86 Q87 V98 I99 T512	S79-I83 WeakPolarHBondContact O-CG2 3.43Å; S79-I83 PolarHBondContact O-N 2.77Å; S79-I83 VanDerWaalsContact O-N 3.12Å; M80-I83 WeakPolarHBondContact O-CG1 3.24Å; M80-I83 HydrophobicContact SD-CD1 3.88Å; I81-I83 VanDerWaalsContact C-N 3.32Å; I81-I83 PolarHBondContact O-N 3.18Å; I83-R85 PolarHBondContact O-N 3.24Å; I83-T86 WeakPolarHBondContact CA-OG1 3.43Å; I83-T86 PolarHBondContact O-N 2.84Å; I83-T86 VanDerWaalsContact O-N 3.16Å; I83-T86 PolarHBondContact O-OG1 2.88Å; I83-Q87 PolarHBondContact O-N 3.24Å; I83-V98 HydrophobicContact CD1-CG1 4.01Å; I83-I99 HydrophobicContact CD1-CD1 3.81Å; I83-I99 HydrophobicContact CG1-CD1 3.73Å; I83-T512 HydrophobicContact CD1-CG2 3.61Å; I83-T512 WeakPolarHBondContact CD1-OG1 3.31Å
84	S	91.1	Very high	89.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-38.4	174.8	-177.9	0	0	0	0	110.5	N64 I81 E82 Q87 D88	N64-S84 WeakPolarHBondContact CB-OG 3.32Å; I81-S84 WeakPolarHBondContact O-CB 3.39Å; I81-S84 PolarHBondContact O-N 3.48Å; E82-S84 VanDerWaalsContact C-N 3.35Å; E82-S84 PolarHBondContact O-N 3.44Å; S84-Q87 PolarHBondContact O-N 3.25Å; S84-D88 WeakPolarHBondContact O-CB 3.34Å; S84-D88 PolarHBondContact O-N 3.33Å
85	R	89.5	Confident	89.4	Confident	144 Å²	144	43.3 Å²	43.3	54%	0.543	22%	0.217	S	C	.	.	H	α-helix	trans	-68.2	-41.1	177	-176.2	180	175.5	173.3	1.7	112	I81 E82 I83 Q87 D88 E89	I81-R85 PolarHBondContact O-N 3.02Å; E82-R85 WeakPolarHBondContact O-CB 3.45Å; E82-R85 PolarHBondContact O-N 3.11Å; E82-R85 VanDerWaalsContact O-N 3.15Å; I83-R85 PolarHBondContact O-N 3.24Å; R85-Q87 VanDerWaalsContact C-N 3.33Å; R85-D88 PolarHBondContact O-N 2.87Å; R85-E89 IonicContact CZ-OE1 2.69Å; R85-E89 IonicContact NE-OE1 3.53Å; R85-E89 PolarHBondContact NE-OE1 2.89Å; R85-E89 IonicContact NH2-OE1 2.66Å; R85-E89 WeakPolarHBondContact O-CG 3.42Å; R85-E89 PolarHBondContact O-N 2.99Å
86	T	90.3	Very high	89.5	Confident	69 Å²	69	40.6 Å²	40.6	42%	0.423	20%	0.2	S	C	.	.	H	α-helix	trans	-66.1	-36.7	176.5	59.3	0	0	0	0	112.4	E82 I83 E89 E90	E82-T86 PolarHBondContact O-N 2.83Å; I83-T86 WeakPolarHBondContact CA-OG1 3.43Å; I83-T86 PolarHBondContact O-N 2.84Å; I83-T86 VanDerWaalsContact O-N 3.16Å; I83-T86 PolarHBondContact O-OG1 2.88Å; T86-E89 PolarHBondContact O-N 3.12Å; T86-E90 WeakPolarHBondContact O-CB 3.43Å; T86-E90 WeakPolarHBondContact O-CG 3.43Å; T86-E90 PolarHBondContact O-N 2.9Å; T86-E90 VanDerWaalsContact O-N 3.08Å
87	Q	90.8	Very high	89.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.1	-45.4	175.7	-177.1	70.1	15.7	0	0	111.5	I83 S84 R85 E89 E90 V91 G92 D93 T95 V98 Q504 T505	I83-Q87 PolarHBondContact O-N 3.24Å; S84-Q87 PolarHBondContact O-N 3.25Å; R85-Q87 VanDerWaalsContact C-N 3.33Å; Q87-E89 VanDerWaalsContact C-N 3.34Å; Q87-E89 PolarHBondContact O-N 3.17Å; Q87-E90 PolarHBondContact O-N 2.91Å; Q87-V91 HydrophobicContact CG-CG2 4.23Å; Q87-V91 WeakPolarHBondContact O-CG2 3.42Å; Q87-V91 PolarHBondContact O-N 2.91Å; Q87-G92 PolarHBondContact O-N 3.4Å; Q87-D93 PolarHBondContact NE2-O 3.33Å; Q87-D93 VanDerWaalsContact NE2-O 3.17Å; Q87-T95 HydrophobicContact CG-CG2 4.35Å; Q87-V98 HydrophobicContact CB-CG2 4.31Å; Q87-V98 HydrophobicContact CG-CG2 3.72Å; Q87-Q504 VanDerWaalsContact OE1-CG 3.27Å; Q87-T505 VanDerWaalsContact NE2-CG2 3.33Å
88	D	88.1	Confident	89.7	Confident	32 Å²	32	41.4 Å²	41.4	17%	0.171	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-41.5	176.6	-175	69.5	0	0	0	112.1	N64 R68 S84 R85 G92 T95	N64-D88 PolarHBondContact ND2-OD1 3.49Å; N64-D88 VanDerWaalsContact ND2-OD1 3.09Å; N64-D88 PolarHBondContact ND2-OD2 3.44Å; R68-D88 IonicContact CZ-OD2 3.96Å; R68-D88 IonicContact NH2-OD2 2.99Å; R68-D88 PolarHBondContact NH2-OD2 3.45Å; S84-D88 WeakPolarHBondContact O-CB 3.34Å; S84-D88 PolarHBondContact O-N 3.33Å; R85-D88 PolarHBondContact O-N 2.87Å; D88-G92 VanDerWaalsContact O-CA 3.29Å; D88-G92 WeakPolarHBondContact O-CA 3.04Å; D88-G92 PolarHBondContact O-N 3.08Å; D88-T95 HydrophobicContact CB-CG2 3.8Å
89	E	86.2	Confident	89.8	Confident	91 Å²	91	36.4 Å²	36.4	43%	0.425	18%	0.184	S	C	.	.	H	α-helix	trans	-72.4	-33.7	180	-72.4	179.1	-170.7	0	0	113.2	R85 T86 Q87	R85-E89 IonicContact CZ-OE1 2.69Å; R85-E89 IonicContact NE-OE1 3.53Å; R85-E89 PolarHBondContact NE-OE1 2.89Å; R85-E89 IonicContact NH2-OE1 2.66Å; R85-E89 WeakPolarHBondContact O-CG 3.42Å; R85-E89 PolarHBondContact O-N 2.99Å; T86-E89 PolarHBondContact O-N 3.12Å; Q87-E89 VanDerWaalsContact C-N 3.34Å; Q87-E89 PolarHBondContact O-N 3.17Å
90	E	86.1	Confident	90	Very high	107 Å²	107	34.9 Å²	34.9	50%	0.5	17%	0.173	S	C	.	.	H	α-helix	trans	-81.5	-56.7	-177.9	-77.8	-65.5	163.6	0	0	113.4	T86 Q87 R399	T86-E90 WeakPolarHBondContact O-CB 3.43Å; T86-E90 WeakPolarHBondContact O-CG 3.43Å; T86-E90 PolarHBondContact O-N 2.9Å; T86-E90 VanDerWaalsContact O-N 3.08Å; Q87-E90 PolarHBondContact O-N 2.91Å; E90-R399 PolarHBondContact O-NH1 3.27Å
91	V	85.6	Confident	90.2	Very high	11 Å²	11	34.9 Å²	34.9	7%	0.067	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-8.5	-170.9	-62.1	0	0	0	0	114	Q87 D93 Q396 N400 V501 Q504	Q87-V91 HydrophobicContact CG-CG2 4.23Å; Q87-V91 WeakPolarHBondContact O-CG2 3.42Å; Q87-V91 PolarHBondContact O-N 2.91Å; V91-D93 WeakPolarHBondContact CG2-O 3.35Å; V91-D93 PolarHBondContact O-N 3.18Å; V91-Q396 WeakPolarHBondContact O-CB 3.38Å; V91-N400 PolarHBondContact O-ND2 3.45Å; V91-V501 HydrophobicContact CB-CG2 4.21Å; V91-V501 HydrophobicContact CG2-CG2 4.45Å; V91-Q504 HydrophobicContact CG1-CB 4.07Å; V91-Q504 HydrophobicContact CG1-CG 4.23Å; V91-Q504 HydrophobicContact CG2-CB 4.49Å; V91-Q504 HydrophobicContact CG2-CG 4.5Å
92	G	82.8	Confident	90.4	Very high	3 Å²	3	33.4 Å²	33.4	3%	0.031	17%	0.165	C	C	.	.	S	Bend	trans	75.5	-45.5	180	0	0	0	0	0	114.7	Q87 D88	Q87-G92 PolarHBondContact O-N 3.4Å; D88-G92 VanDerWaalsContact O-CA 3.29Å; D88-G92 WeakPolarHBondContact O-CA 3.04Å; D88-G92 PolarHBondContact O-N 3.08Å
93	D	84.3	Confident	90.6	Very high	43 Å²	43	27.5 Å²	27.5	23%	0.23	14%	0.138	C	C	.	.	S	Bend	trans	-102	166.4	-175.8	-158.4	6.6	0	0	0	113.5	Q87 V91 T95 V397 V501	Q87-D93 PolarHBondContact NE2-O 3.33Å; Q87-D93 VanDerWaalsContact NE2-O 3.17Å; V91-D93 WeakPolarHBondContact CG2-O 3.35Å; V91-D93 PolarHBondContact O-N 3.18Å; D93-T95 VanDerWaalsContact C-N 3.33Å; D93-T95 PolarHBondContact O-N 3.41Å; D93-V397 HydrophobicContact CB-CG2 4.18Å; D93-V501 HydrophobicContact CB-CG1 4.33Å; D93-V501 HydrophobicContact CB-CG2 4.41Å
94	G	87.1	Confident	90.8	Very high	8 Å²	8	27.9 Å²	27.9	8%	0.082	14%	0.139	C	C	.	.			trans	79.5	11.1	176.5	0	0	0	0	0	114.6	T96 S97 V98	G94-T96 VanDerWaalsContact C-N 3.31Å; G94-T96 PolarHBondContact O-N 3Å; G94-S97 WeakPolarHBondContact O-CB 3.45Å; G94-S97 PolarHBondContact O-N 3.05Å; G94-V98 WeakPolarHBondContact O-CG2 3.32Å; G94-V98 PolarHBondContact O-N 3.09Å
95	T	89.7	Confident	91.1	Very high	7 Å²	7	27.9 Å²	27.9	4%	0.043	14%	0.139	C	C	.	.	H	α-helix	trans	-51.6	-48.8	178.7	55.9	0	0	0	0	111.9	N64 Q87 D88 D93 I99	N64-T95 HydrophobicContact CB-CG2 3.87Å; Q87-T95 HydrophobicContact CG-CG2 4.35Å; D88-T95 HydrophobicContact CB-CG2 3.8Å; D93-T95 VanDerWaalsContact C-N 3.33Å; D93-T95 PolarHBondContact O-N 3.41Å; T95-I99 WeakPolarHBondContact O-CG1 3.49Å
96	T	92.1	Very high	91.3	Very high	13 Å²	13	21 Å²	21	8%	0.08	11%	0.113	C	C	.	.	H	α-helix	trans	-66.1	-40.6	178.1	-57.3	0	0	0	0	111.7	I37 L41 G63 G94 V98 I99 I100	I37-T96 HydrophobicContact CD1-CG2 4.05Å; I37-T96 HydrophobicContact CG1-CG2 4.25Å; L41-T96 HydrophobicContact CB-CG2 4.2Å; L41-T96 HydrophobicContact CD1-CG2 4.32Å; G63-T96 WeakPolarHBondContact CA-OG1 3.39Å; G94-T96 VanDerWaalsContact C-N 3.31Å; G94-T96 PolarHBondContact O-N 3Å; T96-V98 PolarHBondContact O-N 2.96Å; T96-I99 PolarHBondContact O-N 2.94Å; T96-I100 HydrophobicContact CG2-CD1 3.69Å; T96-I100 HydrophobicContact CG2-CG1 4.39Å; T96-I100 VanDerWaalsContact O-CG1 3.31Å; T96-I100 WeakPolarHBondContact O-CG1 3.48Å; T96-I100 PolarHBondContact O-N 3.12Å; T96-I100 VanDerWaalsContact O-N 3.12Å
97	S	93.6	Very high	91.6	Very high	22 Å²	22	19 Å²	19	15%	0.154	10%	0.102	C	C	.	.	H	α-helix	trans	-64	-40.3	-178.2	-56.7	0	0	0	0	112.3	L41 G94 I99 I100 L101	L41-S97 WeakPolarHBondContact CD1-OG 3.21Å; G94-S97 WeakPolarHBondContact O-CB 3.45Å; G94-S97 PolarHBondContact O-N 3.05Å; S97-I99 VanDerWaalsContact C-N 3.34Å; S97-I99 PolarHBondContact O-N 3.35Å; S97-I100 PolarHBondContact O-N 3.1Å; S97-L101 WeakPolarHBondContact O-CB 3.45Å; S97-L101 VanDerWaalsContact O-CG 3.32Å; S97-L101 WeakPolarHBondContact O-CG 3.44Å; S97-L101 PolarHBondContact O-N 3.47Å
98	V	95.3	Very high	91.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-57.3	-48.7	177	175	0	0	0	0	111.4	I83 Q87 G94 T96 L101 A102 T505 T508	I83-V98 HydrophobicContact CD1-CG1 4.01Å; Q87-V98 HydrophobicContact CB-CG2 4.31Å; Q87-V98 HydrophobicContact CG-CG2 3.72Å; G94-V98 WeakPolarHBondContact O-CG2 3.32Å; G94-V98 PolarHBondContact O-N 3.09Å; T96-V98 PolarHBondContact O-N 2.96Å; V98-L101 PolarHBondContact O-N 3.3Å; V98-A102 VanDerWaalsContact O-CB 3.29Å; V98-A102 WeakPolarHBondContact O-CB 3.35Å; V98-A102 PolarHBondContact O-N 3.29Å; V98-T505 HydrophobicContact CG2-CG2 3.68Å; V98-T508 WeakPolarHBondContact CG1-OG1 3.45Å; V98-T508 WeakPolarHBondContact CG2-OG1 3.5Å
99	I	95.4	Very high	92	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.3	-42.8	-175.6	-58.3	-69.3	0	0	0	110.8	I33 A34 I37 L67 M80 I83 T95 T96 S97 G103	I33-I99 HydrophobicContact CG2-CG2 4.06Å; A34-I99 HydrophobicContact CB-CG2 4.24Å; I37-I99 HydrophobicContact CD1-CB 3.63Å; I37-I99 HydrophobicContact CD1-CG1 3.97Å; I37-I99 HydrophobicContact CD1-CG2 3.56Å; I37-I99 HydrophobicContact CG1-CG2 4.14Å; L67-I99 HydrophobicContact CD1-CD1 4.01Å; L67-I99 HydrophobicContact CD1-CG1 3.88Å; M80-I99 HydrophobicContact CB-CD1 4.49Å; M80-I99 HydrophobicContact CE-CD1 4.39Å; M80-I99 HydrophobicContact CE-CG2 3.85Å; M80-I99 WeakPolarHBondContact O-CD1 3.34Å; I83-I99 HydrophobicContact CD1-CD1 3.81Å; I83-I99 HydrophobicContact CG1-CD1 3.73Å; T95-I99 WeakPolarHBondContact O-CG1 3.49Å; T96-I99 PolarHBondContact O-N 2.94Å; S97-I99 VanDerWaalsContact C-N 3.34Å; S97-I99 PolarHBondContact O-N 3.35Å; I99-G103 PolarHBondContact O-N 3.48Å
100	I	95.9	Very high	92.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63	-46.9	177.4	-64.8	168.4	0	0	0	110.3	R38 L41 T96 S97 G103 E104 V446 I447	R38-I100 HydrophobicContact CB-CD1 4.45Å; R38-I100 HydrophobicContact CG-CD1 4.4Å; L41-I100 HydrophobicContact CB-CD1 3.97Å; L41-I100 HydrophobicContact CD2-CD1 3.97Å; L41-I100 HydrophobicContact CG-CD1 4.38Å; T96-I100 HydrophobicContact CG2-CD1 3.69Å; T96-I100 HydrophobicContact CG2-CG1 4.39Å; T96-I100 VanDerWaalsContact O-CG1 3.31Å; T96-I100 WeakPolarHBondContact O-CG1 3.48Å; T96-I100 PolarHBondContact O-N 3.12Å; T96-I100 VanDerWaalsContact O-N 3.12Å; S97-I100 PolarHBondContact O-N 3.1Å; I100-G103 PolarHBondContact O-N 3.46Å; I100-E104 WeakPolarHBondContact O-CB 3.33Å; I100-E104 PolarHBondContact O-N 2.87Å; I100-V446 HydrophobicContact CG2-CG1 3.86Å; I100-V446 HydrophobicContact CG2-CG2 3.95Å; I100-I447 HydrophobicContact CB-CD1 4.48Å; I100-I447 HydrophobicContact CG2-CD1 4.29Å
101	L	96.3	Very high	92.6	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-63.6	-46	179.2	-74.9	174.2	0	0	0	111.9	S97 V98 G103 E104 M105 L444 V446 I447 Y506 A509	S97-L101 WeakPolarHBondContact O-CB 3.45Å; S97-L101 VanDerWaalsContact O-CG 3.32Å; S97-L101 WeakPolarHBondContact O-CG 3.44Å; S97-L101 PolarHBondContact O-N 3.47Å; V98-L101 PolarHBondContact O-N 3.3Å; L101-G103 VanDerWaalsContact C-N 3.34Å; L101-G103 PolarHBondContact O-N 3.3Å; L101-E104 PolarHBondContact O-N 3.02Å; L101-M105 WeakPolarHBondContact O-CB 3.37Å; L101-M105 VanDerWaalsContact O-CG 3.26Å; L101-M105 WeakPolarHBondContact O-CG 3.45Å; L101-M105 PolarHBondContact O-N 2.76Å; L101-L444 HydrophobicContact CD2-CD2 4.09Å; L101-V446 HydrophobicContact CD2-CG1 3.86Å; L101-I447 HydrophobicContact CD1-CG1 4.38Å; L101-I447 HydrophobicContact CD2-CD1 4.28Å; L101-I447 HydrophobicContact CD2-CG1 3.76Å; L101-I447 HydrophobicContact CG-CD1 4.07Å; L101-I447 HydrophobicContact CG-CG1 4.02Å; L101-Y506 HydrophobicContact CD1-CD1 3.88Å; L101-Y506 HydrophobicContact CD1-CE1 3.88Å; L101-A509 HydrophobicContact CB-CB 3.78Å
102	A	96	Very high	92.9	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.8	-43.7	177.4	0	0	0	0	0	111.6	M80 V98 M105 L106 A509 T512	M80-A102 HydrophobicContact CE-CB 3.95Å; M80-A102 HydrophobicContact SD-CB 4.05Å; V98-A102 VanDerWaalsContact O-CB 3.29Å; V98-A102 WeakPolarHBondContact O-CB 3.35Å; V98-A102 PolarHBondContact O-N 3.29Å; A102-M105 PolarHBondContact O-N 2.96Å; A102-L106 WeakPolarHBondContact O-CB 3.43Å; A102-L106 WeakPolarHBondContact O-CD1 3.49Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.48Å; A102-L106 PolarHBondContact O-N 3.05Å; A102-L106 VanDerWaalsContact O-N 3.07Å; A102-A509 HydrophobicContact CB-CB 4.28Å; A102-T512 HydrophobicContact CB-CG2 4.26Å
103	G	95.7	Very high	93.2	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-62.4	-43	176.4	0	0	0	0	0	113	I99 I100 L101 L106 S107	I99-G103 PolarHBondContact O-N 3.48Å; I100-G103 PolarHBondContact O-N 3.46Å; L101-G103 VanDerWaalsContact C-N 3.34Å; L101-G103 PolarHBondContact O-N 3.3Å; G103-L106 PolarHBondContact O-N 3.43Å; G103-S107 PolarHBondContact O-N 2.96Å
104	E	95.9	Very high	93.5	Very high	34 Å²	34	20 Å²	20	16%	0.159	10%	0.104	C	C	.	.	H	α-helix	trans	-68.6	-43.1	178.1	-169.1	72.8	-172.8	0	0	111.9	I100 L101 L106 S107 V108 A443 V446 R449	I100-E104 WeakPolarHBondContact O-CB 3.33Å; I100-E104 PolarHBondContact O-N 2.87Å; L101-E104 PolarHBondContact O-N 3.02Å; E104-L106 PolarHBondContact O-N 3.44Å; E104-S107 PolarHBondContact O-N 3.24Å; E104-S107 VanDerWaalsContact O-N 3.1Å; E104-V108 PolarHBondContact O-N 2.63Å; E104-A443 HydrophobicContact CB-CB 4.41Å; E104-A443 HydrophobicContact CG-CB 3.85Å; E104-V446 HydrophobicContact CB-CB 4.21Å; E104-V446 HydrophobicContact CB-CG1 3.99Å; E104-V446 HydrophobicContact CB-CG2 4.31Å; E104-V446 HydrophobicContact CG-CB 3.87Å; E104-V446 HydrophobicContact CG-CG1 4.14Å; E104-V446 HydrophobicContact CG-CG2 4.13Å; E104-R449 IonicContact OE1-NH1 2.97Å
105	M	95.5	Very high	93.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.6	-34.3	176.6	-74.4	-176.8	-170.8	0	0	112.2	L101 A102 V108 A109 Y126 V440 A443 L444 V510 A513	L101-M105 WeakPolarHBondContact O-CB 3.37Å; L101-M105 VanDerWaalsContact O-CG 3.26Å; L101-M105 WeakPolarHBondContact O-CG 3.45Å; L101-M105 PolarHBondContact O-N 2.76Å; A102-M105 PolarHBondContact O-N 2.96Å; M105-V108 WeakPolarHBondContact O-CG1 3.37Å; M105-A109 WeakPolarHBondContact O-CB 3.44Å; M105-A109 PolarHBondContact O-N 2.93Å; M105-Y126 HydrophobicContact CB-CE2 4.03Å; M105-Y126 PolarHBondContact O-OH 2.96Å; M105-V440 HydrophobicContact CE-CG1 4.19Å; M105-A443 HydrophobicContact CG-CB 4.05Å; M105-L444 HydrophobicContact CE-CD2 4.24Å; M105-V510 HydrophobicContact CE-CG2 3.76Å; M105-V510 HydrophobicContact SD-CB 4.43Å; M105-V510 HydrophobicContact SD-CG2 3.62Å; M105-A513 HydrophobicContact CB-CB 4.08Å
106	L	95.1	Very high	93.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-73.3	-40.9	172.9	-74.3	167.8	0	0	0	111.9	I27 A30 A102 G103 E104 V108 A109 E110 A513 L516 L517	I27-L106 HydrophobicContact CG1-CB 4.18Å; I27-L106 HydrophobicContact CG1-CD2 4.2Å; I27-L106 HydrophobicContact CG2-CB 4.14Å; I27-L106 WeakPolarHBondContact CG2-O 3.47Å; A30-L106 HydrophobicContact CB-CD1 3.54Å; A102-L106 WeakPolarHBondContact O-CB 3.43Å; A102-L106 WeakPolarHBondContact O-CD1 3.49Å; A102-L106 VanDerWaalsContact O-CG 3.3Å; A102-L106 WeakPolarHBondContact O-CG 3.48Å; A102-L106 PolarHBondContact O-N 3.05Å; A102-L106 VanDerWaalsContact O-N 3.07Å; G103-L106 PolarHBondContact O-N 3.43Å; E104-L106 PolarHBondContact O-N 3.44Å; L106-V108 VanDerWaalsContact C-N 3.33Å; L106-V108 PolarHBondContact O-N 3.38Å; L106-A109 WeakPolarHBondContact O-CB 3.42Å; L106-A109 PolarHBondContact O-N 3.2Å; L106-E110 PolarHBondContact O-N 3.39Å; L106-A513 HydrophobicContact CD2-CB 4.1Å; L106-A513 HydrophobicContact CG-CB 4.03Å; L106-L516 HydrophobicContact CD1-CB 4.3Å; L106-L516 HydrophobicContact CD1-CD1 3.64Å; L106-L516 HydrophobicContact CD2-CB 4.14Å; L106-L517 HydrophobicContact CD2-CD1 4.45Å; L106-L517 HydrophobicContact CD2-CD2 4.09Å; L106-L517 HydrophobicContact CD2-CG 3.81Å
107	S	95.3	Very high	93.6	Very high	25 Å²	25	31.5 Å²	31.5	18%	0.175	16%	0.155	C	C	.	.	H	α-helix	trans	-63.3	-38.6	177.8	-168.4	0	0	0	0	112	K31 G103 E104 A109 E110	K31-S107 PolarHBondContact NZ-OG 3.27Å; G103-S107 PolarHBondContact O-N 2.96Å; E104-S107 PolarHBondContact O-N 3.24Å; E104-S107 VanDerWaalsContact O-N 3.1Å; S107-A109 VanDerWaalsContact C-N 3.33Å; S107-E110 WeakPolarHBondContact O-CB 3.14Å
108	V	94.6	Very high	93.5	Very high	32 Å²	32	36.3 Å²	36.3	19%	0.194	18%	0.175	C	C	.	.	H	α-helix	trans	-75.7	-25	177.3	80.8	0	0	0	0	112.1	E104 M105 L106 E110 Y126 A439 A443	E104-V108 PolarHBondContact O-N 2.63Å; M105-V108 WeakPolarHBondContact O-CG1 3.37Å; L106-V108 VanDerWaalsContact C-N 3.33Å; L106-V108 PolarHBondContact O-N 3.38Å; V108-E110 VanDerWaalsContact C-N 3.31Å; V108-Y126 WeakPolarHBondContact CG1-OH 3.44Å; V108-A439 HydrophobicContact CB-CB 4.41Å; V108-A439 HydrophobicContact CG1-CB 3.87Å; V108-A439 HydrophobicContact CG2-CB 3.65Å; V108-A443 HydrophobicContact CG1-CB 4.26Å
109	A	93.3	Very high	93.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.2	-30.6	174.5	0	0	0	0	0	112.6	M105 L106 S107 H111 F112 L113 V122 L517	M105-A109 WeakPolarHBondContact O-CB 3.44Å; M105-A109 PolarHBondContact O-N 2.93Å; L106-A109 WeakPolarHBondContact O-CB 3.42Å; L106-A109 PolarHBondContact O-N 3.2Å; S107-A109 VanDerWaalsContact C-N 3.33Å; A109-H111 VanDerWaalsContact C-N 3.28Å; A109-H111 PolarHBondContact O-N 3.05Å; A109-F112 WeakPolarHBondContact O-CB 3.28Å; A109-F112 PolarHBondContact O-N 3.11Å; A109-L113 PolarHBondContact O-N 2.88Å; A109-V122 HydrophobicContact CB-CG1 4.2Å; A109-L517 HydrophobicContact CB-CD1 4.02Å; A109-L517 HydrophobicContact CB-CD2 3.97Å
110	E	92.2	Very high	93.3	Very high	36 Å²	36	41.2 Å²	41.2	17%	0.168	21%	0.205	C	C	.	.	H	α-helix	trans	-54.3	-43.2	-178.9	-172.5	167.9	-147.2	0	0	112.2	I27 L106 S107 V108 F112 L113 E114	I27-E110 HydrophobicContact CD1-CB 4.15Å; I27-E110 HydrophobicContact CG2-CB 4.46Å; L106-E110 PolarHBondContact O-N 3.39Å; S107-E110 WeakPolarHBondContact O-CB 3.14Å; V108-E110 VanDerWaalsContact C-N 3.31Å; E110-F112 PolarHBondContact O-N 2.92Å; E110-L113 WeakPolarHBondContact O-CB 3.42Å; E110-L113 PolarHBondContact O-N 2.89Å; E110-E114 WeakPolarHBondContact O-CG 3.12Å; E110-E114 PolarHBondContact O-N 3.04Å
111	H	92.6	Very high	93.3	Very high	95 Å²	95	43.3 Å²	43.3	44%	0.44	22%	0.218	S	C	.	.	H	α-helix	trans	-56.7	-37.3	178.1	-176	59	0	0	0	112.9	A109 E114 Q115	A109-H111 VanDerWaalsContact C-N 3.28Å; A109-H111 PolarHBondContact O-N 3.05Å; H111-E114 PolarHBondContact O-N 3.31Å; H111-Q115 PolarHBondContact NE2-NE2 3.2Å; H111-Q115 WeakPolarHBondContact O-CG 3.5Å; H111-Q115 PolarHBondContact O-N 3.28Å
112	F	92.4	Very high	93.2	Very high	15 Å²	15	43.3 Å²	43.3	7%	0.066	22%	0.218	C	C	.	.	H	α-helix	trans	-75.7	-31.9	178.9	-60	-48.4	0	0	0	112.5	A109 E110 E114 Q115 M117 V122 W435 P436 A439	A109-F112 WeakPolarHBondContact O-CB 3.28Å; A109-F112 PolarHBondContact O-N 3.11Å; E110-F112 PolarHBondContact O-N 2.92Å; F112-E114 VanDerWaalsContact C-N 3.35Å; F112-Q115 PolarHBondContact O-N 2.86Å; F112-M117 HydrophobicContact CB-CE 3.44Å; F112-M117 VanDerWaalsContact CB-CE 3.44Å; F112-M117 HydrophobicContact CD1-CE 3.14Å; F112-M117 HydrophobicContact CE1-CE 4.07Å; F112-M117 HydrophobicContact CG-CE 3.51Å; F112-M117 WeakPolarHBondContact O-CB 3.34Å; F112-M117 PolarHBondContact O-N 3.2Å; F112-M117 VanDerWaalsContact O-N 3.11Å; F112-V122 HydrophobicContact CB-CG2 4.12Å; F112-W435 HydrophobicContact CE1-CB 3.69Å; F112-W435 HydrophobicContact CZ-CB 4.07Å; F112-W435 WeakPolarHBondContact CZ-O 3.13Å; F112-P436 HydrophobicContact CD2-CB 4.13Å; F112-P436 HydrophobicContact CD2-CG 4.05Å; F112-P436 HydrophobicContact CE2-CB 4.09Å; F112-P436 HydrophobicContact CE2-CG 4.24Å; F112-P436 HydrophobicContact CG-CG 4.25Å; F112-A439 HydrophobicContact CE2-CB 3.41Å; F112-A439 VanDerWaalsContact CE2-CB 3.41Å; F112-A439 HydrophobicContact CZ-CB 3.65Å
113	L	90	Very high	93.2	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-34.9	173.2	-61.9	178	0	0	0	111.6	R20 Q23 I27 A109 E110 Q115 Q116 P119 L517	R20-L113 PolarHBondContact NH1-O 2.71Å; Q23-L113 HydrophobicContact CB-CD1 4.23Å; I27-L113 HydrophobicContact CD1-CD1 3.73Å; A109-L113 PolarHBondContact O-N 2.88Å; E110-L113 WeakPolarHBondContact O-CB 3.42Å; E110-L113 PolarHBondContact O-N 2.89Å; L113-Q115 VanDerWaalsContact C-N 3.34Å; L113-Q116 PolarHBondContact O-N 2.9Å; L113-P119 HydrophobicContact CD2-CB 4.41Å; L113-P119 HydrophobicContact CD2-CG 3.89Å; L113-L517 HydrophobicContact CD1-CD2 3.99Å
114	E	90.1	Very high	93.1	Very high	124 Å²	124	45.9 Å²	45.9	58%	0.579	24%	0.235	S	C	*	.	H	α-helix	trans	-63.4	-40.9	171.7	-69.1	177.5	160.2	0	0	111.6	E110 H111 F112 Q116	E110-E114 WeakPolarHBondContact O-CG 3.12Å; E110-E114 PolarHBondContact O-N 3.04Å; H111-E114 PolarHBondContact O-N 3.31Å; F112-E114 VanDerWaalsContact C-N 3.35Å; E114-Q116 PolarHBondContact O-N 3.38Å
115	Q	90.3	Very high	93.1	Very high	104 Å²	104	44.4 Å²	44.4	49%	0.486	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	9.3	174.3	-70.5	-177.2	-5.9	0	0	114.6	H111 F112 L113 M117	H111-Q115 PolarHBondContact NE2-NE2 3.2Å; H111-Q115 WeakPolarHBondContact O-CG 3.5Å; H111-Q115 PolarHBondContact O-N 3.28Å; F112-Q115 PolarHBondContact O-N 2.86Å; L113-Q115 VanDerWaalsContact C-N 3.34Å; Q115-M117 PolarHBondContact O-N 3.35Å
116	Q	88.5	Confident	93.2	Very high	137 Å²	137	44.4 Å²	44.4	64%	0.64	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	18.4	178.3	-48.8	-77.7	-33.2	0	0	114.5	L113 E114	L113-Q116 PolarHBondContact O-N 2.9Å; E114-Q116 PolarHBondContact O-N 3.38Å
117	M	91.9	Very high	93.2	Very high	29 Å²	29	50.6 Å²	50.6	14%	0.143	25%	0.252	C	S	.	.			trans	-72.2	137.9	171.7	-74.6	-163	-86.8	0	0	111.1	F112 Q115 P436	F112-M117 HydrophobicContact CB-CE 3.44Å; F112-M117 VanDerWaalsContact CB-CE 3.44Å; F112-M117 HydrophobicContact CD1-CE 3.14Å; F112-M117 HydrophobicContact CE1-CE 4.07Å; F112-M117 HydrophobicContact CG-CE 3.51Å; F112-M117 WeakPolarHBondContact O-CB 3.34Å; F112-M117 PolarHBondContact O-N 3.2Å; F112-M117 VanDerWaalsContact O-N 3.11Å; Q115-M117 PolarHBondContact O-N 3.35Å; M117-P436 HydrophobicContact CE-CG 4.32Å
118	H	92.5	Very high	93.2	Very high	123 Å²	123	53.8 Å²	53.8	57%	0.569	26%	0.262	S	S	*	.			trans	-68.7	133.6	178	-164.9	-83.6	0	0	0	110.4	T120 V121	H118-T120 PolarHBondContact CE1-OG1 3.44Å; H118-T120 WeakPolarHBondContact ND1-CB 3.31Å; H118-T120 PolarHBondContact ND1-N 3.29Å; H118-T120 PolarHBondContact ND1-OG1 3.07Å; H118-T120 PolarHBondContact O-N 3.36Å; H118-V121 PolarHBondContact O-N 2.95Å
119	P	92.9	Very high	93.3	Very high	19 Å²	19	52.2 Å²	52.2	12%	0.123	25%	0.253	C	S	.	.	H	α-helix	trans	-51.9	-33.6	-178	-26.7	30.6	0	0	0	114.3	L113 V121 V122 I123	L113-P119 HydrophobicContact CD2-CB 4.41Å; L113-P119 HydrophobicContact CD2-CG 3.89Å; P119-V121 VanDerWaalsContact C-N 3.26Å; P119-V121 PolarHBondContact O-N 2.9Å; P119-V122 WeakPolarHBondContact O-CB 3.43Å; P119-V122 PolarHBondContact O-N 2.91Å; P119-V122 VanDerWaalsContact O-N 3.15Å; P119-I123 HydrophobicContact CB-CD1 4.47Å; P119-I123 WeakPolarHBondContact O-CB 3.35Å; P119-I123 VanDerWaalsContact O-CG1 3.25Å; P119-I123 WeakPolarHBondContact O-CG1 3.38Å; P119-I123 PolarHBondContact O-N 3.4Å
120	T	93.6	Very high	93.5	Very high	85 Å²	85	52.9 Å²	52.9	52%	0.521	26%	0.256	S	S	.	.	H	α-helix	trans	-55.6	-37.5	176.2	-49.6	0	0	0	0	113.5	H118 I123 S124	H118-T120 PolarHBondContact CE1-OG1 3.44Å; H118-T120 WeakPolarHBondContact ND1-CB 3.31Å; H118-T120 PolarHBondContact ND1-N 3.29Å; H118-T120 PolarHBondContact ND1-OG1 3.07Å; H118-T120 PolarHBondContact O-N 3.36Å; T120-I123 PolarHBondContact O-N 2.83Å; T120-S124 PolarHBondContact O-N 3.12Å; T120-S124 PolarHBondContact O-OG 3.06Å
121	V	94.5	Very high	93.7	Very high	44 Å²	44	56.3 Å²	56.3	27%	0.267	28%	0.276	S	S	.	.	H	α-helix	trans	-70.7	-39.9	179.4	-179.8	0	0	0	0	110.6	H118 P119 S124 A125 V432 E433	H118-V121 PolarHBondContact O-N 2.95Å; P119-V121 VanDerWaalsContact C-N 3.26Å; P119-V121 PolarHBondContact O-N 2.9Å; V121-S124 WeakPolarHBondContact CA-OG 3.47Å; V121-S124 PolarHBondContact O-N 3.33Å; V121-S124 PolarHBondContact O-OG 3.47Å; V121-A125 WeakPolarHBondContact O-CB 3.34Å; V121-A125 PolarHBondContact O-N 3.09Å; V121-A125 VanDerWaalsContact O-N 3.12Å; V121-V432 HydrophobicContact CG1-CG2 3.93Å; V121-E433 HydrophobicContact CG1-CB 4.46Å
122	V	95.2	Very high	93.8	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-46.2	174.3	-179.5	0	0	0	0	109.9	A109 F112 P119 S124 A125 Y126 P436 L517	A109-V122 HydrophobicContact CB-CG1 4.2Å; F112-V122 HydrophobicContact CB-CG2 4.12Å; P119-V122 WeakPolarHBondContact O-CB 3.43Å; P119-V122 PolarHBondContact O-N 2.91Å; P119-V122 VanDerWaalsContact O-N 3.15Å; V122-S124 PolarHBondContact O-N 3.33Å; V122-A125 PolarHBondContact O-N 3.17Å; V122-Y126 HydrophobicContact CG1-CD1 4.04Å; V122-Y126 HydrophobicContact CG1-CE1 3.72Å; V122-Y126 VanDerWaalsContact O-CD1 3.23Å; V122-Y126 WeakPolarHBondContact O-CD1 3.01Å; V122-Y126 PolarHBondContact O-N 2.89Å; V122-P436 HydrophobicContact CB-CB 4.5Å; V122-P436 HydrophobicContact CG1-CB 4.21Å; V122-P436 HydrophobicContact CG2-CB 4.5Å; V122-P436 HydrophobicContact CG2-CG 4.17Å; V122-L517 HydrophobicContact CG1-CD1 3.9Å
123	I	94.8	Very high	94	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.062	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-44.4	178.6	-71.2	165.1	0	0	0	111.7	P119 T120 A125 Y126 R127 V514 L517 R518	P119-I123 HydrophobicContact CB-CD1 4.47Å; P119-I123 WeakPolarHBondContact O-CB 3.35Å; P119-I123 VanDerWaalsContact O-CG1 3.25Å; P119-I123 WeakPolarHBondContact O-CG1 3.38Å; P119-I123 PolarHBondContact O-N 3.4Å; T120-I123 PolarHBondContact O-N 2.83Å; I123-A125 VanDerWaalsContact C-N 3.33Å; I123-Y126 PolarHBondContact O-N 3.47Å; I123-R127 WeakPolarHBondContact O-CG 3.34Å; I123-R127 PolarHBondContact O-N 3.44Å; I123-V514 HydrophobicContact CB-CG1 4.38Å; I123-V514 HydrophobicContact CB-CG2 4.49Å; I123-V514 HydrophobicContact CG1-CG1 4.16Å; I123-V514 HydrophobicContact CG1-CG2 4.43Å; I123-V514 HydrophobicContact CG2-CB 4.36Å; I123-V514 HydrophobicContact CG2-CG1 3.48Å; I123-V514 VanDerWaalsContact CG2-CG1 3.48Å; I123-V514 HydrophobicContact CG2-CG2 4.08Å; I123-L517 HydrophobicContact CD1-CB 4.23Å; I123-L517 HydrophobicContact CG1-CB 4.2Å; I123-R518 HydrophobicContact CD1-CB 4.29Å
124	S	94.8	Very high	94.3	Very high	44 Å²	44	53.3 Å²	53.3	31%	0.308	26%	0.263	S	S	.	.	H	α-helix	trans	-64.7	-39.6	178.6	57.8	0	0	0	0	111.8	T120 V121 V122 R127 K128	T120-S124 PolarHBondContact O-N 3.12Å; T120-S124 PolarHBondContact O-OG 3.06Å; V121-S124 WeakPolarHBondContact CA-OG 3.47Å; V121-S124 PolarHBondContact O-N 3.33Å; V121-S124 PolarHBondContact O-OG 3.47Å; V122-S124 PolarHBondContact O-N 3.33Å; S124-R127 PolarHBondContact O-N 2.81Å; S124-K128 WeakPolarHBondContact O-CG 3.23Å; S124-K128 PolarHBondContact O-N 3.33Å; S124-K128 VanDerWaalsContact O-N 3.1Å
125	A	95.6	Very high	94.5	Very high	2 Å²	2	49.5 Å²	49.5	2%	0.017	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-41.4	175.7	0	0	0	0	0	112.1	V121 V122 I123 K128 A129 E433 P436	V121-A125 WeakPolarHBondContact O-CB 3.34Å; V121-A125 PolarHBondContact O-N 3.09Å; V121-A125 VanDerWaalsContact O-N 3.12Å; V122-A125 PolarHBondContact O-N 3.17Å; I123-A125 VanDerWaalsContact C-N 3.33Å; A125-K128 PolarHBondContact O-N 3.16Å; A125-A129 WeakPolarHBondContact O-CB 3.47Å; A125-A129 PolarHBondContact O-N 3.47Å; A125-E433 HydrophobicContact CB-CB 4.11Å; A125-P436 HydrophobicContact CB-CB 3.82Å; A125-P436 HydrophobicContact CB-CG 4.47Å
126	Y	96.8	Very high	94.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-40.1	178.8	-82.4	31.1	0	0	0	111.7	M105 V108 V122 I123 A129 L130 P436 V440 A513 L517	M105-Y126 HydrophobicContact CB-CE2 4.03Å; M105-Y126 PolarHBondContact O-OH 2.96Å; V108-Y126 WeakPolarHBondContact CG1-OH 3.44Å; V122-Y126 HydrophobicContact CG1-CD1 4.04Å; V122-Y126 HydrophobicContact CG1-CE1 3.72Å; V122-Y126 VanDerWaalsContact O-CD1 3.23Å; V122-Y126 WeakPolarHBondContact O-CD1 3.01Å; V122-Y126 PolarHBondContact O-N 2.89Å; I123-Y126 PolarHBondContact O-N 3.47Å; Y126-A129 PolarHBondContact O-N 2.9Å; Y126-L130 PolarHBondContact O-N 2.97Å; Y126-P436 HydrophobicContact CD1-CB 4.37Å; Y126-P436 HydrophobicContact CE1-CB 4.06Å; Y126-V440 HydrophobicContact CD1-CG2 3.42Å; Y126-V440 VanDerWaalsContact CD1-CG2 3.42Å; Y126-V440 HydrophobicContact CD2-CG2 4.27Å; Y126-V440 HydrophobicContact CE1-CG2 3.43Å; Y126-V440 VanDerWaalsContact CE1-CG2 3.43Å; Y126-V440 HydrophobicContact CE2-CG2 4.29Å; Y126-V440 HydrophobicContact CG-CG2 3.86Å; Y126-A513 HydrophobicContact CD2-CB 4.31Å; Y126-A513 HydrophobicContact CE2-CB 4.28Å; Y126-L517 HydrophobicContact CE2-CD1 4.42Å
127	R	96.2	Very high	94.9	Very high	131 Å²	131	39.1 Å²	39.1	49%	0.494	20%	0.204	S	C	.	.	H	α-helix	trans	-63.6	-45.3	174.3	-74.1	178.5	173.4	-171.5	-7.7	112.3	I123 S124 A129 L130 D131 R518	I123-R127 WeakPolarHBondContact O-CG 3.34Å; I123-R127 PolarHBondContact O-N 3.44Å; S124-R127 PolarHBondContact O-N 2.81Å; R127-A129 VanDerWaalsContact C-N 3.3Å; R127-A129 PolarHBondContact O-N 2.99Å; R127-L130 WeakPolarHBondContact O-CB 3.45Å; R127-L130 PolarHBondContact O-N 2.95Å; R127-L130 VanDerWaalsContact O-N 3.13Å; R127-D131 PolarHBondContact O-N 3Å; R127-D131 VanDerWaalsContact O-N 3.15Å; R127-R518 VanDerWaalsContact NH2-NH2 3.18Å
128	K	95.3	Very high	94.9	Very high	91 Å²	91	43.7 Å²	43.7	40%	0.396	22%	0.223	S	C	.	.	H	α-helix	trans	-59.8	-41.9	174.3	-74.6	175.9	173.5	174.1	0	111.8	S124 A125 L130 D132 E433 Y437	S124-K128 WeakPolarHBondContact O-CG 3.23Å; S124-K128 PolarHBondContact O-N 3.33Å; S124-K128 VanDerWaalsContact O-N 3.1Å; A125-K128 PolarHBondContact O-N 3.16Å; K128-L130 VanDerWaalsContact C-N 3.32Å; K128-L130 PolarHBondContact O-N 3.35Å; K128-D132 PolarHBondContact O-N 3.47Å; K128-E433 IonicContact NZ-OE1 3.37Å; K128-E433 PolarHBondContact NZ-OE1 2.88Å; K128-E433 IonicContact NZ-OE2 3.02Å; K128-E433 PolarHBondContact NZ-OE2 3.38Å; K128-Y437 HydrophobicContact CB-CD2 4.49Å
129	A	96.2	Very high	94.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-41.4	174.8	0	0	0	0	0	111.3	A125 Y126 R127 D132 M133 Y437 V440	A125-A129 WeakPolarHBondContact O-CB 3.47Å; A125-A129 PolarHBondContact O-N 3.47Å; Y126-A129 PolarHBondContact O-N 2.9Å; R127-A129 VanDerWaalsContact C-N 3.3Å; R127-A129 PolarHBondContact O-N 2.99Å; A129-D132 WeakPolarHBondContact O-CB 3.27Å; A129-D132 PolarHBondContact O-N 2.94Å; A129-M133 HydrophobicContact CB-CE 4.4Å; A129-M133 WeakPolarHBondContact O-CG 3.43Å; A129-M133 PolarHBondContact O-N 2.92Å; A129-Y437 HydrophobicContact CB-CD2 3.73Å; A129-Y437 HydrophobicContact CB-CE2 3.86Å; A129-V440 HydrophobicContact CB-CB 4.16Å; A129-V440 HydrophobicContact CB-CG1 4.03Å; A129-V440 HydrophobicContact CB-CG2 4.24Å
130	L	96.7	Very high	94.8	Very high	14 Å²	14	46.7 Å²	46.7	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-45.6	178.6	178.3	63	0	0	0	113.5	Y126 R127 K128 D132 M133 I134 K507 V510	Y126-L130 PolarHBondContact O-N 2.97Å; R127-L130 WeakPolarHBondContact O-CB 3.45Å; R127-L130 PolarHBondContact O-N 2.95Å; R127-L130 VanDerWaalsContact O-N 3.13Å; K128-L130 VanDerWaalsContact C-N 3.32Å; K128-L130 PolarHBondContact O-N 3.35Å; L130-D132 PolarHBondContact O-N 2.84Å; L130-M133 VanDerWaalsContact CA-CE 3.48Å; L130-M133 HydrophobicContact CB-CE 4.11Å; L130-M133 HydrophobicContact CD1-CE 4.15Å; L130-M133 WeakPolarHBondContact O-CB 3.43Å; L130-M133 PolarHBondContact O-N 3.43Å; L130-I134 HydrophobicContact CD1-CD1 4.06Å; L130-I134 HydrophobicContact CD1-CG1 4.26Å; L130-I134 HydrophobicContact CG-CD1 4.03Å; L130-I134 WeakPolarHBondContact O-CG1 3.32Å; L130-I134 PolarHBondContact O-N 2.8Å; L130-K507 HydrophobicContact CD1-CG 4.16Å; L130-V510 HydrophobicContact CB-CB 4.39Å; L130-V510 HydrophobicContact CB-CG1 4.06Å; L130-V510 HydrophobicContact CB-CG2 4.33Å; L130-V510 HydrophobicContact CD1-CB 4.3Å; L130-V510 HydrophobicContact CD1-CG2 4.11Å; L130-V510 HydrophobicContact CD2-CB 4.17Å; L130-V510 HydrophobicContact CD2-CG1 4.18Å
131	D	96.4	Very high	94.7	Very high	108 Å²	108	43.6 Å²	43.6	58%	0.578	22%	0.215	S	C	*	.	H	α-helix	trans	-59.1	-41.2	177.4	-66.4	-32	0	0	0	110.9	R127 S135	R127-D131 PolarHBondContact O-N 3Å; R127-D131 VanDerWaalsContact O-N 3.15Å; D131-S135 PolarHBondContact O-N 3.42Å; D131-S135 VanDerWaalsContact O-N 3.12Å
132	D	96	Very high	94.5	Very high	24 Å²	24	44.3 Å²	44.3	13%	0.128	22%	0.217	C	C	.	.	H	α-helix	trans	-67.6	-42.8	176.8	-71.9	-22.4	0	0	0	112.4	K128 A129 L130 I134 S135 T136 L422 K425 Y437	K128-D132 PolarHBondContact O-N 3.47Å; A129-D132 WeakPolarHBondContact O-CB 3.27Å; A129-D132 PolarHBondContact O-N 2.94Å; L130-D132 PolarHBondContact O-N 2.84Å; D132-I134 VanDerWaalsContact C-N 3.34Å; D132-I134 PolarHBondContact O-N 3.49Å; D132-S135 PolarHBondContact O-N 3.04Å; D132-S135 VanDerWaalsContact O-N 3.16Å; D132-S135 PolarHBondContact O-OG 3.3Å; D132-T136 WeakPolarHBondContact O-CG2 3.36Å; D132-T136 PolarHBondContact O-N 2.94Å; D132-T136 PolarHBondContact O-OG1 3.17Å; D132-T136 VanDerWaalsContact O-OG1 3.08Å; D132-L422 HydrophobicContact CB-CD2 3.7Å; D132-K425 IonicContact OD1-NZ 3.98Å; D132-K425 PolarHBondContact OD1-NZ 2.75Å; D132-K425 WeakPolarHBondContact OD2-CD 3.31Å; D132-K425 WeakPolarHBondContact OD2-CE 3.47Å; D132-K425 IonicContact OD2-NZ 3.9Å; D132-K425 PolarHBondContact OD2-NZ 3.42Å; D132-Y437 PolarHBondContact OD2-OH 3.12Å
133	M	95.7	Very high	94.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58	-44.1	175.7	-72.7	-170.4	-80.1	0	0	112.1	A129 L130 S135 T136 L137 V418 L422 V440 L444 Y506 V510	A129-M133 HydrophobicContact CB-CE 4.4Å; A129-M133 WeakPolarHBondContact O-CG 3.43Å; A129-M133 PolarHBondContact O-N 2.92Å; L130-M133 VanDerWaalsContact CA-CE 3.48Å; L130-M133 HydrophobicContact CB-CE 4.11Å; L130-M133 HydrophobicContact CD1-CE 4.15Å; L130-M133 WeakPolarHBondContact O-CB 3.43Å; L130-M133 PolarHBondContact O-N 3.43Å; M133-S135 VanDerWaalsContact C-N 3.32Å; M133-S135 PolarHBondContact O-N 2.91Å; M133-T136 WeakPolarHBondContact CA-OG1 3.34Å; M133-T136 PolarHBondContact O-N 2.89Å; M133-T136 PolarHBondContact O-OG1 3.21Å; M133-L137 WeakPolarHBondContact O-CB 3.45Å; M133-L137 WeakPolarHBondContact O-CG 3.24Å; M133-L137 PolarHBondContact O-N 3.36Å; M133-V418 HydrophobicContact CB-CG1 3.99Å; M133-V418 HydrophobicContact CG-CG1 3.53Å; M133-V418 HydrophobicContact SD-CG1 4.31Å; M133-L422 HydrophobicContact CG-CD1 3.69Å; M133-L422 HydrophobicContact CG-CD2 4.32Å; M133-L422 HydrophobicContact CG-CG 4.34Å; M133-L422 HydrophobicContact SD-CD1 4.16Å; M133-V440 HydrophobicContact CE-CG1 3.78Å; M133-V440 HydrophobicContact SD-CG1 4.04Å; M133-L444 HydrophobicContact SD-CD1 3.84Å; M133-L444 HydrophobicContact SD-CD2 4.1Å; M133-L444 HydrophobicContact SD-CG 4.39Å; M133-Y506 HydrophobicContact CB-CD2 4.06Å; M133-Y506 HydrophobicContact SD-CD2 4.13Å; M133-V510 HydrophobicContact CE-CG2 3.49Å; M133-V510 VanDerWaalsContact CE-CG2 3.49Å
134	I	95.8	Very high	94	Very high	29 Å²	29	49.3 Å²	49.3	15%	0.149	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-41.2	177.5	-68.6	165.9	0	0	0	110.4	L130 D132 K138 L503 K507	L130-I134 HydrophobicContact CD1-CD1 4.06Å; L130-I134 HydrophobicContact CD1-CG1 4.26Å; L130-I134 HydrophobicContact CG-CD1 4.03Å; L130-I134 WeakPolarHBondContact O-CG1 3.32Å; L130-I134 PolarHBondContact O-N 2.8Å; D132-I134 VanDerWaalsContact C-N 3.34Å; D132-I134 PolarHBondContact O-N 3.49Å; I134-K138 HydrophobicContact CG2-CD 4.48Å; I134-K138 WeakPolarHBondContact O-CG 3.44Å; I134-K138 PolarHBondContact O-N 2.69Å; I134-L503 HydrophobicContact CB-CD2 4.19Å; I134-L503 HydrophobicContact CG1-CD2 4.09Å; I134-L503 HydrophobicContact CG2-CD2 3.88Å; I134-K507 HydrophobicContact CD1-CD 4.35Å; I134-K507 HydrophobicContact CD1-CG 3.89Å
135	S	95.3	Very high	93.6	Very high	44 Å²	44	51.4 Å²	51.4	31%	0.308	26%	0.258	S	S	.	.	H	α-helix	trans	-68.1	-37.1	-179.9	81.2	0	0	0	0	112.8	D131 D132 M133 K139	D131-S135 PolarHBondContact O-N 3.42Å; D131-S135 VanDerWaalsContact O-N 3.12Å; D132-S135 PolarHBondContact O-N 3.04Å; D132-S135 VanDerWaalsContact O-N 3.16Å; D132-S135 PolarHBondContact O-OG 3.3Å; M133-S135 VanDerWaalsContact C-N 3.32Å; M133-S135 PolarHBondContact O-N 2.91Å; S135-K139 WeakPolarHBondContact O-CG 3.34Å; S135-K139 PolarHBondContact O-N 2.89Å
136	T	93.5	Very high	93	Very high	23 Å²	23	53.1 Å²	53.1	14%	0.141	27%	0.266	C	S	.	.	H	α-helix	trans	-75	-40.6	179.3	50.7	0	0	0	0	111.2	D132 M133 K138 K139 I140 A421	D132-T136 WeakPolarHBondContact O-CG2 3.36Å; D132-T136 PolarHBondContact O-N 2.94Å; D132-T136 PolarHBondContact O-OG1 3.17Å; D132-T136 VanDerWaalsContact O-OG1 3.08Å; M133-T136 WeakPolarHBondContact CA-OG1 3.34Å; M133-T136 PolarHBondContact O-N 2.89Å; M133-T136 PolarHBondContact O-OG1 3.21Å; T136-K138 VanDerWaalsContact C-N 3.3Å; T136-K138 PolarHBondContact O-N 3.21Å; T136-K139 WeakPolarHBondContact O-CB 3.37Å; T136-K139 PolarHBondContact O-N 3.48Å; T136-I140 PolarHBondContact O-N 2.84Å; T136-I140 VanDerWaalsContact O-N 3.15Å; T136-A421 HydrophobicContact CG2-CB 3.75Å
137	L	93.2	Very high	92.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-56.4	-42.7	173.9	-81	-178.3	0	0	0	112.7	M133 K139 I140 S141 V408 V418 L499 K502 L503 Y506	M133-L137 WeakPolarHBondContact O-CB 3.45Å; M133-L137 WeakPolarHBondContact O-CG 3.24Å; M133-L137 PolarHBondContact O-N 3.36Å; L137-K139 PolarHBondContact O-N 2.9Å; L137-I140 HydrophobicContact CD2-CD1 3.96Å; L137-I140 VanDerWaalsContact O-CG1 3.24Å; L137-I140 WeakPolarHBondContact O-CG1 3.47Å; L137-I140 PolarHBondContact O-N 3.46Å; L137-S141 PolarHBondContact O-N 3.01Å; L137-V408 HydrophobicContact CD2-CG1 4.35Å; L137-V418 HydrophobicContact CD2-CG2 3.67Å; L137-V418 HydrophobicContact CG-CG2 3.89Å; L137-L499 HydrophobicContact CB-CD1 4Å; L137-K502 HydrophobicContact CD1-CB 4Å; L137-K502 HydrophobicContact CD2-CB 4.48Å; L137-L503 HydrophobicContact CB-CD2 4.18Å; L137-L503 HydrophobicContact CD1-CD2 3.89Å; L137-Y506 HydrophobicContact CD1-CD2 3.44Å; L137-Y506 VanDerWaalsContact CD1-CD2 3.44Å; L137-Y506 HydrophobicContact CD1-CE2 3.48Å; L137-Y506 VanDerWaalsContact CD1-CE2 3.48Å; L137-Y506 HydrophobicContact CD1-CG 4.33Å; L137-Y506 HydrophobicContact CD2-CE2 4.03Å; L137-Y506 HydrophobicContact CG-CD2 4.23Å; L137-Y506 HydrophobicContact CG-CE2 3.9Å
138	K	92.8	Very high	92	Very high	124 Å²	124	56 Å²	56	54%	0.539	29%	0.291	S	S	.	.	H	α-helix	trans	-68.1	-20.6	176.3	-71.8	178.4	179.3	-173.9	0	114	I134 T136 S141 L499	I134-K138 HydrophobicContact CG2-CD 4.48Å; I134-K138 WeakPolarHBondContact O-CG 3.44Å; I134-K138 PolarHBondContact O-N 2.69Å; T136-K138 VanDerWaalsContact C-N 3.3Å; T136-K138 PolarHBondContact O-N 3.21Å; K138-S141 PolarHBondContact O-OG 3.22Å; K138-L499 HydrophobicContact CG-CD2 4.32Å
139	K	91.3	Very high	91.4	Very high	167 Å²	167	54.2 Å²	54.2	73%	0.726	29%	0.29	S	S	*	.	H	α-helix	trans	-82.8	-34	176.9	-72.1	171.4	-176.4	178.4	0	112	S135 T136 L137 S141	S135-K139 WeakPolarHBondContact O-CG 3.34Å; S135-K139 PolarHBondContact O-N 2.89Å; T136-K139 WeakPolarHBondContact O-CB 3.37Å; T136-K139 PolarHBondContact O-N 3.48Å; L137-K139 PolarHBondContact O-N 2.9Å; K139-S141 VanDerWaalsContact C-N 3.33Å
140	I	90.3	Very high	91	Very high	39 Å²	39	59.8 Å²	59.8	20%	0.2	32%	0.32	C	S	.	.	H	α-helix	trans	-86.2	-5.9	178.5	65.8	170.5	0	0	0	112.9	T136 L137 V408 A417	T136-I140 PolarHBondContact O-N 2.84Å; T136-I140 VanDerWaalsContact O-N 3.15Å; L137-I140 HydrophobicContact CD2-CD1 3.96Å; L137-I140 VanDerWaalsContact O-CG1 3.24Å; L137-I140 WeakPolarHBondContact O-CG1 3.47Å; L137-I140 PolarHBondContact O-N 3.46Å; I140-V408 HydrophobicContact CD1-CG1 3.69Å; I140-V408 HydrophobicContact CG1-CG1 4.06Å; I140-A417 HydrophobicContact CD1-CB 4.2Å
141	S	91.9	Very high	90.4	Very high	19 Å²	19	63.7 Å²	63.7	13%	0.133	34%	0.339	C	S	.	.			trans	-75.8	144.2	-179.4	63.8	0	0	0	0	112.3	L137 K138 K139 Q406 L407	L137-S141 PolarHBondContact O-N 3.01Å; K138-S141 PolarHBondContact O-OG 3.22Å; K139-S141 VanDerWaalsContact C-N 3.33Å; S141-Q406 PolarHBondContact OG-OE1 2.85Å; S141-L407 CarbonylContact C-O 3.49Å; S141-L407 VanDerWaalsContact CA-O 3.23Å; S141-L407 WeakPolarHBondContact CA-O 3.28Å
142	I	90.3	Very high	89.9	Confident	60 Å²	60	58.6 Å²	58.6	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.4	-179.4	-57.6	176.1	0	0	0	108.5	Q406 L407 W496	I142-Q406 WeakPolarHBondContact O-CA 3.2Å; I142-L407 PolarHBondContact N-O 3.48Å; I142-L407 PolarHBondContact O-N 3.4Å; I142-W496 HydrophobicContact CD1-CH2 3.46Å; I142-W496 VanDerWaalsContact CD1-CH2 3.46Å; I142-W496 HydrophobicContact CD1-CZ2 4.47Å; I142-W496 HydrophobicContact CD1-CZ3 3.65Å
143	P	91.5	Very high	89.4	Confident	93 Å²	93	59.1 Å²	59.1	60%	0.604	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	146.5	175.8	27.4	-33.7	0	0	0	111.5	P405	P143-P405 WeakPolarHBondContact CA-O 3.23Å
144	V	88.1	Confident	89	Confident	24 Å²	24	62.8 Å²	62.8	15%	0.145	33%	0.334	C	S	.	.			trans	-123	146.5	177.7	171.6	0	0	0	0	111.6	I155 P405 L407	V144-I155 HydrophobicContact CG1-CD1 3.99Å; V144-P405 PolarHBondContact N-O 3.02Å; V144-P405 WeakPolarHBondContact O-CB 3.49Å; V144-L407 HydrophobicContact CG2-CB 4.22Å; V144-L407 HydrophobicContact CG2-CD1 3.4Å; V144-L407 VanDerWaalsContact CG2-CD1 3.4Å; V144-L407 HydrophobicContact CG2-CG 3.5Å; V144-L407 VanDerWaalsContact CG2-CG 3.5Å
145	D	86.8	Confident	88.4	Confident	88 Å²	88	61.7 Å²	61.7	47%	0.471	33%	0.328	S	S	.	.			trans	-82.5	122.9	170	-167	-8.7	0	0	0	110.5	N147 D148	D145-N147 VanDerWaalsContact C-N 3.29Å; D145-N147 PolarHBondContact OD1-N 3.37Å; D145-N147 PolarHBondContact OD1-ND2 3.09Å; D145-D148 HydrophobicContact CB-CB 4.46Å
146	I	83.3	Confident	88	Confident	37 Å²	37	59.6 Å²	59.6	19%	0.19	31%	0.314	C	S	.	.	S	Bend	trans	-74.5	-24.5	-178.1	-57.7	163.3	0	0	0	111	L402 P405	I146-L402 HydrophobicContact CG2-CD2 3.64Å; I146-L402 HydrophobicContact CG2-CG 4.12Å; I146-P405 HydrophobicContact CD1-CB 3.9Å; I146-P405 HydrophobicContact CD1-CG 4.12Å; I146-P405 HydrophobicContact CG1-CB 3.79Å
147	N	83.9	Confident	87.6	Confident	140 Å²	140	60.5 Å²	60.5	75%	0.749	32%	0.318	S	S	*	.	S	Bend	trans	-81.6	-18.7	-176	-61.9	-53.5	0	0	0	112.9	D145 S149	D145-N147 VanDerWaalsContact C-N 3.29Å; D145-N147 PolarHBondContact OD1-N 3.37Å; D145-N147 PolarHBondContact OD1-ND2 3.09Å; N147-S149 PolarHBondContact O-N 2.93Å
148	D	86.9	Confident	87.1	Confident	52 Å²	52	61.4 Å²	61.4	28%	0.278	32%	0.324	S	S	.	.			trans	-76.4	106.7	177.3	-168.8	-22.9	0	0	0	110.2	D145 D150 M151 M152	D145-D148 HydrophobicContact CB-CB 4.46Å; D148-D150 VanDerWaalsContact C-N 3.29Å; D148-D150 PolarHBondContact O-N 3.39Å; D148-D150 PolarHBondContact OD1-N 3.21Å; D148-M151 HydrophobicContact CB-CB 4.14Å; D148-M151 HydrophobicContact CB-CG 4.23Å; D148-M151 PolarHBondContact OD1-N 3.32Å; D148-M151 WeakPolarHBondContact OD2-CG 3.26Å; D148-M152 WeakPolarHBondContact O-CG 3.35Å; D148-M152 PolarHBondContact O-N 2.99Å; D148-M152 VanDerWaalsContact O-N 3.16Å
149	S	83.3	Confident	86.4	Confident	53 Å²	53	56 Å²	56	37%	0.371	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-35.1	179	49.9	0	0	0	0	112.6	N147 M152 L153	N147-S149 PolarHBondContact O-N 2.93Å; S149-M152 PolarHBondContact O-N 2.89Å; S149-L153 WeakPolarHBondContact O-CB 3.49Å; S149-L153 VanDerWaalsContact O-CG 3.26Å; S149-L153 WeakPolarHBondContact O-CG 3.32Å; S149-L153 PolarHBondContact O-N 3.18Å
150	D	87	Confident	85.9	Confident	118 Å²	118	48.1 Å²	48.1	63%	0.631	27%	0.268	S	S	*	.	H	α-helix	trans	-74.6	-40	-173.1	-67.4	-9.5	0	0	0	110.2	D148 L153 N154	D148-D150 VanDerWaalsContact C-N 3.29Å; D148-D150 PolarHBondContact O-N 3.39Å; D148-D150 PolarHBondContact OD1-N 3.21Å; D150-L153 PolarHBondContact O-N 3.16Å; D150-N154 PolarHBondContact O-N 3.41Å
151	M	84.5	Confident	85.3	Confident	95 Å²	95	48.9 Å²	48.9	47%	0.468	27%	0.274	S	S	.	.	H	α-helix	trans	-61.3	-45.6	170.3	-71.7	-162.7	-168.5	0	0	111.5	D148 L153 N154 I155	D148-M151 HydrophobicContact CB-CB 4.14Å; D148-M151 HydrophobicContact CB-CG 4.23Å; D148-M151 PolarHBondContact OD1-N 3.32Å; D148-M151 WeakPolarHBondContact OD2-CG 3.26Å; M151-L153 PolarHBondContact O-N 2.97Å; M151-N154 WeakPolarHBondContact O-CB 3.38Å; M151-N154 PolarHBondContact O-N 2.84Å; M151-N154 VanDerWaalsContact O-N 3.16Å; M151-I155 WeakPolarHBondContact O-CD1 3.48Å; M151-I155 VanDerWaalsContact O-CG1 3.24Å; M151-I155 WeakPolarHBondContact O-CG1 3.37Å; M151-I155 PolarHBondContact O-N 3.29Å
152	M	85.6	Confident	84.4	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-44.6	177.3	-74.8	-63.9	-65.9	0	0	112.1	D148 S149 N154 I155 I156 L177 C398 V401 L402	D148-M152 WeakPolarHBondContact O-CG 3.35Å; D148-M152 PolarHBondContact O-N 2.99Å; D148-M152 VanDerWaalsContact O-N 3.16Å; S149-M152 PolarHBondContact O-N 2.89Å; M152-N154 VanDerWaalsContact C-N 3.3Å; M152-N154 PolarHBondContact O-N 3.15Å; M152-I155 PolarHBondContact O-N 2.99Å; M152-I155 HydrophobicContact SD-CD1 4.22Å; M152-I156 WeakPolarHBondContact O-CD1 3.24Å; M152-I156 WeakPolarHBondContact O-CG1 3.22Å; M152-I156 PolarHBondContact O-N 3.48Å; M152-L177 HydrophobicContact CB-CD1 3.96Å; M152-L177 HydrophobicContact CB-CD2 4.35Å; M152-L177 HydrophobicContact CE-CD1 3.99Å; M152-L177 HydrophobicContact CG-CD1 4.41Å; M152-C398 HydrophobicContact CE-CB 4.48Å; M152-V401 HydrophobicContact CE-CB 4.31Å; M152-V401 HydrophobicContact CE-CG1 4.2Å; M152-V401 HydrophobicContact SD-CB 4.33Å; M152-V401 HydrophobicContact SD-CG1 3.6Å; M152-V401 VanDerWaalsContact SD-CG1 3.6Å; M152-L402 HydrophobicContact CE-CD1 4.49Å
153	L	86.9	Confident	83.7	Confident	34 Å²	34	48.5 Å²	48.5	18%	0.178	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-39.6	176	-71.3	174.9	0	0	0	111.7	S149 D150 M151 I155 I156 N157 C173 N174 L177	S149-L153 WeakPolarHBondContact O-CB 3.49Å; S149-L153 VanDerWaalsContact O-CG 3.26Å; S149-L153 WeakPolarHBondContact O-CG 3.32Å; S149-L153 PolarHBondContact O-N 3.18Å; D150-L153 PolarHBondContact O-N 3.16Å; M151-L153 PolarHBondContact O-N 2.97Å; L153-I155 PolarHBondContact O-N 3.5Å; L153-I156 PolarHBondContact O-N 3.13Å; L153-N157 WeakPolarHBondContact O-CB 3.43Å; L153-N157 VanDerWaalsContact O-CG 3.25Å; L153-N157 PolarHBondContact O-N 3.09Å; L153-N157 PolarHBondContact O-ND2 3.47Å; L153-C173 HydrophobicContact CD2-CB 3.65Å; L153-N174 VanDerWaalsContact CD2-OD1 3.26Å; L153-N174 WeakPolarHBondContact CD2-OD1 3.32Å; L153-L177 HydrophobicContact CD2-CD2 4.1Å; L153-L177 HydrophobicContact CG-CD2 4.28Å
154	N	85.7	Confident	82.6	Confident	77 Å²	77	45.6 Å²	45.6	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-63.6	-41.1	176.7	-162.5	18.6	0	0	0	112.2	D150 M151 M152 I156 N157 S158	D150-N154 PolarHBondContact O-N 3.41Å; M151-N154 WeakPolarHBondContact O-CB 3.38Å; M151-N154 PolarHBondContact O-N 2.84Å; M151-N154 VanDerWaalsContact O-N 3.16Å; M152-N154 VanDerWaalsContact C-N 3.3Å; M152-N154 PolarHBondContact O-N 3.15Å; N154-I156 PolarHBondContact O-N 2.98Å; N154-N157 WeakPolarHBondContact O-CB 3.33Å; N154-N157 PolarHBondContact O-N 3.41Å; N154-S158 PolarHBondContact O-N 3.37Å; N154-S158 VanDerWaalsContact O-N 3.08Å
155	I	84.9	Confident	81.9	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.036	25%	0.25	C	S	.	.	H	α-helix	trans	-63.6	-43.3	177	-61.7	159.2	0	0	0	111	V144 M151 M152 L153 S158 V397 V401 L407	V144-I155 HydrophobicContact CG1-CD1 3.99Å; M151-I155 WeakPolarHBondContact O-CD1 3.48Å; M151-I155 VanDerWaalsContact O-CG1 3.24Å; M151-I155 WeakPolarHBondContact O-CG1 3.37Å; M151-I155 PolarHBondContact O-N 3.29Å; M152-I155 PolarHBondContact O-N 2.99Å; M152-I155 HydrophobicContact SD-CD1 4.22Å; L153-I155 PolarHBondContact O-N 3.5Å; I155-S158 VanDerWaalsContact O-CB 3.29Å; I155-S158 WeakPolarHBondContact O-CB 3.41Å; I155-S158 PolarHBondContact O-N 3.37Å; I155-V397 HydrophobicContact CG2-CG1 4.09Å; I155-V401 HydrophobicContact CD1-CG1 4.24Å; I155-V401 HydrophobicContact CG2-CG2 3.98Å; I155-L407 HydrophobicContact CD1-CD1 3.61Å; I155-L407 HydrophobicContact CD1-CD2 4.31Å; I155-L407 HydrophobicContact CD1-CG 4.41Å; I155-L407 HydrophobicContact CG1-CD1 3.61Å; I155-L407 HydrophobicContact CG1-CD2 4.47Å; I155-L407 HydrophobicContact CG2-CD2 4.2Å
156	I	85.5	Confident	81.4	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-41.6	179	-56.6	160.4	0	0	0	110.2	M152 L153 N154 S158 S159 I160 C173 A176 L177 A394 C398	M152-I156 WeakPolarHBondContact O-CD1 3.24Å; M152-I156 WeakPolarHBondContact O-CG1 3.22Å; M152-I156 PolarHBondContact O-N 3.48Å; L153-I156 PolarHBondContact O-N 3.13Å; N154-I156 PolarHBondContact O-N 2.98Å; I156-S158 PolarHBondContact O-N 3.02Å; I156-S159 PolarHBondContact O-N 3.25Å; I156-S159 PolarHBondContact O-OG 3.11Å; I156-I160 HydrophobicContact CG2-CD1 3.86Å; I156-I160 HydrophobicContact CG2-CG1 4.37Å; I156-I160 PolarHBondContact O-N 3.16Å; I156-C173 HydrophobicContact CB-CB 4.18Å; I156-C173 HydrophobicContact CG2-CB 4.04Å; I156-C173 WeakPolarHBondContact CG2-SG 3.4Å; I156-A176 HydrophobicContact CG2-CB 4.4Å; I156-L177 HydrophobicContact CD1-CB 3.99Å; I156-L177 HydrophobicContact CD1-CD1 4.29Å; I156-A394 HydrophobicContact CG2-CB 3.73Å; I156-C398 WeakPolarHBondContact CD1-SG 2.92Å; I156-C398 WeakPolarHBondContact CG1-SG 3.29Å
157	N	85.1	Confident	81.3	Confident	42 Å²	42	50.5 Å²	50.5	23%	0.225	27%	0.271	C	S	.	.	H	α-helix	trans	-55.3	-40.7	176	-82.7	-40.9	0	0	0	111.5	L153 N154 S159 I160 T161 C173	L153-N157 WeakPolarHBondContact O-CB 3.43Å; L153-N157 VanDerWaalsContact O-CG 3.25Å; L153-N157 PolarHBondContact O-N 3.09Å; L153-N157 PolarHBondContact O-ND2 3.47Å; N154-N157 WeakPolarHBondContact O-CB 3.33Å; N154-N157 PolarHBondContact O-N 3.41Å; N157-S159 VanDerWaalsContact C-N 3.27Å; N157-S159 PolarHBondContact O-N 3.44Å; N157-I160 PolarHBondContact O-N 3.05Å; N157-I160 VanDerWaalsContact O-N 3.15Å; N157-T161 WeakPolarHBondContact O-CB 3.35Å; N157-T161 PolarHBondContact O-N 3.36Å; N157-T161 PolarHBondContact O-OG1 3Å; N157-C173 VanDerWaalsContact CG-SG 3.54Å; N157-C173 PolarHBondContact N-SG 3.41Å; N157-C173 VanDerWaalsContact N-SG 3.45Å; N157-C173 PolarHBondContact OD1-SG 2.87Å
158	S	82.7	Confident	81.3	Confident	19 Å²	19	47.9 Å²	47.9	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-52.4	-43	175.5	-173.9	0	0	0	0	112.4	N154 I155 I156 W496	N154-S158 PolarHBondContact O-N 3.37Å; N154-S158 VanDerWaalsContact O-N 3.08Å; I155-S158 VanDerWaalsContact O-CB 3.29Å; I155-S158 WeakPolarHBondContact O-CB 3.41Å; I155-S158 PolarHBondContact O-N 3.37Å; I156-S158 PolarHBondContact O-N 3.02Å; S158-W496 PolarHBondContact OG-O 3.04Å
159	S	79	Confident	81.1	Confident	11 Å²	11	46.7 Å²	46.7	8%	0.077	25%	0.247	C	C	.	.	H	α-helix	trans	-76	-26.3	-179.5	71	0	0	0	0	114.8	I156 N157 K163	I156-S159 PolarHBondContact O-N 3.25Å; I156-S159 PolarHBondContact O-OG 3.11Å; N157-S159 VanDerWaalsContact C-N 3.27Å; N157-S159 PolarHBondContact O-N 3.44Å; S159-K163 WeakPolarHBondContact O-CE 3.41Å
160	I	81.2	Confident	81.1	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-91.8	-28.4	-175.8	-60.8	-178	0	0	0	112.1	I156 N157 T162 K163 I165 A172 A394	I156-I160 HydrophobicContact CG2-CD1 3.86Å; I156-I160 HydrophobicContact CG2-CG1 4.37Å; I156-I160 PolarHBondContact O-N 3.16Å; N157-I160 PolarHBondContact O-N 3.05Å; N157-I160 VanDerWaalsContact O-N 3.15Å; I160-T162 PolarHBondContact O-N 3.38Å; I160-K163 PolarHBondContact O-N 2.92Å; I160-I165 HydrophobicContact CG2-CB 4.14Å; I160-I165 HydrophobicContact CG2-CG2 4.49Å; I160-A172 HydrophobicContact CD1-CB 3.77Å; I160-A394 HydrophobicContact CD1-CB 3.69Å; I160-A394 HydrophobicContact CG1-CB 3.92Å
161	T	76.3	Confident	81.2	Confident	55 Å²	55	44.1 Å²	44.1	34%	0.337	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.1	-171.1	-60.6	0	0	0	0	113.1	N157 K163	N157-T161 WeakPolarHBondContact O-CB 3.35Å; N157-T161 PolarHBondContact O-N 3.36Å; N157-T161 PolarHBondContact O-OG1 3Å; T161-K163 PolarHBondContact O-N 3.49Å
162	T	73.5	Confident	81.3	Confident	47 Å²	47	39.9 Å²	39.9	29%	0.288	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-5	179.6	62.1	0	0	0	0	114.5	P43 I160	P43-T162 HydrophobicContact CB-CG2 3.91Å; I160-T162 PolarHBondContact O-N 3.38Å
163	K	75.3	Confident	81.4	Confident	23 Å²	23	39.8 Å²	39.8	10%	0.1	22%	0.215	C	C	.	.	S	Bend	trans	-116	168.8	-168.1	-46.7	-168.9	-172.6	169.6	0	112.2	S159 I160 T161 I165 S166 N390 D393	S159-K163 WeakPolarHBondContact O-CE 3.41Å; I160-K163 PolarHBondContact O-N 2.92Å; T161-K163 PolarHBondContact O-N 3.49Å; K163-I165 PolarHBondContact O-N 3.44Å; K163-S166 WeakPolarHBondContact O-CB 3.42Å; K163-S166 PolarHBondContact O-N 3.45Å; K163-S166 PolarHBondContact O-OG 2.82Å; K163-N390 HydrophobicContact CD-CB 3.86Å; K163-N390 WeakPolarHBondContact CD-OD1 3.37Å; K163-D393 VanDerWaalsContact NZ-CB 3.32Å; K163-D393 IonicContact NZ-OD2 2.86Å; K163-D393 PolarHBondContact NZ-OD2 3.43Å
164	A	68.6	Low	81.6	Confident	33 Å²	33	41.9 Å²	41.9	27%	0.273	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-59.7	-18.4	-176.2	0	0	0	0	0	114.8	S166 E386	A164-S166 PolarHBondContact O-N 3.06Å; A164-E386 WeakPolarHBondContact CB-OE1 3.43Å
165	I	73.5	Confident	81.9	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.026	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-84.5	4.2	179.3	-46.5	169.4	0	0	0	111.8	I160 K163 R167 W168 S169 A172 V387 N390	I160-I165 HydrophobicContact CG2-CB 4.14Å; I160-I165 HydrophobicContact CG2-CG2 4.49Å; K163-I165 PolarHBondContact O-N 3.44Å; I165-R167 PolarHBondContact O-N 2.9Å; I165-W168 HydrophobicContact CG2-CB 4.16Å; I165-W168 CarbonylContact O-C 3.58Å; I165-W168 PolarHBondContact O-N 3.13Å; I165-S169 PolarHBondContact O-N 2.91Å; I165-A172 HydrophobicContact CG2-CB 3.99Å; I165-V387 HydrophobicContact CD1-CB 4.08Å; I165-V387 HydrophobicContact CD1-CG1 4.08Å; I165-V387 HydrophobicContact CD1-CG2 4.01Å; I165-V387 HydrophobicContact CG1-CG2 4.05Å; I165-N390 HydrophobicContact CD1-CB 3.3Å; I165-N390 VanDerWaalsContact CD1-ND2 3.31Å; I165-N390 WeakPolarHBondContact CD1-ND2 3.49Å; I165-N390 HydrophobicContact CG1-CB 4.35Å
166	S	76.2	Confident	82.2	Confident	53 Å²	53	38.3 Å²	38.3	37%	0.371	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-48.6	-34.6	176.9	58	0	0	0	0	113.3	K163 A164 W168 S169	K163-S166 WeakPolarHBondContact O-CB 3.42Å; K163-S166 PolarHBondContact O-N 3.45Å; K163-S166 PolarHBondContact O-OG 2.82Å; A164-S166 PolarHBondContact O-N 3.06Å; S166-W168 PolarHBondContact O-N 3.06Å; S166-S169 WeakPolarHBondContact O-CB 3.35Å; S166-S169 PolarHBondContact O-OG 2.95Å
167	R	81.4	Confident	82.4	Confident	194 Å²	194	38.7 Å²	38.7	73%	0.732	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-64.9	-30	175.2	-72.8	-178.2	-87.3	-177.1	-6.8	115	I165	I165-R167 PolarHBondContact O-N 2.9Å
168	W	83.9	Confident	82.7	Confident	84 Å²	84	40.3 Å²	40.3	32%	0.318	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-119.7	29.1	-179.8	-58.4	-76.6	0	0	0	111.7	I165 S166 S170 L171 A172 I209	I165-W168 HydrophobicContact CG2-CB 4.16Å; I165-W168 CarbonylContact O-C 3.58Å; I165-W168 PolarHBondContact O-N 3.13Å; S166-W168 PolarHBondContact O-N 3.06Å; W168-S170 VanDerWaalsContact C-N 3.31Å; W168-S170 PolarHBondContact O-N 3.31Å; W168-L171 PolarHBondContact O-N 3.19Å; W168-A172 PolarHBondContact O-N 3Å; W168-I209 HydrophobicContact CD2-CD1 3.98Å; W168-I209 HydrophobicContact CD2-CG2 3.79Å; W168-I209 VanDerWaalsContact CE2-CG2 3.49Å; W168-I209 HydrophobicContact CE3-CD1 3.83Å; W168-I209 HydrophobicContact CG-CD1 4.3Å; W168-I209 HydrophobicContact CG-CG2 3.88Å; W168-I209 HydrophobicContact CZ2-CG2 4.03Å; W168-I209 HydrophobicContact CZ3-CD1 4.32Å
169	S	81.9	Confident	83.2	Confident	27 Å²	27	39.4 Å²	39.4	19%	0.189	21%	0.211	C	C	.	.	H	α-helix	trans	-56.6	-42.1	-177.1	45	0	0	0	0	112.5	I165 S166 L171 A172 C173	I165-S169 PolarHBondContact O-N 2.91Å; S166-S169 WeakPolarHBondContact O-CB 3.35Å; S166-S169 PolarHBondContact O-OG 2.95Å; S169-L171 PolarHBondContact O-N 2.89Å; S169-A172 PolarHBondContact O-N 2.92Å; S169-C173 WeakPolarHBondContact O-CB 3.31Å; S169-C173 PolarHBondContact O-N 3.43Å; S169-C173 PolarHBondContact O-SG 3.49Å
170	S	85.2	Confident	83.7	Confident	79 Å²	79	38.9 Å²	38.9	55%	0.552	21%	0.207	S	C	*	.	H	α-helix	trans	-58.2	-47.3	178.2	54.9	0	0	0	0	112.8	W168 C173 N174	W168-S170 VanDerWaalsContact C-N 3.31Å; W168-S170 PolarHBondContact O-N 3.31Å; S170-C173 PolarHBondContact O-N 3.37Å; S170-N174 PolarHBondContact O-N 3.15Å; S170-N174 VanDerWaalsContact O-N 3.11Å; S170-N174 PolarHBondContact O-ND2 3.19Å
171	L	87.5	Confident	84.1	Confident	39 Å²	39	43 Å²	43	20%	0.204	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-44.2	178.5	-178.4	147.2	0	0	0	111.1	W168 S169 C173 N174 I175 E210	W168-L171 PolarHBondContact O-N 3.19Å; S169-L171 PolarHBondContact O-N 2.89Å; L171-C173 VanDerWaalsContact C-N 3.34Å; L171-C173 PolarHBondContact O-N 3.35Å; L171-N174 PolarHBondContact O-N 3.45Å; L171-I175 HydrophobicContact CD2-CD1 3.39Å; L171-I175 HydrophobicContact CD2-CG1 4.32Å; L171-I175 HydrophobicContact CG-CD1 4.12Å; L171-I175 VanDerWaalsContact O-CG1 3.3Å; L171-I175 WeakPolarHBondContact O-CG1 3.48Å; L171-I175 PolarHBondContact O-N 2.92Å; L171-E210 HydrophobicContact CD1-CB 4.46Å; L171-E210 HydrophobicContact CD1-CG 4.48Å
172	A	87.1	Confident	84.6	Confident	6 Å²	6	41.2 Å²	41.2	5%	0.05	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-40.1	178.2	0	0	0	0	0	112.4	I160 I165 W168 S169 I175 A176	I160-A172 HydrophobicContact CD1-CB 3.77Å; I165-A172 HydrophobicContact CG2-CB 3.99Å; W168-A172 PolarHBondContact O-N 3Å; S169-A172 PolarHBondContact O-N 2.92Å; A172-I175 PolarHBondContact O-N 3.45Å; A172-A176 WeakPolarHBondContact O-CB 3.18Å; A172-A176 PolarHBondContact O-N 3.34Å
173	C	88.1	Confident	85.3	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-44	177	-68.3	0	0	0	0	112.3	L153 I156 N157 S169 S170 L171 A176 L177	L153-C173 HydrophobicContact CD2-CB 3.65Å; I156-C173 HydrophobicContact CB-CB 4.18Å; I156-C173 HydrophobicContact CG2-CB 4.04Å; I156-C173 WeakPolarHBondContact CG2-SG 3.4Å; N157-C173 VanDerWaalsContact CG-SG 3.54Å; N157-C173 PolarHBondContact N-SG 3.41Å; N157-C173 VanDerWaalsContact N-SG 3.45Å; N157-C173 PolarHBondContact OD1-SG 2.87Å; S169-C173 WeakPolarHBondContact O-CB 3.31Å; S169-C173 PolarHBondContact O-N 3.43Å; S169-C173 PolarHBondContact O-SG 3.49Å; S170-C173 PolarHBondContact O-N 3.37Å; L171-C173 VanDerWaalsContact C-N 3.34Å; L171-C173 PolarHBondContact O-N 3.35Å; C173-A176 PolarHBondContact O-N 3.01Å; C173-L177 WeakPolarHBondContact O-CB 3.35Å; C173-L177 PolarHBondContact O-N 2.95Å
174	N	90.8	Very high	85.8	Confident	77 Å²	77	40.5 Å²	40.5	41%	0.412	21%	0.208	S	C	.	.	H	α-helix	trans	-61.2	-46.1	176	-73.1	-21.8	0	0	0	111.1	L153 S170 L171 A176 L177 D178	L153-N174 VanDerWaalsContact CD2-OD1 3.26Å; L153-N174 WeakPolarHBondContact CD2-OD1 3.32Å; S170-N174 PolarHBondContact O-N 3.15Å; S170-N174 VanDerWaalsContact O-N 3.11Å; S170-N174 PolarHBondContact O-ND2 3.19Å; L171-N174 PolarHBondContact O-N 3.45Å; N174-A176 PolarHBondContact O-N 3.28Å; N174-L177 PolarHBondContact O-N 2.88Å; N174-D178 VanDerWaalsContact O-CB 3.32Å; N174-D178 WeakPolarHBondContact O-CB 3.47Å; N174-D178 PolarHBondContact O-N 3.46Å
175	I	91.9	Very high	86.4	Confident	10 Å²	10	40.4 Å²	40.4	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-61.4	-44.7	177.8	-70.8	178.3	0	0	0	111.4	L171 A172 A179 V214 I374 L391	L171-I175 HydrophobicContact CD2-CD1 3.39Å; L171-I175 HydrophobicContact CD2-CG1 4.32Å; L171-I175 HydrophobicContact CG-CD1 4.12Å; L171-I175 VanDerWaalsContact O-CG1 3.3Å; L171-I175 WeakPolarHBondContact O-CG1 3.48Å; L171-I175 PolarHBondContact O-N 2.92Å; A172-I175 PolarHBondContact O-N 3.45Å; I175-A179 WeakPolarHBondContact O-CB 3.42Å; I175-A179 PolarHBondContact O-N 3.18Å; I175-V214 HydrophobicContact CB-CG2 3.99Å; I175-V214 HydrophobicContact CG1-CG2 4.19Å; I175-V214 HydrophobicContact CG2-CG2 3.57Å; I175-V214 WeakPolarHBondContact O-CG2 3.34Å; I175-I374 HydrophobicContact CG2-CD1 4.45Å; I175-I374 HydrophobicContact CG2-CG2 3.54Å; I175-L391 HydrophobicContact CG2-CD1 3.76Å; I175-L391 HydrophobicContact CG2-CD2 4.28Å; I175-L391 HydrophobicContact CG2-CG 4.4Å
176	A	91.3	Very high	86.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-45.8	178.9	0	0	0	0	0	111.7	I156 A172 C173 N174 A179 V180 A394 M395	I156-A176 HydrophobicContact CG2-CB 4.4Å; A172-A176 WeakPolarHBondContact O-CB 3.18Å; A172-A176 PolarHBondContact O-N 3.34Å; C173-A176 PolarHBondContact O-N 3.01Å; N174-A176 PolarHBondContact O-N 3.28Å; A176-A179 PolarHBondContact O-N 3Å; A176-V180 WeakPolarHBondContact O-CB 3.46Å; A176-V180 VanDerWaalsContact O-CG2 3.24Å; A176-V180 WeakPolarHBondContact O-CG2 3.26Å; A176-V180 PolarHBondContact O-N 3.39Å; A176-A394 HydrophobicContact CB-CB 3.95Å; A176-M395 HydrophobicContact CB-CG 3.93Å
177	L	90.7	Very high	86.7	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.037	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-47.1	179.6	-173.4	62.9	0	0	0	111.5	M152 L153 I156 C173 N174 V180 K181	M152-L177 HydrophobicContact CB-CD1 3.96Å; M152-L177 HydrophobicContact CB-CD2 4.35Å; M152-L177 HydrophobicContact CE-CD1 3.99Å; M152-L177 HydrophobicContact CG-CD1 4.41Å; L153-L177 HydrophobicContact CD2-CD2 4.1Å; L153-L177 HydrophobicContact CG-CD2 4.28Å; I156-L177 HydrophobicContact CD1-CB 3.99Å; I156-L177 HydrophobicContact CD1-CD1 4.29Å; C173-L177 WeakPolarHBondContact O-CB 3.35Å; C173-L177 PolarHBondContact O-N 2.95Å; N174-L177 PolarHBondContact O-N 2.88Å; L177-V180 PolarHBondContact O-N 2.91Å; L177-K181 HydrophobicContact CD1-CD 4.32Å; L177-K181 HydrophobicContact CD1-CG 4.47Å; L177-K181 HydrophobicContact CG-CD 4.19Å; L177-K181 WeakPolarHBondContact O-CB 3.37Å; L177-K181 WeakPolarHBondContact O-CG 3.37Å; L177-K181 PolarHBondContact O-N 3.45Å
178	D	91	Very high	86.2	Confident	76 Å²	76	46.5 Å²	46.5	41%	0.406	24%	0.238	S	C	.	.	H	α-helix	trans	-64	-43.3	179.1	-77.7	-12.6	0	0	0	111.6	N174 T182 V214	N174-D178 VanDerWaalsContact O-CB 3.32Å; N174-D178 WeakPolarHBondContact O-CB 3.47Å; N174-D178 PolarHBondContact O-N 3.46Å; D178-T182 WeakPolarHBondContact O-CB 3.35Å; D178-T182 PolarHBondContact O-N 3.19Å; D178-T182 PolarHBondContact O-OG1 2.89Å; D178-V214 HydrophobicContact CB-CB 4.39Å; D178-V214 HydrophobicContact CB-CG2 4.1Å
179	A	91.9	Very high	85.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-47.4	177.6	0	0	0	0	0	111.4	I175 A176 T182 V183 V214 I374 M395	I175-A179 WeakPolarHBondContact O-CB 3.42Å; I175-A179 PolarHBondContact O-N 3.18Å; A176-A179 PolarHBondContact O-N 3Å; A179-T182 WeakPolarHBondContact O-CB 3.47Å; A179-T182 PolarHBondContact O-N 2.93Å; A179-V183 WeakPolarHBondContact O-CG2 3.47Å; A179-V183 PolarHBondContact O-N 3.44Å; A179-V214 HydrophobicContact CB-CG1 4.45Å; A179-V214 HydrophobicContact CB-CG2 4.32Å; A179-I374 HydrophobicContact CB-CD1 3.68Å; A179-I374 HydrophobicContact CB-CG1 4.11Å; A179-M395 HydrophobicContact CB-SD 3.95Å
180	V	90.6	Very high	85.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.6	-41.8	-177.2	175.2	0	0	0	0	111.8	A176 L177 T182 V183 Q184 I193 I195 M395 C398 L402	A176-V180 WeakPolarHBondContact O-CB 3.46Å; A176-V180 VanDerWaalsContact O-CG2 3.24Å; A176-V180 WeakPolarHBondContact O-CG2 3.26Å; A176-V180 PolarHBondContact O-N 3.39Å; L177-V180 PolarHBondContact O-N 2.91Å; V180-T182 PolarHBondContact O-N 3.24Å; V180-V183 PolarHBondContact O-N 2.84Å; V180-Q184 PolarHBondContact O-N 2.82Å; V180-I193 HydrophobicContact CG1-CD1 4.24Å; V180-I193 HydrophobicContact CG1-CG2 4.06Å; V180-I195 HydrophobicContact CG2-CD1 4.23Å; V180-I195 HydrophobicContact CG2-CG1 4.44Å; V180-M395 HydrophobicContact CG2-CB 3.71Å; V180-M395 HydrophobicContact CG2-CG 3.87Å; V180-C398 HydrophobicContact CB-CB 4.08Å; V180-C398 HydrophobicContact CG1-CB 3.97Å; V180-C398 HydrophobicContact CG2-CB 3.9Å; V180-L402 HydrophobicContact CG1-CD1 3.37Å
181	K	88.6	Confident	85.1	Confident	87 Å²	87	53.1 Å²	53.1	38%	0.378	27%	0.274	S	S	.	.	H	α-helix	trans	-61.9	-34.3	172.5	-75.2	-178.6	176.1	179.7	0	112.1	L177	L177-K181 HydrophobicContact CD1-CD 4.32Å; L177-K181 HydrophobicContact CD1-CG 4.47Å; L177-K181 HydrophobicContact CG-CD 4.19Å; L177-K181 WeakPolarHBondContact O-CB 3.37Å; L177-K181 WeakPolarHBondContact O-CG 3.37Å; L177-K181 PolarHBondContact O-N 3.45Å
182	T	87.9	Confident	84.8	Confident	19 Å²	19	55.6 Å²	55.6	12%	0.117	28%	0.284	C	S	.	.	H	α-helix	trans	-70.9	-43.5	178.5	-60.3	0	0	0	0	111.7	D178 A179 V180 Q184 P369 C372	D178-T182 WeakPolarHBondContact O-CB 3.35Å; D178-T182 PolarHBondContact O-N 3.19Å; D178-T182 PolarHBondContact O-OG1 2.89Å; A179-T182 WeakPolarHBondContact O-CB 3.47Å; A179-T182 PolarHBondContact O-N 2.93Å; V180-T182 PolarHBondContact O-N 3.24Å; T182-Q184 VanDerWaalsContact C-N 3.28Å; T182-Q184 PolarHBondContact O-N 3.04Å; T182-P369 HydrophobicContact CG2-CB 3.9Å; T182-P369 HydrophobicContact CG2-CG 3.9Å; T182-P369 WeakPolarHBondContact CG2-O 3.38Å; T182-C372 HydrophobicContact CG2-CB 3.74Å
183	V	88.1	Confident	84.8	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-81.5	-4.4	179	-60.5	0	0	0	0	114.2	A179 V180 F185 I193 A199	A179-V183 WeakPolarHBondContact O-CG2 3.47Å; A179-V183 PolarHBondContact O-N 3.44Å; V180-V183 PolarHBondContact O-N 2.84Å; V183-F185 PolarHBondContact O-N 2.98Å; V183-I193 HydrophobicContact CG2-CG2 3.86Å; V183-A199 HydrophobicContact CG1-CB 4.07Å
184	Q	86.1	Confident	84.6	Confident	50 Å²	50	58.6 Å²	58.6	23%	0.234	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	127.9	177.6	179.8	-179.1	-14.2	0	0	110	V180 T182 E186	V180-Q184 PolarHBondContact O-N 2.82Å; T182-Q184 VanDerWaalsContact C-N 3.28Å; T182-Q184 PolarHBondContact O-N 3.04Å; Q184-E186 PolarHBondContact NE2-OE1 2.88Å
185	F	81.5	Confident	84.4	Confident	32 Å²	32	55.4 Å²	55.4	14%	0.14	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.5	177.9	-173.1	-113.9	0	0	0	110.2	V183 E187 K191 E192 R325 K370	V183-F185 PolarHBondContact O-N 2.98Å; F185-E187 HydrophobicContact CD1-CB 4.24Å; F185-E187 HydrophobicContact CD1-CG 4.39Å; F185-E187 HydrophobicContact CE1-CB 3.59Å; F185-E187 HydrophobicContact CE1-CG 3.32Å; F185-E187 WeakPolarHBondContact CE1-OE1 3.24Å; F185-E187 HydrophobicContact CZ-CB 4.16Å; F185-E187 VanDerWaalsContact CZ-CD 3.5Å; F185-E187 HydrophobicContact CZ-CG 3.46Å; F185-E187 VanDerWaalsContact CZ-CG 3.46Å; F185-E187 WeakPolarHBondContact CZ-OE1 3.26Å; F185-K191 WeakPolarHBondContact O-CA 3.46Å; F185-E192 PolarHBondContact N-O 2.95Å; F185-E192 PolarHBondContact O-N 3.27Å; F185-R325 VanDerWaalsContact CE2-NH2 3.31Å; F185-K370 HydrophobicContact CD2-CD 3.75Å; F185-K370 HydrophobicContact CD2-CG 4.26Å; F185-K370 HydrophobicContact CE2-CD 3.86Å; F185-K370 VanDerWaalsContact CE2-CE 3.47Å; F185-K370 VanDerWaalsContact CE2-NZ 3.35Å
186	E	79.7	Confident	84.1	Confident	110 Å²	110	63.2 Å²	63.2	51%	0.514	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	112.2	176.6	-54.5	-164.2	164.8	0	0	108.8	Q184 K191	Q184-E186 PolarHBondContact NE2-OE1 2.88Å; E186-K191 HydrophobicContact CG-CG 4.09Å; E186-K191 WeakPolarHBondContact OE1-CE 3.41Å; E186-K191 IonicContact OE1-NZ 3.3Å; E186-K191 PolarHBondContact OE1-NZ 3.24Å
187	E	75.7	Confident	83.8	Confident	102 Å²	102	69.4 Å²	69.4	48%	0.477	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.1	172.7	-117.1	-179.5	-145	0	0	108.5	F185 G189 R190	F185-E187 HydrophobicContact CD1-CB 4.24Å; F185-E187 HydrophobicContact CD1-CG 4.39Å; F185-E187 HydrophobicContact CE1-CB 3.59Å; F185-E187 HydrophobicContact CE1-CG 3.32Å; F185-E187 WeakPolarHBondContact CE1-OE1 3.24Å; F185-E187 HydrophobicContact CZ-CB 4.16Å; F185-E187 VanDerWaalsContact CZ-CD 3.5Å; F185-E187 HydrophobicContact CZ-CG 3.46Å; F185-E187 VanDerWaalsContact CZ-CG 3.46Å; F185-E187 WeakPolarHBondContact CZ-OE1 3.26Å; E187-G189 PolarHBondContact O-N 2.94Å; E187-G189 VanDerWaalsContact O-N 3.12Å; E187-R190 PolarHBondContact N-O 3.22Å; E187-R190 VanDerWaalsContact N-O 3.12Å; E187-R190 PolarHBondContact O-N 3.36Å
188	N	69.8	Low	83.7	Confident	167 Å²	167	72 Å²	72	89%	0.893	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	35.8	175.8	-56.3	-33.4	0	0	0	114.8	R190	N188-R190 VanDerWaalsContact C-N 3.25Å; N188-R190 PolarHBondContact O-N 3.41Å
189	G	72.4	Confident	83.7	Confident	81 Å²	81	68.7 Å²	68.7	84%	0.835	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	-1.4	179.7	0	0	0	0	0	115	E187	E187-G189 PolarHBondContact O-N 2.94Å; E187-G189 VanDerWaalsContact O-N 3.12Å
190	R	75.3	Confident	83.7	Confident	175 Å²	175	71 Å²	71	66%	0.66	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	125	170.1	-169.9	179	-178.3	178.9	-1.9	109.3	E187 N188 E192	E187-R190 PolarHBondContact N-O 3.22Å; E187-R190 VanDerWaalsContact N-O 3.12Å; E187-R190 PolarHBondContact O-N 3.36Å; N188-R190 VanDerWaalsContact C-N 3.25Å; N188-R190 PolarHBondContact O-N 3.41Å; R190-E192 HydrophobicContact CG-CG 4.27Å; R190-E192 IonicContact CZ-OE1 2.77Å; R190-E192 IonicContact NE-OE1 3.04Å; R190-E192 IonicContact NH1-OE1 3.47Å
191	K	80.8	Confident	83.8	Confident	73 Å²	73	71.7 Å²	71.7	32%	0.317	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	121.1	171	-54.8	-169.9	-178.6	-166	0	108.4	F185 E186 L403	F185-K191 WeakPolarHBondContact O-CA 3.46Å; E186-K191 HydrophobicContact CG-CG 4.09Å; E186-K191 WeakPolarHBondContact OE1-CE 3.41Å; E186-K191 IonicContact OE1-NZ 3.3Å; E186-K191 PolarHBondContact OE1-NZ 3.24Å; K191-L403 HydrophobicContact CB-CD2 4.38Å; K191-L403 VanDerWaalsContact O-CD2 3.27Å; K191-L403 WeakPolarHBondContact O-CD2 3.32Å
192	E	82.6	Confident	84	Confident	91 Å²	91	69 Å²	69	43%	0.425	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	133.3	172.1	-67.4	-168.1	168.6	0	0	109.1	F185 R190	F185-E192 PolarHBondContact N-O 2.95Å; F185-E192 PolarHBondContact O-N 3.27Å; R190-E192 HydrophobicContact CG-CG 4.27Å; R190-E192 IonicContact CZ-OE1 2.77Å; R190-E192 IonicContact NE-OE1 3.04Å; R190-E192 IonicContact NH1-OE1 3.47Å
193	I	85.5	Confident	84.2	Confident	5 Å²	5	72.3 Å²	72.3	3%	0.026	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	101.7	-175.9	-52.9	-178.8	0	0	0	107.5	V180 V183 I195 R399 L402	V180-I193 HydrophobicContact CG1-CD1 4.24Å; V180-I193 HydrophobicContact CG1-CG2 4.06Å; V183-I193 HydrophobicContact CG2-CG2 3.86Å; I193-I195 HydrophobicContact CG2-CG1 3.96Å; I193-R399 HydrophobicContact CB-CG 4.07Å; I193-R399 HydrophobicContact CD1-CG 4.47Å; I193-R399 HydrophobicContact CG2-CB 4.27Å; I193-R399 HydrophobicContact CG2-CG 4.24Å; I193-R399 WeakPolarHBondContact O-CD 3.41Å; I193-R399 PolarHBondContact O-NE 3.12Å; I193-R399 VanDerWaalsContact O-NE 3.09Å; I193-L402 HydrophobicContact CD1-CB 3.77Å; I193-L402 HydrophobicContact CD1-CD1 4.13Å; I193-L402 HydrophobicContact CD1-CG 4.41Å
194	D	85.1	Confident	84.4	Confident	65 Å²	65	72.7 Å²	72.7	35%	0.348	35%	0.354	S	S	.	.			trans	-102.5	76.5	-178.4	-102	15.1	0	0	0	110.3	K196 K197 Y198	D194-K196 PolarHBondContact O-N 3.4Å; D194-K197 IonicContact OD2-NZ 3.75Å; D194-K197 PolarHBondContact OD2-NZ 3.49Å; D194-Y198 HydrophobicContact CB-CD2 3.55Å; D194-Y198 HydrophobicContact CB-CE2 3.7Å; D194-Y198 WeakPolarHBondContact O-CD2 3.18Å; D194-Y198 PolarHBondContact O-N 3.35Å
195	I	86.5	Confident	84.6	Confident	9 Å²	9	73.1 Å²	73.1	5%	0.046	36%	0.361	C	S	.	.	H	α-helix	trans	-58.7	-47.6	-177.8	-60.2	163.7	0	0	0	110.8	V180 I193 K197 Y198 A199 M395 Q396 R399	V180-I195 HydrophobicContact CG2-CD1 4.23Å; V180-I195 HydrophobicContact CG2-CG1 4.44Å; I193-I195 HydrophobicContact CG2-CG1 3.96Å; I195-K197 VanDerWaalsContact C-N 3.27Å; I195-K197 PolarHBondContact O-N 3.08Å; I195-K197 VanDerWaalsContact O-N 3.16Å; I195-Y198 PolarHBondContact O-N 3.27Å; I195-A199 HydrophobicContact CG2-CB 3.96Å; I195-A199 WeakPolarHBondContact O-CA 3.34Å; I195-A199 WeakPolarHBondContact O-CB 3.4Å; I195-A199 PolarHBondContact O-N 3.45Å; I195-M395 HydrophobicContact CD1-CB 3.84Å; I195-M395 VanDerWaalsContact CD1-O 3.27Å; I195-M395 WeakPolarHBondContact CD1-O 3.45Å; I195-M395 HydrophobicContact CG2-CB 4.07Å; I195-M395 HydrophobicContact CG2-CE 3.71Å; I195-M395 HydrophobicContact CG2-SD 3.87Å; I195-Q396 HydrophobicContact CD1-CG 4.44Å; I195-R399 HydrophobicContact CD1-CB 3.69Å; I195-R399 HydrophobicContact CD1-CG 4.36Å
196	K	84.4	Confident	84.8	Confident	174 Å²	174	73 Å²	73	76%	0.757	37%	0.369	S	S	*	.	H	α-helix	trans	-58.6	-33.1	-172.8	-172.9	173.3	-177.1	172.1	0	114.3	D194	D194-K196 PolarHBondContact O-N 3.4Å
197	K	85.6	Confident	85.1	Confident	131 Å²	131	69.9 Å²	69.9	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-94.2	-37.8	-177.3	-66.4	177.1	-165.6	146.9	0	112.3	D194 I195 R322	D194-K197 IonicContact OD2-NZ 3.75Å; D194-K197 PolarHBondContact OD2-NZ 3.49Å; I195-K197 VanDerWaalsContact C-N 3.27Å; I195-K197 PolarHBondContact O-N 3.08Å; I195-K197 VanDerWaalsContact O-N 3.16Å; K197-R322 WeakPolarHBondContact O-CD 3.39Å; K197-R322 WeakPolarHBondContact O-CG 3.06Å
198	Y	89.4	Confident	85.7	Confident	60 Å²	60	70 Å²	70	24%	0.235	37%	0.369	C	S	.	.	H	α-helix	trans	-104.5	-28.8	-166.9	-61.2	-61.7	0	0	0	113.8	D194 I195 R322 R325 A371 C372	D194-Y198 HydrophobicContact CB-CD2 3.55Å; D194-Y198 HydrophobicContact CB-CE2 3.7Å; D194-Y198 WeakPolarHBondContact O-CD2 3.18Å; D194-Y198 PolarHBondContact O-N 3.35Å; I195-Y198 PolarHBondContact O-N 3.27Å; Y198-R322 HydrophobicContact CD1-CG 4.34Å; Y198-R322 PolarHBondContact O-NE 3.35Å; Y198-R322 PolarHBondContact O-NH2 2.97Å; Y198-R325 HydrophobicContact CD1-CB 4.42Å; Y198-R325 HydrophobicContact CD1-CG 4.23Å; Y198-R325 HydrophobicContact CE1-CB 4.11Å; Y198-R325 HydrophobicContact CE1-CG 3.89Å; Y198-A371 HydrophobicContact CD1-CB 4.14Å; Y198-C372 PolarHBondContact O-N 2.86Å; Y198-C372 VanDerWaalsContact O-N 3.11Å
199	A	90.8	Very high	86.5	Confident	8 Å²	8	63 Å²	63	7%	0.066	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	90.8	172	0	0	0	0	0	110.4	V183 I195 C372 M395	V183-A199 HydrophobicContact CG1-CB 4.07Å; I195-A199 HydrophobicContact CG2-CB 3.96Å; I195-A199 WeakPolarHBondContact O-CA 3.34Å; I195-A199 WeakPolarHBondContact O-CB 3.4Å; I195-A199 PolarHBondContact O-N 3.45Å; A199-C372 WeakPolarHBondContact CA-O 3.26Å; A199-M395 HydrophobicContact CB-SD 4.31Å
200	K	91.5	Very high	87.3	Confident	47 Å²	47	65.3 Å²	65.3	20%	0.204	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.3	176.2	-173.5	-173.1	178.5	-164.4	0	109.5	E202 D319 R322 C372 T373 I374	K200-E202 WeakPolarHBondContact CE-OE2 3.3Å; K200-E202 IonicContact NZ-OE2 2.7Å; K200-E202 PolarHBondContact NZ-OE2 2.87Å; K200-D319 WeakPolarHBondContact CD-OD1 3.5Å; K200-D319 IonicContact NZ-OD1 2.58Å; K200-D319 PolarHBondContact NZ-OD1 3.17Å; K200-D319 IonicContact NZ-OD2 3.44Å; K200-D319 PolarHBondContact NZ-OD2 3.11Å; K200-R322 VanDerWaalsContact CB-NH2 3.33Å; K200-C372 PolarHBondContact N-O 3.34Å; K200-T373 CarbonylContact O-C 3.6Å; K200-T373 WeakPolarHBondContact O-CA 3.44Å; K200-I374 PolarHBondContact O-N 2.86Å
201	V	93	Very high	87.9	Confident	16 Å²	16	61 Å²	61	10%	0.097	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120.1	171.1	-176.1	0	0	0	0	108.8	K203 I374 L376 E388	V201-K203 HydrophobicContact CG1-CG 4.29Å; V201-I374 CarbonylContact C-O 3.59Å; V201-I374 WeakPolarHBondContact CA-O 3.43Å; V201-I374 HydrophobicContact CG2-CB 4.3Å; V201-I374 HydrophobicContact CG2-CD1 4.24Å; V201-L376 HydrophobicContact CG1-CB 4.46Å; V201-L376 HydrophobicContact CG1-CD1 3.27Å; V201-L376 HydrophobicContact CG1-CG 3.67Å; V201-E388 HydrophobicContact CB-CG 4.1Å; V201-E388 HydrophobicContact CG1-CB 4.21Å; V201-E388 HydrophobicContact CG1-CG 3.97Å; V201-E388 HydrophobicContact CG2-CG 4.26Å
202	E	92.1	Very high	88.4	Confident	31 Å²	31	58 Å²	58	15%	0.145	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	112.7	174.6	-161.7	71.2	-147.6	0	0	108.6	K200 I204 M219 T373 I374 L376	K200-E202 WeakPolarHBondContact CE-OE2 3.3Å; K200-E202 IonicContact NZ-OE2 2.7Å; K200-E202 PolarHBondContact NZ-OE2 2.87Å; E202-I204 HydrophobicContact CG-CG1 4.42Å; E202-M219 HydrophobicContact CB-SD 4.38Å; E202-M219 HydrophobicContact CG-SD 4.24Å; E202-T373 HydrophobicContact CB-CG2 3.85Å; E202-I374 PolarHBondContact N-O 3.32Å; E202-L376 PolarHBondContact O-N 3.28Å
203	K	92.5	Very high	88.8	Confident	88 Å²	88	56 Å²	56	38%	0.383	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	112.5	-176.5	-65.9	177.5	-69.3	-163.8	0	109.9	V201 L384 E388	V201-K203 HydrophobicContact CG1-CG 4.29Å; K203-L384 HydrophobicContact CB-CB 4.41Å; K203-L384 HydrophobicContact CB-CD1 4.39Å; K203-L384 HydrophobicContact CD-CB 4.17Å; K203-L384 HydrophobicContact CG-CB 4.31Å; K203-E388 HydrophobicContact CD-CB 4.3Å; K203-E388 VanDerWaalsContact CD-OE2 3.25Å; K203-E388 WeakPolarHBondContact CD-OE2 3.18Å; K203-E388 WeakPolarHBondContact CE-OE2 3.34Å; K203-E388 IonicContact NZ-OE2 2.7Å; K203-E388 PolarHBondContact NZ-OE2 3.39Å
204	I	91.7	Very high	89.2	Confident	11 Å²	11	57.2 Å²	57.2	6%	0.056	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	114	177.9	-46.4	-176.1	0	0	0	109.1	E202 M219 I355 F360 L375 L376 R377	E202-I204 HydrophobicContact CG-CG1 4.42Å; I204-M219 HydrophobicContact CD1-CE 3.53Å; I204-I355 HydrophobicContact CD1-CD1 4.41Å; I204-I355 HydrophobicContact CD1-CG2 4.38Å; I204-I355 HydrophobicContact CG2-CG2 4.11Å; I204-F360 HydrophobicContact CD1-CD1 4.47Å; I204-F360 HydrophobicContact CD1-CD2 4.31Å; I204-F360 HydrophobicContact CD1-CE1 3.9Å; I204-F360 HydrophobicContact CD1-CE2 3.74Å; I204-F360 HydrophobicContact CD1-CZ 3.52Å; I204-F360 HydrophobicContact CG1-CZ 4.17Å; I204-L375 HydrophobicContact CB-CD1 4.44Å; I204-L375 HydrophobicContact CD1-CD1 3.43Å; I204-L375 VanDerWaalsContact CD1-CD1 3.43Å; I204-L375 HydrophobicContact CG1-CD1 3.75Å; I204-L376 PolarHBondContact N-O 3.42Å; I204-R377 PolarHBondContact O-NH1 3.31Å
205	P	90.9	Very high	89.5	Confident	60 Å²	60	55.5 Å²	55.5	39%	0.39	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	153.2	178.8	29.2	-34.8	0	0	0	111.7	R377 K381	P205-R377 PolarHBondContact O-NH1 3.4Å; P205-K381 HydrophobicContact CB-CG 4.32Å; P205-K381 HydrophobicContact CG-CG 4.49Å
206	G	86.7	Confident	89.7	Confident	30 Å²	30	62.7 Å²	62.7	31%	0.309	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	88.8	171.9	-174.4	0	0	0	0	0	113.4	R377 G378	G206-R377 PolarHBondContact O-NE 2.98Å; G206-R377 PolarHBondContact O-NH1 3.44Å; G206-R377 PolarHBondContact O-NH2 2.61Å; G206-G378 PolarHBondContact N-O 3.34Å; G206-G378 PolarHBondContact O-N 3.06Å
207	G	85.9	Confident	90	Very high	43 Å²	43	54.4 Å²	54.4	44%	0.443	28%	0.283	S	S	.	.	S	Bend	trans	76.7	-171.2	-171.6	0	0	0	0	0	113
208	I	87.9	Confident	90.3	Very high	104 Å²	104	48.1 Å²	48.1	53%	0.533	26%	0.255	S	S	.	.			trans	-103	151.5	176.4	-54.4	172.5	0	0	0	107.8	E210 D211 R377	I208-E210 HydrophobicContact CG2-CB 4.14Å; I208-E210 HydrophobicContact CG2-CG 4.33Å; I208-E210 PolarHBondContact O-N 2.77Å; I208-D211 PolarHBondContact N-OD2 3.31Å; I208-D211 VanDerWaalsContact O-CB 3.31Å; I208-D211 WeakPolarHBondContact O-CB 3.23Å; I208-D211 PolarHBondContact O-N 3.41Å; I208-R377 WeakPolarHBondContact O-CB 3.49Å
209	I	86.3	Confident	90.5	Very high	20 Å²	20	45.3 Å²	45.3	10%	0.103	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-61.3	-27.7	178.3	-164.6	167.5	0	0	0	112.8	W168 D211 S212 R377 V387	W168-I209 HydrophobicContact CD2-CD1 3.98Å; W168-I209 HydrophobicContact CD2-CG2 3.79Å; W168-I209 VanDerWaalsContact CE2-CG2 3.49Å; W168-I209 HydrophobicContact CE3-CD1 3.83Å; W168-I209 HydrophobicContact CG-CD1 4.3Å; W168-I209 HydrophobicContact CG-CG2 3.88Å; W168-I209 HydrophobicContact CZ2-CG2 4.03Å; W168-I209 HydrophobicContact CZ3-CD1 4.32Å; I209-D211 PolarHBondContact O-N 3.27Å; I209-S212 WeakPolarHBondContact O-CB 3.49Å; I209-S212 PolarHBondContact O-N 3.03Å; I209-S212 PolarHBondContact O-OG 3.4Å; I209-R377 WeakPolarHBondContact CA-O 3.31Å; I209-V387 HydrophobicContact CD1-CG2 4.18Å
210	E	88.1	Confident	90.6	Very high	131 Å²	131	45.1 Å²	45.1	61%	0.612	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-65.3	-20.1	174.9	-67.3	173.3	-173.8	0	0	113.4	L171 I208 S212	L171-E210 HydrophobicContact CD1-CB 4.46Å; L171-E210 HydrophobicContact CD1-CG 4.48Å; I208-E210 HydrophobicContact CG2-CB 4.14Å; I208-E210 HydrophobicContact CG2-CG 4.33Å; I208-E210 PolarHBondContact O-N 2.77Å; E210-S212 PolarHBondContact O-N 2.97Å
211	D	89.4	Confident	90.7	Very high	85 Å²	85	45.7 Å²	45.7	46%	0.455	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-74.8	-6.1	173.5	-57.5	-32.5	0	0	0	112.3	I208 I209 R377	I208-D211 PolarHBondContact N-OD2 3.31Å; I208-D211 VanDerWaalsContact O-CB 3.31Å; I208-D211 WeakPolarHBondContact O-CB 3.23Å; I208-D211 PolarHBondContact O-N 3.41Å; I209-D211 PolarHBondContact O-N 3.27Å; D211-R377 HydrophobicContact CB-CB 4.06Å; D211-R377 HydrophobicContact CB-CG 3.95Å
212	S	91.4	Very high	90.7	Very high	8 Å²	8	48.9 Å²	48.9	6%	0.056	26%	0.26	C	S	.	.			trans	-72	132.4	178.6	-54.2	0	0	0	0	110.6	I209 E210 L375 R377	I209-S212 WeakPolarHBondContact O-CB 3.49Å; I209-S212 PolarHBondContact O-N 3.03Å; I209-S212 PolarHBondContact O-OG 3.4Å; E210-S212 PolarHBondContact O-N 2.97Å; S212-L375 CarbonylContact C-O 3.33Å; S212-L375 WeakPolarHBondContact CA-O 3.48Å; S212-L375 VanDerWaalsContact CB-O 3.28Å; S212-L375 WeakPolarHBondContact CB-O 3.19Å; S212-R377 PolarHBondContact OG-N 3.32Å; S212-R377 PolarHBondContact OG-O 3.34Å
213	C	91.1	Very high	90.8	Very high	51 Å²	51	49.8 Å²	49.8	35%	0.345	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	156.5	-174.6	53.7	0	0	0	0	112.5	L375	C213-L375 PolarHBondContact N-O 3.22Å; C213-L375 PolarHBondContact O-N 3.02Å
214	V	93.2	Very high	90.8	Very high	29 Å²	29	46.2 Å²	46.2	18%	0.176	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119.6	168.9	-178	0	0	0	0	108.8	I175 D178 A179 C372 I374	I175-V214 HydrophobicContact CB-CG2 3.99Å; I175-V214 HydrophobicContact CG1-CG2 4.19Å; I175-V214 HydrophobicContact CG2-CG2 3.57Å; I175-V214 WeakPolarHBondContact O-CG2 3.34Å; D178-V214 HydrophobicContact CB-CB 4.39Å; D178-V214 HydrophobicContact CB-CG2 4.1Å; A179-V214 HydrophobicContact CB-CG1 4.45Å; A179-V214 HydrophobicContact CB-CG2 4.32Å; V214-C372 HydrophobicContact CG1-CB 4.15Å; V214-I374 HydrophobicContact CG2-CG1 4.48Å
215	L	91.8	Very high	90.7	Very high	29 Å²	29	46.7 Å²	46.7	15%	0.152	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	120.8	171.8	-60.3	168.9	0	0	0	108.7	G217 M219 F362 C372 T373 L375	L215-G217 PolarHBondContact O-N 3.33Å; L215-M219 HydrophobicContact CD1-CB 4.29Å; L215-M219 HydrophobicContact CD1-SD 4.14Å; L215-F362 HydrophobicContact CD1-CD1 3.84Å; L215-F362 HydrophobicContact CD1-CE1 3.74Å; L215-C372 WeakPolarHBondContact O-CA 3.18Å; L215-C372 WeakPolarHBondContact O-CB 3.38Å; L215-T373 WeakPolarHBondContact CB-O 3.36Å; L215-T373 PolarHBondContact N-O 2.89Å; L215-T373 PolarHBondContact O-N 2.96Å; L215-L375 HydrophobicContact CD1-CB 4.27Å
216	R	90.3	Very high	90.7	Very high	160 Å²	160	46.5 Å²	46.5	60%	0.604	25%	0.248	S	C	*	.	S	Bend	trans	-73.1	74.1	171.3	-67.1	-174.9	-178.8	-168.9	1	110.3	E365 P369	R216-E365 PolarHBondContact O-N 2.88Å; R216-P369 HydrophobicContact CB-CB 4.23Å; R216-P369 HydrophobicContact CB-CG 4.17Å
217	G	89.6	Confident	90.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	154.7	-156	-177	0	0	0	0	0	112.1	L215 I363 C372 T373	L215-G217 PolarHBondContact O-N 3.33Å; G217-I363 CarbonylContact C-O 3.59Å; G217-I363 VanDerWaalsContact CA-O 3.23Å; G217-I363 WeakPolarHBondContact CA-O 3.4Å; G217-C372 CarbonylContact O-C 3.54Å; G217-C372 WeakPolarHBondContact O-CA 3.26Å; G217-T373 PolarHBondContact O-N 2.96Å
218	V	93.1	Very high	90.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.2	-173.9	-174.6	0	0	0	0	110.8	I220 R322 I323 A326 I363	V218-I220 HydrophobicContact CG1-CG1 4.14Å; V218-R322 HydrophobicContact CG2-CB 3.91Å; V218-I323 HydrophobicContact CB-CG1 4.02Å; V218-I323 HydrophobicContact CG1-CG1 3.88Å; V218-I323 HydrophobicContact CG2-CG1 4.21Å; V218-A326 HydrophobicContact CG2-CB 4.1Å; V218-I363 PolarHBondContact N-O 3.19Å; V218-I363 PolarHBondContact O-N 2.71Å
219	M	93	Very high	91.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	136.9	171.8	-176.4	-177.4	-167.9	0	0	109.9	E202 I204 L215 I355 F360 T361 F362 T373 L375	E202-M219 HydrophobicContact CB-SD 4.38Å; E202-M219 HydrophobicContact CG-SD 4.24Å; I204-M219 HydrophobicContact CD1-CE 3.53Å; L215-M219 HydrophobicContact CD1-CB 4.29Å; L215-M219 HydrophobicContact CD1-SD 4.14Å; M219-I355 HydrophobicContact CE-CD1 3.99Å; M219-F360 HydrophobicContact CE-CB 3.6Å; M219-F360 HydrophobicContact CE-CD1 3.38Å; M219-F360 HydrophobicContact CE-CD2 3.99Å; M219-F360 HydrophobicContact CE-CE1 4Å; M219-F360 HydrophobicContact CE-CG 3.37Å; M219-F360 HydrophobicContact CG-CB 4.39Å; M219-F360 HydrophobicContact CG-CD1 4.17Å; M219-F360 HydrophobicContact SD-CD1 4.39Å; M219-T361 WeakPolarHBondContact CA-O 3.38Å; M219-F362 HydrophobicContact CB-CD1 4.45Å; M219-F362 HydrophobicContact CE-CE1 3.47Å; M219-F362 VanDerWaalsContact CE-CE1 3.47Å; M219-F362 HydrophobicContact CE-CE2 4.23Å; M219-F362 HydrophobicContact CE-CZ 3.26Å; M219-F362 HydrophobicContact CG-CD1 4.12Å; M219-F362 HydrophobicContact CG-CE1 3.83Å; M219-F362 HydrophobicContact CG-CZ 4.29Å; M219-F362 HydrophobicContact SD-CD1 4.48Å; M219-F362 HydrophobicContact SD-CE1 3.69Å; M219-F362 HydrophobicContact SD-CZ 4.13Å; M219-T373 HydrophobicContact CB-CG2 3.82Å; M219-T373 PolarHBondContact N-OG1 2.88Å; M219-L375 HydrophobicContact CE-CD1 4.17Å; M219-L375 HydrophobicContact SD-CD1 4.09Å
220	I	94.1	Very high	91.4	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	133.1	-176.8	-47.9	168.3	0	0	0	109	V218 K222 V315 I323 F360 T361 I363	V218-I220 HydrophobicContact CG1-CG1 4.14Å; I220-K222 HydrophobicContact CG2-CB 4.03Å; I220-K222 HydrophobicContact CG2-CG 3.79Å; I220-K222 PolarHBondContact O-N 3.26Å; I220-V315 HydrophobicContact CG2-CG2 4.43Å; I220-I323 HydrophobicContact CD1-CD1 3.38Å; I220-I323 HydrophobicContact CD1-CG1 4.24Å; I220-I323 HydrophobicContact CG1-CD1 4.32Å; I220-F360 CarbonylContact O-C 3.58Å; I220-F360 WeakPolarHBondContact O-CA 3.43Å; I220-T361 PolarHBondContact N-O 3.16Å; I220-T361 PolarHBondContact O-N 3.13Å; I220-I363 HydrophobicContact CD1-CD1 4.31Å
221	N	92.7	Very high	91.6	Very high	59 Å²	59	53.9 Å²	53.9	32%	0.316	26%	0.255	S	S	.	.	S	Bend	trans	-82.4	69	172.5	-165.9	-16.6	0	0	0	111	E358 Y359 F360	N221-E358 PolarHBondContact ND2-OE2 3.4Å; N221-Y359 PolarHBondContact OD1-O 2.99Å; N221-F360 HydrophobicContact CB-CD1 3.89Å; N221-F360 HydrophobicContact CB-CE1 3.59Å; N221-F360 HydrophobicContact CB-CZ 4.45Å
222	K	92.8	Very high	91.9	Very high	84 Å²	84	55.6 Å²	55.6	37%	0.365	26%	0.256	S	S	.	.			trans	-146	145	175.3	-66.6	-62.3	168.8	-162.2	0	109.9	I220 I312 R314 T361	I220-K222 HydrophobicContact CG2-CB 4.03Å; I220-K222 HydrophobicContact CG2-CG 3.79Å; I220-K222 PolarHBondContact O-N 3.26Å; K222-I312 HydrophobicContact CB-CG2 3.79Å; K222-I312 HydrophobicContact CG-CG2 4.32Å; K222-R314 WeakPolarHBondContact CE-O 3.35Å; K222-T361 PolarHBondContact O-N 3.26Å; K222-T361 PolarHBondContact O-OG1 3.08Å
223	D	93.4	Very high	92	Very high	49 Å²	49	55.6 Å²	55.6	26%	0.262	26%	0.255	S	S	.	.			trans	-99.5	170.3	169.7	-164.3	8.7	0	0	0	110.1	R231 Y359	D223-R231 IonicContact OD1-CZ 3.25Å; D223-R231 IonicContact OD1-NE 3.67Å; D223-R231 IonicContact OD1-NH2 3.32Å; D223-R231 PolarHBondContact OD1-NH2 3.25Å; D223-R231 IonicContact OD2-NH2 3.32Å; D223-R231 PolarHBondContact OD2-NH2 3.46Å; D223-Y359 HydrophobicContact CB-CD2 4.39Å; D223-Y359 HydrophobicContact CB-CG 4.23Å
224	V	92.9	Very high	92.1	Very high	13 Å²	13	60 Å²	60	8%	0.079	27%	0.269	C	S	.	.			trans	-57.4	152	167.2	-62.2	0	0	0	0	111.3	H226 M229 R231 T310 I352	V224-H226 VanDerWaalsContact CG2-O 3.32Å; V224-H226 WeakPolarHBondContact CG2-O 3.36Å; V224-M229 HydrophobicContact CB-CB 4.19Å; V224-M229 HydrophobicContact CG1-CB 4.2Å; V224-R231 HydrophobicContact CG1-CG 4.42Å; V224-T310 HydrophobicContact CG1-CG2 3.64Å; V224-I352 HydrophobicContact CB-CD1 4.4Å; V224-I352 HydrophobicContact CG1-CD1 3.2Å
225	T	90.4	Very high	92.1	Very high	21 Å²	21	64.2 Å²	64.2	13%	0.129	29%	0.29	C	S	.	.	S	Bend	trans	-75.2	-33.5	176.9	60.2	0	0	0	0	113	I296 Q301 A311 R313	T225-I296 HydrophobicContact CG2-CD1 4.42Å; T225-Q301 VanDerWaalsContact CB-OE1 3.3Å; T225-Q301 PolarHBondContact O-OE1 3.03Å; T225-Q301 WeakPolarHBondContact OG1-CG 3.38Å; T225-Q301 PolarHBondContact OG1-OE1 2.94Å; T225-A311 HydrophobicContact CG2-CB 4.45Å; T225-A311 PolarHBondContact N-O 3.38Å; T225-R313 HydrophobicContact CG2-CB 4.08Å; T225-R313 HydrophobicContact CG2-CG 3.74Å
226	H	90.8	Very high	92.2	Very high	56 Å²	56	62.8 Å²	62.8	26%	0.259	28%	0.282	S	S	.	.	S	Bend	trans	-121.8	133.7	-176.2	-169	-83.9	0	0	0	111.9	V224 R228 M229 M305	V224-H226 VanDerWaalsContact CG2-O 3.32Å; V224-H226 WeakPolarHBondContact CG2-O 3.36Å; H226-R228 PolarHBondContact ND1-N 2.86Å; H226-R228 PolarHBondContact O-N 2.98Å; H226-R228 VanDerWaalsContact O-N 3.11Å; H226-M229 HydrophobicContact CB-CE 3.96Å; H226-M229 HydrophobicContact CB-CG 4Å; H226-M229 HydrophobicContact CB-SD 3.96Å; H226-M229 WeakPolarHBondContact O-CB 3.38Å; H226-M229 PolarHBondContact O-N 3.4Å; H226-M305 PolarHBondContact CE1-SD 3.47Å; H226-M305 PolarHBondContact ND1-SD 2.77Å; H226-M305 VanDerWaalsContact ND1-SD 3.44Å
227	P	88.3	Confident	92.4	Very high	109 Å²	109	57.8 Å²	57.8	71%	0.708	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.3	-174.2	-26.4	34.1	0	0	0	115.5
228	R	88.9	Confident	92.7	Very high	198 Å²	198	57.8 Å²	57.8	75%	0.747	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-1.6	179.5	-61.8	-176	69.6	177.5	3.5	114.2	H226 M305	H226-R228 PolarHBondContact ND1-N 2.86Å; H226-R228 PolarHBondContact O-N 2.98Å; H226-R228 VanDerWaalsContact O-N 3.11Å; R228-M305 HydrophobicContact CB-CE 3.51Å; R228-M305 HydrophobicContact CB-SD 3.96Å; R228-M305 HydrophobicContact CG-CE 4.29Å
229	M	92.5	Very high	92.8	Very high	12 Å²	12	57.9 Å²	57.9	6%	0.059	26%	0.264	C	S	.	.	S	Bend	trans	-69.6	153.8	174.5	-77	174.4	178	0	0	111.2	V224 H226 R231 Q301 M305 T310 A311	V224-M229 HydrophobicContact CB-CB 4.19Å; V224-M229 HydrophobicContact CG1-CB 4.2Å; H226-M229 HydrophobicContact CB-CE 3.96Å; H226-M229 HydrophobicContact CB-CG 4Å; H226-M229 HydrophobicContact CB-SD 3.96Å; H226-M229 WeakPolarHBondContact O-CB 3.38Å; H226-M229 PolarHBondContact O-N 3.4Å; M229-R231 PolarHBondContact O-N 3.14Å; M229-Q301 HydrophobicContact CE-CB 4.32Å; M229-Q301 WeakPolarHBondContact CE-O 3.47Å; M229-M305 HydrophobicContact CE-CB 4.16Å; M229-T310 HydrophobicContact CB-CG2 4.42Å; M229-A311 HydrophobicContact CE-CB 3.94Å; M229-A311 HydrophobicContact SD-CB 4.18Å; M229-A311 PolarHBondContact SD-N 3.36Å
230	R	92.1	Very high	92.9	Very high	74 Å²	74	57.9 Å²	57.9	28%	0.279	26%	0.264	S	S	.	.			trans	-68	131.5	179.6	-63.5	-175.3	-72.4	163.5	-1.7	109.6	I233 D288 N308 T310	R230-I233 HydrophobicContact CB-CD1 4.27Å; R230-I233 HydrophobicContact CB-CG1 4.11Å; R230-D288 IonicContact CZ-OD1 2.66Å; R230-D288 IonicContact NH1-OD1 3.27Å; R230-D288 IonicContact NH2-OD1 2.96Å; R230-D288 PolarHBondContact NH2-OD1 3.07Å; R230-N308 WeakPolarHBondContact CD-OD1 3.1Å; R230-N308 PolarHBondContact NE-ND2 3.43Å; R230-N308 PolarHBondContact NE-O 3.15Å; R230-N308 PolarHBondContact NE-OD1 3.08Å; R230-N308 PolarHBondContact NH2-O 3.46Å; R230-T310 WeakPolarHBondContact O-CG2 3.27Å; R230-T310 PolarHBondContact O-OG1 2.93Å
231	R	92.9	Very high	93	Very high	91 Å²	91	57.7 Å²	57.7	34%	0.343	26%	0.263	S	S	.	.	S	Bend	trans	-97.1	-9.4	176	-70.8	-176.3	168.4	-163	-12.1	113.8	D223 V224 M229 E351 I352	D223-R231 IonicContact OD1-CZ 3.25Å; D223-R231 IonicContact OD1-NE 3.67Å; D223-R231 IonicContact OD1-NH2 3.32Å; D223-R231 PolarHBondContact OD1-NH2 3.25Å; D223-R231 IonicContact OD2-NH2 3.32Å; D223-R231 PolarHBondContact OD2-NH2 3.46Å; V224-R231 HydrophobicContact CG1-CG 4.42Å; M229-R231 PolarHBondContact O-N 3.14Å; R231-E351 CarbonylContact O-C 3.56Å; R231-E351 WeakPolarHBondContact O-CA 3.48Å; R231-I352 HydrophobicContact CB-CB 4.16Å; R231-I352 HydrophobicContact CG-CB 4.31Å; R231-I352 HydrophobicContact CG-CD1 4.38Å; R231-I352 PolarHBondContact O-N 2.91Å
232	Y	94.3	Very high	93	Very high	121 Å²	121	56.7 Å²	56.7	48%	0.475	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	119.2	-175.8	-176.3	-90.8	0	0	0	109.7	K234 L349 L350 E351	Y232-K234 HydrophobicContact CE1-CD 4.37Å; Y232-K234 HydrophobicContact CE1-CG 3.78Å; Y232-K234 WeakPolarHBondContact OH-CE 3.34Å; Y232-L349 HydrophobicContact CD2-CD1 4.25Å; Y232-L349 HydrophobicContact CE1-CD1 4.36Å; Y232-L349 HydrophobicContact CE2-CD1 3.56Å; Y232-L349 HydrophobicContact CE2-CD2 4.34Å; Y232-L349 HydrophobicContact CE2-CG 4.4Å; Y232-L350 WeakPolarHBondContact CA-O 3.45Å; Y232-E351 HydrophobicContact CD2-CB 4.46Å; Y232-E351 HydrophobicContact CD2-CG 4.36Å
233	I	94.4	Very high	93	Very high	7 Å²	7	53 Å²	53	4%	0.036	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	122.7	-178.3	-54.2	173.6	0	0	0	108.7	R230 P236 D288 V289 L350	R230-I233 HydrophobicContact CB-CD1 4.27Å; R230-I233 HydrophobicContact CB-CG1 4.11Å; I233-P236 HydrophobicContact CB-CB 4.35Å; I233-P236 HydrophobicContact CG2-CB 3.9Å; I233-D288 HydrophobicContact CD1-CB 4.33Å; I233-D288 HydrophobicContact CG2-CB 4.12Å; I233-V289 HydrophobicContact CD1-CG2 3.83Å; I233-L350 HydrophobicContact CB-CB 4.4Å; I233-L350 PolarHBondContact N-O 3.19Å; I233-L350 PolarHBondContact O-N 3.06Å
234	K	93.4	Very high	92.9	Very high	145 Å²	145	51.8 Å²	51.8	63%	0.63	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	137.1	171.4	-65.3	-170.5	174.1	-172.4	0	109.7	Y232 L349	Y232-K234 HydrophobicContact CE1-CD 4.37Å; Y232-K234 HydrophobicContact CE1-CG 3.78Å; Y232-K234 WeakPolarHBondContact OH-CE 3.34Å; K234-L349 HydrophobicContact CG-CD1 4.25Å
235	N	91.9	Very high	92.9	Very high	116 Å²	116	51.3 Å²	51.3	62%	0.62	24%	0.235	S	C	*	.	S	Bend	trans	48.1	57	-177.1	-57.6	-42.1	0	0	0	113.3	A347 G348	N235-A347 WeakPolarHBondContact CA-O 3.49Å; N235-G348 PolarHBondContact N-O 2.69Å
236	P	94.3	Very high	92.9	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.245	C	C	.	.			trans	-65.3	135.7	-176	28.6	-36.6	0	0	0	112.2	I233 I238 V289 A347 L350	I233-P236 HydrophobicContact CB-CB 4.35Å; I233-P236 HydrophobicContact CG2-CB 3.9Å; P236-I238 HydrophobicContact CB-CG1 4.18Å; P236-I238 HydrophobicContact CG-CD1 4.19Å; P236-I238 HydrophobicContact CG-CG1 4.34Å; P236-V289 HydrophobicContact CB-CG2 3.72Å; P236-A347 WeakPolarHBondContact CD-O 3.29Å; P236-A347 HydrophobicContact CG-CB 3.87Å; P236-L350 HydrophobicContact CB-CB 4.3Å; P236-L350 HydrophobicContact CG-CB 3.98Å
237	R	94.6	Very high	92.8	Very high	54 Å²	54	55.7 Å²	55.7	20%	0.204	25%	0.251	C	S	.	.			trans	-83.8	114.2	164.6	-59.8	-175.6	69.4	-160.3	1.8	109.8	L285 K286 D288 V289 E340 V343 T345	R237-L285 VanDerWaalsContact CZ-O 3.31Å; R237-L285 PolarHBondContact NH1-O 3.49Å; R237-L285 PolarHBondContact NH2-O 3.03Å; R237-K286 PolarHBondContact NH1-O 3.48Å; R237-D288 PolarHBondContact N-OD2 2.95Å; R237-D288 PolarHBondContact O-N 3.31Å; R237-V289 PolarHBondContact O-N 3.04Å; R237-E340 IonicContact CZ-OE1 3.7Å; R237-E340 VanDerWaalsContact NH2-CD 3.29Å; R237-E340 IonicContact NH2-OE1 2.81Å; R237-E340 PolarHBondContact NH2-OE1 3.09Å; R237-E340 IonicContact NH2-OE2 3.72Å; R237-E340 PolarHBondContact NH2-OE2 2.91Å; R237-V343 HydrophobicContact CB-CG1 3.91Å; R237-T345 HydrophobicContact CG-CG2 4.08Å
238	I	94.9	Very high	92.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.1	-170.2	-58.9	165.6	0	0	0	110.5	P236 L240 V289 I291 I323 C327 G344 A347 I363	P236-I238 HydrophobicContact CB-CG1 4.18Å; P236-I238 HydrophobicContact CG-CD1 4.19Å; P236-I238 HydrophobicContact CG-CG1 4.34Å; I238-L240 HydrophobicContact CG2-CD2 3.69Å; I238-L240 HydrophobicContact CG2-CG 4.31Å; I238-V289 WeakPolarHBondContact CA-O 3.45Å; I238-V289 HydrophobicContact CG1-CB 4.13Å; I238-I291 HydrophobicContact CG2-CD1 4.03Å; I238-I291 HydrophobicContact CG2-CG1 4.36Å; I238-I323 HydrophobicContact CG2-CG2 4.39Å; I238-C327 HydrophobicContact CD1-CB 4.13Å; I238-C327 WeakPolarHBondContact CD1-SG 3.46Å; I238-G344 PolarHBondContact N-O 3.04Å; I238-G344 PolarHBondContact O-N 2.78Å; I238-A347 HydrophobicContact CD1-CB 3.59Å; I238-I363 HydrophobicContact CD1-CD1 4.47Å; I238-I363 HydrophobicContact CD1-CG2 3.94Å
239	V	96	Very high	92.4	Very high	2 Å²	2	54 Å²	54	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.7	170.4	171.8	0	0	0	0	109.5	L241 P287 V289 V290 I291 L338 V343	V239-L241 HydrophobicContact CG1-CD2 4.39Å; V239-L241 HydrophobicContact CG1-CG 4.18Å; V239-P287 HydrophobicContact CB-CB 4.44Å; V239-P287 HydrophobicContact CG2-CB 3.65Å; V239-P287 HydrophobicContact CG2-CG 4.06Å; V239-V289 PolarHBondContact N-O 3.05Å; V239-V290 HydrophobicContact CB-CG2 4.41Å; V239-I291 PolarHBondContact O-N 3.34Å; V239-L338 HydrophobicContact CG1-CD1 4.14Å; V239-L338 HydrophobicContact CG1-CD2 3.82Å; V239-V343 HydrophobicContact CG2-CG1 4.48Å; V239-V343 HydrophobicContact CG2-CG2 4Å
240	L	95.8	Very high	92	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.7	-178.4	-57.4	-178.2	0	0	0	110.7	I238 I291 N320 I323 A324 A329 I331 V332	I238-L240 HydrophobicContact CG2-CD2 3.69Å; I238-L240 HydrophobicContact CG2-CG 4.31Å; L240-I291 HydrophobicContact CD2-CB 3.72Å; L240-I291 HydrophobicContact CD2-CD1 4Å; L240-I291 HydrophobicContact CD2-CG1 4.16Å; L240-I291 HydrophobicContact CD2-CG2 4.36Å; L240-N320 WeakPolarHBondContact CD2-OD1 3.35Å; L240-I323 HydrophobicContact CD1-CB 4.3Å; L240-I323 HydrophobicContact CD1-CG2 4.19Å; L240-I323 HydrophobicContact CD2-CB 4.38Å; L240-I323 HydrophobicContact CD2-CG2 3.84Å; L240-A324 VanDerWaalsContact CD1-CA 3.42Å; L240-A324 HydrophobicContact CD1-CB 3.54Å; L240-A329 HydrophobicContact CD1-CB 3.74Å; L240-A329 HydrophobicContact CG-CB 3.9Å; L240-I331 HydrophobicContact CB-CG1 4.07Å; L240-I331 HydrophobicContact CD1-CG1 4.05Å; L240-V332 PolarHBondContact O-N 3.49Å
241	L	94.9	Very high	91.7	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.4	-178.7	-63.4	171.6	0	0	0	112.4	V239 I282 V290 I291 T292 E293 V332 P335 L338	V239-L241 HydrophobicContact CG1-CD2 4.39Å; V239-L241 HydrophobicContact CG1-CG 4.18Å; L241-I282 HydrophobicContact CD1-CD1 3.7Å; L241-I282 HydrophobicContact CD1-CG1 4.46Å; L241-V290 HydrophobicContact CD1-CG1 4.18Å; L241-I291 PolarHBondContact N-O 3.36Å; L241-T292 HydrophobicContact CB-CG2 4.17Å; L241-T292 HydrophobicContact CD1-CG2 4.32Å; L241-T292 WeakPolarHBondContact O-CA 3.14Å; L241-E293 PolarHBondContact O-N 2.99Å; L241-V332 VanDerWaalsContact CA-O 3.28Å; L241-V332 WeakPolarHBondContact CA-O 3.39Å; L241-V332 HydrophobicContact CD2-CB 4.28Å; L241-V332 WeakPolarHBondContact CD2-O 3.38Å; L241-P335 HydrophobicContact CD1-CG 4.32Å; L241-L338 HydrophobicContact CD2-CD1 4.29Å; L241-L338 HydrophobicContact CD2-CD2 4.09Å; L241-L338 HydrophobicContact CD2-CG 4.43Å
242	D	94.2	Very high	91.6	Very high	39 Å²	39	62.5 Å²	62.5	21%	0.209	31%	0.308	C	S	.	.	S	Bend	trans	-83.3	-24.6	168.3	-162.6	-19.4	0	0	0	110.8	K294 K317 I331 V332	D242-K294 VanDerWaalsContact O-CG 3.23Å; D242-K294 WeakPolarHBondContact O-CG 3.5Å; D242-K317 IonicContact OD2-NZ 2.67Å; D242-K317 PolarHBondContact OD2-NZ 3.07Å; D242-I331 HydrophobicContact CB-CG2 4.31Å; D242-V332 PolarHBondContact N-O 3.28Å; D242-V332 VanDerWaalsContact N-O 3.09Å
243	S	91.2	Very high	91.2	Very high	7 Å²	7	65.8 Å²	65.8	5%	0.049	33%	0.328	C	S	.	.	S	Bend	trans	-75.2	153.8	178.7	51.8	0	0	0	0	114.6	S333	S243-S333 WeakPolarHBondContact CB-O 3.5Å; S243-S333 PolarHBondContact OG-O 3.13Å; S243-S333 VanDerWaalsContact OG-O 3.1Å
244	S	92.4	Very high	90.7	Very high	23 Å²	23	69.7 Å²	69.7	16%	0.161	35%	0.352	C	S	.	.			trans	-72.2	147.7	161.9	51.6	0	0	0	0	111.9	E246 G295	S244-E246 VanDerWaalsContact C-N 3.27Å; S244-E246 PolarHBondContact O-N 2.74Å; S244-G295 WeakPolarHBondContact CA-O 3.37Å
245	L	92.1	Very high	90.3	Very high	2 Å²	2	69.8 Å²	69.8	1%	0.01	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-97.4	54.8	167	-70.3	169.5	0	0	0	109.3	L278 I282 V290 T292 G295 I296 S297 A300 L304 P335	L245-L278 HydrophobicContact CD2-CB 4.3Å; L245-I282 HydrophobicContact CD1-CD1 4.17Å; L245-I282 HydrophobicContact CD2-CD1 3.7Å; L245-V290 HydrophobicContact CD1-CG1 4.29Å; L245-T292 HydrophobicContact CD1-CG2 3.87Å; L245-T292 HydrophobicContact CG-CG2 4.26Å; L245-G295 PolarHBondContact N-O 3.1Å; L245-G295 VanDerWaalsContact N-O 3.09Å; L245-I296 HydrophobicContact CB-CB 4.42Å; L245-I296 HydrophobicContact CB-CG1 4.37Å; L245-I296 HydrophobicContact CB-CG2 4.06Å; L245-I296 HydrophobicContact CD1-CD1 4.38Å; L245-I296 HydrophobicContact CD1-CG1 4.25Å; L245-I296 HydrophobicContact CD1-CG2 4.21Å; L245-S297 WeakPolarHBondContact O-CB 3.48Å; L245-S297 PolarHBondContact O-N 3.35Å; L245-A300 HydrophobicContact CB-CB 4.17Å; L245-L304 HydrophobicContact CD1-CD1 4.07Å; L245-P335 HydrophobicContact CD2-CG 4.46Å
246	E	91.1	Very high	89.9	Confident	72 Å²	72	69.3 Å²	69.3	34%	0.336	36%	0.355	S	S	.	.	S	Bend	trans	-131.9	155.7	-178.5	-67.3	172.4	-178.5	0	0	108.1	S244 K248 G295 I296	S244-E246 VanDerWaalsContact C-N 3.27Å; S244-E246 PolarHBondContact O-N 2.74Å; E246-K248 PolarHBondContact O-N 3.26Å; E246-G295 WeakPolarHBondContact OE1-CA 3.47Å; E246-I296 PolarHBondContact OE1-N 3.17Å
247	Y	89.3	Confident	89.6	Confident	98 Å²	98	77.6 Å²	77.6	38%	0.384	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-59.9	128	174.1	-179.6	-104.2	0	0	0	110.5	E271 Y274	Y247-E271 HydrophobicContact CD2-CB 4.34Å; Y247-E271 HydrophobicContact CD2-CG 4.01Å; Y247-E271 HydrophobicContact CG-CG 3.84Å; Y247-Y274 AromaticContact CD2-CD1 3.74Å; Y247-Y274 HydrophobicContact CD2-CD1 3.74Å; Y247-Y274 HydrophobicContact CD2-CE1 4.42Å; Y247-Y274 HydrophobicContact CD2-CG 4.09Å; Y247-Y274 HydrophobicContact CE2-CD1 4.48Å; Y247-Y274 HydrophobicContact CE2-CG 4.46Å
248	K	84.2	Confident	89.4	Confident	89 Å²	89	79.1 Å²	79.1	39%	0.387	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-102.8	131	179.8	-66.1	-179	-173.3	170.5	0	109	E246	E246-K248 PolarHBondContact O-N 3.26Å
249	K	83.9	Confident	89.2	Confident	183 Å²	183	85 Å²	85	80%	0.796	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-71.5	148	168.1	-61.1	-174.4	179.4	-173.2	0	109.1
250	G	82.9	Confident	88.9	Confident	49 Å²	49	91.3 Å²	91.3	51%	0.505	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-57.1	143.1	172.2	0	0	0	0	0	111.2	S252	G250-S252 PolarHBondContact O-N 2.98Å
251	E	86.4	Confident	88.6	Confident	209 Å²	209	99.8 Å²	99.8	98%	0.977	51%	0.505	S	S	*	.	S	Bend	trans	-69.7	-26.4	177.3	-67.2	-176.6	169.4	0	0	112.1
252	S	91.1	Very high	88.3	Confident	96 Å²	96	104.5 Å²	104.5	67%	0.671	53%	0.527	S	S	*	.	S	Bend	trans	-81.1	155.5	172.5	-63.1	0	0	0	0	111.2	G250 T254	G250-S252 PolarHBondContact O-N 2.98Å; S252-T254 PolarHBondContact O-N 3.44Å; S252-T254 PolarHBondContact O-OG1 2.92Å
253	Q	85.3	Confident	88.1	Confident	191 Å²	191	104.1 Å²	104.1	89%	0.893	53%	0.525	S	S	*	.			trans	-55.8	107.7	172.7	-74.5	-174.1	-23.5	0	0	109.1
254	T	84.3	Confident	87.9	Confident	89 Å²	89	109.4 Å²	109.4	55%	0.546	55%	0.547	S	S	.	.			trans	-114.2	94.9	-178	-48.2	0	0	0	0	106.8	S252	S252-T254 PolarHBondContact O-N 3.44Å; S252-T254 PolarHBondContact O-OG1 2.92Å
255	D	86.2	Confident	87.8	Confident	146 Å²	146	111.9 Å²	111.9	78%	0.781	56%	0.561	S	S	*	*			trans	-90.3	128.4	175.8	-66.5	-35.8	0	0	0	109.1
256	I	83.3	Confident	87.6	Confident	106 Å²	106	117.2 Å²	117.2	54%	0.544	58%	0.581	S	S	.	*			trans	-112.6	111	-179.4	-56.4	175.9	0	0	0	107.5	I258 I267	I256-I258 HydrophobicContact CG2-CG1 4.07Å; I256-I267 HydrophobicContact CG2-CD1 3.68Å
257	E	87.9	Confident	87.5	Confident	174 Å²	174	116.2 Å²	116.2	81%	0.813	58%	0.578	S	S	*	*			trans	-94.3	115.1	174.1	-68.4	-174.3	173.7	0	0	110
258	I	89.9	Confident	87.5	Confident	87 Å²	87	115.3 Å²	115.3	45%	0.446	58%	0.579	S	S	.	*			trans	-100.4	111.7	-179.8	-53.5	177.7	0	0	0	107.9	I256 D263 F264 I267	I256-I258 HydrophobicContact CG2-CG1 4.07Å; I258-D263 HydrophobicContact CG2-CB 4.41Å; I258-F264 HydrophobicContact CD1-CD2 4.14Å; I258-F264 HydrophobicContact CG2-CB 4.46Å; I258-I267 HydrophobicContact CD1-CD1 3.82Å; I258-I267 HydrophobicContact CG1-CD1 3.95Å
259	T	89.9	Confident	87.8	Confident	123 Å²	123	115.7 Å²	115.7	76%	0.755	58%	0.582	S	S	*	*			trans	-109.6	-32.6	179.4	58.4	0	0	0	0	112.8
260	R	91	Very high	88.1	Confident	134 Å²	134	112.5 Å²	112.5	51%	0.506	57%	0.572	S	S	.	*	S	Bend	trans	-112.2	148.7	177.6	-59.5	174.6	60	170.2	-3.9	111.4	E262 D263	R260-E262 IonicContact CZ-OE1 3.75Å; R260-E262 IonicContact CZ-OE2 3.86Å; R260-E262 IonicContact NH2-OE1 2.73Å; R260-E262 PolarHBondContact NH2-OE1 2.89Å; R260-E262 IonicContact NH2-OE2 3.06Å; R260-E262 PolarHBondContact NH2-OE2 3.23Å; R260-E262 PolarHBondContact O-N 3Å; R260-D263 WeakPolarHBondContact CB-OD2 3.28Å; R260-D263 PolarHBondContact N-OD2 3Å; R260-D263 WeakPolarHBondContact O-CB 3.13Å; R260-D263 PolarHBondContact O-N 2.85Å; R260-D263 VanDerWaalsContact O-N 3.1Å
261	E	88.6	Confident	88.4	Confident	179 Å²	179	113.4 Å²	113.4	84%	0.836	56%	0.563	S	S	*	*	H	α-helix	trans	-60.3	-33.2	174.8	-67.5	-178.1	172.7	0	0	112.7	D263 F264	E261-D263 VanDerWaalsContact C-N 3.27Å; E261-D263 PolarHBondContact O-N 3.22Å; E261-F264 WeakPolarHBondContact O-CB 3.42Å; E261-F264 PolarHBondContact O-N 2.94Å
262	E	89.6	Confident	88.7	Confident	99 Å²	99	107.8 Å²	107.8	46%	0.463	54%	0.536	S	S	.	.	H	α-helix	trans	-62.3	-33.1	175.8	-68.8	169.9	-145	0	0	112.9	R260 F264 T265 R266	R260-E262 IonicContact CZ-OE1 3.75Å; R260-E262 IonicContact CZ-OE2 3.86Å; R260-E262 IonicContact NH2-OE1 2.73Å; R260-E262 PolarHBondContact NH2-OE1 2.89Å; R260-E262 IonicContact NH2-OE2 3.06Å; R260-E262 PolarHBondContact NH2-OE2 3.23Å; R260-E262 PolarHBondContact O-N 3Å; E262-F264 VanDerWaalsContact C-N 3.27Å; E262-F264 PolarHBondContact O-N 3.48Å; E262-T265 PolarHBondContact O-N 3.4Å; E262-R266 PolarHBondContact O-N 3.44Å; E262-R266 VanDerWaalsContact O-N 3.1Å; E262-R266 IonicContact OE2-NH2 2.6Å; E262-R266 PolarHBondContact OE2-NH2 3.34Å
263	D	88.7	Confident	88.8	Confident	30 Å²	30	108.8 Å²	108.8	16%	0.16	53%	0.531	C	S	.	.	H	α-helix	trans	-67.1	-33.8	-178.1	-57.6	-29	0	0	0	110.6	I258 R260 E261 T265 R266 I267	I258-D263 HydrophobicContact CG2-CB 4.41Å; R260-D263 WeakPolarHBondContact CB-OD2 3.28Å; R260-D263 PolarHBondContact N-OD2 3Å; R260-D263 WeakPolarHBondContact O-CB 3.13Å; R260-D263 PolarHBondContact O-N 2.85Å; R260-D263 VanDerWaalsContact O-N 3.1Å; E261-D263 VanDerWaalsContact C-N 3.27Å; E261-D263 PolarHBondContact O-N 3.22Å; D263-T265 VanDerWaalsContact C-N 3.33Å; D263-T265 PolarHBondContact O-N 3.33Å; D263-R266 PolarHBondContact O-N 2.66Å; D263-R266 IonicContact OD1-CZ 3.35Å; D263-R266 VanDerWaalsContact OD1-CZ 3.32Å; D263-R266 IonicContact OD1-NH1 3.72Å; D263-R266 PolarHBondContact OD1-NH1 2.96Å; D263-R266 IonicContact OD1-NH2 2.64Å; D263-R266 PolarHBondContact OD1-NH2 2.6Å; D263-I267 WeakPolarHBondContact O-CD1 3.29Å; D263-I267 VanDerWaalsContact O-CG1 3.31Å; D263-I267 WeakPolarHBondContact O-CG1 3.37Å; D263-I267 PolarHBondContact O-N 2.74Å
264	F	87.2	Confident	89.1	Confident	118 Å²	118	102.9 Å²	102.9	52%	0.518	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-41.3	173.9	-171.7	-99	0	0	0	111.9	I258 E261 E262 I267 L268	I258-F264 HydrophobicContact CD1-CD2 4.14Å; I258-F264 HydrophobicContact CG2-CB 4.46Å; E261-F264 WeakPolarHBondContact O-CB 3.42Å; E261-F264 PolarHBondContact O-N 2.94Å; E262-F264 VanDerWaalsContact C-N 3.27Å; E262-F264 PolarHBondContact O-N 3.48Å; F264-I267 PolarHBondContact O-N 3.16Å; F264-L268 HydrophobicContact CD1-CD1 4.08Å; F264-L268 HydrophobicContact CE1-CD1 3.74Å; F264-L268 HydrophobicContact CE1-CG 4.4Å; F264-L268 HydrophobicContact CZ-CD1 4.49Å; F264-L268 PolarHBondContact O-N 3.12Å
265	T	90.5	Very high	89.5	Confident	75 Å²	75	98.7 Å²	98.7	46%	0.46	48%	0.475	S	S	.	.	H	α-helix	trans	-67.6	-39.5	178.2	-52	0	0	0	0	111.3	E262 D263 I267 L268 Q269	E262-T265 PolarHBondContact O-N 3.4Å; D263-T265 VanDerWaalsContact C-N 3.33Å; D263-T265 PolarHBondContact O-N 3.33Å; T265-I267 VanDerWaalsContact C-N 3.34Å; T265-I267 PolarHBondContact O-N 3.23Å; T265-L268 PolarHBondContact O-N 3.35Å; T265-Q269 WeakPolarHBondContact O-CG 3.5Å; T265-Q269 PolarHBondContact O-N 2.98Å
266	R	89.1	Confident	89.9	Confident	114 Å²	114	95.9 Å²	95.9	43%	0.43	46%	0.457	S	S	.	.	H	α-helix	trans	-64	-38.1	176.5	-67.5	-169.8	-137.9	114.6	11.4	112.3	E262 D263 L268 Q269 M270	E262-R266 PolarHBondContact O-N 3.44Å; E262-R266 VanDerWaalsContact O-N 3.1Å; E262-R266 IonicContact OE2-NH2 2.6Å; E262-R266 PolarHBondContact OE2-NH2 3.34Å; D263-R266 PolarHBondContact O-N 2.66Å; D263-R266 IonicContact OD1-CZ 3.35Å; D263-R266 VanDerWaalsContact OD1-CZ 3.32Å; D263-R266 IonicContact OD1-NH1 3.72Å; D263-R266 PolarHBondContact OD1-NH1 2.96Å; D263-R266 IonicContact OD1-NH2 2.64Å; D263-R266 PolarHBondContact OD1-NH2 2.6Å; R266-L268 VanDerWaalsContact C-N 3.34Å; R266-L268 PolarHBondContact O-N 3.44Å; R266-Q269 PolarHBondContact O-N 3.35Å; R266-M270 WeakPolarHBondContact O-CG 3.45Å; R266-M270 PolarHBondContact O-N 3.24Å
267	I	88.6	Confident	90.3	Very high	52 Å²	52	96.2 Å²	96.2	27%	0.267	46%	0.456	S	S	.	.	H	α-helix	trans	-62.1	-43.1	176.8	-68.1	161	0	0	0	111	I256 I258 D263 F264 T265 Q269 M270 E271	I256-I267 HydrophobicContact CG2-CD1 3.68Å; I258-I267 HydrophobicContact CD1-CD1 3.82Å; I258-I267 HydrophobicContact CG1-CD1 3.95Å; D263-I267 WeakPolarHBondContact O-CD1 3.29Å; D263-I267 VanDerWaalsContact O-CG1 3.31Å; D263-I267 WeakPolarHBondContact O-CG1 3.37Å; D263-I267 PolarHBondContact O-N 2.74Å; F264-I267 PolarHBondContact O-N 3.16Å; T265-I267 VanDerWaalsContact C-N 3.34Å; T265-I267 PolarHBondContact O-N 3.23Å; I267-Q269 VanDerWaalsContact C-N 3.35Å; I267-M270 PolarHBondContact O-N 3.3Å; I267-E271 PolarHBondContact O-N 3.21Å
268	L	89.4	Confident	90.6	Very high	79 Å²	79	88.2 Å²	88.2	41%	0.414	42%	0.419	S	S	.	.	H	α-helix	trans	-62.8	-42.1	175.8	-67.3	173.2	0	0	0	111.7	F264 T265 R266 E271 E272	F264-L268 HydrophobicContact CD1-CD1 4.08Å; F264-L268 HydrophobicContact CE1-CD1 3.74Å; F264-L268 HydrophobicContact CE1-CG 4.4Å; F264-L268 HydrophobicContact CZ-CD1 4.49Å; F264-L268 PolarHBondContact O-N 3.12Å; T265-L268 PolarHBondContact O-N 3.35Å; R266-L268 VanDerWaalsContact C-N 3.34Å; R266-L268 PolarHBondContact O-N 3.44Å; L268-E271 PolarHBondContact O-N 3.11Å; L268-E272 PolarHBondContact O-N 3.42Å
269	Q	91.1	Very high	90.7	Very high	97 Å²	97	84.1 Å²	84.1	45%	0.453	40%	0.398	S	S	.	.	H	α-helix	trans	-61.6	-43.4	175.2	-72.4	173.2	-11.6	0	0	111.8	T265 R266 I267 E271 E272 E273	T265-Q269 WeakPolarHBondContact O-CG 3.5Å; T265-Q269 PolarHBondContact O-N 2.98Å; R266-Q269 PolarHBondContact O-N 3.35Å; I267-Q269 VanDerWaalsContact C-N 3.35Å; Q269-E271 VanDerWaalsContact C-N 3.3Å; Q269-E271 PolarHBondContact O-N 3.06Å; Q269-E272 PolarHBondContact O-N 3.08Å; Q269-E273 WeakPolarHBondContact O-CB 3.4Å; Q269-E273 VanDerWaalsContact O-CG 3.32Å; Q269-E273 WeakPolarHBondContact O-CG 3.33Å; Q269-E273 PolarHBondContact O-N 3.02Å
270	M	89.3	Confident	90.9	Very high	115 Å²	115	84 Å²	84	57%	0.567	39%	0.389	S	S	*	.	H	α-helix	trans	-62.4	-37.1	176.5	-72	178.8	69.6	0	0	112.4	R266 I267 Y274	R266-M270 WeakPolarHBondContact O-CG 3.45Å; R266-M270 PolarHBondContact O-N 3.24Å; I267-M270 PolarHBondContact O-N 3.3Å; M270-Y274 VanDerWaalsContact O-CB 3.32Å; M270-Y274 WeakPolarHBondContact O-CB 3.23Å; M270-Y274 PolarHBondContact O-N 3.06Å
271	E	89.8	Confident	91	Very high	69 Å²	69	79.2 Å²	79.2	32%	0.322	37%	0.374	S	S	.	.	H	α-helix	trans	-64.5	-44.3	174.6	-175.8	171.7	-175.1	0	0	111.4	Y247 I267 L268 Q269 I275	Y247-E271 HydrophobicContact CD2-CB 4.34Å; Y247-E271 HydrophobicContact CD2-CG 4.01Å; Y247-E271 HydrophobicContact CG-CG 3.84Å; I267-E271 PolarHBondContact O-N 3.21Å; L268-E271 PolarHBondContact O-N 3.11Å; Q269-E271 VanDerWaalsContact C-N 3.3Å; Q269-E271 PolarHBondContact O-N 3.06Å; E271-I275 HydrophobicContact CG-CD1 4.29Å; E271-I275 WeakPolarHBondContact O-CG1 3.24Å; E271-I275 PolarHBondContact O-N 3.3Å; E271-I275 VanDerWaalsContact O-N 3.16Å
272	E	91.9	Very high	91.3	Very high	90 Å²	90	70.8 Å²	70.8	42%	0.421	33%	0.334	S	S	.	.	H	α-helix	trans	-63.4	-46.7	175.9	-72.9	-176.2	170.7	0	0	112.2	L268 Q269 Y274 I275 Q276 L299	L268-E272 PolarHBondContact O-N 3.42Å; Q269-E272 PolarHBondContact O-N 3.08Å; E272-Y274 PolarHBondContact O-N 3.5Å; E272-I275 PolarHBondContact O-N 3.04Å; E272-Q276 VanDerWaalsContact O-CB 3.29Å; E272-Q276 WeakPolarHBondContact O-CB 3.34Å; E272-Q276 PolarHBondContact O-N 2.91Å; E272-L299 HydrophobicContact CG-CD1 3.95Å
273	E	92.6	Very high	91.5	Very high	118 Å²	118	68.8 Å²	68.8	55%	0.551	33%	0.326	S	S	*	.	H	α-helix	trans	-60.4	-43.6	178	-75.6	175.4	-177.9	0	0	111.4	Q269 I275 Q276 Q277	Q269-E273 WeakPolarHBondContact O-CB 3.4Å; Q269-E273 VanDerWaalsContact O-CG 3.32Å; Q269-E273 WeakPolarHBondContact O-CG 3.33Å; Q269-E273 PolarHBondContact O-N 3.02Å; E273-I275 PolarHBondContact O-N 3.43Å; E273-Q276 PolarHBondContact O-N 3.15Å; E273-Q277 WeakPolarHBondContact O-CB 3.39Å; E273-Q277 PolarHBondContact O-N 3.39Å
274	Y	92.1	Very high	91.8	Very high	67 Å²	67	74.8 Å²	74.8	26%	0.263	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-47	177.1	-179.9	-100.8	0	0	0	111.9	Y247 M270 E272 Q276 Q277 L278	Y247-Y274 AromaticContact CD2-CD1 3.74Å; Y247-Y274 HydrophobicContact CD2-CD1 3.74Å; Y247-Y274 HydrophobicContact CD2-CE1 4.42Å; Y247-Y274 HydrophobicContact CD2-CG 4.09Å; Y247-Y274 HydrophobicContact CE2-CD1 4.48Å; Y247-Y274 HydrophobicContact CE2-CG 4.46Å; M270-Y274 VanDerWaalsContact O-CB 3.32Å; M270-Y274 WeakPolarHBondContact O-CB 3.23Å; M270-Y274 PolarHBondContact O-N 3.06Å; E272-Y274 PolarHBondContact O-N 3.5Å; Y274-Q276 VanDerWaalsContact C-N 3.31Å; Y274-Q276 PolarHBondContact O-N 3.46Å; Y274-Q277 PolarHBondContact O-N 3.38Å; Y274-L278 HydrophobicContact CD1-CD1 4.05Å; Y274-L278 HydrophobicContact CE1-CD1 3.47Å; Y274-L278 VanDerWaalsContact CE1-CD1 3.47Å; Y274-L278 HydrophobicContact CE1-CG 4.24Å; Y274-L278 WeakPolarHBondContact O-CG 3.41Å; Y274-L278 PolarHBondContact O-N 2.62Å; Y274-L278 VanDerWaalsContact O-N 3.14Å
275	I	93.4	Very high	91.9	Very high	1 Å²	1	70 Å²	70	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-38.3	178.5	-67.6	170.1	0	0	0	110.8	E271 E272 E273 C279 L299 A300 Y303	E271-I275 HydrophobicContact CG-CD1 4.29Å; E271-I275 WeakPolarHBondContact O-CG1 3.24Å; E271-I275 PolarHBondContact O-N 3.3Å; E271-I275 VanDerWaalsContact O-N 3.16Å; E272-I275 PolarHBondContact O-N 3.04Å; E273-I275 PolarHBondContact O-N 3.43Å; I275-C279 PolarHBondContact O-N 2.98Å; I275-C279 VanDerWaalsContact O-N 3.1Å; I275-C279 PolarHBondContact O-SG 3.39Å; I275-L299 HydrophobicContact CD1-CB 4.31Å; I275-L299 HydrophobicContact CD1-CD1 4Å; I275-L299 HydrophobicContact CG2-CB 4.12Å; I275-A300 HydrophobicContact CG2-CB 3.74Å; I275-Y303 HydrophobicContact CG2-CD2 4.47Å
276	Q	93.3	Very high	92	Very high	87 Å²	87	74 Å²	74	41%	0.407	34%	0.344	S	S	.	.	H	α-helix	trans	-62.3	-45.8	177	-177.1	176.7	-12.2	0	0	111	E272 E273 Y274 C279 E280 Y303	E272-Q276 VanDerWaalsContact O-CB 3.29Å; E272-Q276 WeakPolarHBondContact O-CB 3.34Å; E272-Q276 PolarHBondContact O-N 2.91Å; E273-Q276 PolarHBondContact O-N 3.15Å; Y274-Q276 VanDerWaalsContact C-N 3.31Å; Y274-Q276 PolarHBondContact O-N 3.46Å; Q276-C279 PolarHBondContact O-N 2.82Å; Q276-C279 VanDerWaalsContact O-N 3.16Å; Q276-E280 WeakPolarHBondContact O-CB 3.35Å; Q276-E280 PolarHBondContact O-N 3.49Å; Q276-Y303 HydrophobicContact CB-CE2 4.07Å
277	Q	92.9	Very high	92.3	Very high	112 Å²	112	68.8 Å²	68.8	52%	0.523	33%	0.325	S	S	.	.	H	α-helix	trans	-61	-46.8	178.7	-173	170.2	-5.1	0	0	111.8	E273 Y274 C279 E280 D281	E273-Q277 WeakPolarHBondContact O-CB 3.39Å; E273-Q277 PolarHBondContact O-N 3.39Å; Y274-Q277 PolarHBondContact O-N 3.38Å; Q277-C279 PolarHBondContact O-N 2.94Å; Q277-E280 PolarHBondContact O-N 3.16Å; Q277-E280 VanDerWaalsContact O-N 3.09Å; Q277-D281 PolarHBondContact O-N 2.65Å
278	L	92.8	Very high	92.6	Very high	6 Å²	6	68.2 Å²	68.2	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-36.4	175.6	-68.4	179.7	0	0	0	112.9	L245 Y274 I282 P335	L245-L278 HydrophobicContact CD2-CB 4.3Å; Y274-L278 HydrophobicContact CD1-CD1 4.05Å; Y274-L278 HydrophobicContact CE1-CD1 3.47Å; Y274-L278 VanDerWaalsContact CE1-CD1 3.47Å; Y274-L278 HydrophobicContact CE1-CG 4.24Å; Y274-L278 WeakPolarHBondContact O-CG 3.41Å; Y274-L278 PolarHBondContact O-N 2.62Å; Y274-L278 VanDerWaalsContact O-N 3.14Å; L278-I282 WeakPolarHBondContact O-CG1 3.35Å; L278-P335 HydrophobicContact CD2-CB 4.25Å; L278-P335 HydrophobicContact CD2-CG 4.07Å
279	C	93.9	Very high	92.9	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.007	30%	0.302	C	S	.	.	H	α-helix	trans	-73	-38.3	176.4	-66.6	0	0	0	0	111.4	I275 Q276 Q277 I282 I283	I275-C279 PolarHBondContact O-N 2.98Å; I275-C279 VanDerWaalsContact O-N 3.1Å; I275-C279 PolarHBondContact O-SG 3.39Å; Q276-C279 PolarHBondContact O-N 2.82Å; Q276-C279 VanDerWaalsContact O-N 3.16Å; Q277-C279 PolarHBondContact O-N 2.94Å; C279-I282 PolarHBondContact O-N 2.98Å; C279-I283 HydrophobicContact CB-CD1 4.28Å; C279-I283 WeakPolarHBondContact O-CB 3.41Å; C279-I283 VanDerWaalsContact O-CD1 3.31Å; C279-I283 WeakPolarHBondContact O-CD1 3.36Å; C279-I283 WeakPolarHBondContact O-CG1 3.31Å; C279-I283 PolarHBondContact O-N 3.27Å
280	E	94	Very high	93.1	Very high	122 Å²	122	59.8 Å²	59.8	57%	0.57	28%	0.281	S	S	*	.	H	α-helix	trans	-62.5	-43.2	179.3	-171.1	165.6	-171.2	0	0	111.6	Q276 Q277 I282 I283 Q284	Q276-E280 WeakPolarHBondContact O-CB 3.35Å; Q276-E280 PolarHBondContact O-N 3.49Å; Q277-E280 PolarHBondContact O-N 3.16Å; Q277-E280 VanDerWaalsContact O-N 3.09Å; E280-I282 VanDerWaalsContact C-N 3.26Å; E280-I282 PolarHBondContact O-N 3.15Å; E280-I283 PolarHBondContact O-N 3.02Å; E280-I283 VanDerWaalsContact O-N 3.08Å; E280-Q284 PolarHBondContact O-N 2.98Å
281	D	93.3	Very high	93.4	Very high	33 Å²	33	54.3 Å²	54.3	18%	0.176	25%	0.254	C	S	.	.	H	α-helix	trans	-55.7	-42.3	174.1	-68.6	-20.9	0	0	0	111.4	Q277 L285 E336	Q277-D281 PolarHBondContact O-N 2.65Å; D281-L285 WeakPolarHBondContact O-CD1 3.48Å; D281-E336 WeakPolarHBondContact OD2-CG 3.38Å
282	I	94.2	Very high	93.7	Very high	1 Å²	1	51 Å²	51	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-70	-42.8	176.9	-65.4	170.2	0	0	0	111.1	L241 L245 L278 C279 E280 Q284 L285 P287 V290 L304 P335 L338	L241-I282 HydrophobicContact CD1-CD1 3.7Å; L241-I282 HydrophobicContact CD1-CG1 4.46Å; L245-I282 HydrophobicContact CD1-CD1 4.17Å; L245-I282 HydrophobicContact CD2-CD1 3.7Å; L278-I282 WeakPolarHBondContact O-CG1 3.35Å; C279-I282 PolarHBondContact O-N 2.98Å; E280-I282 VanDerWaalsContact C-N 3.26Å; E280-I282 PolarHBondContact O-N 3.15Å; I282-Q284 PolarHBondContact O-N 3Å; I282-L285 PolarHBondContact O-N 3.25Å; I282-P287 HydrophobicContact CG2-CG 3.75Å; I282-P287 WeakPolarHBondContact O-CD 3.29Å; I282-V290 HydrophobicContact CG2-CG2 3.53Å; I282-L304 HydrophobicContact CG2-CD2 4.34Å; I282-P335 HydrophobicContact CD1-CB 4.44Å; I282-P335 HydrophobicContact CG1-CB 4.24Å; I282-L338 HydrophobicContact CG1-CD1 3.74Å
283	I	94.3	Very high	93.8	Very high	58 Å²	58	47.7 Å²	47.7	30%	0.297	22%	0.223	S	C	.	.	H	α-helix	trans	-65.6	-29.9	-178	-68.2	161.2	0	0	0	111.1	C279 E280 L285 K286 A307 I309	C279-I283 HydrophobicContact CB-CD1 4.28Å; C279-I283 WeakPolarHBondContact O-CB 3.41Å; C279-I283 VanDerWaalsContact O-CD1 3.31Å; C279-I283 WeakPolarHBondContact O-CD1 3.36Å; C279-I283 WeakPolarHBondContact O-CG1 3.31Å; C279-I283 PolarHBondContact O-N 3.27Å; E280-I283 PolarHBondContact O-N 3.02Å; E280-I283 VanDerWaalsContact O-N 3.08Å; I283-L285 PolarHBondContact O-N 2.98Å; I283-K286 WeakPolarHBondContact O-CA 3.42Å; I283-K286 WeakPolarHBondContact O-CG 3.41Å; I283-K286 PolarHBondContact O-N 3.05Å; I283-A307 HydrophobicContact CD1-CB 3.77Å; I283-A307 HydrophobicContact CG1-CB 3.67Å; I283-A307 HydrophobicContact CG2-CB 4.16Å; I283-I309 HydrophobicContact CG1-CD1 3.75Å
284	Q	93.2	Very high	93.9	Very high	155 Å²	155	47.3 Å²	47.3	72%	0.724	22%	0.219	S	C	*	.	H	α-helix	trans	-55.4	-39	177.9	-175.4	177	-10.4	0	0	112.3	E280 I282 K286	E280-Q284 PolarHBondContact O-N 2.98Å; I282-Q284 PolarHBondContact O-N 3Å; Q284-K286 VanDerWaalsContact C-N 3.26Å; Q284-K286 PolarHBondContact O-N 3.44Å
285	L	91.1	Very high	93.9	Very high	17 Å²	17	44.5 Å²	44.5	9%	0.089	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-11.3	177.5	-66.2	89.9	0	0	0	113.1	R237 D281 I282 I283 L338 R339 V343	R237-L285 VanDerWaalsContact CZ-O 3.31Å; R237-L285 PolarHBondContact NH1-O 3.49Å; R237-L285 PolarHBondContact NH2-O 3.03Å; D281-L285 WeakPolarHBondContact O-CD1 3.48Å; I282-L285 PolarHBondContact O-N 3.25Å; I283-L285 PolarHBondContact O-N 2.98Å; L285-L338 HydrophobicContact CD1-CB 3.89Å; L285-L338 HydrophobicContact CD2-CB 4.19Å; L285-R339 VanDerWaalsContact CD2-O 3.23Å; L285-R339 WeakPolarHBondContact CD2-O 3.46Å; L285-V343 HydrophobicContact CB-CG2 4.28Å; L285-V343 HydrophobicContact CD2-CG2 3.58Å
286	K	92.8	Very high	93.9	Very high	160 Å²	160	44.5 Å²	44.5	70%	0.696	21%	0.211	S	C	*	.			trans	51.5	56.5	-175.9	-58.4	175.1	-178.5	171.7	0	113.7	R237 I283 Q284	R237-K286 PolarHBondContact NH1-O 3.48Å; I283-K286 WeakPolarHBondContact O-CA 3.42Å; I283-K286 WeakPolarHBondContact O-CG 3.41Å; I283-K286 PolarHBondContact O-N 3.05Å; Q284-K286 VanDerWaalsContact C-N 3.26Å; Q284-K286 PolarHBondContact O-N 3.44Å
287	P	94.7	Very high	94	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.032	20%	0.201	C	C	.	.			trans	-75.9	156.6	172.5	33.7	-34.6	0	0	0	111.1	V239 I282 V290 I309	V239-P287 HydrophobicContact CB-CB 4.44Å; V239-P287 HydrophobicContact CG2-CB 3.65Å; V239-P287 HydrophobicContact CG2-CG 4.06Å; I282-P287 HydrophobicContact CG2-CG 3.75Å; I282-P287 WeakPolarHBondContact O-CD 3.29Å; P287-V290 HydrophobicContact CG-CG2 4.15Å; P287-I309 HydrophobicContact CG-CD1 4.12Å; P287-I309 HydrophobicContact CG-CG2 4.48Å; P287-I309 WeakPolarHBondContact O-CG1 3.43Å
288	D	94.8	Very high	94	Very high	39 Å²	39	41.9 Å²	41.9	21%	0.209	21%	0.205	C	C	.	.	S	Bend	trans	-90.7	-27.5	172.9	-73.9	-65.2	0	0	0	112	R230 I233 R237 I309 T310	R230-D288 IonicContact CZ-OD1 2.66Å; R230-D288 IonicContact NH1-OD1 3.27Å; R230-D288 IonicContact NH2-OD1 2.96Å; R230-D288 PolarHBondContact NH2-OD1 3.07Å; I233-D288 HydrophobicContact CD1-CB 4.33Å; I233-D288 HydrophobicContact CG2-CB 4.12Å; R237-D288 PolarHBondContact N-OD2 2.95Å; R237-D288 PolarHBondContact O-N 3.31Å; D288-I309 WeakPolarHBondContact O-CA 3.15Å; D288-T310 PolarHBondContact O-N 3.37Å
289	V	95.3	Very high	94	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	132	-171.8	-174.1	0	0	0	0	109.8	I233 P236 R237 I238 V239 I291 T310 L350	I233-V289 HydrophobicContact CD1-CG2 3.83Å; P236-V289 HydrophobicContact CB-CG2 3.72Å; R237-V289 PolarHBondContact O-N 3.04Å; I238-V289 WeakPolarHBondContact CA-O 3.45Å; I238-V289 HydrophobicContact CG1-CB 4.13Å; V239-V289 PolarHBondContact N-O 3.05Å; V289-I291 HydrophobicContact CG1-CD1 4.32Å; V289-I291 HydrophobicContact CG1-CG1 3.93Å; V289-T310 CarbonylContact C-O 3.47Å; V289-T310 WeakPolarHBondContact CA-O 3.49Å; V289-L350 HydrophobicContact CB-CD1 4.3Å; V289-L350 HydrophobicContact CG1-CD1 3.69Å; V289-L350 HydrophobicContact CG2-CD1 3.62Å
290	V	95.7	Very high	94	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	125.3	173.4	173.5	0	0	0	0	108.4	V239 L241 L245 I282 P287 T292 I309 T310 A311 I312	V239-V290 HydrophobicContact CB-CG2 4.41Å; L241-V290 HydrophobicContact CD1-CG1 4.18Å; L245-V290 HydrophobicContact CD1-CG1 4.29Å; I282-V290 HydrophobicContact CG2-CG2 3.53Å; P287-V290 HydrophobicContact CG-CG2 4.15Å; V290-T292 HydrophobicContact CG1-CG2 4.03Å; V290-I309 HydrophobicContact CB-CG2 4.23Å; V290-I309 HydrophobicContact CG2-CG2 3.55Å; V290-T310 PolarHBondContact N-O 2.95Å; V290-A311 CarbonylContact O-C 3.55Å; V290-A311 WeakPolarHBondContact O-CA 3.31Å; V290-I312 PolarHBondContact O-N 3.3Å
291	I	95.9	Very high	94	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.7	178.8	-53.2	-176.4	0	0	0	108.2	I238 V239 L240 L241 V289 I312 V315 I323 I363	I238-I291 HydrophobicContact CG2-CD1 4.03Å; I238-I291 HydrophobicContact CG2-CG1 4.36Å; V239-I291 PolarHBondContact O-N 3.34Å; L240-I291 HydrophobicContact CD2-CB 3.72Å; L240-I291 HydrophobicContact CD2-CD1 4Å; L240-I291 HydrophobicContact CD2-CG1 4.16Å; L240-I291 HydrophobicContact CD2-CG2 4.36Å; L241-I291 PolarHBondContact N-O 3.36Å; V289-I291 HydrophobicContact CG1-CD1 4.32Å; V289-I291 HydrophobicContact CG1-CG1 3.93Å; I291-I312 WeakPolarHBondContact CA-O 3.37Å; I291-I312 HydrophobicContact CD1-CD1 4.38Å; I291-I312 HydrophobicContact CG1-CB 4.34Å; I291-I312 HydrophobicContact CG1-CD1 4.34Å; I291-I312 HydrophobicContact CG2-CB 4.43Å; I291-V315 HydrophobicContact CG2-CB 3.95Å; I291-V315 HydrophobicContact CG2-CG1 4.32Å; I291-V315 HydrophobicContact CG2-CG2 3.43Å; I291-V315 VanDerWaalsContact CG2-CG2 3.43Å; I291-I323 HydrophobicContact CD1-CD1 3.99Å; I291-I323 HydrophobicContact CD1-CG2 4.21Å; I291-I323 HydrophobicContact CG2-CD1 4.43Å; I291-I363 HydrophobicContact CD1-CD1 3.78Å
292	T	95.3	Very high	94	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.7	179	70.1	0	0	0	0	111.7	L241 L245 V290 K294 I296 I312 R314 V315	L241-T292 HydrophobicContact CB-CG2 4.17Å; L241-T292 HydrophobicContact CD1-CG2 4.32Å; L241-T292 WeakPolarHBondContact O-CA 3.14Å; L245-T292 HydrophobicContact CD1-CG2 3.87Å; L245-T292 HydrophobicContact CG-CG2 4.26Å; V290-T292 HydrophobicContact CG1-CG2 4.03Å; T292-K294 VanDerWaalsContact C-N 3.26Å; T292-K294 PolarHBondContact OG1-O 3.43Å; T292-K294 VanDerWaalsContact OG1-O 3.06Å; T292-I296 HydrophobicContact CG2-CD1 3.98Å; T292-I296 HydrophobicContact CG2-CG1 4.11Å; T292-I296 WeakPolarHBondContact OG1-CG1 3.47Å; T292-I312 PolarHBondContact N-O 3.05Å; T292-R314 PolarHBondContact O-N 3.36Å; T292-R314 VanDerWaalsContact O-N 3.15Å; T292-V315 PolarHBondContact O-N 2.92Å; T292-V315 VanDerWaalsContact O-N 3.09Å
293	E	94.6	Very high	94	Very high	20 Å²	20	44.2 Å²	44.2	9%	0.093	21%	0.214	C	C	.	.	S	Bend	trans	-71.7	-24.3	172.6	-65.3	-165.4	-171.5	0	0	112.5	L241 R314 V315 K317 N320	L241-E293 PolarHBondContact O-N 2.99Å; E293-R314 WeakPolarHBondContact O-CA 3.27Å; E293-V315 WeakPolarHBondContact CA-O 3.25Å; E293-K317 WeakPolarHBondContact OE2-CB 3.48Å; E293-N320 HydrophobicContact CG-CB 4.16Å; E293-N320 VanDerWaalsContact CG-ND2 3.34Å; E293-N320 WeakPolarHBondContact CG-ND2 3.18Å; E293-N320 PolarHBondContact OE1-ND2 2.64Å
294	K	93.6	Very high	94	Very high	110 Å²	110	41.5 Å²	41.5	48%	0.478	20%	0.2	S	C	.	.	S	Bend	trans	-109	-164.3	-175.9	-54	-63	179.7	-172.8	0	111.4	D242 T292 R314	D242-K294 VanDerWaalsContact O-CG 3.23Å; D242-K294 WeakPolarHBondContact O-CG 3.5Å; T292-K294 VanDerWaalsContact C-N 3.26Å; T292-K294 PolarHBondContact OG1-O 3.43Å; T292-K294 VanDerWaalsContact OG1-O 3.06Å; K294-R314 PolarHBondContact O-N 3.08Å
295	G	92.8	Very high	94	Very high	7 Å²	7	36.2 Å²	36.2	7%	0.072	18%	0.176	C	C	.	.			trans	-76.7	167.1	177.4	0	0	0	0	0	113.3	S244 L245 E246	S244-G295 WeakPolarHBondContact CA-O 3.37Å; L245-G295 PolarHBondContact N-O 3.1Å; L245-G295 VanDerWaalsContact N-O 3.09Å; E246-G295 WeakPolarHBondContact OE1-CA 3.47Å
296	I	94.4	Very high	94.1	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-134.2	121.2	176.6	-56.1	179.3	0	0	0	105.7	T225 L245 E246 T292 A300 Q301 A311 R313	T225-I296 HydrophobicContact CG2-CD1 4.42Å; L245-I296 HydrophobicContact CB-CB 4.42Å; L245-I296 HydrophobicContact CB-CG1 4.37Å; L245-I296 HydrophobicContact CB-CG2 4.06Å; L245-I296 HydrophobicContact CD1-CD1 4.38Å; L245-I296 HydrophobicContact CD1-CG1 4.25Å; L245-I296 HydrophobicContact CD1-CG2 4.21Å; E246-I296 PolarHBondContact OE1-N 3.17Å; T292-I296 HydrophobicContact CG2-CD1 3.98Å; T292-I296 HydrophobicContact CG2-CG1 4.11Å; T292-I296 WeakPolarHBondContact OG1-CG1 3.47Å; I296-A300 HydrophobicContact CG2-CB 3.85Å; I296-Q301 HydrophobicContact CB-CG 4.44Å; I296-Q301 HydrophobicContact CG2-CG 3.74Å; I296-Q301 PolarHBondContact O-NE2 3.45Å; I296-Q301 VanDerWaalsContact O-NE2 3.12Å; I296-A311 HydrophobicContact CD1-CB 3.75Å; I296-R313 HydrophobicContact CB-CB 4.31Å; I296-R313 HydrophobicContact CD1-CB 3.76Å; I296-R313 HydrophobicContact CG1-CB 3.69Å
297	S	94.5	Very high	94.1	Very high	29 Å²	29	38.7 Å²	38.7	20%	0.203	19%	0.189	C	C	.	.			trans	-63.1	150.8	177.5	-179.8	0	0	0	0	111.2	L245 L299 A300 Q301	L245-S297 WeakPolarHBondContact O-CB 3.48Å; L245-S297 PolarHBondContact O-N 3.35Å; S297-L299 VanDerWaalsContact C-N 3.25Å; S297-L299 PolarHBondContact O-N 3.32Å; S297-A300 WeakPolarHBondContact O-CB 3.41Å; S297-A300 PolarHBondContact O-N 2.83Å; S297-A300 VanDerWaalsContact O-N 3.12Å; S297-Q301 WeakPolarHBondContact O-CG 3.33Å; S297-Q301 PolarHBondContact O-N 3.41Å
298	D	92.6	Very high	94	Very high	115 Å²	115	42.5 Å²	42.5	62%	0.615	21%	0.209	S	C	*	.	H	α-helix	trans	-64.4	-32	-179.3	-63.8	-26.6	0	0	0	112	Q301 H302	D298-Q301 WeakPolarHBondContact O-CB 3.18Å; D298-Q301 PolarHBondContact O-N 3.5Å; D298-Q301 PolarHBondContact OD1-NE2 3.03Å; D298-H302 PolarHBondContact O-N 2.98Å; D298-H302 VanDerWaalsContact O-N 3.08Å
299	L	92.9	Very high	94.1	Very high	60 Å²	60	40.8 Å²	40.8	31%	0.314	20%	0.2	S	C	.	.	H	α-helix	trans	-61.8	-46.2	171.2	-70	171.9	0	0	0	111.6	E272 I275 S297 Q301 H302 Y303	E272-L299 HydrophobicContact CG-CD1 3.95Å; I275-L299 HydrophobicContact CD1-CB 4.31Å; I275-L299 HydrophobicContact CD1-CD1 4Å; I275-L299 HydrophobicContact CG2-CB 4.12Å; S297-L299 VanDerWaalsContact C-N 3.25Å; S297-L299 PolarHBondContact O-N 3.32Å; L299-Q301 VanDerWaalsContact C-N 3.3Å; L299-Q301 PolarHBondContact O-N 2.81Å; L299-H302 WeakPolarHBondContact O-CB 3.12Å; L299-H302 PolarHBondContact O-N 3.49Å; L299-Y303 WeakPolarHBondContact O-CD2 3.49Å; L299-Y303 PolarHBondContact O-N 3.44Å; L299-Y303 VanDerWaalsContact O-N 3.09Å
300	A	94.4	Very high	94	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-40.1	176.8	0	0	0	0	0	111.4	L245 I275 I296 S297 H302 Y303 L304	L245-A300 HydrophobicContact CB-CB 4.17Å; I275-A300 HydrophobicContact CG2-CB 3.74Å; I296-A300 HydrophobicContact CG2-CB 3.85Å; S297-A300 WeakPolarHBondContact O-CB 3.41Å; S297-A300 PolarHBondContact O-N 2.83Å; S297-A300 VanDerWaalsContact O-N 3.12Å; A300-H302 VanDerWaalsContact C-N 3.3Å; A300-H302 PolarHBondContact O-N 3.43Å; A300-Y303 PolarHBondContact O-N 2.87Å; A300-L304 WeakPolarHBondContact O-CB 3.31Å; A300-L304 VanDerWaalsContact O-CG 3.28Å; A300-L304 WeakPolarHBondContact O-CG 3.47Å; A300-L304 PolarHBondContact O-N 3.12Å
301	Q	93.9	Very high	94	Very high	9 Å²	9	40.8 Å²	40.8	4%	0.042	20%	0.2	C	C	.	.	H	α-helix	trans	-61.1	-39.9	176.4	-64.2	170.5	47.2	0	0	111.9	T225 M229 I296 S297 D298 L299 M305	T225-Q301 VanDerWaalsContact CB-OE1 3.3Å; T225-Q301 PolarHBondContact O-OE1 3.03Å; T225-Q301 WeakPolarHBondContact OG1-CG 3.38Å; T225-Q301 PolarHBondContact OG1-OE1 2.94Å; M229-Q301 HydrophobicContact CE-CB 4.32Å; M229-Q301 WeakPolarHBondContact CE-O 3.47Å; I296-Q301 HydrophobicContact CB-CG 4.44Å; I296-Q301 HydrophobicContact CG2-CG 3.74Å; I296-Q301 PolarHBondContact O-NE2 3.45Å; I296-Q301 VanDerWaalsContact O-NE2 3.12Å; S297-Q301 WeakPolarHBondContact O-CG 3.33Å; S297-Q301 PolarHBondContact O-N 3.41Å; D298-Q301 WeakPolarHBondContact O-CB 3.18Å; D298-Q301 PolarHBondContact O-N 3.5Å; D298-Q301 PolarHBondContact OD1-NE2 3.03Å; L299-Q301 VanDerWaalsContact C-N 3.3Å; L299-Q301 PolarHBondContact O-N 2.81Å; Q301-M305 WeakPolarHBondContact O-CB 3.25Å; Q301-M305 PolarHBondContact O-N 3.33Å
302	H	93.1	Very high	94	Very high	95 Å²	95	40.8 Å²	40.8	44%	0.44	20%	0.2	S	C	.	.	H	α-helix	trans	-65.5	-44.9	176.8	178.5	-106.3	0	0	0	112	D298 L299 A300 M305 R306	D298-H302 PolarHBondContact O-N 2.98Å; D298-H302 VanDerWaalsContact O-N 3.08Å; L299-H302 WeakPolarHBondContact O-CB 3.12Å; L299-H302 PolarHBondContact O-N 3.49Å; A300-H302 VanDerWaalsContact C-N 3.3Å; A300-H302 PolarHBondContact O-N 3.43Å; H302-M305 PolarHBondContact O-N 2.73Å; H302-R306 WeakPolarHBondContact O-CG 3.11Å; H302-R306 PolarHBondContact O-N 3.1Å
303	Y	94	Very high	93.9	Very high	48 Å²	48	45.3 Å²	45.3	19%	0.188	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-46.8	176.8	-69.2	-54.2	0	0	0	112.5	I275 Q276 L299 A300 M305 R306 A307	I275-Y303 HydrophobicContact CG2-CD2 4.47Å; Q276-Y303 HydrophobicContact CB-CE2 4.07Å; L299-Y303 WeakPolarHBondContact O-CD2 3.49Å; L299-Y303 PolarHBondContact O-N 3.44Å; L299-Y303 VanDerWaalsContact O-N 3.09Å; A300-Y303 PolarHBondContact O-N 2.87Å; Y303-M305 VanDerWaalsContact C-N 3.33Å; Y303-M305 PolarHBondContact O-N 3.3Å; Y303-R306 PolarHBondContact O-N 2.58Å; Y303-A307 PolarHBondContact O-N 3.14Å; Y303-A307 VanDerWaalsContact O-N 3.13Å
304	L	94.4	Very high	93.9	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-40.4	175.9	-69.1	176.1	0	0	0	111.7	L245 I282 A300 R306 A307 N308 I309 A311	L245-L304 HydrophobicContact CD1-CD1 4.07Å; I282-L304 HydrophobicContact CG2-CD2 4.34Å; A300-L304 WeakPolarHBondContact O-CB 3.31Å; A300-L304 VanDerWaalsContact O-CG 3.28Å; A300-L304 WeakPolarHBondContact O-CG 3.47Å; A300-L304 PolarHBondContact O-N 3.12Å; L304-R306 PolarHBondContact O-N 3.32Å; L304-A307 CarbonylContact O-C 3.36Å; L304-A307 PolarHBondContact O-N 3.45Å; L304-N308 PolarHBondContact O-N 3.49Å; L304-I309 HydrophobicContact CB-CB 4.24Å; L304-I309 HydrophobicContact CD2-CB 4.25Å; L304-I309 HydrophobicContact CD2-CD1 3.9Å; L304-I309 HydrophobicContact CD2-CG2 4.34Å; L304-I309 PolarHBondContact O-N 3.06Å; L304-A311 HydrophobicContact CD1-CB 3.96Å
305	M	93.8	Very high	93.9	Very high	45 Å²	45	47 Å²	47	22%	0.222	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-43.8	175.8	-178.6	-163.1	151.7	0	0	111.7	H226 R228 M229 Q301 H302 Y303 A307 N308	H226-M305 PolarHBondContact CE1-SD 3.47Å; H226-M305 PolarHBondContact ND1-SD 2.77Å; H226-M305 VanDerWaalsContact ND1-SD 3.44Å; R228-M305 HydrophobicContact CB-CE 3.51Å; R228-M305 HydrophobicContact CB-SD 3.96Å; R228-M305 HydrophobicContact CG-CE 4.29Å; M229-M305 HydrophobicContact CE-CB 4.16Å; Q301-M305 WeakPolarHBondContact O-CB 3.25Å; Q301-M305 PolarHBondContact O-N 3.33Å; H302-M305 PolarHBondContact O-N 2.73Å; Y303-M305 VanDerWaalsContact C-N 3.33Å; Y303-M305 PolarHBondContact O-N 3.3Å; M305-A307 PolarHBondContact O-N 3.34Å; M305-N308 WeakPolarHBondContact O-CA 3.44Å; M305-N308 PolarHBondContact O-N 2.92Å
306	R	92.7	Very high	94	Very high	188 Å²	188	55 Å²	55	71%	0.709	25%	0.248	S	C	*	.	H	α-helix	trans	-61.8	-35.1	177.5	-75.4	-178.1	65.7	-171.7	0.5	112.2	H302 Y303 L304 N308	H302-R306 WeakPolarHBondContact O-CG 3.11Å; H302-R306 PolarHBondContact O-N 3.1Å; Y303-R306 PolarHBondContact O-N 2.58Å; L304-R306 PolarHBondContact O-N 3.32Å; R306-N308 PolarHBondContact O-N 3.48Å
307	A	92.8	Very high	93.9	Very high	41 Å²	41	60.3 Å²	60.3	34%	0.339	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	4.1	173.1	0	0	0	0	0	113.8	I283 Y303 L304 M305 I309	I283-A307 HydrophobicContact CD1-CB 3.77Å; I283-A307 HydrophobicContact CG1-CB 3.67Å; I283-A307 HydrophobicContact CG2-CB 4.16Å; Y303-A307 PolarHBondContact O-N 3.14Å; Y303-A307 VanDerWaalsContact O-N 3.13Å; L304-A307 CarbonylContact O-C 3.36Å; L304-A307 PolarHBondContact O-N 3.45Å; M305-A307 PolarHBondContact O-N 3.34Å; A307-I309 VanDerWaalsContact C-N 3.31Å; A307-I309 HydrophobicContact CB-CD1 3.85Å; A307-I309 HydrophobicContact CB-CG1 3.88Å; A307-I309 PolarHBondContact O-N 3.28Å
308	N	93.2	Very high	93.8	Very high	85 Å²	85	63.2 Å²	63.2	46%	0.455	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	28.5	-179.2	-158.7	18.7	0	0	0	114.5	R230 L304 M305 R306	R230-N308 WeakPolarHBondContact CD-OD1 3.1Å; R230-N308 PolarHBondContact NE-ND2 3.43Å; R230-N308 PolarHBondContact NE-O 3.15Å; R230-N308 PolarHBondContact NE-OD1 3.08Å; R230-N308 PolarHBondContact NH2-O 3.46Å; L304-N308 PolarHBondContact O-N 3.49Å; M305-N308 WeakPolarHBondContact O-CA 3.44Å; M305-N308 PolarHBondContact O-N 2.92Å; R306-N308 PolarHBondContact O-N 3.48Å
309	I	95.4	Very high	93.8	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-98.1	131.5	-178.5	-48.7	179.9	0	0	0	109.4	I283 P287 D288 V290 L304 A307	I283-I309 HydrophobicContact CG1-CD1 3.75Å; P287-I309 HydrophobicContact CG-CD1 4.12Å; P287-I309 HydrophobicContact CG-CG2 4.48Å; P287-I309 WeakPolarHBondContact O-CG1 3.43Å; D288-I309 WeakPolarHBondContact O-CA 3.15Å; V290-I309 HydrophobicContact CB-CG2 4.23Å; V290-I309 HydrophobicContact CG2-CG2 3.55Å; L304-I309 HydrophobicContact CB-CB 4.24Å; L304-I309 HydrophobicContact CD2-CB 4.25Å; L304-I309 HydrophobicContact CD2-CD1 3.9Å; L304-I309 HydrophobicContact CD2-CG2 4.34Å; L304-I309 PolarHBondContact O-N 3.06Å; A307-I309 VanDerWaalsContact C-N 3.31Å; A307-I309 HydrophobicContact CB-CD1 3.85Å; A307-I309 HydrophobicContact CB-CG1 3.88Å; A307-I309 PolarHBondContact O-N 3.28Å
310	T	95.1	Very high	93.8	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.6	177.2	-57.3	0	0	0	0	110	V224 M229 R230 D288 V289 V290	V224-T310 HydrophobicContact CG1-CG2 3.64Å; M229-T310 HydrophobicContact CB-CG2 4.42Å; R230-T310 WeakPolarHBondContact O-CG2 3.27Å; R230-T310 PolarHBondContact O-OG1 2.93Å; D288-T310 PolarHBondContact O-N 3.37Å; V289-T310 CarbonylContact C-O 3.47Å; V289-T310 WeakPolarHBondContact CA-O 3.49Å; V290-T310 PolarHBondContact N-O 2.95Å
311	A	95.1	Very high	93.8	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.1	-177.4	0	0	0	0	0	111.3	T225 M229 V290 I296 L304	T225-A311 HydrophobicContact CG2-CB 4.45Å; T225-A311 PolarHBondContact N-O 3.38Å; M229-A311 HydrophobicContact CE-CB 3.94Å; M229-A311 HydrophobicContact SD-CB 4.18Å; M229-A311 PolarHBondContact SD-N 3.36Å; V290-A311 CarbonylContact O-C 3.55Å; V290-A311 WeakPolarHBondContact O-CA 3.31Å; I296-A311 HydrophobicContact CD1-CB 3.75Å; L304-A311 HydrophobicContact CD1-CB 3.96Å
312	I	94.9	Very high	93.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.3	172.2	-56.1	175.5	0	0	0	107.9	K222 V290 I291 T292 V315 T361	K222-I312 HydrophobicContact CB-CG2 3.79Å; K222-I312 HydrophobicContact CG-CG2 4.32Å; V290-I312 PolarHBondContact O-N 3.3Å; I291-I312 WeakPolarHBondContact CA-O 3.37Å; I291-I312 HydrophobicContact CD1-CD1 4.38Å; I291-I312 HydrophobicContact CG1-CB 4.34Å; I291-I312 HydrophobicContact CG1-CD1 4.34Å; I291-I312 HydrophobicContact CG2-CB 4.43Å; T292-I312 PolarHBondContact N-O 3.05Å; I312-V315 HydrophobicContact CG2-CG2 3.69Å; I312-T361 HydrophobicContact CD1-CG2 3.72Å
313	R	94.3	Very high	93.7	Very high	94 Å²	94	54 Å²	54	36%	0.355	24%	0.242	S	C	.	.			trans	-110.5	157.3	-176	71	-175.8	176	-176.1	-1.4	112.8	T225 I296 V315	T225-R313 HydrophobicContact CG2-CB 4.08Å; T225-R313 HydrophobicContact CG2-CG 3.74Å; I296-R313 HydrophobicContact CB-CB 4.31Å; I296-R313 HydrophobicContact CD1-CB 3.76Å; I296-R313 HydrophobicContact CG1-CB 3.69Å; R313-V315 VanDerWaalsContact C-N 3.35Å; R313-V315 PolarHBondContact O-N 3.11Å
314	R	93.7	Very high	93.6	Very high	160 Å²	160	52.5 Å²	52.5	60%	0.604	24%	0.239	S	C	*	.	S	Bend	trans	58.5	43.1	173	-56.7	-177.7	-179	-140.7	-0.3	113	K222 T292 E293 K294	K222-R314 WeakPolarHBondContact CE-O 3.35Å; T292-R314 PolarHBondContact O-N 3.36Å; T292-R314 VanDerWaalsContact O-N 3.15Å; E293-R314 WeakPolarHBondContact O-CA 3.27Å; K294-R314 PolarHBondContact O-N 3.08Å
315	V	94.7	Very high	93.4	Very high	6 Å²	6	56.4 Å²	56.4	4%	0.036	25%	0.254	C	S	.	.			trans	-76.6	141.1	172.6	180	0	0	0	0	109.7	I220 I291 T292 E293 I312 R313 D319 I323	I220-V315 HydrophobicContact CG2-CG2 4.43Å; I291-V315 HydrophobicContact CG2-CB 3.95Å; I291-V315 HydrophobicContact CG2-CG1 4.32Å; I291-V315 HydrophobicContact CG2-CG2 3.43Å; I291-V315 VanDerWaalsContact CG2-CG2 3.43Å; T292-V315 PolarHBondContact O-N 2.92Å; T292-V315 VanDerWaalsContact O-N 3.09Å; E293-V315 WeakPolarHBondContact CA-O 3.25Å; I312-V315 HydrophobicContact CG2-CG2 3.69Å; R313-V315 VanDerWaalsContact C-N 3.35Å; R313-V315 PolarHBondContact O-N 3.11Å; V315-D319 HydrophobicContact CG1-CB 3.84Å; V315-I323 HydrophobicContact CG1-CD1 4.28Å
316	R	94	Very high	93.2	Very high	176 Å²	176	54.4 Å²	54.4	66%	0.664	24%	0.244	S	C	*	.			trans	-68.5	141	176.9	-65.2	179.7	179.3	-177.9	2.3	109.3	T318 D319 N320	R316-T318 PolarHBondContact O-N 3.46Å; R316-T318 VanDerWaalsContact O-N 3.13Å; R316-D319 WeakPolarHBondContact O-CA 3.47Å; R316-D319 PolarHBondContact O-N 3.03Å; R316-N320 PolarHBondContact O-N 3.47Å
317	K	92.4	Very high	93	Very high	113 Å²	113	45.6 Å²	45.6	49%	0.491	21%	0.212	S	C	.	.	H	α-helix	trans	-51.2	-38.4	175.6	-171.3	157.6	-169.3	144.5	0	113.7	D242 E293 D319 N320 N321	D242-K317 IonicContact OD2-NZ 2.67Å; D242-K317 PolarHBondContact OD2-NZ 3.07Å; E293-K317 WeakPolarHBondContact OE2-CB 3.48Å; K317-D319 PolarHBondContact O-N 3.32Å; K317-N320 PolarHBondContact O-N 3.09Å; K317-N321 VanDerWaalsContact O-CG 3.23Å; K317-N321 PolarHBondContact O-N 2.83Å; K317-N321 PolarHBondContact O-ND2 3.21Å
318	T	92.2	Very high	92.8	Very high	90 Å²	90	46.3 Å²	46.3	55%	0.552	22%	0.223	S	C	*	.	H	α-helix	trans	-62.4	-40.6	175.4	54.6	0	0	0	0	112.6	R316 R322	R316-T318 PolarHBondContact O-N 3.46Å; R316-T318 VanDerWaalsContact O-N 3.13Å; T318-R322 WeakPolarHBondContact O-CD 3.36Å; T318-R322 VanDerWaalsContact O-CG 3.26Å; T318-R322 WeakPolarHBondContact O-CG 2.83Å; T318-R322 PolarHBondContact O-N 2.76Å
319	D	93.1	Very high	92.8	Very high	7 Å²	7	42.6 Å²	42.6	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-73.4	-38.7	177	-66.7	-36.1	0	0	0	109.9	K200 V315 R316 K317 N321 R322 I323	K200-D319 WeakPolarHBondContact CD-OD1 3.5Å; K200-D319 IonicContact NZ-OD1 2.58Å; K200-D319 PolarHBondContact NZ-OD1 3.17Å; K200-D319 IonicContact NZ-OD2 3.44Å; K200-D319 PolarHBondContact NZ-OD2 3.11Å; V315-D319 HydrophobicContact CG1-CB 3.84Å; R316-D319 WeakPolarHBondContact O-CA 3.47Å; R316-D319 PolarHBondContact O-N 3.03Å; K317-D319 PolarHBondContact O-N 3.32Å; D319-N321 PolarHBondContact O-N 3.07Å; D319-R322 WeakPolarHBondContact O-CB 3.4Å; D319-R322 PolarHBondContact O-N 3.48Å; D319-R322 IonicContact OD1-NH1 3.79Å; D319-I323 VanDerWaalsContact O-CG1 3.24Å; D319-I323 WeakPolarHBondContact O-CG1 3.25Å; D319-I323 PolarHBondContact O-N 2.99Å
320	N	93.4	Very high	92.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.9	-46.4	176.4	-159.3	24.8	0	0	0	112.4	L240 E293 R316 K317 R322 I323 A324 I331	L240-N320 WeakPolarHBondContact CD2-OD1 3.35Å; E293-N320 HydrophobicContact CG-CB 4.16Å; E293-N320 VanDerWaalsContact CG-ND2 3.34Å; E293-N320 WeakPolarHBondContact CG-ND2 3.18Å; E293-N320 PolarHBondContact OE1-ND2 2.64Å; R316-N320 PolarHBondContact O-N 3.47Å; K317-N320 PolarHBondContact O-N 3.09Å; N320-R322 PolarHBondContact O-N 3.44Å; N320-I323 PolarHBondContact O-N 3.06Å; N320-A324 WeakPolarHBondContact O-CB 3.43Å; N320-A324 PolarHBondContact O-N 3.49Å; N320-I331 HydrophobicContact CB-CD1 4.36Å
321	N	92.9	Very high	92.6	Very high	74 Å²	74	52.8 Å²	52.8	40%	0.396	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-34.7	174.3	-70.1	-22.2	0	0	0	112.9	K317 D319 R325 I331	K317-N321 VanDerWaalsContact O-CG 3.23Å; K317-N321 PolarHBondContact O-N 2.83Å; K317-N321 PolarHBondContact O-ND2 3.21Å; D319-N321 PolarHBondContact O-N 3.07Å; N321-R325 WeakPolarHBondContact O-CB 3.46Å; N321-R325 PolarHBondContact O-N 2.93Å; N321-I331 WeakPolarHBondContact OD1-CD1 3.23Å
322	R	92.3	Very high	92.6	Very high	5 Å²	5	53.5 Å²	53.5	2%	0.019	25%	0.251	C	S	.	.	H	α-helix	trans	-74	-39.8	177.4	-68.6	170.3	70.8	-128.8	-5.8	111.4	K197 Y198 K200 V218 T318 D319 N320 A324 R325 A326 A371 C372 T373	K197-R322 WeakPolarHBondContact O-CD 3.39Å; K197-R322 WeakPolarHBondContact O-CG 3.06Å; Y198-R322 HydrophobicContact CD1-CG 4.34Å; Y198-R322 PolarHBondContact O-NE 3.35Å; Y198-R322 PolarHBondContact O-NH2 2.97Å; K200-R322 VanDerWaalsContact CB-NH2 3.33Å; V218-R322 HydrophobicContact CG2-CB 3.91Å; T318-R322 WeakPolarHBondContact O-CD 3.36Å; T318-R322 VanDerWaalsContact O-CG 3.26Å; T318-R322 WeakPolarHBondContact O-CG 2.83Å; T318-R322 PolarHBondContact O-N 2.76Å; D319-R322 WeakPolarHBondContact O-CB 3.4Å; D319-R322 PolarHBondContact O-N 3.48Å; D319-R322 IonicContact OD1-NH1 3.79Å; N320-R322 PolarHBondContact O-N 3.44Å; R322-A324 VanDerWaalsContact C-N 3.35Å; R322-R325 PolarHBondContact O-N 3.03Å; R322-A326 WeakPolarHBondContact O-CB 3.32Å; R322-A326 PolarHBondContact O-N 2.7Å; R322-A371 HydrophobicContact CB-CB 4.14Å; R322-A371 HydrophobicContact CG-CB 4.48Å; R322-C372 PolarHBondContact NH2-O 3.16Å; R322-T373 PolarHBondContact NH1-OG1 3.25Å; R322-T373 PolarHBondContact NH2-OG1 2.65Å
323	I	92.9	Very high	92.5	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-44.5	175.4	-59.6	158.8	0	0	0	109.9	V218 I220 I238 L240 I291 V315 D319 N320 R325 A326 C327 I363	V218-I323 HydrophobicContact CB-CG1 4.02Å; V218-I323 HydrophobicContact CG1-CG1 3.88Å; V218-I323 HydrophobicContact CG2-CG1 4.21Å; I220-I323 HydrophobicContact CD1-CD1 3.38Å; I220-I323 HydrophobicContact CD1-CG1 4.24Å; I220-I323 HydrophobicContact CG1-CD1 4.32Å; I238-I323 HydrophobicContact CG2-CG2 4.39Å; L240-I323 HydrophobicContact CD1-CB 4.3Å; L240-I323 HydrophobicContact CD1-CG2 4.19Å; L240-I323 HydrophobicContact CD2-CB 4.38Å; L240-I323 HydrophobicContact CD2-CG2 3.84Å; I291-I323 HydrophobicContact CD1-CD1 3.99Å; I291-I323 HydrophobicContact CD1-CG2 4.21Å; I291-I323 HydrophobicContact CG2-CD1 4.43Å; V315-I323 HydrophobicContact CG1-CD1 4.28Å; D319-I323 VanDerWaalsContact O-CG1 3.24Å; D319-I323 WeakPolarHBondContact O-CG1 3.25Å; D319-I323 PolarHBondContact O-N 2.99Å; N320-I323 PolarHBondContact O-N 3.06Å; I323-R325 VanDerWaalsContact C-N 3.26Å; I323-R325 PolarHBondContact O-N 3.43Å; I323-A326 PolarHBondContact O-N 2.88Å; I323-C327 WeakPolarHBondContact O-CB 3.45Å; I323-C327 PolarHBondContact O-N 2.96Å; I323-C327 PolarHBondContact O-SG 3.33Å; I323-I363 HydrophobicContact CD1-CD1 4.36Å; I323-I363 HydrophobicContact CG1-CD1 4.2Å; I323-I363 HydrophobicContact CG2-CD1 3.89Å
324	A	92.8	Very high	92.3	Very high	15 Å²	15	59.7 Å²	59.7	12%	0.124	29%	0.285	C	S	.	.	H	α-helix	trans	-53.4	-47.2	174.8	0	0	0	0	0	111	L240 N320 R322 G328 A329 I331	L240-A324 VanDerWaalsContact CD1-CA 3.42Å; L240-A324 HydrophobicContact CD1-CB 3.54Å; N320-A324 WeakPolarHBondContact O-CB 3.43Å; N320-A324 PolarHBondContact O-N 3.49Å; R322-A324 VanDerWaalsContact C-N 3.35Å; A324-G328 CarbonylContact O-C 3.6Å; A324-G328 VanDerWaalsContact O-CA 3.26Å; A324-G328 WeakPolarHBondContact O-CA 3.32Å; A324-G328 PolarHBondContact O-N 3.43Å; A324-A329 WeakPolarHBondContact CA-O 3.5Å; A324-A329 WeakPolarHBondContact CB-O 3.32Å; A324-A329 PolarHBondContact O-N 3.16Å; A324-A329 VanDerWaalsContact O-N 3.17Å; A324-I331 HydrophobicContact CB-CD1 4.09Å; A324-I331 HydrophobicContact CB-CG1 3.95Å
325	R	89.7	Confident	92.1	Very high	82 Å²	82	52.4 Å²	52.4	31%	0.309	26%	0.259	S	S	.	.	H	α-helix	trans	-71.5	-35.8	-178.8	-161.9	60.7	173.6	-174	0.8	113.4	F185 Y198 N321 R322 I323 K370	F185-R325 VanDerWaalsContact CE2-NH2 3.31Å; Y198-R325 HydrophobicContact CD1-CB 4.42Å; Y198-R325 HydrophobicContact CD1-CG 4.23Å; Y198-R325 HydrophobicContact CE1-CB 4.11Å; Y198-R325 HydrophobicContact CE1-CG 3.89Å; N321-R325 WeakPolarHBondContact O-CB 3.46Å; N321-R325 PolarHBondContact O-N 2.93Å; R322-R325 PolarHBondContact O-N 3.03Å; I323-R325 VanDerWaalsContact C-N 3.26Å; I323-R325 PolarHBondContact O-N 3.43Å; R325-K370 HydrophobicContact CG-CB 3.69Å; R325-K370 HydrophobicContact CG-CD 4.5Å
326	A	90.1	Very high	91.9	Very high	3 Å²	3	58 Å²	58	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-74.2	-38.4	177.8	0	0	0	0	0	113.1	V218 R322 I323 C366 A371	V218-A326 HydrophobicContact CG2-CB 4.1Å; R322-A326 WeakPolarHBondContact O-CB 3.32Å; R322-A326 PolarHBondContact O-N 2.7Å; I323-A326 PolarHBondContact O-N 2.88Å; A326-C366 WeakPolarHBondContact O-CB 3.44Å; A326-A371 HydrophobicContact CB-CB 4.44Å
327	C	89.1	Confident	91.8	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.02	28%	0.279	C	S	.	.	H	α-helix	trans	-97.2	-12.3	-174.5	-51.4	0	0	0	0	113.2	I238 I323 A329 G344 G346	I238-C327 HydrophobicContact CD1-CB 4.13Å; I238-C327 WeakPolarHBondContact CD1-SG 3.46Å; I323-C327 WeakPolarHBondContact O-CB 3.45Å; I323-C327 PolarHBondContact O-N 2.96Å; I323-C327 PolarHBondContact O-SG 3.33Å; C327-A329 VanDerWaalsContact C-N 3.27Å; C327-G344 WeakPolarHBondContact O-CA 3.46Å; C327-G346 WeakPolarHBondContact O-CA 3.42Å; C327-G346 PolarHBondContact O-N 3.15Å
328	G	88.3	Confident	91.8	Very high	57 Å²	57	50.9 Å²	50.9	59%	0.588	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	14.4	-172	0	0	0	0	0	114.2	A324	A324-G328 CarbonylContact O-C 3.6Å; A324-G328 VanDerWaalsContact O-CA 3.26Å; A324-G328 WeakPolarHBondContact O-CA 3.32Å; A324-G328 PolarHBondContact O-N 3.43Å
329	A	91.9	Very high	91.9	Very high	7 Å²	7	54.9 Å²	54.9	6%	0.058	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-76.1	151.4	177.3	0	0	0	0	0	111.2	L240 A324 C327 D342	L240-A329 HydrophobicContact CD1-CB 3.74Å; L240-A329 HydrophobicContact CG-CB 3.9Å; A324-A329 WeakPolarHBondContact CA-O 3.5Å; A324-A329 WeakPolarHBondContact CB-O 3.32Å; A324-A329 PolarHBondContact O-N 3.16Å; A324-A329 VanDerWaalsContact O-N 3.17Å; C327-A329 VanDerWaalsContact C-N 3.27Å; A329-D342 WeakPolarHBondContact CA-O 3.42Å
330	R	92.9	Very high	91.8	Very high	162 Å²	162	59.9 Å²	59.9	61%	0.611	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-98.6	139.9	169.3	-65.1	-178.2	125.3	158.8	-2.3	109.8	D342	R330-D342 HydrophobicContact CB-CB 4.09Å; R330-D342 WeakPolarHBondContact CB-OD1 3.32Å; R330-D342 VanDerWaalsContact CD-OD1 3.22Å; R330-D342 WeakPolarHBondContact CD-OD1 3.36Å; R330-D342 PolarHBondContact N-O 2.65Å; R330-D342 VanDerWaalsContact N-O 3.08Å
331	I	94.8	Very high	91.7	Very high	55 Å²	55	65.8 Å²	65.8	28%	0.282	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	119.7	176	-58.6	170	0	0	0	107.5	L240 D242 N320 N321 A324	L240-I331 HydrophobicContact CB-CG1 4.07Å; L240-I331 HydrophobicContact CD1-CG1 4.05Å; D242-I331 HydrophobicContact CB-CG2 4.31Å; N320-I331 HydrophobicContact CB-CD1 4.36Å; N321-I331 WeakPolarHBondContact OD1-CD1 3.23Å; A324-I331 HydrophobicContact CB-CD1 4.09Å; A324-I331 HydrophobicContact CB-CG1 3.95Å
332	V	94.8	Very high	91.6	Very high	15 Å²	15	63.2 Å²	63.2	9%	0.091	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140.3	-178.9	-177.4	0	0	0	0	109.5	L240 L241 D242 R334 E337 L338 D342	L240-V332 PolarHBondContact O-N 3.49Å; L241-V332 VanDerWaalsContact CA-O 3.28Å; L241-V332 WeakPolarHBondContact CA-O 3.39Å; L241-V332 HydrophobicContact CD2-CB 4.28Å; L241-V332 WeakPolarHBondContact CD2-O 3.38Å; D242-V332 PolarHBondContact N-O 3.28Å; D242-V332 VanDerWaalsContact N-O 3.09Å; V332-R334 VanDerWaalsContact CG1-O 3.24Å; V332-R334 WeakPolarHBondContact CG1-O 3.22Å; V332-E337 HydrophobicContact CG1-CB 4.5Å; V332-L338 HydrophobicContact CB-CD2 3.8Å; V332-L338 HydrophobicContact CG1-CD2 4.06Å; V332-L338 HydrophobicContact CG1-CG 4.42Å; V332-L338 HydrophobicContact CG2-CD2 3.88Å; V332-D342 HydrophobicContact CG2-CB 3.85Å
333	S	91.9	Very high	91.6	Very high	74 Å²	74	63.5 Å²	63.5	52%	0.517	31%	0.309	S	S	.	.	S	Bend	trans	-91.5	-25.1	-178.9	-172.9	0	0	0	0	113.5	S243	S243-S333 WeakPolarHBondContact CB-O 3.5Å; S243-S333 PolarHBondContact OG-O 3.13Å; S243-S333 VanDerWaalsContact OG-O 3.1Å
334	R	90.7	Very high	91.5	Very high	150 Å²	150	63.6 Å²	63.6	57%	0.566	31%	0.31	S	S	*	.			trans	-122.1	122.6	-178.5	-73.3	-176.1	168.7	-170.1	-5.8	109.5	V332 E336 E337	V332-R334 VanDerWaalsContact CG1-O 3.24Å; V332-R334 WeakPolarHBondContact CG1-O 3.22Å; R334-E336 PolarHBondContact O-N 2.93Å; R334-E337 HydrophobicContact CB-CB 4.43Å; R334-E337 HydrophobicContact CB-CG 4.3Å; R334-E337 PolarHBondContact O-N 3.43Å; R334-E337 VanDerWaalsContact O-N 3.13Å
335	P	90.1	Very high	91.4	Very high	7 Å²	7	67 Å²	67	5%	0.045	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-57.3	-35.3	177.7	-28.1	38	0	0	0	113.4	L241 L245 L278 I282 E337 L338	L241-P335 HydrophobicContact CD1-CG 4.32Å; L245-P335 HydrophobicContact CD2-CG 4.46Å; L278-P335 HydrophobicContact CD2-CB 4.25Å; L278-P335 HydrophobicContact CD2-CG 4.07Å; I282-P335 HydrophobicContact CD1-CB 4.44Å; I282-P335 HydrophobicContact CG1-CB 4.24Å; P335-E337 PolarHBondContact O-N 3.34Å; P335-L338 HydrophobicContact CB-CD1 4.33Å; P335-L338 VanDerWaalsContact O-CB 3.24Å; P335-L338 WeakPolarHBondContact O-CB 3.29Å; P335-L338 WeakPolarHBondContact O-CD1 3.37Å; P335-L338 WeakPolarHBondContact O-CG 3.49Å; P335-L338 PolarHBondContact O-N 2.9Å; P335-L338 VanDerWaalsContact O-N 3.1Å
336	E	90.4	Very high	91.3	Very high	122 Å²	122	63.9 Å²	63.9	57%	0.57	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-59.9	-26.3	177.8	-64.3	169	-156.8	0	0	113.9	D281 R334	D281-E336 WeakPolarHBondContact OD2-CG 3.38Å; R334-E336 PolarHBondContact O-N 2.93Å
337	E	92.1	Very high	91.2	Very high	119 Å²	119	63.8 Å²	63.8	56%	0.556	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-92.7	1.4	-178.7	-70.5	178.9	-171.6	0	0	112.9	V332 R334 P335 R339	V332-E337 HydrophobicContact CG1-CB 4.5Å; R334-E337 HydrophobicContact CB-CB 4.43Å; R334-E337 HydrophobicContact CB-CG 4.3Å; R334-E337 PolarHBondContact O-N 3.43Å; R334-E337 VanDerWaalsContact O-N 3.13Å; P335-E337 PolarHBondContact O-N 3.34Å; E337-R339 PolarHBondContact O-N 3.35Å
338	L	92.6	Very high	91.2	Very high	21 Å²	21	64.1 Å²	64.1	11%	0.11	33%	0.326	C	S	.	.			trans	-60.5	128.4	-177.9	-76.9	170	0	0	0	111.5	V239 L241 I282 L285 V332 P335	V239-L338 HydrophobicContact CG1-CD1 4.14Å; V239-L338 HydrophobicContact CG1-CD2 3.82Å; L241-L338 HydrophobicContact CD2-CD1 4.29Å; L241-L338 HydrophobicContact CD2-CD2 4.09Å; L241-L338 HydrophobicContact CD2-CG 4.43Å; I282-L338 HydrophobicContact CG1-CD1 3.74Å; L285-L338 HydrophobicContact CD1-CB 3.89Å; L285-L338 HydrophobicContact CD2-CB 4.19Å; V332-L338 HydrophobicContact CB-CD2 3.8Å; V332-L338 HydrophobicContact CG1-CD2 4.06Å; V332-L338 HydrophobicContact CG1-CG 4.42Å; V332-L338 HydrophobicContact CG2-CD2 3.88Å; P335-L338 HydrophobicContact CB-CD1 4.33Å; P335-L338 VanDerWaalsContact O-CB 3.24Å; P335-L338 WeakPolarHBondContact O-CB 3.29Å; P335-L338 WeakPolarHBondContact O-CD1 3.37Å; P335-L338 WeakPolarHBondContact O-CG 3.49Å; P335-L338 PolarHBondContact O-N 2.9Å; P335-L338 VanDerWaalsContact O-N 3.1Å
339	R	92.5	Very high	91.5	Very high	174 Å²	174	62.3 Å²	62.3	66%	0.657	30%	0.302	S	S	*	.			trans	-115.8	159.6	174	-58.4	-178.8	-173	-163.1	-0.1	110.6	L285 E337 D341 D342	L285-R339 VanDerWaalsContact CD2-O 3.23Å; L285-R339 WeakPolarHBondContact CD2-O 3.46Å; E337-R339 PolarHBondContact O-N 3.35Å; R339-D341 PolarHBondContact O-N 3.1Å; R339-D341 VanDerWaalsContact O-N 3.16Å; R339-D342 PolarHBondContact N-OD2 2.95Å; R339-D342 WeakPolarHBondContact O-CB 3.15Å; R339-D342 PolarHBondContact O-N 2.93Å
340	E	91	Very high	91.6	Very high	112 Å²	112	62 Å²	62	52%	0.523	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-57.2	-30.6	174.6	-168.3	68.5	-177.2	0	0	111.8	R237 D342 V343	R237-E340 IonicContact CZ-OE1 3.7Å; R237-E340 VanDerWaalsContact NH2-CD 3.29Å; R237-E340 IonicContact NH2-OE1 2.81Å; R237-E340 PolarHBondContact NH2-OE1 3.09Å; R237-E340 IonicContact NH2-OE2 3.72Å; R237-E340 PolarHBondContact NH2-OE2 2.91Å; E340-D342 PolarHBondContact O-N 3.45Å; E340-V343 PolarHBondContact O-N 3.41Å
341	D	91.2	Very high	91.7	Very high	125 Å²	125	57.3 Å²	57.3	67%	0.668	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-66	-17.9	176.1	-60.7	-30.7	0	0	0	113.9	R339	R339-D341 PolarHBondContact O-N 3.1Å; R339-D341 VanDerWaalsContact O-N 3.16Å
342	D	91.8	Very high	91.7	Very high	19 Å²	19	55.4 Å²	55.4	10%	0.102	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-88.1	-16.1	-179	-57.3	-43.5	0	0	0	112.2	A329 R330 V332 R339 E340 G344	A329-D342 WeakPolarHBondContact CA-O 3.42Å; R330-D342 HydrophobicContact CB-CB 4.09Å; R330-D342 WeakPolarHBondContact CB-OD1 3.32Å; R330-D342 VanDerWaalsContact CD-OD1 3.22Å; R330-D342 WeakPolarHBondContact CD-OD1 3.36Å; R330-D342 PolarHBondContact N-O 2.65Å; R330-D342 VanDerWaalsContact N-O 3.08Å; V332-D342 HydrophobicContact CG2-CB 3.85Å; R339-D342 PolarHBondContact N-OD2 2.95Å; R339-D342 WeakPolarHBondContact O-CB 3.15Å; R339-D342 PolarHBondContact O-N 2.93Å; E340-D342 PolarHBondContact O-N 3.45Å; D342-G344 PolarHBondContact O-N 3.16Å
343	V	92.6	Very high	91.6	Very high	12 Å²	12	60.1 Å²	60.1	7%	0.073	29%	0.294	C	S	.	.			trans	-76.6	116.5	-177	-175.9	0	0	0	0	110.8	R237 V239 L285 E340 T345	R237-V343 HydrophobicContact CB-CG1 3.91Å; V239-V343 HydrophobicContact CG2-CG1 4.48Å; V239-V343 HydrophobicContact CG2-CG2 4Å; L285-V343 HydrophobicContact CB-CG2 4.28Å; L285-V343 HydrophobicContact CD2-CG2 3.58Å; E340-V343 PolarHBondContact O-N 3.41Å; V343-T345 PolarHBondContact O-N 3.32Å
344	G	91	Very high	91.5	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.01	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-76	120.3	174.7	0	0	0	0	0	111.8	I238 C327 D342	I238-G344 PolarHBondContact N-O 3.04Å; I238-G344 PolarHBondContact O-N 2.78Å; C327-G344 WeakPolarHBondContact O-CA 3.46Å; D342-G344 PolarHBondContact O-N 3.16Å
345	T	91.1	Very high	91.4	Very high	88 Å²	88	55.6 Å²	55.6	54%	0.54	27%	0.271	S	S	.	.			trans	-110.1	7	172.9	39	0	0	0	0	112.6	R237 V343 A347	R237-T345 HydrophobicContact CG-CG2 4.08Å; V343-T345 PolarHBondContact O-N 3.32Å; T345-A347 VanDerWaalsContact C-N 3.34Å; T345-A347 PolarHBondContact O-N 3.31Å
346	G	85.8	Confident	91.1	Very high	15 Å²	15	58.1 Å²	58.1	16%	0.155	30%	0.297	C	S	.	.			trans	-77.5	-12	-174.4	0	0	0	0	0	115.4	C327 C366 K367	C327-G346 WeakPolarHBondContact O-CA 3.42Å; C327-G346 PolarHBondContact O-N 3.15Å; G346-C366 CarbonylContact O-C 3.49Å; G346-C366 WeakPolarHBondContact O-CA 3.29Å; G346-K367 PolarHBondContact O-N 3.32Å
347	A	89.2	Confident	90.9	Very high	2 Å²	2	59.2 Å²	59.2	2%	0.017	31%	0.307	C	S	.	.			trans	-85.6	135.9	-179.4	0	0	0	0	0	111.9	N235 P236 I238 T345 I363	N235-A347 WeakPolarHBondContact CA-O 3.49Å; P236-A347 WeakPolarHBondContact CD-O 3.29Å; P236-A347 HydrophobicContact CG-CB 3.87Å; I238-A347 HydrophobicContact CD1-CB 3.59Å; T345-A347 VanDerWaalsContact C-N 3.34Å; T345-A347 PolarHBondContact O-N 3.31Å; A347-I363 HydrophobicContact CB-CG2 3.74Å
348	G	89.4	Confident	90.9	Very high	10 Å²	10	58.4 Å²	58.4	10%	0.103	30%	0.304	C	S	.	.	S	Bend	trans	-89.1	-34.9	178.3	0	0	0	0	0	113.3	N235 T364 E365	N235-G348 PolarHBondContact N-O 2.69Å; G348-T364 PolarHBondContact N-O 3.45Å; G348-E365 VanDerWaalsContact CA-O 3.32Å; G348-E365 WeakPolarHBondContact CA-O 3.32Å; G348-E365 PolarHBondContact N-O 2.7Å
349	L	93.8	Very high	90.9	Very high	18 Å²	18	61.5 Å²	61.5	9%	0.094	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	129.7	-175.2	-170	64.2	0	0	0	112.6	Y232 K234 I363 T364	Y232-L349 HydrophobicContact CD2-CD1 4.25Å; Y232-L349 HydrophobicContact CE1-CD1 4.36Å; Y232-L349 HydrophobicContact CE2-CD1 3.56Å; Y232-L349 HydrophobicContact CE2-CD2 4.34Å; Y232-L349 HydrophobicContact CE2-CG 4.4Å; K234-L349 HydrophobicContact CG-CD1 4.25Å; L349-I363 WeakPolarHBondContact O-CA 3.38Å; L349-T364 PolarHBondContact N-O 2.95Å; L349-T364 PolarHBondContact O-N 3.49Å
350	L	94.5	Very high	91	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120	160.2	-174.6	150.4	0	0	0	109.3	Y232 I233 P236 V289 I352 T361 F362 I363	Y232-L350 WeakPolarHBondContact CA-O 3.45Å; I233-L350 HydrophobicContact CB-CB 4.4Å; I233-L350 PolarHBondContact N-O 3.19Å; I233-L350 PolarHBondContact O-N 3.06Å; P236-L350 HydrophobicContact CB-CB 4.3Å; P236-L350 HydrophobicContact CG-CB 3.98Å; V289-L350 HydrophobicContact CB-CD1 4.3Å; V289-L350 HydrophobicContact CG1-CD1 3.69Å; V289-L350 HydrophobicContact CG2-CD1 3.62Å; L350-I352 HydrophobicContact CD2-CD1 4.47Å; L350-I352 HydrophobicContact CD2-CG1 4.26Å; L350-T361 HydrophobicContact CD1-CG2 4.22Å; L350-T361 HydrophobicContact CD2-CG2 4.4Å; L350-T361 HydrophobicContact CG-CG2 4.11Å; L350-F362 VanDerWaalsContact CA-O 3.32Å; L350-F362 WeakPolarHBondContact CA-O 3.37Å; L350-I363 HydrophobicContact CD1-CG1 4.42Å
351	E	94.9	Very high	91.1	Very high	65 Å²	65	48 Å²	48	30%	0.304	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.4	176.6	-176.4	-175.8	179.2	0	0	110.1	R231 Y232 F362	R231-E351 CarbonylContact O-C 3.56Å; R231-E351 WeakPolarHBondContact O-CA 3.48Å; Y232-E351 HydrophobicContact CD2-CB 4.46Å; Y232-E351 HydrophobicContact CD2-CG 4.36Å; E351-F362 HydrophobicContact CB-CB 4.49Å; E351-F362 PolarHBondContact N-O 3.29Å; E351-F362 WeakPolarHBondContact O-CB 3.31Å; E351-F362 PolarHBondContact O-N 3.03Å
352	I	94.3	Very high	91.3	Very high	15 Å²	15	42.9 Å²	42.9	8%	0.077	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	113.8	170.5	-62.6	172.7	0	0	0	108.7	V224 R231 L350 Y359 F360 T361	V224-I352 HydrophobicContact CB-CD1 4.4Å; V224-I352 HydrophobicContact CG1-CD1 3.2Å; R231-I352 HydrophobicContact CB-CB 4.16Å; R231-I352 HydrophobicContact CG-CB 4.31Å; R231-I352 HydrophobicContact CG-CD1 4.38Å; R231-I352 PolarHBondContact O-N 2.91Å; L350-I352 HydrophobicContact CD2-CD1 4.47Å; L350-I352 HydrophobicContact CD2-CG1 4.26Å; I352-Y359 HydrophobicContact CG2-CD1 4.32Å; I352-F360 CarbonylContact C-O 3.36Å; I352-F360 WeakPolarHBondContact CA-O 3.4Å; I352-T361 HydrophobicContact CG1-CG2 4.03Å
353	K	92.1	Very high	91.4	Very high	113 Å²	113	42 Å²	42	49%	0.491	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.7	-176.5	-170.7	176.9	-176.1	174.6	0	110.2	F360 F362	K353-F360 PolarHBondContact N-O 3.13Å; K353-F360 PolarHBondContact O-N 2.93Å; K353-F362 HydrophobicContact CB-CD2 4.1Å; K353-F362 HydrophobicContact CB-CE2 3.74Å
354	K	90.5	Very high	91.3	Very high	101 Å²	101	42.4 Å²	42.4	44%	0.439	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.1	174.3	-160.1	-175.9	179.3	-161.9	0	108.9	G356 D357 E358 Y359	K354-G356 VanDerWaalsContact CE-O 3.26Å; K354-G356 WeakPolarHBondContact CE-O 3.38Å; K354-D357 WeakPolarHBondContact CE-O 3.4Å; K354-D357 IonicContact NZ-OD1 2.75Å; K354-E358 WeakPolarHBondContact CA-O 3.38Å; K354-E358 WeakPolarHBondContact CG-O 3.41Å; K354-Y359 HydrophobicContact CB-CD1 3.93Å; K354-Y359 HydrophobicContact CB-CE1 3.85Å; K354-Y359 HydrophobicContact CD-CE1 4.14Å; K354-Y359 HydrophobicContact CG-CD1 4.09Å; K354-Y359 HydrophobicContact CG-CE1 3.99Å
355	I	87.7	Confident	91.2	Very high	29 Å²	29	48.8 Å²	48.8	15%	0.149	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	113	172.4	-61.8	-174.3	0	0	0	107.5	I204 M219 D357 E358 F360 F362	I204-I355 HydrophobicContact CD1-CD1 4.41Å; I204-I355 HydrophobicContact CD1-CG2 4.38Å; I204-I355 HydrophobicContact CG2-CG2 4.11Å; M219-I355 HydrophobicContact CE-CD1 3.99Å; I355-D357 PolarHBondContact O-N 2.91Å; I355-E358 PolarHBondContact N-O 3.29Å; I355-E358 PolarHBondContact O-N 3.37Å; I355-F360 HydrophobicContact CB-CD2 3.94Å; I355-F360 HydrophobicContact CB-CE2 4.08Å; I355-F360 HydrophobicContact CG1-CD2 4.31Å; I355-F362 HydrophobicContact CD1-CE2 4.45Å; I355-F362 HydrophobicContact CD1-CZ 3.71Å
356	G	84.1	Confident	91	Very high	59 Å²	59	45 Å²	45	61%	0.608	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	-122.2	-168.6	0	0	0	0	0	110.4	K354	K354-G356 VanDerWaalsContact CE-O 3.26Å; K354-G356 WeakPolarHBondContact CE-O 3.38Å
357	D	87	Confident	90.8	Very high	145 Å²	145	52.1 Å²	52.1	78%	0.775	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-5.9	-178.6	-68	-41.3	0	0	0	114.4	K354 I355	K354-D357 WeakPolarHBondContact CE-O 3.4Å; K354-D357 IonicContact NZ-OD1 2.75Å; I355-D357 PolarHBondContact O-N 2.91Å
358	E	91.1	Very high	90.4	Very high	103 Å²	103	57.7 Å²	57.7	48%	0.481	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	149	-176.7	-65.2	-170	158.6	0	0	112.7	N221 K354 I355 F360	N221-E358 PolarHBondContact ND2-OE2 3.4Å; K354-E358 WeakPolarHBondContact CA-O 3.38Å; K354-E358 WeakPolarHBondContact CG-O 3.41Å; I355-E358 PolarHBondContact N-O 3.29Å; I355-E358 PolarHBondContact O-N 3.37Å; E358-F360 HydrophobicContact CB-CD2 4.46Å; E358-F360 HydrophobicContact CB-CE2 3.72Å; E358-F360 HydrophobicContact CB-CZ 4.14Å
359	Y	92.7	Very high	89.8	Confident	85 Å²	85	58.2 Å²	58.2	33%	0.333	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.4	175.2	-73.6	-75.1	0	0	0	110.5	N221 D223 I352 K354	N221-Y359 PolarHBondContact OD1-O 2.99Å; D223-Y359 HydrophobicContact CB-CD2 4.39Å; D223-Y359 HydrophobicContact CB-CG 4.23Å; I352-Y359 HydrophobicContact CG2-CD1 4.32Å; K354-Y359 HydrophobicContact CB-CD1 3.93Å; K354-Y359 HydrophobicContact CB-CE1 3.85Å; K354-Y359 HydrophobicContact CD-CE1 4.14Å; K354-Y359 HydrophobicContact CG-CD1 4.09Å; K354-Y359 HydrophobicContact CG-CE1 3.99Å
360	F	94.6	Very high	89.4	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.009	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.6	175.9	-66.8	-88.4	0	0	0	110.4	I204 M219 I220 N221 I352 K353 I355 E358 F362	I204-F360 HydrophobicContact CD1-CD1 4.47Å; I204-F360 HydrophobicContact CD1-CD2 4.31Å; I204-F360 HydrophobicContact CD1-CE1 3.9Å; I204-F360 HydrophobicContact CD1-CE2 3.74Å; I204-F360 HydrophobicContact CD1-CZ 3.52Å; I204-F360 HydrophobicContact CG1-CZ 4.17Å; M219-F360 HydrophobicContact CE-CB 3.6Å; M219-F360 HydrophobicContact CE-CD1 3.38Å; M219-F360 HydrophobicContact CE-CD2 3.99Å; M219-F360 HydrophobicContact CE-CE1 4Å; M219-F360 HydrophobicContact CE-CG 3.37Å; M219-F360 HydrophobicContact CG-CB 4.39Å; M219-F360 HydrophobicContact CG-CD1 4.17Å; M219-F360 HydrophobicContact SD-CD1 4.39Å; I220-F360 CarbonylContact O-C 3.58Å; I220-F360 WeakPolarHBondContact O-CA 3.43Å; N221-F360 HydrophobicContact CB-CD1 3.89Å; N221-F360 HydrophobicContact CB-CE1 3.59Å; N221-F360 HydrophobicContact CB-CZ 4.45Å; I352-F360 CarbonylContact C-O 3.36Å; I352-F360 WeakPolarHBondContact CA-O 3.4Å; K353-F360 PolarHBondContact N-O 3.13Å; K353-F360 PolarHBondContact O-N 2.93Å; I355-F360 HydrophobicContact CB-CD2 3.94Å; I355-F360 HydrophobicContact CB-CE2 4.08Å; I355-F360 HydrophobicContact CG1-CD2 4.31Å; E358-F360 HydrophobicContact CB-CD2 4.46Å; E358-F360 HydrophobicContact CB-CE2 3.72Å; E358-F360 HydrophobicContact CB-CZ 4.14Å; F360-F362 HydrophobicContact CB-CD2 4.39Å; F360-F362 HydrophobicContact CB-CE2 3.62Å; F360-F362 HydrophobicContact CB-CZ 3.94Å
361	T	94.8	Very high	89.2	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.2	167.8	-57.3	0	0	0	0	109	M219 I220 K222 I312 L350 I352 I363	M219-T361 WeakPolarHBondContact CA-O 3.38Å; I220-T361 PolarHBondContact N-O 3.16Å; I220-T361 PolarHBondContact O-N 3.13Å; K222-T361 PolarHBondContact O-N 3.26Å; K222-T361 PolarHBondContact O-OG1 3.08Å; I312-T361 HydrophobicContact CD1-CG2 3.72Å; L350-T361 HydrophobicContact CD1-CG2 4.22Å; L350-T361 HydrophobicContact CD2-CG2 4.4Å; L350-T361 HydrophobicContact CG-CG2 4.11Å; I352-T361 HydrophobicContact CG1-CG2 4.03Å; T361-I363 HydrophobicContact CG2-CG1 4.46Å
362	F	94.8	Very high	89	Confident	18 Å²	18	57.5 Å²	57.5	8%	0.079	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.8	176	-63.9	-90.7	0	0	0	108.9	L215 M219 L350 E351 K353 I355 F360 T364	L215-F362 HydrophobicContact CD1-CD1 3.84Å; L215-F362 HydrophobicContact CD1-CE1 3.74Å; M219-F362 HydrophobicContact CB-CD1 4.45Å; M219-F362 HydrophobicContact CE-CE1 3.47Å; M219-F362 VanDerWaalsContact CE-CE1 3.47Å; M219-F362 HydrophobicContact CE-CE2 4.23Å; M219-F362 HydrophobicContact CE-CZ 3.26Å; M219-F362 HydrophobicContact CG-CD1 4.12Å; M219-F362 HydrophobicContact CG-CE1 3.83Å; M219-F362 HydrophobicContact CG-CZ 4.29Å; M219-F362 HydrophobicContact SD-CD1 4.48Å; M219-F362 HydrophobicContact SD-CE1 3.69Å; M219-F362 HydrophobicContact SD-CZ 4.13Å; L350-F362 VanDerWaalsContact CA-O 3.32Å; L350-F362 WeakPolarHBondContact CA-O 3.37Å; E351-F362 HydrophobicContact CB-CB 4.49Å; E351-F362 PolarHBondContact N-O 3.29Å; E351-F362 WeakPolarHBondContact O-CB 3.31Å; E351-F362 PolarHBondContact O-N 3.03Å; K353-F362 HydrophobicContact CB-CD2 4.1Å; K353-F362 HydrophobicContact CB-CE2 3.74Å; I355-F362 HydrophobicContact CD1-CE2 4.45Å; I355-F362 HydrophobicContact CD1-CZ 3.71Å; F360-F362 HydrophobicContact CB-CD2 4.39Å; F360-F362 HydrophobicContact CB-CE2 3.62Å; F360-F362 HydrophobicContact CB-CZ 3.94Å; F362-T364 HydrophobicContact CB-CG2 4.05Å
363	I	93.7	Very high	89	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	99.6	167.6	-58	173.2	0	0	0	105.4	G217 V218 I220 I238 I291 I323 A347 L349 L350 T361	G217-I363 CarbonylContact C-O 3.59Å; G217-I363 VanDerWaalsContact CA-O 3.23Å; G217-I363 WeakPolarHBondContact CA-O 3.4Å; V218-I363 PolarHBondContact N-O 3.19Å; V218-I363 PolarHBondContact O-N 2.71Å; I220-I363 HydrophobicContact CD1-CD1 4.31Å; I238-I363 HydrophobicContact CD1-CD1 4.47Å; I238-I363 HydrophobicContact CD1-CG2 3.94Å; I291-I363 HydrophobicContact CD1-CD1 3.78Å; I323-I363 HydrophobicContact CD1-CD1 4.36Å; I323-I363 HydrophobicContact CG1-CD1 4.2Å; I323-I363 HydrophobicContact CG2-CD1 3.89Å; A347-I363 HydrophobicContact CB-CG2 3.74Å; L349-I363 WeakPolarHBondContact O-CA 3.38Å; L350-I363 HydrophobicContact CD1-CG1 4.42Å; T361-I363 HydrophobicContact CG2-CG1 4.46Å
364	T	90.9	Very high	89.2	Confident	21 Å²	21	51.4 Å²	51.4	13%	0.129	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	176.1	-168.4	54.6	0	0	0	0	111.5	G348 L349 F362 C366	G348-T364 PolarHBondContact N-O 3.45Å; L349-T364 PolarHBondContact N-O 2.95Å; L349-T364 PolarHBondContact O-N 3.49Å; F362-T364 HydrophobicContact CB-CG2 4.05Å; T364-C366 PolarHBondContact O-N 2.92Å
365	E	88.5	Confident	89.3	Confident	135 Å²	135	47.2 Å²	47.2	63%	0.631	24%	0.243	S	C	*	.			trans	56.7	39.2	-178.4	-58.5	-177.5	169.4	0	0	112.4	R216 G348	R216-E365 PolarHBondContact O-N 2.88Å; G348-E365 VanDerWaalsContact CA-O 3.32Å; G348-E365 WeakPolarHBondContact CA-O 3.32Å; G348-E365 PolarHBondContact N-O 2.7Å
366	C	85.9	Confident	89.6	Confident	10 Å²	10	45.9 Å²	45.9	7%	0.068	24%	0.237	C	C	.	.			trans	-69.8	142.7	176.5	-59.3	0	0	0	0	110.1	A326 G346 T364 P369	A326-C366 WeakPolarHBondContact O-CB 3.44Å; G346-C366 CarbonylContact O-C 3.49Å; G346-C366 WeakPolarHBondContact O-CA 3.29Å; T364-C366 PolarHBondContact O-N 2.92Å; C366-P369 HydrophobicContact CB-CB 4.1Å; C366-P369 WeakPolarHBondContact O-CD 3.4Å
367	K	81.9	Confident	89.9	Confident	163 Å²	163	44.7 Å²	44.7	71%	0.709	21%	0.214	S	C	*	.	S	Bend	trans	-62.6	-50.7	-179.2	-69.1	-178.9	-178.8	173.7	0	112.2	G346 P369	G346-K367 PolarHBondContact O-N 3.32Å; K367-P369 WeakPolarHBondContact O-CD 3.16Å
368	D	80.9	Confident	90	Very high	120 Å²	120	38 Å²	38	64%	0.642	18%	0.179	S	C	*	.	S	Bend	trans	-121.7	76.1	177.7	-64.3	-38	0	0	0	109.6	K370	D368-K370 VanDerWaalsContact C-N 3.26Å; D368-K370 PolarHBondContact O-N 3.44Å
369	P	77.3	Confident	89.7	Confident	21 Å²	21	37.4 Å²	37.4	14%	0.136	19%	0.191	C	C	.	.			trans	-72.9	78.1	-174.2	29	-32	0	0	0	110.7	T182 R216 C366 K367 A371	T182-P369 HydrophobicContact CG2-CB 3.9Å; T182-P369 HydrophobicContact CG2-CG 3.9Å; T182-P369 WeakPolarHBondContact CG2-O 3.38Å; R216-P369 HydrophobicContact CB-CB 4.23Å; R216-P369 HydrophobicContact CB-CG 4.17Å; C366-P369 HydrophobicContact CB-CB 4.1Å; C366-P369 WeakPolarHBondContact O-CD 3.4Å; K367-P369 WeakPolarHBondContact O-CD 3.16Å; P369-A371 PolarHBondContact O-N 2.66Å
370	K	85.3	Confident	89.4	Confident	67 Å²	67	35.3 Å²	35.3	29%	0.291	19%	0.189	S	C	.	.	S	Bend	trans	-70.3	3.2	173.7	-68.6	173.7	-171.3	174.5	0	113.3	F185 R325 D368	F185-K370 HydrophobicContact CD2-CD 3.75Å; F185-K370 HydrophobicContact CD2-CG 4.26Å; F185-K370 HydrophobicContact CE2-CD 3.86Å; F185-K370 VanDerWaalsContact CE2-CE 3.47Å; F185-K370 VanDerWaalsContact CE2-NZ 3.35Å; R325-K370 HydrophobicContact CG-CB 3.69Å; R325-K370 HydrophobicContact CG-CD 4.5Å; D368-K370 VanDerWaalsContact C-N 3.26Å; D368-K370 PolarHBondContact O-N 3.44Å
371	A	89.8	Confident	89	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-143.3	141.4	172.6	0	0	0	0	0	109.7	Y198 R322 A326 P369	Y198-A371 HydrophobicContact CD1-CB 4.14Å; R322-A371 HydrophobicContact CB-CB 4.14Å; R322-A371 HydrophobicContact CG-CB 4.48Å; A326-A371 HydrophobicContact CB-CB 4.44Å; P369-A371 PolarHBondContact O-N 2.66Å
372	C	92.3	Very high	88.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146	-179.3	64.2	0	0	0	0	111.1	T182 Y198 A199 K200 V214 L215 G217 R322	T182-C372 HydrophobicContact CG2-CB 3.74Å; Y198-C372 PolarHBondContact O-N 2.86Å; Y198-C372 VanDerWaalsContact O-N 3.11Å; A199-C372 WeakPolarHBondContact CA-O 3.26Å; K200-C372 PolarHBondContact N-O 3.34Å; V214-C372 HydrophobicContact CG1-CB 4.15Å; L215-C372 WeakPolarHBondContact O-CA 3.18Å; L215-C372 WeakPolarHBondContact O-CB 3.38Å; G217-C372 CarbonylContact O-C 3.54Å; G217-C372 WeakPolarHBondContact O-CA 3.26Å; R322-C372 PolarHBondContact NH2-O 3.16Å
373	T	93.8	Very high	87.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.1	167	-67.8	0	0	0	0	109.3	K200 E202 L215 G217 M219 R322	K200-T373 CarbonylContact O-C 3.6Å; K200-T373 WeakPolarHBondContact O-CA 3.44Å; E202-T373 HydrophobicContact CB-CG2 3.85Å; L215-T373 WeakPolarHBondContact CB-O 3.36Å; L215-T373 PolarHBondContact N-O 2.89Å; L215-T373 PolarHBondContact O-N 2.96Å; G217-T373 PolarHBondContact O-N 2.96Å; M219-T373 HydrophobicContact CB-CG2 3.82Å; M219-T373 PolarHBondContact N-OG1 2.88Å; R322-T373 PolarHBondContact NH1-OG1 3.25Å; R322-T373 PolarHBondContact NH2-OG1 2.65Å
374	I	94.8	Very high	87.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	111.4	173.3	-55.5	173	0	0	0	106.8	I175 A179 K200 V201 E202 V214 L376 L391 M395	I175-I374 HydrophobicContact CG2-CD1 4.45Å; I175-I374 HydrophobicContact CG2-CG2 3.54Å; A179-I374 HydrophobicContact CB-CD1 3.68Å; A179-I374 HydrophobicContact CB-CG1 4.11Å; K200-I374 PolarHBondContact O-N 2.86Å; V201-I374 CarbonylContact C-O 3.59Å; V201-I374 WeakPolarHBondContact CA-O 3.43Å; V201-I374 HydrophobicContact CG2-CB 4.3Å; V201-I374 HydrophobicContact CG2-CD1 4.24Å; E202-I374 PolarHBondContact N-O 3.32Å; V214-I374 HydrophobicContact CG2-CG1 4.48Å; I374-L376 HydrophobicContact CG2-CD2 4.07Å; I374-L376 HydrophobicContact CG2-CG 4.3Å; I374-L391 HydrophobicContact CD1-CD2 3.71Å; I374-L391 HydrophobicContact CG2-CD1 4.11Å; I374-M395 HydrophobicContact CD1-CE 4.03Å; I374-M395 HydrophobicContact CD1-SD 3.49Å; I374-M395 WeakPolarHBondContact CD1-SD 3.26Å
375	L	93.6	Very high	87.3	Confident	13 Å²	13	53.6 Å²	53.6	7%	0.068	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	116.7	176	174.8	60.9	0	0	0	108.6	I204 S212 C213 L215 M219 R377	I204-L375 HydrophobicContact CB-CD1 4.44Å; I204-L375 HydrophobicContact CD1-CD1 3.43Å; I204-L375 VanDerWaalsContact CD1-CD1 3.43Å; I204-L375 HydrophobicContact CG1-CD1 3.75Å; S212-L375 CarbonylContact C-O 3.33Å; S212-L375 WeakPolarHBondContact CA-O 3.48Å; S212-L375 VanDerWaalsContact CB-O 3.28Å; S212-L375 WeakPolarHBondContact CB-O 3.19Å; C213-L375 PolarHBondContact N-O 3.22Å; C213-L375 PolarHBondContact O-N 3.02Å; L215-L375 HydrophobicContact CD1-CB 4.27Å; M219-L375 HydrophobicContact CE-CD1 4.17Å; M219-L375 HydrophobicContact SD-CD1 4.09Å; L375-R377 HydrophobicContact CG-CG 4.29Å
376	L	93.1	Very high	87	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.9	173.7	-65.7	-176.4	0	0	0	111	V201 E202 I204 I374 L384 V387 E388 L391	V201-L376 HydrophobicContact CG1-CB 4.46Å; V201-L376 HydrophobicContact CG1-CD1 3.27Å; V201-L376 HydrophobicContact CG1-CG 3.67Å; E202-L376 PolarHBondContact O-N 3.28Å; I204-L376 PolarHBondContact N-O 3.42Å; I374-L376 HydrophobicContact CG2-CD2 4.07Å; I374-L376 HydrophobicContact CG2-CG 4.3Å; L376-L384 HydrophobicContact CB-CD2 3.81Å; L376-V387 HydrophobicContact CD1-CB 4.45Å; L376-V387 HydrophobicContact CD1-CG1 3.87Å; L376-V387 HydrophobicContact CD2-CG1 4.12Å; L376-E388 HydrophobicContact CD1-CB 4.21Å; L376-L391 HydrophobicContact CD1-CD1 4.46Å; L376-L391 HydrophobicContact CD2-CD1 3.86Å
377	R	91	Very high	87	Confident	34 Å²	34	49.2 Å²	49.2	13%	0.128	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.8	176.7	-60.1	-67.8	-74.2	155.4	-6.1	109.2	I204 P205 G206 I208 I209 D211 S212 L375	I204-R377 PolarHBondContact O-NH1 3.31Å; P205-R377 PolarHBondContact O-NH1 3.4Å; G206-R377 PolarHBondContact O-NE 2.98Å; G206-R377 PolarHBondContact O-NH1 3.44Å; G206-R377 PolarHBondContact O-NH2 2.61Å; I208-R377 WeakPolarHBondContact O-CB 3.49Å; I209-R377 WeakPolarHBondContact CA-O 3.31Å; D211-R377 HydrophobicContact CB-CB 4.06Å; D211-R377 HydrophobicContact CB-CG 3.95Å; S212-R377 PolarHBondContact OG-N 3.32Å; S212-R377 PolarHBondContact OG-O 3.34Å; L375-R377 HydrophobicContact CG-CG 4.29Å
378	G	88.3	Confident	87.3	Confident	5 Å²	5	43.3 Å²	43.3	5%	0.052	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174	160.8	-173.4	0	0	0	0	0	113.4	G206	G206-G378 PolarHBondContact N-O 3.34Å; G206-G378 PolarHBondContact O-N 3.06Å
379	A	86.6	Confident	87.4	Confident	89 Å²	89	41.5 Å²	41.5	74%	0.736	22%	0.216	S	C	*	.	S	Bend	trans	-64.5	-45.2	-171.1	0	0	0	0	0	113.4
380	S	86	Confident	87.7	Confident	41 Å²	41	40.7 Å²	40.7	29%	0.287	21%	0.21	S	C	.	.			trans	-128.6	153.2	-176.9	73	0	0	0	0	112.1	E382 I383 L384	S380-E382 VanDerWaalsContact C-N 3.26Å; S380-E382 PolarHBondContact O-N 2.69Å; S380-I383 PolarHBondContact O-N 3.31Å; S380-I383 WeakPolarHBondContact OG-CD1 3.23Å; S380-I383 VanDerWaalsContact OG-CG1 3.26Å; S380-I383 WeakPolarHBondContact OG-CG1 3.19Å; S380-I383 PolarHBondContact OG-N 3.08Å; S380-L384 WeakPolarHBondContact O-CG 3.28Å; S380-L384 PolarHBondContact O-N 3.44Å; S380-L384 VanDerWaalsContact O-N 3.1Å
381	K	85.9	Confident	87.9	Confident	154 Å²	154	37.6 Å²	37.6	67%	0.67	20%	0.197	S	C	*	.	H	α-helix	trans	-64.4	-32	177	-70.1	-174.9	177.6	-179.8	0	112.5	P205 L384 S385	P205-K381 HydrophobicContact CB-CG 4.32Å; P205-K381 HydrophobicContact CG-CG 4.49Å; K381-L384 PolarHBondContact O-N 3.12Å; K381-S385 PolarHBondContact O-N 3.47Å
382	E	82.1	Confident	87.7	Confident	152 Å²	152	41.4 Å²	41.4	71%	0.71	22%	0.215	S	C	*	.	H	α-helix	trans	-66	-49.8	178.4	-67.9	171.6	-167.1	0	0	111.2	S380 L384 S385 E386	S380-E382 VanDerWaalsContact C-N 3.26Å; S380-E382 PolarHBondContact O-N 2.69Å; E382-L384 VanDerWaalsContact C-N 3.29Å; E382-L384 PolarHBondContact O-N 3.37Å; E382-S385 PolarHBondContact O-N 3.06Å; E382-S385 PolarHBondContact O-OG 3.32Å; E382-E386 PolarHBondContact O-N 3.23Å; E382-E386 VanDerWaalsContact O-N 3.08Å
383	I	83.6	Confident	87.5	Confident	78 Å²	78	42 Å²	42	40%	0.4	22%	0.218	S	C	.	.	H	α-helix	trans	-59.8	-43.3	175.1	-64.9	168.4	0	0	0	109.9	S380 S385 E386 V387	S380-I383 PolarHBondContact O-N 3.31Å; S380-I383 WeakPolarHBondContact OG-CD1 3.23Å; S380-I383 VanDerWaalsContact OG-CG1 3.26Å; S380-I383 WeakPolarHBondContact OG-CG1 3.19Å; S380-I383 PolarHBondContact OG-N 3.08Å; I383-S385 VanDerWaalsContact C-N 3.27Å; I383-S385 PolarHBondContact O-N 2.87Å; I383-E386 PolarHBondContact O-N 2.95Å; I383-E386 VanDerWaalsContact O-N 3.17Å; I383-V387 HydrophobicContact CG2-CG2 4.17Å; I383-V387 VanDerWaalsContact O-CG2 3.27Å; I383-V387 WeakPolarHBondContact O-CG2 3.4Å; I383-V387 PolarHBondContact O-N 3.43Å
384	L	87.8	Confident	87.2	Confident	3 Å²	3	42 Å²	42	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-60.7	-34.8	176.6	-74.4	171.2	0	0	0	113.3	K203 L376 S380 K381 E382 V387 E388	K203-L384 HydrophobicContact CB-CB 4.41Å; K203-L384 HydrophobicContact CB-CD1 4.39Å; K203-L384 HydrophobicContact CD-CB 4.17Å; K203-L384 HydrophobicContact CG-CB 4.31Å; L376-L384 HydrophobicContact CB-CD2 3.81Å; S380-L384 WeakPolarHBondContact O-CG 3.28Å; S380-L384 PolarHBondContact O-N 3.44Å; S380-L384 VanDerWaalsContact O-N 3.1Å; K381-L384 PolarHBondContact O-N 3.12Å; E382-L384 VanDerWaalsContact C-N 3.29Å; E382-L384 PolarHBondContact O-N 3.37Å; L384-V387 PolarHBondContact O-N 3Å; L384-E388 WeakPolarHBondContact O-CB 3.45Å; L384-E388 PolarHBondContact O-N 3.3Å
385	S	85.4	Confident	87	Confident	39 Å²	39	42.1 Å²	42.1	27%	0.273	22%	0.218	S	C	.	.	H	α-helix	trans	-71.2	-34.3	176.2	67.9	0	0	0	0	112.8	K381 E382 I383 R389	K381-S385 PolarHBondContact O-N 3.47Å; E382-S385 PolarHBondContact O-N 3.06Å; E382-S385 PolarHBondContact O-OG 3.32Å; I383-S385 VanDerWaalsContact C-N 3.27Å; I383-S385 PolarHBondContact O-N 2.87Å; S385-R389 WeakPolarHBondContact O-CG 3.48Å; S385-R389 PolarHBondContact O-N 3.27Å
386	E	80.8	Confident	86.8	Confident	41 Å²	41	42.8 Å²	42.8	19%	0.192	22%	0.221	C	C	.	.	H	α-helix	trans	-68.6	-41.4	170.8	-170.8	177.4	-169.4	0	0	111	A164 E382 I383 E388 R389 N390	A164-E386 WeakPolarHBondContact CB-OE1 3.43Å; E382-E386 PolarHBondContact O-N 3.23Å; E382-E386 VanDerWaalsContact O-N 3.08Å; I383-E386 PolarHBondContact O-N 2.95Å; I383-E386 VanDerWaalsContact O-N 3.17Å; E386-E388 PolarHBondContact O-N 3.38Å; E386-R389 PolarHBondContact O-N 3.32Å; E386-N390 PolarHBondContact O-N 2.97Å; E386-N390 VanDerWaalsContact O-N 3.14Å; E386-N390 PolarHBondContact O-ND2 2.83Å
387	V	86.5	Confident	86.6	Confident	11 Å²	11	42.8 Å²	42.8	7%	0.067	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-47.5	176.2	175.4	0	0	0	0	111.6	I165 I209 L376 I383 L384 R389 N390 L391	I165-V387 HydrophobicContact CD1-CB 4.08Å; I165-V387 HydrophobicContact CD1-CG1 4.08Å; I165-V387 HydrophobicContact CD1-CG2 4.01Å; I165-V387 HydrophobicContact CG1-CG2 4.05Å; I209-V387 HydrophobicContact CD1-CG2 4.18Å; L376-V387 HydrophobicContact CD1-CB 4.45Å; L376-V387 HydrophobicContact CD1-CG1 3.87Å; L376-V387 HydrophobicContact CD2-CG1 4.12Å; I383-V387 HydrophobicContact CG2-CG2 4.17Å; I383-V387 VanDerWaalsContact O-CG2 3.27Å; I383-V387 WeakPolarHBondContact O-CG2 3.4Å; I383-V387 PolarHBondContact O-N 3.43Å; L384-V387 PolarHBondContact O-N 3Å; V387-R389 PolarHBondContact O-N 3.03Å; V387-N390 PolarHBondContact O-N 2.77Å; V387-L391 VanDerWaalsContact O-CB 3.23Å; V387-L391 WeakPolarHBondContact O-CB 3.32Å; V387-L391 PolarHBondContact O-N 3.44Å
388	E	87.8	Confident	86.6	Confident	39 Å²	39	41.2 Å²	41.2	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-56.5	-47.8	177.1	174.5	-176.6	-163.6	0	0	112.4	V201 K203 L376 L384 E386 L391 Q392	V201-E388 HydrophobicContact CB-CG 4.1Å; V201-E388 HydrophobicContact CG1-CB 4.21Å; V201-E388 HydrophobicContact CG1-CG 3.97Å; V201-E388 HydrophobicContact CG2-CG 4.26Å; K203-E388 HydrophobicContact CD-CB 4.3Å; K203-E388 VanDerWaalsContact CD-OE2 3.25Å; K203-E388 WeakPolarHBondContact CD-OE2 3.18Å; K203-E388 WeakPolarHBondContact CE-OE2 3.34Å; K203-E388 IonicContact NZ-OE2 2.7Å; K203-E388 PolarHBondContact NZ-OE2 3.39Å; L376-E388 HydrophobicContact CD1-CB 4.21Å; L384-E388 WeakPolarHBondContact O-CB 3.45Å; L384-E388 PolarHBondContact O-N 3.3Å; E386-E388 PolarHBondContact O-N 3.38Å; E388-L391 PolarHBondContact O-N 3.37Å; E388-Q392 WeakPolarHBondContact O-CG 3.34Å; E388-Q392 PolarHBondContact O-N 3.22Å; E388-Q392 PolarHBondContact OE1-NE2 2.88Å
389	R	83.1	Confident	86.7	Confident	82 Å²	82	43.2 Å²	43.2	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-61.3	-50.7	-178.7	-72	174.9	-176.2	-176.1	0.7	111.4	S385 E386 V387 L391 Q392 D393	S385-R389 WeakPolarHBondContact O-CG 3.48Å; S385-R389 PolarHBondContact O-N 3.27Å; E386-R389 PolarHBondContact O-N 3.32Å; V387-R389 PolarHBondContact O-N 3.03Å; R389-L391 PolarHBondContact O-N 3.38Å; R389-Q392 WeakPolarHBondContact O-CB 3.23Å; R389-Q392 PolarHBondContact O-N 3.17Å; R389-Q392 VanDerWaalsContact O-N 3.09Å; R389-D393 PolarHBondContact O-N 3.42Å
390	N	84.4	Confident	86.9	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-64.5	-33	-179	-61.6	-16.3	0	0	0	112.2	K163 I165 E386 V387 D393 A394	K163-N390 HydrophobicContact CD-CB 3.86Å; K163-N390 WeakPolarHBondContact CD-OD1 3.37Å; I165-N390 HydrophobicContact CD1-CB 3.3Å; I165-N390 VanDerWaalsContact CD1-ND2 3.31Å; I165-N390 WeakPolarHBondContact CD1-ND2 3.49Å; I165-N390 HydrophobicContact CG1-CB 4.35Å; E386-N390 PolarHBondContact O-N 2.97Å; E386-N390 VanDerWaalsContact O-N 3.14Å; E386-N390 PolarHBondContact O-ND2 2.83Å; V387-N390 PolarHBondContact O-N 2.77Å; N390-D393 PolarHBondContact O-N 3.12Å; N390-A394 WeakPolarHBondContact O-CB 3.31Å; N390-A394 PolarHBondContact O-N 3.33Å
391	L	88.4	Confident	87.1	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-69.9	-39.3	175.2	-160.7	161.9	0	0	0	110.9	I175 I374 L376 V387 E388 R389 D393 A394 M395	I175-L391 HydrophobicContact CG2-CD1 3.76Å; I175-L391 HydrophobicContact CG2-CD2 4.28Å; I175-L391 HydrophobicContact CG2-CG 4.4Å; I374-L391 HydrophobicContact CD1-CD2 3.71Å; I374-L391 HydrophobicContact CG2-CD1 4.11Å; L376-L391 HydrophobicContact CD1-CD1 4.46Å; L376-L391 HydrophobicContact CD2-CD1 3.86Å; V387-L391 VanDerWaalsContact O-CB 3.23Å; V387-L391 WeakPolarHBondContact O-CB 3.32Å; V387-L391 PolarHBondContact O-N 3.44Å; E388-L391 PolarHBondContact O-N 3.37Å; R389-L391 PolarHBondContact O-N 3.38Å; L391-D393 VanDerWaalsContact C-N 3.34Å; L391-D393 PolarHBondContact O-N 3.3Å; L391-A394 WeakPolarHBondContact O-CB 3.45Å; L391-A394 PolarHBondContact O-N 3.42Å; L391-M395 HydrophobicContact CD2-CE 3.48Å; L391-M395 VanDerWaalsContact CD2-CE 3.48Å; L391-M395 HydrophobicContact CD2-CG 3.82Å; L391-M395 HydrophobicContact CD2-SD 3.61Å; L391-M395 WeakPolarHBondContact O-CG 3.42Å; L391-M395 PolarHBondContact O-N 3.34Å
392	Q	87.4	Confident	87.1	Confident	81 Å²	81	30.4 Å²	30.4	38%	0.379	15%	0.145	S	C	.	.	H	α-helix	trans	-58.8	-45.3	172.1	-73.7	174.5	5.3	0	0	111.5	E388 R389 A394 M395 Q396	E388-Q392 WeakPolarHBondContact O-CG 3.34Å; E388-Q392 PolarHBondContact O-N 3.22Å; E388-Q392 PolarHBondContact OE1-NE2 2.88Å; R389-Q392 WeakPolarHBondContact O-CB 3.23Å; R389-Q392 PolarHBondContact O-N 3.17Å; R389-Q392 VanDerWaalsContact O-N 3.09Å; Q392-A394 VanDerWaalsContact C-N 3.35Å; Q392-A394 PolarHBondContact O-N 2.96Å; Q392-M395 HydrophobicContact CB-CE 4.42Å; Q392-M395 HydrophobicContact CG-CE 3.98Å; Q392-M395 PolarHBondContact O-N 3.16Å; Q392-Q396 WeakPolarHBondContact O-CG 3.36Å; Q392-Q396 PolarHBondContact O-N 3.36Å
393	D	86.1	Confident	87.4	Confident	13 Å²	13	26.4 Å²	26.4	7%	0.07	13%	0.128	C	C	.	.	H	α-helix	trans	-61.7	-44.4	177.1	-58.5	-20.2	0	0	0	111.4	K163 R389 N390 L391 M395 Q396 V397	K163-D393 VanDerWaalsContact NZ-CB 3.32Å; K163-D393 IonicContact NZ-OD2 2.86Å; K163-D393 PolarHBondContact NZ-OD2 3.43Å; R389-D393 PolarHBondContact O-N 3.42Å; N390-D393 PolarHBondContact O-N 3.12Å; L391-D393 VanDerWaalsContact C-N 3.34Å; L391-D393 PolarHBondContact O-N 3.3Å; D393-M395 PolarHBondContact O-N 3.39Å; D393-Q396 PolarHBondContact O-N 2.93Å; D393-V397 WeakPolarHBondContact O-CG2 3.35Å; D393-V397 PolarHBondContact O-N 3.4Å
394	A	88.6	Confident	87.6	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.9	-43	175.9	0	0	0	0	0	112.3	I156 I160 A176 N390 L391 Q392 Q396 V397 C398	I156-A394 HydrophobicContact CG2-CB 3.73Å; I160-A394 HydrophobicContact CD1-CB 3.69Å; I160-A394 HydrophobicContact CG1-CB 3.92Å; A176-A394 HydrophobicContact CB-CB 3.95Å; N390-A394 WeakPolarHBondContact O-CB 3.31Å; N390-A394 PolarHBondContact O-N 3.33Å; L391-A394 WeakPolarHBondContact O-CB 3.45Å; L391-A394 PolarHBondContact O-N 3.42Å; Q392-A394 VanDerWaalsContact C-N 3.35Å; Q392-A394 PolarHBondContact O-N 2.96Å; A394-Q396 VanDerWaalsContact C-N 3.35Å; A394-V397 PolarHBondContact O-N 3.04Å; A394-C398 PolarHBondContact O-N 3.24Å; A394-C398 PolarHBondContact O-SG 3.03Å
395	M	90.8	Very high	87.7	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-38.8	175.6	-72	-174.7	-64.2	0	0	111.8	A176 A179 V180 I195 A199 I374 L391 Q392 D393 C398 R399	A176-M395 HydrophobicContact CB-CG 3.93Å; A179-M395 HydrophobicContact CB-SD 3.95Å; V180-M395 HydrophobicContact CG2-CB 3.71Å; V180-M395 HydrophobicContact CG2-CG 3.87Å; I195-M395 HydrophobicContact CD1-CB 3.84Å; I195-M395 VanDerWaalsContact CD1-O 3.27Å; I195-M395 WeakPolarHBondContact CD1-O 3.45Å; I195-M395 HydrophobicContact CG2-CB 4.07Å; I195-M395 HydrophobicContact CG2-CE 3.71Å; I195-M395 HydrophobicContact CG2-SD 3.87Å; A199-M395 HydrophobicContact CB-SD 4.31Å; I374-M395 HydrophobicContact CD1-CE 4.03Å; I374-M395 HydrophobicContact CD1-SD 3.49Å; I374-M395 WeakPolarHBondContact CD1-SD 3.26Å; L391-M395 HydrophobicContact CD2-CE 3.48Å; L391-M395 VanDerWaalsContact CD2-CE 3.48Å; L391-M395 HydrophobicContact CD2-CG 3.82Å; L391-M395 HydrophobicContact CD2-SD 3.61Å; L391-M395 WeakPolarHBondContact O-CG 3.42Å; L391-M395 PolarHBondContact O-N 3.34Å; Q392-M395 HydrophobicContact CB-CE 4.42Å; Q392-M395 HydrophobicContact CG-CE 3.98Å; Q392-M395 PolarHBondContact O-N 3.16Å; D393-M395 PolarHBondContact O-N 3.39Å; M395-C398 WeakPolarHBondContact O-CB 3.49Å; M395-C398 PolarHBondContact O-N 3.4Å; M395-R399 PolarHBondContact O-N 3.46Å
396	Q	89.6	Confident	88	Confident	28 Å²	28	29.6 Å²	29.6	13%	0.131	14%	0.143	C	C	.	.	H	α-helix	trans	-66.5	-41.2	176.7	-69.1	-69.7	4.4	0	0	111.7	V91 I195 Q392 D393 A394 C398 R399 N400	V91-Q396 WeakPolarHBondContact O-CB 3.38Å; I195-Q396 HydrophobicContact CD1-CG 4.44Å; Q392-Q396 WeakPolarHBondContact O-CG 3.36Å; Q392-Q396 PolarHBondContact O-N 3.36Å; D393-Q396 PolarHBondContact O-N 2.93Å; A394-Q396 VanDerWaalsContact C-N 3.35Å; Q396-C398 VanDerWaalsContact C-N 3.34Å; Q396-C398 PolarHBondContact O-N 3.12Å; Q396-R399 WeakPolarHBondContact O-CB 3.37Å; Q396-R399 PolarHBondContact O-N 3.03Å; Q396-N400 PolarHBondContact O-N 2.9Å; Q396-N400 PolarHBondContact O-ND2 2.89Å; Q396-N400 PolarHBondContact O-OD1 3.24Å
397	V	89.1	Confident	88.6	Confident	2 Å²	2	28 Å²	28	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-58.3	-45.9	172.4	168.1	0	0	0	0	110.9	D93 I155 D393 A394 R399 N400 V401 P498	D93-V397 HydrophobicContact CB-CG2 4.18Å; I155-V397 HydrophobicContact CG2-CG1 4.09Å; D393-V397 WeakPolarHBondContact O-CG2 3.35Å; D393-V397 PolarHBondContact O-N 3.4Å; A394-V397 PolarHBondContact O-N 3.04Å; V397-R399 PolarHBondContact O-N 3.48Å; V397-N400 PolarHBondContact O-N 3.25Å; V397-V401 WeakPolarHBondContact O-CG2 3.49Å; V397-V401 PolarHBondContact O-N 2.92Å; V397-V401 VanDerWaalsContact O-N 3.15Å; V397-P498 HydrophobicContact CG1-CG 3.8Å
398	C	89.4	Confident	88.9	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-56.7	-50.2	173.8	-61.9	0	0	0	0	111.5	M152 I156 V180 A394 M395 Q396 N400 V401 L402	M152-C398 HydrophobicContact CE-CB 4.48Å; I156-C398 WeakPolarHBondContact CD1-SG 2.92Å; I156-C398 WeakPolarHBondContact CG1-SG 3.29Å; V180-C398 HydrophobicContact CB-CB 4.08Å; V180-C398 HydrophobicContact CG1-CB 3.97Å; V180-C398 HydrophobicContact CG2-CB 3.9Å; A394-C398 PolarHBondContact O-N 3.24Å; A394-C398 PolarHBondContact O-SG 3.03Å; M395-C398 WeakPolarHBondContact O-CB 3.49Å; M395-C398 PolarHBondContact O-N 3.4Å; Q396-C398 VanDerWaalsContact C-N 3.34Å; Q396-C398 PolarHBondContact O-N 3.12Å; C398-N400 VanDerWaalsContact C-N 3.28Å; C398-N400 PolarHBondContact O-N 3.33Å; C398-V401 PolarHBondContact O-N 2.95Å; C398-L402 HydrophobicContact CB-CD1 4.5Å; C398-L402 WeakPolarHBondContact O-CD1 3.45Å; C398-L402 PolarHBondContact O-N 3.46Å
399	R	90.9	Very high	89.2	Confident	48 Å²	48	25.7 Å²	25.7	18%	0.181	12%	0.124	C	C	.	.	H	α-helix	trans	-56.2	-44	179.6	163.6	176.5	172.9	-103.3	-6.5	111.2	E90 I193 I195 M395 Q396 V397 V401 L402 L403	E90-R399 PolarHBondContact O-NH1 3.27Å; I193-R399 HydrophobicContact CB-CG 4.07Å; I193-R399 HydrophobicContact CD1-CG 4.47Å; I193-R399 HydrophobicContact CG2-CB 4.27Å; I193-R399 HydrophobicContact CG2-CG 4.24Å; I193-R399 WeakPolarHBondContact O-CD 3.41Å; I193-R399 PolarHBondContact O-NE 3.12Å; I193-R399 VanDerWaalsContact O-NE 3.09Å; I195-R399 HydrophobicContact CD1-CB 3.69Å; I195-R399 HydrophobicContact CD1-CG 4.36Å; M395-R399 PolarHBondContact O-N 3.46Å; Q396-R399 WeakPolarHBondContact O-CB 3.37Å; Q396-R399 PolarHBondContact O-N 3.03Å; V397-R399 PolarHBondContact O-N 3.48Å; R399-V401 VanDerWaalsContact C-N 3.34Å; R399-V401 PolarHBondContact O-N 2.86Å; R399-L402 PolarHBondContact O-N 3.38Å; R399-L403 HydrophobicContact CG-CD1 3.95Å; R399-L403 VanDerWaalsContact O-CG 3.31Å; R399-L403 WeakPolarHBondContact O-CG 3.34Å; R399-L403 PolarHBondContact O-N 3.38Å
400	N	90.9	Very high	89.5	Confident	8 Å²	8	21.8 Å²	21.8	4%	0.043	11%	0.11	C	C	.	.	H	α-helix	trans	-60.9	-43.3	179.2	-65.3	-25	0	0	0	111.5	V91 Q396 V397 C398 L403 D404 P498 A500	V91-N400 PolarHBondContact O-ND2 3.45Å; Q396-N400 PolarHBondContact O-N 2.9Å; Q396-N400 PolarHBondContact O-ND2 2.89Å; Q396-N400 PolarHBondContact O-OD1 3.24Å; V397-N400 PolarHBondContact O-N 3.25Å; C398-N400 VanDerWaalsContact C-N 3.28Å; C398-N400 PolarHBondContact O-N 3.33Å; N400-L403 PolarHBondContact O-N 2.96Å; N400-D404 PolarHBondContact O-N 3.5Å; N400-P498 HydrophobicContact CB-CB 4.17Å; N400-A500 HydrophobicContact CB-CB 4.25Å
401	V	89.8	Confident	89.8	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-69.3	-36.5	178.6	178.6	0	0	0	0	112	M152 I155 V397 C398 R399 L403 D404 P405 L407 P498	M152-V401 HydrophobicContact CE-CB 4.31Å; M152-V401 HydrophobicContact CE-CG1 4.2Å; M152-V401 HydrophobicContact SD-CB 4.33Å; M152-V401 HydrophobicContact SD-CG1 3.6Å; M152-V401 VanDerWaalsContact SD-CG1 3.6Å; I155-V401 HydrophobicContact CD1-CG1 4.24Å; I155-V401 HydrophobicContact CG2-CG2 3.98Å; V397-V401 WeakPolarHBondContact O-CG2 3.49Å; V397-V401 PolarHBondContact O-N 2.92Å; V397-V401 VanDerWaalsContact O-N 3.15Å; C398-V401 PolarHBondContact O-N 2.95Å; R399-V401 VanDerWaalsContact C-N 3.34Å; R399-V401 PolarHBondContact O-N 2.86Å; V401-L403 VanDerWaalsContact C-N 3.32Å; V401-L403 PolarHBondContact O-N 3.44Å; V401-D404 CarbonylContact O-C 3.51Å; V401-P405 WeakPolarHBondContact O-CA 3.46Å; V401-L407 HydrophobicContact CG2-CD2 4.07Å; V401-P498 HydrophobicContact CG2-CB 4.22Å; V401-P498 HydrophobicContact CG2-CG 3.96Å
402	L	87.3	Confident	89.9	Confident	7 Å²	7	22.1 Å²	22.1	4%	0.037	11%	0.114	C	C	.	.	H	α-helix	trans	-67.2	-31.3	176.6	-89.9	143.4	0	0	0	113.2	I146 M152 V180 I193 C398 R399	I146-L402 HydrophobicContact CG2-CD2 3.64Å; I146-L402 HydrophobicContact CG2-CG 4.12Å; M152-L402 HydrophobicContact CE-CD1 4.49Å; V180-L402 HydrophobicContact CG1-CD1 3.37Å; I193-L402 HydrophobicContact CD1-CB 3.77Å; I193-L402 HydrophobicContact CD1-CD1 4.13Å; I193-L402 HydrophobicContact CD1-CG 4.41Å; C398-L402 HydrophobicContact CB-CD1 4.5Å; C398-L402 WeakPolarHBondContact O-CD1 3.45Å; C398-L402 PolarHBondContact O-N 3.46Å; R399-L402 PolarHBondContact O-N 3.38Å
403	L	87.6	Confident	90.3	Very high	68 Å²	68	18.2 Å²	18.2	36%	0.356	10%	0.096	S	C	.	.	H	α-helix	trans	-81.3	-51.5	175.9	-67.4	173.6	0	0	0	111.2	K191 R399 N400 V401	K191-L403 HydrophobicContact CB-CD2 4.38Å; K191-L403 VanDerWaalsContact O-CD2 3.27Å; K191-L403 WeakPolarHBondContact O-CD2 3.32Å; R399-L403 HydrophobicContact CG-CD1 3.95Å; R399-L403 VanDerWaalsContact O-CG 3.31Å; R399-L403 WeakPolarHBondContact O-CG 3.34Å; R399-L403 PolarHBondContact O-N 3.38Å; N400-L403 PolarHBondContact O-N 2.96Å; V401-L403 VanDerWaalsContact C-N 3.32Å; V401-L403 PolarHBondContact O-N 3.44Å
404	D	88.2	Confident	90.7	Very high	91 Å²	91	17.6 Å²	17.6	49%	0.487	9%	0.093	S	C	.	.	S	Bend	trans	-124.4	97.6	-178.8	-70	-33.3	0	0	0	109.7	N400 V401 Q406	N400-D404 PolarHBondContact O-N 3.5Å; V401-D404 CarbonylContact O-C 3.51Å; D404-Q406 PolarHBondContact O-N 3.18Å
405	P	90.1	Very high	91	Very high	41 Å²	41	17.8 Å²	17.8	27%	0.266	9%	0.094	S	C	.	.			trans	-80.1	60.8	-173.8	33.3	-37.3	0	0	0	112	P143 V144 I146 V401	P143-P405 WeakPolarHBondContact CA-O 3.23Å; V144-P405 PolarHBondContact N-O 3.02Å; V144-P405 WeakPolarHBondContact O-CB 3.49Å; I146-P405 HydrophobicContact CD1-CB 3.9Å; I146-P405 HydrophobicContact CD1-CG 4.12Å; I146-P405 HydrophobicContact CG1-CB 3.79Å; V401-P405 WeakPolarHBondContact O-CA 3.46Å
406	Q	92	Very high	91.1	Very high	55 Å²	55	18 Å²	18	26%	0.257	9%	0.094	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.2	-179.6	-65.2	-67.2	-41.6	0	0	109.7	S141 I142 D404 L499	S141-Q406 PolarHBondContact OG-OE1 2.85Å; I142-Q406 WeakPolarHBondContact O-CA 3.2Å; D404-Q406 PolarHBondContact O-N 3.18Å; Q406-L499 HydrophobicContact CB-CB 3.81Å; Q406-L499 HydrophobicContact CB-CD2 3.69Å; Q406-L499 HydrophobicContact CB-CG 4.4Å; Q406-L499 HydrophobicContact CG-CD2 4.21Å; Q406-L499 WeakPolarHBondContact O-CB 3.48Å; Q406-L499 PolarHBondContact O-N 3.43Å
407	L	92.2	Very high	91.3	Very high	7 Å²	7	17.1 Å²	17.1	4%	0.037	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	155.5	177.8	-63.2	-174.8	0	0	0	111.5	S141 I142 V144 I155 V401 W496 E497	S141-L407 CarbonylContact C-O 3.49Å; S141-L407 VanDerWaalsContact CA-O 3.23Å; S141-L407 WeakPolarHBondContact CA-O 3.28Å; I142-L407 PolarHBondContact N-O 3.48Å; I142-L407 PolarHBondContact O-N 3.4Å; V144-L407 HydrophobicContact CG2-CB 4.22Å; V144-L407 HydrophobicContact CG2-CD1 3.4Å; V144-L407 VanDerWaalsContact CG2-CD1 3.4Å; V144-L407 HydrophobicContact CG2-CG 3.5Å; V144-L407 VanDerWaalsContact CG2-CG 3.5Å; I155-L407 HydrophobicContact CD1-CD1 3.61Å; I155-L407 HydrophobicContact CD1-CD2 4.31Å; I155-L407 HydrophobicContact CD1-CG 4.41Å; I155-L407 HydrophobicContact CG1-CD1 3.61Å; I155-L407 HydrophobicContact CG1-CD2 4.47Å; I155-L407 HydrophobicContact CG2-CD2 4.2Å; V401-L407 HydrophobicContact CG2-CD2 4.07Å; L407-W496 HydrophobicContact CB-CB 4.2Å; L407-W496 HydrophobicContact CB-CE3 4.24Å; L407-W496 HydrophobicContact CD1-CB 3.69Å; L407-W496 HydrophobicContact CD1-CG 3.98Å; L407-W496 HydrophobicContact CG-CB 4.41Å; L407-E497 WeakPolarHBondContact CA-O 3.25Å
408	V	93.4	Very high	91.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	144.2	178.7	-176.2	0	0	0	0	108.3	L137 I140 G410 S414 E497 L499	L137-V408 HydrophobicContact CD2-CG1 4.35Å; I140-V408 HydrophobicContact CD1-CG1 3.69Å; I140-V408 HydrophobicContact CG1-CG1 4.06Å; V408-G410 PolarHBondContact O-N 3.37Å; V408-S414 VanDerWaalsContact CG1-CB 3.44Å; V408-E497 PolarHBondContact N-O 3.42Å; V408-E497 PolarHBondContact O-N 3.2Å; V408-L499 HydrophobicContact CG2-CB 3.98Å; V408-L499 HydrophobicContact CG2-CD1 3.57Å; V408-L499 HydrophobicContact CG2-CG 4.35Å
409	P	92.9	Very high	91.8	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.013	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	128.9	177.3	27	-37.6	0	0	0	111.1	A413 S414 T477 M490 W496	P409-A413 HydrophobicContact CB-CB 3.84Å; P409-A413 HydrophobicContact CG-CB 4.05Å; P409-S414 PolarHBondContact O-N 3.29Å; P409-T477 HydrophobicContact CB-CG2 4.44Å; P409-T477 HydrophobicContact CG-CG2 4.23Å; P409-M490 HydrophobicContact CB-CB 3.86Å; P409-W496 HydrophobicContact CB-CE3 4.46Å; P409-W496 HydrophobicContact CB-CZ3 4.09Å
410	G	91.4	Very high	92	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-153.8	-179.3	0	0	0	0	0	113.3	V408 G412 A413 I495	V408-G410 PolarHBondContact O-N 3.37Å; G410-G412 PolarHBondContact O-N 3.06Å; G410-A413 VanDerWaalsContact O-CB 3.25Å; G410-A413 WeakPolarHBondContact O-CB 3.4Å; G410-A413 PolarHBondContact O-N 3.29Å; G410-I495 PolarHBondContact N-O 3.04Å; G410-I495 VanDerWaalsContact N-O 3.07Å
411	G	89.3	Confident	92.1	Very high	10 Å²	10	18.6 Å²	18.6	10%	0.103	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	23.1	169.1	0	0	0	0	0	115.3	A413 V480	G411-A413 VanDerWaalsContact C-N 3.33Å; G411-V480 PolarHBondContact O-N 3.41Å
412	G	91.9	Very high	92.3	Very high	2 Å²	2	18.7 Å²	18.7	2%	0.021	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	3.4	-176.4	0	0	0	0	0	115.2	G410 E415 M416	G410-G412 PolarHBondContact O-N 3.06Å; G412-E415 VanDerWaalsContact CA-OE2 3.23Å; G412-E415 WeakPolarHBondContact CA-OE2 3.43Å; G412-M416 WeakPolarHBondContact O-CB 3.45Å; G412-M416 PolarHBondContact O-N 2.77Å; G412-M416 VanDerWaalsContact O-N 3.16Å
413	A	94.1	Very high	92.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66	-49.4	178.1	0	0	0	0	0	111.1	P409 G410 G411 E415 M416 A417 W478 M490	P409-A413 HydrophobicContact CB-CB 3.84Å; P409-A413 HydrophobicContact CG-CB 4.05Å; G410-A413 VanDerWaalsContact O-CB 3.25Å; G410-A413 WeakPolarHBondContact O-CB 3.4Å; G410-A413 PolarHBondContact O-N 3.29Å; G411-A413 VanDerWaalsContact C-N 3.33Å; A413-E415 VanDerWaalsContact C-N 3.3Å; A413-E415 PolarHBondContact O-N 3.21Å; A413-M416 PolarHBondContact O-N 3.12Å; A413-M416 VanDerWaalsContact O-N 3.12Å; A413-A417 WeakPolarHBondContact O-CB 3.49Å; A413-A417 PolarHBondContact O-N 2.93Å; A413-W478 VanDerWaalsContact CA-O 3.31Å; A413-W478 WeakPolarHBondContact CA-O 3.38Å; A413-W478 WeakPolarHBondContact CB-O 3.47Å; A413-M490 HydrophobicContact CB-CG 4.13Å
414	S	94.4	Very high	92.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.1	-42.3	176.7	56.3	0	0	0	0	113.5	V408 P409 M416 A417 V418 K502	V408-S414 VanDerWaalsContact CG1-CB 3.44Å; P409-S414 PolarHBondContact O-N 3.29Å; S414-M416 VanDerWaalsContact C-N 3.3Å; S414-M416 PolarHBondContact O-N 2.84Å; S414-A417 PolarHBondContact O-N 2.73Å; S414-V418 WeakPolarHBondContact O-CB 3.23Å; S414-V418 WeakPolarHBondContact O-CG2 3.31Å; S414-V418 PolarHBondContact O-N 3.09Å; S414-K502 WeakPolarHBondContact OG-CE 3.45Å; S414-K502 PolarHBondContact OG-NZ 3.11Å
415	E	95.3	Very high	93.1	Very high	4 Å²	4	21.3 Å²	21.3	2%	0.019	12%	0.115	C	C	.	.	H	α-helix	trans	-64.4	-39.4	179.4	-72.3	68.6	-155.2	0	0	110.7	G412 A413 A419 L444 I447 K502 Y506	G412-E415 VanDerWaalsContact CA-OE2 3.23Å; G412-E415 WeakPolarHBondContact CA-OE2 3.43Å; A413-E415 VanDerWaalsContact C-N 3.3Å; A413-E415 PolarHBondContact O-N 3.21Å; E415-A419 WeakPolarHBondContact O-CB 3.46Å; E415-A419 PolarHBondContact O-N 3.31Å; E415-L444 HydrophobicContact CB-CB 4.49Å; E415-I447 HydrophobicContact CG-CB 3.92Å; E415-I447 HydrophobicContact CG-CG1 4.09Å; E415-I447 HydrophobicContact CG-CG2 4.15Å; E415-K502 IonicContact OE1-NZ 3.78Å; E415-K502 PolarHBondContact OE1-NZ 3.16Å; E415-K502 IonicContact OE2-NZ 3.17Å; E415-K502 PolarHBondContact OE2-NZ 3.17Å; E415-Y506 WeakPolarHBondContact CA-OH 3.36Å; E415-Y506 HydrophobicContact CG-CE1 4.45Å; E415-Y506 VanDerWaalsContact CG-OH 3.28Å; E415-Y506 WeakPolarHBondContact CG-OH 2.95Å; E415-Y506 PolarHBondContact OE1-OH 3.24Å; E415-Y506 VanDerWaalsContact OE1-OH 3.1Å
416	M	94.3	Very high	93.3	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.02	10%	0.103	C	C	.	.	H	α-helix	trans	-73.1	-40.8	178.9	-167.8	60.3	68.1	0	0	112.4	G412 A413 S414 V418 A419 H420 E445 P448 L463 L466 R467 H470	G412-M416 WeakPolarHBondContact O-CB 3.45Å; G412-M416 PolarHBondContact O-N 2.77Å; G412-M416 VanDerWaalsContact O-N 3.16Å; A413-M416 PolarHBondContact O-N 3.12Å; A413-M416 VanDerWaalsContact O-N 3.12Å; S414-M416 VanDerWaalsContact C-N 3.3Å; S414-M416 PolarHBondContact O-N 2.84Å; M416-V418 VanDerWaalsContact C-N 3.34Å; M416-V418 PolarHBondContact O-N 2.93Å; M416-A419 PolarHBondContact O-N 3.41Å; M416-H420 WeakPolarHBondContact O-CB 3.47Å; M416-H420 PolarHBondContact O-N 3.32Å; M416-E445 HydrophobicContact CE-CG 4.14Å; M416-E445 HydrophobicContact SD-CG 4.41Å; M416-P448 HydrophobicContact CE-CG 4.12Å; M416-L463 HydrophobicContact CE-CD2 4.25Å; M416-L466 HydrophobicContact CE-CD2 3.83Å; M416-L466 HydrophobicContact CE-CG 4.11Å; M416-L466 HydrophobicContact CG-CG 4.23Å; M416-R467 HydrophobicContact CE-CG 3.97Å; M416-R467 HydrophobicContact SD-CG 3.63Å; M416-H470 HydrophobicContact CG-CB 3.99Å; M416-H470 WeakPolarHBondContact CG-ND1 3.46Å
417	A	93.6	Very high	93.3	Very high	11 Å²	11	22.9 Å²	22.9	9%	0.091	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-44.1	175.2	0	0	0	0	0	111.3	I140 A413 S414 H420 A421 E476	I140-A417 HydrophobicContact CD1-CB 4.2Å; A413-A417 WeakPolarHBondContact O-CB 3.49Å; A413-A417 PolarHBondContact O-N 2.93Å; S414-A417 PolarHBondContact O-N 2.73Å; A417-H420 PolarHBondContact O-N 2.89Å; A417-A421 WeakPolarHBondContact O-CB 3.35Å; A417-A421 PolarHBondContact O-N 3.33Å; A417-E476 HydrophobicContact CB-CB 4.25Å
418	V	94.9	Very high	93.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68	-42.8	176.6	175.6	0	0	0	0	111	M133 L137 S414 M416 H420 A421 L422 L444 Y506	M133-V418 HydrophobicContact CB-CG1 3.99Å; M133-V418 HydrophobicContact CG-CG1 3.53Å; M133-V418 HydrophobicContact SD-CG1 4.31Å; L137-V418 HydrophobicContact CD2-CG2 3.67Å; L137-V418 HydrophobicContact CG-CG2 3.89Å; S414-V418 WeakPolarHBondContact O-CB 3.23Å; S414-V418 WeakPolarHBondContact O-CG2 3.31Å; S414-V418 PolarHBondContact O-N 3.09Å; M416-V418 VanDerWaalsContact C-N 3.34Å; M416-V418 PolarHBondContact O-N 2.93Å; V418-H420 VanDerWaalsContact C-N 3.34Å; V418-H420 PolarHBondContact O-N 2.8Å; V418-A421 PolarHBondContact O-N 3.48Å; V418-L422 HydrophobicContact CG1-CD1 4.18Å; V418-L422 HydrophobicContact CG1-CG 4.34Å; V418-L422 WeakPolarHBondContact O-CB 3.47Å; V418-L422 WeakPolarHBondContact O-CG 3.46Å; V418-L422 PolarHBondContact O-N 3.4Å; V418-L444 HydrophobicContact CB-CD1 4.14Å; V418-L444 HydrophobicContact CG1-CD1 3.59Å; V418-Y506 HydrophobicContact CG1-CE2 4.3Å; V418-Y506 HydrophobicContact CG2-CE2 4.23Å
419	A	94.5	Very high	93.1	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-57	-47.6	174.4	0	0	0	0	0	111.3	E415 M416 L422 T423 A441 L444 E445	E415-A419 WeakPolarHBondContact O-CB 3.46Å; E415-A419 PolarHBondContact O-N 3.31Å; M416-A419 PolarHBondContact O-N 3.41Å; A419-L422 PolarHBondContact O-N 2.95Å; A419-T423 WeakPolarHBondContact O-CG2 3.42Å; A419-T423 PolarHBondContact O-N 3.38Å; A419-T423 PolarHBondContact O-OG1 3Å; A419-A441 VanDerWaalsContact CB-O 3.23Å; A419-A441 WeakPolarHBondContact CB-O 3.43Å; A419-L444 HydrophobicContact CB-CB 4.34Å; A419-E445 HydrophobicContact CB-CG 4.43Å
420	H	93.4	Very high	93	Very high	52 Å²	52	34.3 Å²	34.3	24%	0.241	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-50.3	178.1	-178.2	47	0	0	0	111.8	M416 A417 V418 L422 T423 E424 H470	M416-H420 WeakPolarHBondContact O-CB 3.47Å; M416-H420 PolarHBondContact O-N 3.32Å; A417-H420 PolarHBondContact O-N 2.89Å; V418-H420 VanDerWaalsContact C-N 3.34Å; V418-H420 PolarHBondContact O-N 2.8Å; H420-L422 VanDerWaalsContact C-N 3.34Å; H420-L422 PolarHBondContact O-N 3.48Å; H420-T423 WeakPolarHBondContact CA-OG1 3.25Å; H420-T423 PolarHBondContact O-N 3.1Å; H420-T423 VanDerWaalsContact O-N 3.08Å; H420-T423 PolarHBondContact O-OG1 3.3Å; H420-E424 IonicContact CE1-OE1 2.65Å; H420-E424 PolarHBondContact O-N 3.49Å; H420-H470 PolarHBondContact CD2-O 3.1Å; H420-H470 VanDerWaalsContact CD2-O 3.26Å
421	A	93.2	Very high	93	Very high	36 Å²	36	36.5 Å²	36.5	30%	0.298	22%	0.217	S	C	.	.	H	α-helix	trans	-59.4	-41.9	179.3	0	0	0	0	0	112.8	T136 A417 V418 K425	T136-A421 HydrophobicContact CG2-CB 3.75Å; A417-A421 WeakPolarHBondContact O-CB 3.35Å; A417-A421 PolarHBondContact O-N 3.33Å; V418-A421 PolarHBondContact O-N 3.48Å; A421-K425 WeakPolarHBondContact O-CB 3.42Å; A421-K425 PolarHBondContact O-N 3.17Å
422	L	94.6	Very high	93	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-65	-42.3	173.9	-70.8	178.9	0	0	0	111.4	D132 M133 V418 A419 H420 E424 K425 S426 Y437 V440 A441 L444	D132-L422 HydrophobicContact CB-CD2 3.7Å; M133-L422 HydrophobicContact CG-CD1 3.69Å; M133-L422 HydrophobicContact CG-CD2 4.32Å; M133-L422 HydrophobicContact CG-CG 4.34Å; M133-L422 HydrophobicContact SD-CD1 4.16Å; V418-L422 HydrophobicContact CG1-CD1 4.18Å; V418-L422 HydrophobicContact CG1-CG 4.34Å; V418-L422 WeakPolarHBondContact O-CB 3.47Å; V418-L422 WeakPolarHBondContact O-CG 3.46Å; V418-L422 PolarHBondContact O-N 3.4Å; A419-L422 PolarHBondContact O-N 2.95Å; H420-L422 VanDerWaalsContact C-N 3.34Å; H420-L422 PolarHBondContact O-N 3.48Å; L422-E424 VanDerWaalsContact C-N 3.34Å; L422-E424 PolarHBondContact O-N 3.37Å; L422-K425 PolarHBondContact O-N 2.84Å; L422-S426 WeakPolarHBondContact O-CB 3.29Å; L422-S426 PolarHBondContact O-N 3.32Å; L422-Y437 HydrophobicContact CB-CE1 4.32Å; L422-Y437 HydrophobicContact CD2-CE1 4.16Å; L422-Y437 HydrophobicContact CD2-CE2 4.23Å; L422-Y437 VanDerWaalsContact CD2-OH 3.23Å; L422-Y437 WeakPolarHBondContact CD2-OH 3.37Å; L422-Y437 WeakPolarHBondContact O-CE1 3.36Å; L422-V440 HydrophobicContact CD1-CG1 4.36Å; L422-A441 HydrophobicContact CB-CB 3.69Å; L422-A441 HydrophobicContact CD1-CB 4.15Å; L422-L444 HydrophobicContact CD1-CD1 3.99Å
423	T	93.8	Very high	93	Very high	33 Å²	33	42.4 Å²	42.4	20%	0.202	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-41.2	178.2	56.6	0	0	0	0	112.4	A419 H420 S426 K427 A441	A419-T423 WeakPolarHBondContact O-CG2 3.42Å; A419-T423 PolarHBondContact O-N 3.38Å; A419-T423 PolarHBondContact O-OG1 3Å; H420-T423 WeakPolarHBondContact CA-OG1 3.25Å; H420-T423 PolarHBondContact O-N 3.1Å; H420-T423 VanDerWaalsContact O-N 3.08Å; H420-T423 PolarHBondContact O-OG1 3.3Å; T423-S426 WeakPolarHBondContact O-CB 3.46Å; T423-S426 PolarHBondContact O-N 3.48Å; T423-S426 PolarHBondContact O-OG 3.11Å; T423-K427 PolarHBondContact O-N 3.32Å; T423-A441 HydrophobicContact CG2-CB 3.73Å
424	E	92.2	Very high	93	Very high	83 Å²	83	44.1 Å²	44.1	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-64.8	-46.2	175.8	-70.8	-54.1	138.6	0	0	111.3	H420 L422 S426 K427	H420-E424 IonicContact CE1-OE1 2.65Å; H420-E424 PolarHBondContact O-N 3.49Å; L422-E424 VanDerWaalsContact C-N 3.34Å; L422-E424 PolarHBondContact O-N 3.37Å; E424-S426 PolarHBondContact O-N 3.01Å; E424-K427 WeakPolarHBondContact O-CB 3.38Å; E424-K427 PolarHBondContact O-N 3.21Å; E424-K427 IonicContact OE1-NZ 2.67Å; E424-K427 PolarHBondContact OE1-NZ 2.7Å; E424-K427 IonicContact OE2-NZ 3.5Å; E424-K427 PolarHBondContact OE2-NZ 3.06Å
425	K	93.6	Very high	92.9	Very high	105 Å²	105	50.8 Å²	50.8	46%	0.457	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-32.3	177.4	-164.6	165.2	-179.2	-172.2	0	112.6	D132 A421 L422 K427 A428 M429 Y437	D132-K425 IonicContact OD1-NZ 3.98Å; D132-K425 PolarHBondContact OD1-NZ 2.75Å; D132-K425 WeakPolarHBondContact OD2-CD 3.31Å; D132-K425 WeakPolarHBondContact OD2-CE 3.47Å; D132-K425 IonicContact OD2-NZ 3.9Å; D132-K425 PolarHBondContact OD2-NZ 3.42Å; A421-K425 WeakPolarHBondContact O-CB 3.42Å; A421-K425 PolarHBondContact O-N 3.17Å; L422-K425 PolarHBondContact O-N 2.84Å; K425-K427 PolarHBondContact O-N 2.88Å; K425-A428 PolarHBondContact O-N 3.25Å; K425-M429 PolarHBondContact O-N 3.48Å; K425-Y437 HydrophobicContact CB-CE1 4.49Å; K425-Y437 WeakPolarHBondContact CD-OH 3.44Å
426	S	94	Very high	92.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-28.9	174.8	84.3	0	0	0	0	112.7	L422 T423 E424 A428 M429 Q434 R438	L422-S426 WeakPolarHBondContact O-CB 3.29Å; L422-S426 PolarHBondContact O-N 3.32Å; T423-S426 WeakPolarHBondContact O-CB 3.46Å; T423-S426 PolarHBondContact O-N 3.48Å; T423-S426 PolarHBondContact O-OG 3.11Å; E424-S426 PolarHBondContact O-N 3.01Å; S426-A428 VanDerWaalsContact C-N 3.32Å; S426-M429 PolarHBondContact O-N 3.16Å; S426-Q434 WeakPolarHBondContact O-CG 3.35Å; S426-Q434 PolarHBondContact O-NE2 3.2Å; S426-R438 PolarHBondContact OG-NE 2.83Å; S426-R438 PolarHBondContact OG-NH2 3.37Å
427	K	92.5	Very high	93	Very high	129 Å²	129	50.4 Å²	50.4	56%	0.561	28%	0.279	S	S	*	.	H	α-helix	trans	-69.6	-31.4	179.6	-65.1	176.6	-170.2	161.1	0	112	T423 E424 K425	T423-K427 PolarHBondContact O-N 3.32Å; E424-K427 WeakPolarHBondContact O-CB 3.38Å; E424-K427 PolarHBondContact O-N 3.21Å; E424-K427 IonicContact OE1-NZ 2.67Å; E424-K427 PolarHBondContact OE1-NZ 2.7Å; E424-K427 IonicContact OE2-NZ 3.5Å; E424-K427 PolarHBondContact OE2-NZ 3.06Å; K425-K427 PolarHBondContact O-N 2.88Å
428	A	91.8	Very high	93	Very high	87 Å²	87	52.7 Å²	52.7	72%	0.719	29%	0.285	S	S	*	.	H	α-helix	trans	-80.1	-21	177.1	0	0	0	0	0	113.1	K425 S426	K425-A428 PolarHBondContact O-N 3.25Å; S426-A428 VanDerWaalsContact C-N 3.32Å
429	M	90.5	Very high	93	Very high	38 Å²	38	52.9 Å²	52.9	19%	0.187	29%	0.287	C	S	.	.			trans	-78.1	132.4	-179.9	-170.7	-175.5	-67.2	0	0	111.2	K425 S426 E433 Q434 Y437	K425-M429 PolarHBondContact O-N 3.48Å; S426-M429 PolarHBondContact O-N 3.16Å; M429-E433 HydrophobicContact SD-CG 3.97Å; M429-Q434 VanDerWaalsContact O-CD 3.24Å; M429-Q434 PolarHBondContact O-NE2 3.22Å; M429-Y437 HydrophobicContact CE-CD1 4.25Å; M429-Y437 HydrophobicContact CE-CD2 3.78Å; M429-Y437 HydrophobicContact CE-CE1 4.39Å; M429-Y437 HydrophobicContact CE-CE2 3.92Å; M429-Y437 HydrophobicContact CE-CG 3.94Å; M429-Y437 HydrophobicContact SD-CG 4.37Å
430	T	90.1	Very high	93	Very high	125 Å²	125	52.9 Å²	52.9	77%	0.767	29%	0.286	S	S	*	.			trans	-106.4	141.3	173.7	60.6	0	0	0	0	110.8
431	G	90.5	Very high	93.1	Very high	45 Å²	45	50.4 Å²	50.4	46%	0.464	28%	0.275	S	S	.	.	S	Bend	trans	119.6	176.7	172	0	0	0	0	0	114	E433 Q434	G431-E433 PolarHBondContact O-N 3.39Å; G431-Q434 WeakPolarHBondContact O-CB 3.3Å; G431-Q434 PolarHBondContact O-N 3.06Å
432	V	90.7	Very high	93	Very high	94 Å²	94	53.5 Å²	53.5	57%	0.57	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-26.1	-175.6	-65.2	0	0	0	0	113.4	V121 Q434 P436	V121-V432 HydrophobicContact CG1-CG2 3.93Å; V432-Q434 PolarHBondContact O-N 3.09Å; V432-P436 WeakPolarHBondContact O-CD 3.4Å
433	E	90.9	Very high	93	Very high	43 Å²	43	53.5 Å²	53.5	20%	0.201	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-12.3	177.3	59.3	174.5	-167.5	0	0	113.9	V121 A125 K128 M429 G431 W435 P436 Y437	V121-E433 HydrophobicContact CG1-CB 4.46Å; A125-E433 HydrophobicContact CB-CB 4.11Å; K128-E433 IonicContact NZ-OE1 3.37Å; K128-E433 PolarHBondContact NZ-OE1 2.88Å; K128-E433 IonicContact NZ-OE2 3.02Å; K128-E433 PolarHBondContact NZ-OE2 3.38Å; M429-E433 HydrophobicContact SD-CG 3.97Å; G431-E433 PolarHBondContact O-N 3.39Å; E433-W435 VanDerWaalsContact C-N 3.3Å; E433-W435 PolarHBondContact O-N 3.28Å; E433-P436 WeakPolarHBondContact O-CD 3.19Å; E433-Y437 VanDerWaalsContact O-CB 3.28Å; E433-Y437 WeakPolarHBondContact O-CB 3.38Å; E433-Y437 PolarHBondContact O-N 3.5Å; E433-Y437 VanDerWaalsContact O-N 3.16Å
434	Q	94.4	Very high	93.1	Very high	36 Å²	36	52 Å²	52	17%	0.168	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-38.9	176.8	-172.5	-172.8	24.7	0	0	112	S426 M429 G431 V432 R438	S426-Q434 WeakPolarHBondContact O-CG 3.35Å; S426-Q434 PolarHBondContact O-NE2 3.2Å; M429-Q434 VanDerWaalsContact O-CD 3.24Å; M429-Q434 PolarHBondContact O-NE2 3.22Å; G431-Q434 WeakPolarHBondContact O-CB 3.3Å; G431-Q434 PolarHBondContact O-N 3.06Å; V432-Q434 PolarHBondContact O-N 3.09Å; Q434-R438 VanDerWaalsContact NE2-NH2 3.2Å; Q434-R438 WeakPolarHBondContact O-CB 3.15Å; Q434-R438 PolarHBondContact O-N 2.85Å
435	W	93.2	Very high	93.2	Very high	139 Å²	139	48.8 Å²	48.8	53%	0.527	26%	0.259	S	S	.	.	H	α-helix	trans	-70.4	-50.8	-175.4	-51.9	99.1	0	0	0	112.5	F112 E433 Y437 R438 A439	F112-W435 HydrophobicContact CE1-CB 3.69Å; F112-W435 HydrophobicContact CZ-CB 4.07Å; F112-W435 WeakPolarHBondContact CZ-O 3.13Å; E433-W435 VanDerWaalsContact C-N 3.3Å; E433-W435 PolarHBondContact O-N 3.28Å; W435-Y437 VanDerWaalsContact C-N 3.29Å; W435-Y437 PolarHBondContact O-N 3.43Å; W435-R438 PolarHBondContact O-N 2.93Å; W435-A439 PolarHBondContact O-N 3.18Å
436	P	94.8	Very high	93.2	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-33.8	175	-21.1	34.4	0	0	0	112.9	F112 M117 V122 A125 Y126 V432 E433 A439 V440	F112-P436 HydrophobicContact CD2-CB 4.13Å; F112-P436 HydrophobicContact CD2-CG 4.05Å; F112-P436 HydrophobicContact CE2-CB 4.09Å; F112-P436 HydrophobicContact CE2-CG 4.24Å; F112-P436 HydrophobicContact CG-CG 4.25Å; M117-P436 HydrophobicContact CE-CG 4.32Å; V122-P436 HydrophobicContact CB-CB 4.5Å; V122-P436 HydrophobicContact CG1-CB 4.21Å; V122-P436 HydrophobicContact CG2-CB 4.5Å; V122-P436 HydrophobicContact CG2-CG 4.17Å; A125-P436 HydrophobicContact CB-CB 3.82Å; A125-P436 HydrophobicContact CB-CG 4.47Å; Y126-P436 HydrophobicContact CD1-CB 4.37Å; Y126-P436 HydrophobicContact CE1-CB 4.06Å; V432-P436 WeakPolarHBondContact O-CD 3.4Å; E433-P436 WeakPolarHBondContact O-CD 3.19Å; P436-A439 WeakPolarHBondContact O-CB 3.23Å; P436-A439 PolarHBondContact O-N 3.3Å; P436-V440 PolarHBondContact O-N 2.96Å
437	Y	95.7	Very high	93.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-46	174.2	-178.6	-85.5	0	0	0	111.8	K128 A129 D132 L422 K425 M429 E433 W435 A439 V440	K128-Y437 HydrophobicContact CB-CD2 4.49Å; A129-Y437 HydrophobicContact CB-CD2 3.73Å; A129-Y437 HydrophobicContact CB-CE2 3.86Å; D132-Y437 PolarHBondContact OD2-OH 3.12Å; L422-Y437 HydrophobicContact CB-CE1 4.32Å; L422-Y437 HydrophobicContact CD2-CE1 4.16Å; L422-Y437 HydrophobicContact CD2-CE2 4.23Å; L422-Y437 VanDerWaalsContact CD2-OH 3.23Å; L422-Y437 WeakPolarHBondContact CD2-OH 3.37Å; L422-Y437 WeakPolarHBondContact O-CE1 3.36Å; K425-Y437 HydrophobicContact CB-CE1 4.49Å; K425-Y437 WeakPolarHBondContact CD-OH 3.44Å; M429-Y437 HydrophobicContact CE-CD1 4.25Å; M429-Y437 HydrophobicContact CE-CD2 3.78Å; M429-Y437 HydrophobicContact CE-CE1 4.39Å; M429-Y437 HydrophobicContact CE-CE2 3.92Å; M429-Y437 HydrophobicContact CE-CG 3.94Å; M429-Y437 HydrophobicContact SD-CG 4.37Å; E433-Y437 VanDerWaalsContact O-CB 3.28Å; E433-Y437 WeakPolarHBondContact O-CB 3.38Å; E433-Y437 PolarHBondContact O-N 3.5Å; E433-Y437 VanDerWaalsContact O-N 3.16Å; W435-Y437 VanDerWaalsContact C-N 3.29Å; W435-Y437 PolarHBondContact O-N 3.43Å; Y437-A439 VanDerWaalsContact C-N 3.3Å; Y437-A439 PolarHBondContact O-N 3.12Å; Y437-V440 PolarHBondContact O-N 3.45Å
438	R	94.8	Very high	93.4	Very high	60 Å²	60	38.2 Å²	38.2	23%	0.226	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-32.9	176.3	-176	175.6	-68.3	148.2	4.2	112.5	S426 Q434 W435 V440 A441 Q442	S426-R438 PolarHBondContact OG-NE 2.83Å; S426-R438 PolarHBondContact OG-NH2 3.37Å; Q434-R438 VanDerWaalsContact NE2-NH2 3.2Å; Q434-R438 WeakPolarHBondContact O-CB 3.15Å; Q434-R438 PolarHBondContact O-N 2.85Å; W435-R438 PolarHBondContact O-N 2.93Å; R438-V440 VanDerWaalsContact C-N 3.34Å; R438-A441 WeakPolarHBondContact O-CB 3.46Å; R438-A441 PolarHBondContact O-N 2.96Å; R438-Q442 PolarHBondContact O-N 3.5Å
439	A	94.7	Very high	93.5	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.033	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-35.8	177.4	0	0	0	0	0	113.1	V108 F112 W435 P436 Y437 A441 Q442 A443	V108-A439 HydrophobicContact CB-CB 4.41Å; V108-A439 HydrophobicContact CG1-CB 3.87Å; V108-A439 HydrophobicContact CG2-CB 3.65Å; F112-A439 HydrophobicContact CE2-CB 3.41Å; F112-A439 VanDerWaalsContact CE2-CB 3.41Å; F112-A439 HydrophobicContact CZ-CB 3.65Å; W435-A439 PolarHBondContact O-N 3.18Å; P436-A439 WeakPolarHBondContact O-CB 3.23Å; P436-A439 PolarHBondContact O-N 3.3Å; Y437-A439 VanDerWaalsContact C-N 3.3Å; Y437-A439 PolarHBondContact O-N 3.12Å; A439-A441 VanDerWaalsContact C-N 3.26Å; A439-A441 PolarHBondContact O-N 2.88Å; A439-Q442 PolarHBondContact O-N 2.9Å; A439-Q442 VanDerWaalsContact O-N 3.16Å; A439-A443 WeakPolarHBondContact O-CB 3.18Å; A439-A443 PolarHBondContact O-N 3.41Å
440	V	94.6	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-42.1	172.7	175	0	0	0	0	110.7	M105 Y126 A129 M133 L422 P436 Y437 R438 Q442 A443 L444	M105-V440 HydrophobicContact CE-CG1 4.19Å; Y126-V440 HydrophobicContact CD1-CG2 3.42Å; Y126-V440 VanDerWaalsContact CD1-CG2 3.42Å; Y126-V440 HydrophobicContact CD2-CG2 4.27Å; Y126-V440 HydrophobicContact CE1-CG2 3.43Å; Y126-V440 VanDerWaalsContact CE1-CG2 3.43Å; Y126-V440 HydrophobicContact CE2-CG2 4.29Å; Y126-V440 HydrophobicContact CG-CG2 3.86Å; A129-V440 HydrophobicContact CB-CB 4.16Å; A129-V440 HydrophobicContact CB-CG1 4.03Å; A129-V440 HydrophobicContact CB-CG2 4.24Å; M133-V440 HydrophobicContact CE-CG1 3.78Å; M133-V440 HydrophobicContact SD-CG1 4.04Å; L422-V440 HydrophobicContact CD1-CG1 4.36Å; P436-V440 PolarHBondContact O-N 2.96Å; Y437-V440 PolarHBondContact O-N 3.45Å; R438-V440 VanDerWaalsContact C-N 3.34Å; V440-Q442 VanDerWaalsContact C-N 3.31Å; V440-Q442 PolarHBondContact O-N 3.32Å; V440-A443 WeakPolarHBondContact O-CB 3.22Å; V440-A443 PolarHBondContact O-N 3.25Å; V440-A443 VanDerWaalsContact O-N 3.17Å; V440-L444 WeakPolarHBondContact O-CG 3.42Å; V440-L444 PolarHBondContact O-N 2.95Å; V440-L444 VanDerWaalsContact O-N 3.12Å
441	A	93.9	Very high	93.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-40.9	177.2	0	0	0	0	0	112.4	A419 L422 T423 R438 A439 L444	A419-A441 VanDerWaalsContact CB-O 3.23Å; A419-A441 WeakPolarHBondContact CB-O 3.43Å; L422-A441 HydrophobicContact CB-CB 3.69Å; L422-A441 HydrophobicContact CD1-CB 4.15Å; T423-A441 HydrophobicContact CG2-CB 3.73Å; R438-A441 WeakPolarHBondContact O-CB 3.46Å; R438-A441 PolarHBondContact O-N 2.96Å; A439-A441 VanDerWaalsContact C-N 3.26Å; A439-A441 PolarHBondContact O-N 2.88Å; A441-L444 PolarHBondContact O-N 3.22Å
442	Q	91.6	Very high	93.9	Very high	102 Å²	102	29.2 Å²	29.2	48%	0.477	13%	0.132	S	C	.	.	H	α-helix	trans	-70.5	-33.9	176.1	-65.6	178.9	-6.7	0	0	112.6	R438 A439 V440 L444 E445	R438-Q442 PolarHBondContact O-N 3.5Å; A439-Q442 PolarHBondContact O-N 2.9Å; A439-Q442 VanDerWaalsContact O-N 3.16Å; V440-Q442 VanDerWaalsContact C-N 3.31Å; V440-Q442 PolarHBondContact O-N 3.32Å; Q442-L444 VanDerWaalsContact C-N 3.31Å; Q442-L444 PolarHBondContact O-N 2.95Å; Q442-E445 WeakPolarHBondContact O-CB 3.31Å; Q442-E445 PolarHBondContact O-N 3.45Å
443	A	95.1	Very high	93.9	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-34.8	177.4	0	0	0	0	0	111.8	E104 M105 V108 A439 V440 E445 V446	E104-A443 HydrophobicContact CB-CB 4.41Å; E104-A443 HydrophobicContact CG-CB 3.85Å; M105-A443 HydrophobicContact CG-CB 4.05Å; V108-A443 HydrophobicContact CG1-CB 4.26Å; A439-A443 WeakPolarHBondContact O-CB 3.18Å; A439-A443 PolarHBondContact O-N 3.41Å; V440-A443 WeakPolarHBondContact O-CB 3.22Å; V440-A443 PolarHBondContact O-N 3.25Å; V440-A443 VanDerWaalsContact O-N 3.17Å; A443-E445 PolarHBondContact O-N 3.29Å; A443-V446 VanDerWaalsContact O-CB 3.31Å; A443-V446 WeakPolarHBondContact O-CB 3.39Å; A443-V446 WeakPolarHBondContact O-CG1 3.48Å; A443-V446 PolarHBondContact O-N 3.19Å; A443-V446 VanDerWaalsContact O-N 3.09Å
444	L	94.8	Very high	93.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.1	-28.6	175.8	-68.4	172.6	0	0	0	112.9	L101 M105 M133 E415 V418 A419 L422 V440 A441 Q442 V446 I447 Y506	L101-L444 HydrophobicContact CD2-CD2 4.09Å; M105-L444 HydrophobicContact CE-CD2 4.24Å; M133-L444 HydrophobicContact SD-CD1 3.84Å; M133-L444 HydrophobicContact SD-CD2 4.1Å; M133-L444 HydrophobicContact SD-CG 4.39Å; E415-L444 HydrophobicContact CB-CB 4.49Å; V418-L444 HydrophobicContact CB-CD1 4.14Å; V418-L444 HydrophobicContact CG1-CD1 3.59Å; A419-L444 HydrophobicContact CB-CB 4.34Å; L422-L444 HydrophobicContact CD1-CD1 3.99Å; V440-L444 WeakPolarHBondContact O-CG 3.42Å; V440-L444 PolarHBondContact O-N 2.95Å; V440-L444 VanDerWaalsContact O-N 3.12Å; A441-L444 PolarHBondContact O-N 3.22Å; Q442-L444 VanDerWaalsContact C-N 3.31Å; Q442-L444 PolarHBondContact O-N 2.95Å; L444-V446 PolarHBondContact O-N 3.39Å; L444-I447 PolarHBondContact O-N 3.32Å; L444-Y506 HydrophobicContact CD2-CE1 4.16Å; L444-Y506 HydrophobicContact CD2-CE2 4.45Å
445	E	94.4	Very high	93.6	Very high	17 Å²	17	28.7 Å²	28.7	8%	0.079	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-10	177.6	-56.2	-176.8	-173.6	0	0	113.2	M416 A419 Q442 A443 I447 P448 R449 R467	M416-E445 HydrophobicContact CE-CG 4.14Å; M416-E445 HydrophobicContact SD-CG 4.41Å; A419-E445 HydrophobicContact CB-CG 4.43Å; Q442-E445 WeakPolarHBondContact O-CB 3.31Å; Q442-E445 PolarHBondContact O-N 3.45Å; A443-E445 PolarHBondContact O-N 3.29Å; E445-I447 VanDerWaalsContact C-N 3.27Å; E445-I447 PolarHBondContact O-N 3.3Å; E445-P448 WeakPolarHBondContact O-CD 3.5Å; E445-P448 WeakPolarHBondContact O-CG 3.26Å; E445-R449 WeakPolarHBondContact O-CB 3.1Å; E445-R449 PolarHBondContact O-N 3.15Å; E445-R467 WeakPolarHBondContact OE1-CD 3.38Å
446	V	95.1	Very high	93.3	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.018	14%	0.137	C	C	.	.	H	α-helix	trans	-63.6	-30.7	178.4	74.6	0	0	0	0	113	I100 L101 E104 A443 L444 R449 T450	I100-V446 HydrophobicContact CG2-CG1 3.86Å; I100-V446 HydrophobicContact CG2-CG2 3.95Å; L101-V446 HydrophobicContact CD2-CG1 3.86Å; E104-V446 HydrophobicContact CB-CB 4.21Å; E104-V446 HydrophobicContact CB-CG1 3.99Å; E104-V446 HydrophobicContact CB-CG2 4.31Å; E104-V446 HydrophobicContact CG-CB 3.87Å; E104-V446 HydrophobicContact CG-CG1 4.14Å; E104-V446 HydrophobicContact CG-CG2 4.13Å; A443-V446 VanDerWaalsContact O-CB 3.31Å; A443-V446 WeakPolarHBondContact O-CB 3.39Å; A443-V446 WeakPolarHBondContact O-CG1 3.48Å; A443-V446 PolarHBondContact O-N 3.19Å; A443-V446 VanDerWaalsContact O-N 3.09Å; L444-V446 PolarHBondContact O-N 3.39Å; V446-R449 PolarHBondContact O-N 2.99Å; V446-T450 VanDerWaalsContact O-CB 3.23Å; V446-T450 WeakPolarHBondContact O-CB 3.39Å; V446-T450 PolarHBondContact O-N 2.73Å; V446-T450 PolarHBondContact O-OG1 3.44Å
447	I	94.7	Very high	93.1	Very high	9 Å²	9	26.9 Å²	26.9	5%	0.046	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-58.1	179.5	-64.1	-61.8	0	0	0	110.9	L41 I100 L101 E415 L444 E445 R449 T450 L451	L41-I447 HydrophobicContact CD2-CD1 3.89Å; L41-I447 HydrophobicContact CD2-CG2 4.33Å; I100-I447 HydrophobicContact CB-CD1 4.48Å; I100-I447 HydrophobicContact CG2-CD1 4.29Å; L101-I447 HydrophobicContact CD1-CG1 4.38Å; L101-I447 HydrophobicContact CD2-CD1 4.28Å; L101-I447 HydrophobicContact CD2-CG1 3.76Å; L101-I447 HydrophobicContact CG-CD1 4.07Å; L101-I447 HydrophobicContact CG-CG1 4.02Å; E415-I447 HydrophobicContact CG-CB 3.92Å; E415-I447 HydrophobicContact CG-CG1 4.09Å; E415-I447 HydrophobicContact CG-CG2 4.15Å; L444-I447 PolarHBondContact O-N 3.32Å; E445-I447 VanDerWaalsContact C-N 3.27Å; E445-I447 PolarHBondContact O-N 3.3Å; I447-R449 PolarHBondContact O-N 3.41Å; I447-T450 PolarHBondContact O-N 3.07Å; I447-L451 PolarHBondContact O-N 3.02Å
448	P	94.4	Very high	92.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.4	-33.7	174.1	20.8	-30	0	0	0	111.8	M416 E445 T450 L451 I452 L463 L466 V480	M416-P448 HydrophobicContact CE-CG 4.12Å; E445-P448 WeakPolarHBondContact O-CD 3.5Å; E445-P448 WeakPolarHBondContact O-CG 3.26Å; P448-T450 PolarHBondContact O-N 3.26Å; P448-L451 PolarHBondContact O-N 3.33Å; P448-I452 WeakPolarHBondContact O-CD1 3.48Å; P448-I452 WeakPolarHBondContact O-CG1 3.5Å; P448-I452 PolarHBondContact O-N 3.3Å; P448-L463 HydrophobicContact CB-CD2 4.1Å; P448-L463 HydrophobicContact CG-CD2 4.23Å; P448-L466 HydrophobicContact CB-CD2 4.13Å; P448-V480 HydrophobicContact CB-CG2 4.23Å
449	R	94.6	Very high	92.7	Very high	87 Å²	87	28.7 Å²	28.7	33%	0.328	17%	0.168	S	C	.	.	H	α-helix	trans	-59.5	-47.1	175.4	-175.7	-179.9	-58.5	166.9	6.1	112.2	E104 E445 V446 I447 I452 Q453 L463	E104-R449 IonicContact OE1-NH1 2.97Å; E445-R449 WeakPolarHBondContact O-CB 3.1Å; E445-R449 PolarHBondContact O-N 3.15Å; V446-R449 PolarHBondContact O-N 2.99Å; I447-R449 PolarHBondContact O-N 3.41Å; R449-I452 PolarHBondContact O-N 3.27Å; R449-Q453 WeakPolarHBondContact O-CB 3.19Å; R449-Q453 PolarHBondContact O-N 3.3Å; R449-L463 HydrophobicContact CB-CD1 3.7Å; R449-L463 HydrophobicContact CB-CD2 4.47Å; R449-L463 HydrophobicContact CG-CD1 3.78Å
450	T	93.6	Very high	92.6	Very high	1 Å²	1	35 Å²	35	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-41.2	-179.5	-61.5	0	0	0	0	110.5	R38 L41 V446 I447 P448 I452 Q453 N454	R38-T450 HydrophobicContact CG-CG2 3.43Å; R38-T450 VanDerWaalsContact CG-CG2 3.43Å; R38-T450 WeakPolarHBondContact O-CG2 3.36Å; L41-T450 HydrophobicContact CB-CG2 4.01Å; L41-T450 HydrophobicContact CD2-CG2 3.83Å; V446-T450 VanDerWaalsContact O-CB 3.23Å; V446-T450 WeakPolarHBondContact O-CB 3.39Å; V446-T450 PolarHBondContact O-N 2.73Å; V446-T450 PolarHBondContact O-OG1 3.44Å; I447-T450 PolarHBondContact O-N 3.07Å; P448-T450 PolarHBondContact O-N 3.26Å; T450-I452 PolarHBondContact O-N 2.94Å; T450-Q453 WeakPolarHBondContact O-CB 3.35Å; T450-Q453 PolarHBondContact O-N 3.37Å; T450-N454 WeakPolarHBondContact O-CB 3.46Å; T450-N454 VanDerWaalsContact O-CG 3.23Å; T450-N454 PolarHBondContact O-N 3.35Å; T450-N454 PolarHBondContact O-ND2 3.02Å
451	L	92.1	Very high	92.5	Very high	17 Å²	17	43.4 Å²	43.4	9%	0.089	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-43.5	176.7	-164.9	164.8	0	0	0	111.1	I447 P448 Q453 N454 C455 V480	I447-L451 PolarHBondContact O-N 3.02Å; P448-L451 PolarHBondContact O-N 3.33Å; L451-Q453 VanDerWaalsContact C-N 3.34Å; L451-Q453 PolarHBondContact O-N 3.21Å; L451-N454 PolarHBondContact O-N 3.26Å; L451-C455 PolarHBondContact O-N 3.14Å; L451-V480 HydrophobicContact CD2-CB 3.82Å; L451-V480 HydrophobicContact CD2-CG1 3.55Å
452	I	93.3	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-38.7	174.3	-63.6	159.8	0	0	0	111.7	P448 R449 T450 C455 G456 A457 T459 L462 L463 V480	P448-I452 WeakPolarHBondContact O-CD1 3.48Å; P448-I452 WeakPolarHBondContact O-CG1 3.5Å; P448-I452 PolarHBondContact O-N 3.3Å; R449-I452 PolarHBondContact O-N 3.27Å; T450-I452 PolarHBondContact O-N 2.94Å; I452-C455 VanDerWaalsContact CA-SG 3.58Å; I452-C455 PolarHBondContact O-N 3.03Å; I452-C455 PolarHBondContact O-SG 3.5Å; I452-G456 PolarHBondContact O-N 2.75Å; I452-A457 HydrophobicContact CG2-CB 4.04Å; I452-A457 PolarHBondContact O-N 3.01Å; I452-T459 HydrophobicContact CB-CG2 4.25Å; I452-T459 HydrophobicContact CG2-CG2 3.94Å; I452-L462 HydrophobicContact CD1-CB 3.82Å; I452-L462 HydrophobicContact CG1-CB 4.37Å; I452-L462 HydrophobicContact CG1-CD1 4.45Å; I452-L462 HydrophobicContact CG2-CB 4.25Å; I452-L462 HydrophobicContact CG2-CD1 3.69Å; I452-L463 HydrophobicContact CD1-CD2 3.72Å; I452-L463 HydrophobicContact CD1-CG 3.72Å; I452-V480 HydrophobicContact CD1-CG2 3.83Å; I452-V480 HydrophobicContact CG1-CB 4.23Å; I452-V480 HydrophobicContact CG1-CG1 3.61Å; I452-V480 HydrophobicContact CG1-CG2 3.73Å
453	Q	91.9	Very high	92.5	Very high	109 Å²	109	40 Å²	40	51%	0.509	22%	0.217	S	C	.	.	H	α-helix	trans	-65.3	-44.4	178.3	-176	177.4	1.6	0	0	111.3	R449 T450 L451 C455 G456 T459	R449-Q453 WeakPolarHBondContact O-CB 3.19Å; R449-Q453 PolarHBondContact O-N 3.3Å; T450-Q453 WeakPolarHBondContact O-CB 3.35Å; T450-Q453 PolarHBondContact O-N 3.37Å; L451-Q453 VanDerWaalsContact C-N 3.34Å; L451-Q453 PolarHBondContact O-N 3.21Å; Q453-C455 VanDerWaalsContact C-N 3.27Å; Q453-C455 PolarHBondContact O-N 3.18Å; Q453-G456 PolarHBondContact O-N 3.2Å; Q453-T459 HydrophobicContact CB-CG2 3.96Å
454	N	89.9	Confident	92.4	Very high	29 Å²	29	43.2 Å²	43.2	16%	0.155	24%	0.236	C	C	.	.	H	α-helix	trans	-69.8	-23.8	-177.8	-66.8	-12.9	0	0	0	112.4	R38 L41 T450 L451 G456	R38-N454 PolarHBondContact O-ND2 2.92Å; L41-N454 PolarHBondContact O-ND2 3.39Å; T450-N454 WeakPolarHBondContact O-CB 3.46Å; T450-N454 VanDerWaalsContact O-CG 3.23Å; T450-N454 PolarHBondContact O-N 3.35Å; T450-N454 PolarHBondContact O-ND2 3.02Å; L451-N454 PolarHBondContact O-N 3.26Å; N454-G456 VanDerWaalsContact C-N 3.3Å
455	C	87.7	Confident	92.3	Very high	25 Å²	25	45.6 Å²	45.6	17%	0.169	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3.2	171.9	74.1	0	0	0	0	114.1	L451 I452 Q453 A457 G482 G485	L451-C455 PolarHBondContact O-N 3.14Å; I452-C455 VanDerWaalsContact CA-SG 3.58Å; I452-C455 PolarHBondContact O-N 3.03Å; I452-C455 PolarHBondContact O-SG 3.5Å; Q453-C455 VanDerWaalsContact C-N 3.27Å; Q453-C455 PolarHBondContact O-N 3.18Å; C455-A457 VanDerWaalsContact C-N 3.31Å; C455-A457 PolarHBondContact O-N 3.38Å; C455-G482 WeakPolarHBondContact CB-O 3.43Å; C455-G485 WeakPolarHBondContact SG-CA 3.31Å
456	G	87.4	Confident	92.2	Very high	70 Å²	70	44.8 Å²	44.8	72%	0.722	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.9	10.8	178.2	0	0	0	0	0	114.6	I452 Q453 N454	I452-G456 PolarHBondContact O-N 2.75Å; Q453-G456 PolarHBondContact O-N 3.2Å; N454-G456 VanDerWaalsContact C-N 3.3Å
457	A	89.8	Confident	92	Very high	31 Å²	31	49.6 Å²	49.6	26%	0.256	27%	0.267	S	S	.	.			trans	-88.9	163.7	-179.7	0	0	0	0	0	112.4	I452 C455 T459 L462	I452-A457 HydrophobicContact CG2-CB 4.04Å; I452-A457 PolarHBondContact O-N 3.01Å; C455-A457 VanDerWaalsContact C-N 3.31Å; C455-A457 PolarHBondContact O-N 3.38Å; A457-T459 PolarHBondContact O-N 3.01Å; A457-L462 HydrophobicContact CB-CD1 3.55Å
458	S	91.5	Very high	91.8	Very high	54 Å²	54	51.5 Å²	51.5	38%	0.378	29%	0.285	S	S	.	.			trans	-69	103.3	-179.5	60.8	0	0	0	0	111.5	I460 R461 L462	S458-I460 PolarHBondContact O-N 3.46Å; S458-R461 PolarHBondContact O-N 3.49Å; S458-R461 PolarHBondContact OG-NE 2.75Å; S458-L462 PolarHBondContact O-N 3.2Å
459	T	91.9	Very high	91.6	Very high	43 Å²	43	54.2 Å²	54.2	26%	0.264	30%	0.296	S	S	.	.	H	α-helix	trans	-55.7	-48.4	-177.7	53.4	0	0	0	0	113.2	I452 Q453 A457 R461 L463	I452-T459 HydrophobicContact CB-CG2 4.25Å; I452-T459 HydrophobicContact CG2-CG2 3.94Å; Q453-T459 HydrophobicContact CB-CG2 3.96Å; A457-T459 PolarHBondContact O-N 3.01Å; T459-R461 PolarHBondContact O-N 3.05Å; T459-L463 VanDerWaalsContact O-CB 3.31Å; T459-L463 WeakPolarHBondContact O-CB 3.35Å; T459-L463 WeakPolarHBondContact O-CG 3.43Å; T459-L463 PolarHBondContact O-N 3.42Å
460	I	92	Very high	91.3	Very high	136 Å²	136	50.4 Å²	50.4	70%	0.697	28%	0.282	S	S	*	.	H	α-helix	trans	-61.4	-49	-175.5	-60.3	175.1	0	0	0	111.6	S458 T464	S458-I460 PolarHBondContact O-N 3.46Å; I460-T464 VanDerWaalsContact O-CB 3.32Å; I460-T464 WeakPolarHBondContact O-CB 3.48Å; I460-T464 PolarHBondContact O-N 3.12Å; I460-T464 VanDerWaalsContact O-N 3.12Å; I460-T464 PolarHBondContact O-OG1 3.47Å
461	R	92.9	Very high	91	Very high	177 Å²	177	54.6 Å²	54.6	67%	0.668	31%	0.308	S	S	*	.	H	α-helix	trans	-66.2	-46.1	-176.9	-175.3	176.6	66	164.3	3.9	111.5	S458 T459 S465	S458-R461 PolarHBondContact O-N 3.49Å; S458-R461 PolarHBondContact OG-NE 2.75Å; T459-R461 PolarHBondContact O-N 3.05Å; R461-S465 WeakPolarHBondContact O-CB 3.3Å; R461-S465 PolarHBondContact O-N 3.26Å; R461-S465 PolarHBondContact O-OG 3.47Å
462	L	92.6	Very high	90.7	Very high	21 Å²	21	59.4 Å²	59.4	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-71.5	-42.8	-176.8	-75	172.2	0	0	0	112.3	I452 A457 S458 T464 S465 L466 G485 L487	I452-L462 HydrophobicContact CD1-CB 3.82Å; I452-L462 HydrophobicContact CG1-CB 4.37Å; I452-L462 HydrophobicContact CG1-CD1 4.45Å; I452-L462 HydrophobicContact CG2-CB 4.25Å; I452-L462 HydrophobicContact CG2-CD1 3.69Å; A457-L462 HydrophobicContact CB-CD1 3.55Å; S458-L462 PolarHBondContact O-N 3.2Å; L462-T464 VanDerWaalsContact C-N 3.31Å; L462-T464 PolarHBondContact O-N 2.96Å; L462-S465 PolarHBondContact O-N 2.94Å; L462-L466 VanDerWaalsContact O-CB 3.29Å; L462-L466 WeakPolarHBondContact O-CB 3.47Å; L462-L466 PolarHBondContact O-N 3.39Å; L462-G485 WeakPolarHBondContact CD1-O 3.46Å; L462-L487 HydrophobicContact CD2-CD2 4.3Å; L462-L487 HydrophobicContact CD2-CG 4.13Å
463	L	92.8	Very high	89.7	Confident	10 Å²	10	67.8 Å²	67.8	5%	0.052	37%	0.369	C	S	.	.	H	α-helix	trans	-62.5	-39.5	174.9	-76.3	175.6	0	0	0	112.3	M416 P448 R449 I452 T459 S465 L466 R467	M416-L463 HydrophobicContact CE-CD2 4.25Å; P448-L463 HydrophobicContact CB-CD2 4.1Å; P448-L463 HydrophobicContact CG-CD2 4.23Å; R449-L463 HydrophobicContact CB-CD1 3.7Å; R449-L463 HydrophobicContact CB-CD2 4.47Å; R449-L463 HydrophobicContact CG-CD1 3.78Å; I452-L463 HydrophobicContact CD1-CD2 3.72Å; I452-L463 HydrophobicContact CD1-CG 3.72Å; T459-L463 VanDerWaalsContact O-CB 3.31Å; T459-L463 WeakPolarHBondContact O-CB 3.35Å; T459-L463 WeakPolarHBondContact O-CG 3.43Å; T459-L463 PolarHBondContact O-N 3.42Å; L463-S465 VanDerWaalsContact C-N 3.34Å; L463-L466 PolarHBondContact O-N 3.36Å; L463-R467 WeakPolarHBondContact O-CG 3.46Å; L463-R467 PolarHBondContact O-N 2.89Å
464	T	93.4	Very high	88.8	Confident	68 Å²	68	69 Å²	69	42%	0.417	38%	0.379	S	S	.	.	H	α-helix	trans	-65.5	-41.8	177.2	-57.1	0	0	0	0	111.1	I460 L462 L466 R467 A468	I460-T464 VanDerWaalsContact O-CB 3.32Å; I460-T464 WeakPolarHBondContact O-CB 3.48Å; I460-T464 PolarHBondContact O-N 3.12Å; I460-T464 VanDerWaalsContact O-N 3.12Å; I460-T464 PolarHBondContact O-OG1 3.47Å; L462-T464 VanDerWaalsContact C-N 3.31Å; L462-T464 PolarHBondContact O-N 2.96Å; T464-L466 VanDerWaalsContact C-N 3.35Å; T464-R467 PolarHBondContact OG1-NH2 3.18Å; T464-A468 PolarHBondContact O-N 3.01Å; T464-A468 VanDerWaalsContact O-N 3.09Å
465	S	92.3	Very high	88.2	Confident	50 Å²	50	68.7 Å²	68.7	35%	0.35	38%	0.379	S	S	.	.	H	α-helix	trans	-65.3	-38.5	174.9	-54	0	0	0	0	111.9	R461 L462 L463 A468 K469	R461-S465 WeakPolarHBondContact O-CB 3.3Å; R461-S465 PolarHBondContact O-N 3.26Å; R461-S465 PolarHBondContact O-OG 3.47Å; L462-S465 PolarHBondContact O-N 2.94Å; L463-S465 VanDerWaalsContact C-N 3.34Å; S465-A468 PolarHBondContact O-N 3.49Å; S465-K469 WeakPolarHBondContact O-CG 3.43Å; S465-K469 PolarHBondContact O-N 2.75Å; S465-K469 VanDerWaalsContact O-N 3.11Å
466	L	92.9	Very high	87.9	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-67.1	-43.3	179.2	-174.3	59.7	0	0	0	111.7	M416 P448 L462 L463 T464 K469 H470 W478 V480 L487	M416-L466 HydrophobicContact CE-CD2 3.83Å; M416-L466 HydrophobicContact CE-CG 4.11Å; M416-L466 HydrophobicContact CG-CG 4.23Å; P448-L466 HydrophobicContact CB-CD2 4.13Å; L462-L466 VanDerWaalsContact O-CB 3.29Å; L462-L466 WeakPolarHBondContact O-CB 3.47Å; L462-L466 PolarHBondContact O-N 3.39Å; L463-L466 PolarHBondContact O-N 3.36Å; T464-L466 VanDerWaalsContact C-N 3.35Å; L466-K469 PolarHBondContact O-N 2.65Å; L466-H470 VanDerWaalsContact CD1-CE1 3.44Å; L466-H470 WeakPolarHBondContact CD1-CE1 3.42Å; L466-H470 PolarHBondContact O-N 3.4Å; L466-H470 VanDerWaalsContact O-N 3.08Å; L466-H470 PolarHBondContact O-ND1 3.31Å; L466-W478 HydrophobicContact CD1-CB 4.37Å; L466-V480 HydrophobicContact CD2-CG2 3.84Å; L466-L487 HydrophobicContact CB-CD1 3.98Å; L466-L487 HydrophobicContact CB-CD2 4.08Å; L466-L487 HydrophobicContact CD1-CD1 4.27Å; L466-L487 HydrophobicContact CD1-CD2 3.99Å; L466-L487 HydrophobicContact CD2-CD2 4.47Å; L466-L487 HydrophobicContact CG-CD2 4.41Å
467	R	90.6	Very high	87.9	Confident	104 Å²	104	69.5 Å²	69.5	39%	0.392	36%	0.363	S	S	.	.	H	α-helix	trans	-59.9	-45.4	173.3	-74.3	-178.5	-62.1	171.6	2.1	111.6	M416 E445 L463 T464 K469 H470 T471	M416-R467 HydrophobicContact CE-CG 3.97Å; M416-R467 HydrophobicContact SD-CG 3.63Å; E445-R467 WeakPolarHBondContact OE1-CD 3.38Å; L463-R467 WeakPolarHBondContact O-CG 3.46Å; L463-R467 PolarHBondContact O-N 2.89Å; T464-R467 PolarHBondContact OG1-NH2 3.18Å; R467-K469 PolarHBondContact O-N 3.47Å; R467-H470 PolarHBondContact O-N 2.9Å; R467-H470 VanDerWaalsContact O-N 3.16Å; R467-T471 PolarHBondContact O-N 2.67Å; R467-T471 VanDerWaalsContact O-N 3.13Å
468	A	90.9	Very high	88.1	Confident	50 Å²	50	71.2 Å²	71.2	41%	0.413	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-33	178	0	0	0	0	0	112.8	T464 S465 T471	T464-A468 PolarHBondContact O-N 3.01Å; T464-A468 VanDerWaalsContact O-N 3.09Å; S465-A468 PolarHBondContact O-N 3.49Å; A468-T471 PolarHBondContact O-OG1 3.49Å
469	K	89.6	Confident	88.1	Confident	56 Å²	56	68.6 Å²	68.6	24%	0.243	35%	0.345	C	S	.	.	H	α-helix	trans	-70.7	-42.3	173.6	-71.8	-175.3	177.7	-169.3	0	112.4	S465 L466 R467 T471 Q472 C475 W478 L487	S465-K469 WeakPolarHBondContact O-CG 3.43Å; S465-K469 PolarHBondContact O-N 2.75Å; S465-K469 VanDerWaalsContact O-N 3.11Å; L466-K469 PolarHBondContact O-N 2.65Å; R467-K469 PolarHBondContact O-N 3.47Å; K469-T471 PolarHBondContact O-N 2.92Å; K469-Q472 WeakPolarHBondContact O-CB 3.48Å; K469-Q472 PolarHBondContact O-N 3.43Å; K469-C475 WeakPolarHBondContact O-CB 3.38Å; K469-W478 HydrophobicContact CD-CD2 3.94Å; K469-W478 HydrophobicContact CD-CE3 3.69Å; K469-W478 HydrophobicContact CD-CG 4.48Å; K469-W478 HydrophobicContact CD-CZ3 4.1Å; K469-W478 VanDerWaalsContact NZ-CE3 3.32Å; K469-L487 HydrophobicContact CD-CD1 4.18Å
470	H	88.9	Confident	88.2	Confident	8 Å²	8	66.7 Å²	66.7	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-70.6	-16.8	-179.9	-76.4	74.5	0	0	0	114.2	M416 H420 L466 R467 Q472 W478	M416-H470 HydrophobicContact CG-CB 3.99Å; M416-H470 WeakPolarHBondContact CG-ND1 3.46Å; H420-H470 PolarHBondContact CD2-O 3.1Å; H420-H470 VanDerWaalsContact CD2-O 3.26Å; L466-H470 VanDerWaalsContact CD1-CE1 3.44Å; L466-H470 WeakPolarHBondContact CD1-CE1 3.42Å; L466-H470 PolarHBondContact O-N 3.4Å; L466-H470 VanDerWaalsContact O-N 3.08Å; L466-H470 PolarHBondContact O-ND1 3.31Å; R467-H470 PolarHBondContact O-N 2.9Å; R467-H470 VanDerWaalsContact O-N 3.16Å; H470-Q472 VanDerWaalsContact C-N 3.27Å; H470-W478 PolarHBondContact CE1-O 3.02Å; H470-W478 PolarHBondContact NE2-O 3.4Å
471	T	86.6	Confident	88.1	Confident	89 Å²	89	61.2 Å²	61.2	55%	0.546	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-12.8	170.2	52.8	0	0	0	0	113.4	R467 A468 K469	R467-T471 PolarHBondContact O-N 2.67Å; R467-T471 VanDerWaalsContact O-N 3.13Å; A468-T471 PolarHBondContact O-OG1 3.49Å; K469-T471 PolarHBondContact O-N 2.92Å
472	Q	86.4	Confident	87.8	Confident	118 Å²	118	53.1 Å²	53.1	55%	0.551	28%	0.277	S	S	*	.	S	Bend	trans	-87.4	146.3	175.4	-61.3	173.5	-3.8	0	0	109.8	K469 H470	K469-Q472 WeakPolarHBondContact O-CB 3.48Å; K469-Q472 PolarHBondContact O-N 3.43Å; H470-Q472 VanDerWaalsContact C-N 3.27Å
473	E	71.3	Confident	87.5	Confident	175 Å²	175	57.3 Å²	57.3	82%	0.818	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	141.5	179.7	-64.1	-178.1	174.1	0	0	111.7	C475	E473-C475 VanDerWaalsContact C-N 3.29Å; E473-C475 PolarHBondContact O-N 2.82Å
474	N	72.6	Confident	87.2	Confident	136 Å²	136	60.9 Å²	60.9	73%	0.727	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	17.1	177.8	-49.8	-49.6	0	0	0	116.1	E476	N474-E476 VanDerWaalsContact C-OE2 3.32Å; N474-E476 WeakPolarHBondContact CA-OE2 3.2Å
475	C	79.1	Confident	86.9	Confident	22 Å²	22	58 Å²	58	15%	0.149	30%	0.302	C	S	.	.			trans	-106	21.1	179.8	-72.2	0	0	0	0	113.3	K469 E473 T477 W478	K469-C475 WeakPolarHBondContact O-CB 3.38Å; E473-C475 VanDerWaalsContact C-N 3.29Å; E473-C475 PolarHBondContact O-N 2.82Å; C475-T477 PolarHBondContact O-N 3.48Å; C475-W478 PolarHBondContact O-N 3.19Å
476	E	80	Confident	86.8	Confident	86 Å²	86	58.8 Å²	58.8	40%	0.402	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.9	-175.2	-55.9	88.2	173.7	0	0	114	A417 N474	A417-E476 HydrophobicContact CB-CB 4.25Å; N474-E476 VanDerWaalsContact C-OE2 3.32Å; N474-E476 WeakPolarHBondContact CA-OE2 3.2Å
477	T	88.6	Confident	86.8	Confident	26 Å²	26	59.9 Å²	59.9	16%	0.16	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-1.3	-178.7	56.8	0	0	0	0	113.7	P409 C475 G479 D489 M490	P409-T477 HydrophobicContact CB-CG2 4.44Å; P409-T477 HydrophobicContact CG-CG2 4.23Å; C475-T477 PolarHBondContact O-N 3.48Å; T477-G479 PolarHBondContact O-N 3.38Å; T477-D489 WeakPolarHBondContact CB-OD1 3.41Å; T477-D489 PolarHBondContact OG1-OD1 3.46Å; T477-M490 VanDerWaalsContact O-CB 3.31Å; T477-M490 WeakPolarHBondContact O-CB 3.48Å; T477-M490 WeakPolarHBondContact O-CG 3.45Å; T477-M490 PolarHBondContact O-N 3.5Å
478	W	92.6	Very high	86.9	Confident	66 Å²	66	56.6 Å²	56.6	25%	0.25	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	132.1	178.6	-79.1	72.5	0	0	0	111.1	A413 L466 K469 H470 C475 L487	A413-W478 VanDerWaalsContact CA-O 3.31Å; A413-W478 WeakPolarHBondContact CA-O 3.38Å; A413-W478 WeakPolarHBondContact CB-O 3.47Å; L466-W478 HydrophobicContact CD1-CB 4.37Å; K469-W478 HydrophobicContact CD-CD2 3.94Å; K469-W478 HydrophobicContact CD-CE3 3.69Å; K469-W478 HydrophobicContact CD-CG 4.48Å; K469-W478 HydrophobicContact CD-CZ3 4.1Å; K469-W478 VanDerWaalsContact NZ-CE3 3.32Å; H470-W478 PolarHBondContact CE1-O 3.02Å; H470-W478 PolarHBondContact NE2-O 3.4Å; C475-W478 PolarHBondContact O-N 3.19Å; W478-L487 HydrophobicContact CE3-CB 4.16Å; W478-L487 HydrophobicContact CZ3-CB 4.35Å; W478-L487 WeakPolarHBondContact CZ3-O 3.5Å
479	G	92.8	Very high	86.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	-170.3	176.8	0	0	0	0	0	112	T477 L487 V488 M490	T477-G479 PolarHBondContact O-N 3.38Å; G479-L487 WeakPolarHBondContact O-CA 3.36Å; G479-V488 PolarHBondContact N-O 3.28Å; G479-V488 PolarHBondContact O-N 2.85Å; G479-V488 VanDerWaalsContact O-N 3.13Å; G479-M490 VanDerWaalsContact CA-CE 3.43Å
480	V	92.7	Very high	87	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.3	172.8	-173.1	0	0	0	0	109.4	G411 P448 L451 I452 L466 G482 L487 M490	G411-V480 PolarHBondContact O-N 3.41Å; P448-V480 HydrophobicContact CB-CG2 4.23Å; L451-V480 HydrophobicContact CD2-CB 3.82Å; L451-V480 HydrophobicContact CD2-CG1 3.55Å; I452-V480 HydrophobicContact CD1-CG2 3.83Å; I452-V480 HydrophobicContact CG1-CB 4.23Å; I452-V480 HydrophobicContact CG1-CG1 3.61Å; I452-V480 HydrophobicContact CG1-CG2 3.73Å; L466-V480 HydrophobicContact CD2-CG2 3.84Å; V480-G482 PolarHBondContact O-N 3.16Å; V480-L487 HydrophobicContact CG2-CD2 3.94Å; V480-M490 VanDerWaalsContact C-CE 3.4Å; V480-M490 WeakPolarHBondContact O-CE 3.16Å
481	N	91.2	Very high	86.9	Confident	22 Å²	22	58.4 Å²	58.4	12%	0.118	30%	0.302	C	S	.	.			trans	-74.8	117.2	168.4	180	-15.5	0	0	0	109.2	E483 T484 G485 T486 V488 L493	N481-E483 VanDerWaalsContact C-N 3.27Å; N481-E483 PolarHBondContact O-N 3.01Å; N481-E483 PolarHBondContact OD1-N 3.19Å; N481-T484 WeakPolarHBondContact CB-OG1 3.32Å; N481-T484 VanDerWaalsContact CG-OG1 3.3Å; N481-T484 PolarHBondContact ND2-OG1 2.87Å; N481-G485 VanDerWaalsContact O-CA 3.31Å; N481-G485 WeakPolarHBondContact O-CA 3.36Å; N481-G485 PolarHBondContact O-N 3.24Å; N481-T486 PolarHBondContact N-O 2.87Å; N481-V488 HydrophobicContact CB-CG2 4.1Å; N481-L493 HydrophobicContact CB-CD2 4.24Å
482	G	85.8	Confident	87	Confident	7 Å²	7	61.9 Å²	61.9	7%	0.072	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-13	-176.7	0	0	0	0	0	115.5	C455 V480	C455-G482 WeakPolarHBondContact CB-O 3.43Å; V480-G482 PolarHBondContact O-N 3.16Å
483	E	85.9	Confident	87	Confident	108 Å²	108	59.7 Å²	59.7	51%	0.505	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-51.7	176.1	-64	-176.1	173.2	0	0	111.8	K44 N481	K44-E483 WeakPolarHBondContact CE-O 3.15Å; K44-E483 PolarHBondContact NZ-O 3.44Å; N481-E483 VanDerWaalsContact C-N 3.27Å; N481-E483 PolarHBondContact O-N 3.01Å; N481-E483 PolarHBondContact OD1-N 3.19Å
484	T	86.7	Confident	87.6	Confident	85 Å²	85	51.8 Å²	51.8	52%	0.521	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-20.6	-175.4	59.4	0	0	0	0	113.1	N481 T486	N481-T484 WeakPolarHBondContact CB-OG1 3.32Å; N481-T484 VanDerWaalsContact CG-OG1 3.3Å; N481-T484 PolarHBondContact ND2-OG1 2.87Å; T484-T486 VanDerWaalsContact C-N 3.28Å; T484-T486 PolarHBondContact O-N 2.94Å; T484-T486 PolarHBondContact OG1-OG1 3.43Å
485	G	86.6	Confident	88.4	Confident	7 Å²	7	47.9 Å²	47.9	7%	0.072	25%	0.248	C	C	.	.			trans	68.6	26.8	-174.3	0	0	0	0	0	113.4	C455 L462 N481	C455-G485 WeakPolarHBondContact SG-CA 3.31Å; L462-G485 WeakPolarHBondContact CD1-O 3.46Å; N481-G485 VanDerWaalsContact O-CA 3.31Å; N481-G485 WeakPolarHBondContact O-CA 3.36Å; N481-G485 PolarHBondContact O-N 3.24Å
486	T	91.1	Very high	88.9	Confident	67 Å²	67	48.5 Å²	48.5	41%	0.411	25%	0.247	S	C	.	.			trans	-111.8	160.5	178.8	61.4	0	0	0	0	111.5	N481 T484	N481-T486 PolarHBondContact N-O 2.87Å; T484-T486 VanDerWaalsContact C-N 3.28Å; T484-T486 PolarHBondContact O-N 2.94Å; T484-T486 PolarHBondContact OG1-OG1 3.43Å
487	L	92.1	Very high	89.4	Confident	24 Å²	24	46.6 Å²	46.6	13%	0.126	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.1	174.4	-54.4	-174.4	0	0	0	108.7	L462 L466 K469 W478 G479 V480	L462-L487 HydrophobicContact CD2-CD2 4.3Å; L462-L487 HydrophobicContact CD2-CG 4.13Å; L466-L487 HydrophobicContact CB-CD1 3.98Å; L466-L487 HydrophobicContact CB-CD2 4.08Å; L466-L487 HydrophobicContact CD1-CD1 4.27Å; L466-L487 HydrophobicContact CD1-CD2 3.99Å; L466-L487 HydrophobicContact CD2-CD2 4.47Å; L466-L487 HydrophobicContact CG-CD2 4.41Å; K469-L487 HydrophobicContact CD-CD1 4.18Å; W478-L487 HydrophobicContact CE3-CB 4.16Å; W478-L487 HydrophobicContact CZ3-CB 4.35Å; W478-L487 WeakPolarHBondContact CZ3-O 3.5Å; G479-L487 WeakPolarHBondContact O-CA 3.36Å; V480-L487 HydrophobicContact CG2-CD2 3.94Å
488	V	92.4	Very high	89.6	Confident	35 Å²	35	45.6 Å²	45.6	21%	0.212	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	152.2	-177.2	-175.8	0	0	0	0	108.5	G479 N481 M490 L493	G479-V488 PolarHBondContact N-O 3.28Å; G479-V488 PolarHBondContact O-N 2.85Å; G479-V488 VanDerWaalsContact O-N 3.13Å; N481-V488 HydrophobicContact CB-CG2 4.1Å; V488-M490 PolarHBondContact O-N 3.42Å; V488-L493 HydrophobicContact CG1-CB 4.36Å
489	D	91.9	Very high	89.6	Confident	24 Å²	24	43 Å²	43	13%	0.128	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	120.1	168.7	-174.1	1.6	0	0	0	110	T477 K491 E492 L493	T477-D489 WeakPolarHBondContact CB-OD1 3.41Å; T477-D489 PolarHBondContact OG1-OD1 3.46Å; D489-K491 PolarHBondContact O-N 3.32Å; D489-K491 WeakPolarHBondContact OD1-CB 3.39Å; D489-K491 PolarHBondContact OD1-N 2.92Å; D489-E492 HydrophobicContact CB-CB 4.3Å; D489-E492 HydrophobicContact CB-CG 4.09Å; D489-E492 PolarHBondContact O-N 3.47Å; D489-L493 PolarHBondContact O-N 3.23Å
490	M	90.7	Very high	89.6	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-67.4	-23.2	-179.9	-66.2	-63.4	142.5	0	0	112.2	P409 A413 T477 G479 V480 V488 L493 G494 I495	P409-M490 HydrophobicContact CB-CB 3.86Å; A413-M490 HydrophobicContact CB-CG 4.13Å; T477-M490 VanDerWaalsContact O-CB 3.31Å; T477-M490 WeakPolarHBondContact O-CB 3.48Å; T477-M490 WeakPolarHBondContact O-CG 3.45Å; T477-M490 PolarHBondContact O-N 3.5Å; G479-M490 VanDerWaalsContact CA-CE 3.43Å; V480-M490 VanDerWaalsContact C-CE 3.4Å; V480-M490 WeakPolarHBondContact O-CE 3.16Å; V488-M490 PolarHBondContact O-N 3.42Å; M490-L493 HydrophobicContact CE-CD2 4.37Å; M490-L493 HydrophobicContact SD-CD2 4.2Å; M490-G494 PolarHBondContact O-N 3Å; M490-I495 PolarHBondContact O-N 3.21Å; M490-I495 VanDerWaalsContact O-N 3.16Å; M490-I495 HydrophobicContact SD-CB 4.03Å; M490-I495 HydrophobicContact SD-CG2 4.47Å
491	K	87.6	Confident	89.6	Confident	126 Å²	126	43.8 Å²	43.8	55%	0.548	23%	0.23	S	C	.	.	H	α-helix	trans	-67.5	-42.2	174.4	179.9	166.6	-172.2	-177.7	0	112	D489 W496	D489-K491 PolarHBondContact O-N 3.32Å; D489-K491 WeakPolarHBondContact OD1-CB 3.39Å; D489-K491 PolarHBondContact OD1-N 2.92Å; K491-W496 HydrophobicContact CB-CH2 3.83Å; K491-W496 HydrophobicContact CB-CZ2 3.81Å; K491-W496 HydrophobicContact CD-CH2 4.36Å; K491-W496 HydrophobicContact CG-CH2 3.97Å; K491-W496 HydrophobicContact CG-CZ2 3.76Å
492	E	88.1	Confident	89.8	Confident	163 Å²	163	43.1 Å²	43.1	76%	0.762	23%	0.225	S	C	*	.	H	α-helix	trans	-72.1	-38.2	175.9	-65.9	-175.3	163.8	0	0	111.9	D489 G494	D489-E492 HydrophobicContact CB-CB 4.3Å; D489-E492 HydrophobicContact CB-CG 4.09Å; D489-E492 PolarHBondContact O-N 3.47Å; E492-G494 PolarHBondContact O-N 3.35Å
493	L	86.4	Confident	90.2	Very high	71 Å²	71	43.8 Å²	43.8	37%	0.372	23%	0.227	S	C	.	.	H	α-helix	trans	-72.1	-19.5	177.7	-163.5	65.8	0	0	0	112.7	N481 V488 D489 M490 I495	N481-L493 HydrophobicContact CB-CD2 4.24Å; V488-L493 HydrophobicContact CG1-CB 4.36Å; D489-L493 PolarHBondContact O-N 3.23Å; M490-L493 HydrophobicContact CE-CD2 4.37Å; M490-L493 HydrophobicContact SD-CD2 4.2Å; L493-I495 HydrophobicContact CB-CG1 4.3Å; L493-I495 HydrophobicContact CD2-CG1 3.74Å; L493-I495 HydrophobicContact CG-CG1 3.83Å
494	G	84.8	Confident	90.6	Very high	10 Å²	10	41.1 Å²	41.1	10%	0.103	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	18	-179.9	0	0	0	0	0	114.5	M490 E492 W496	M490-G494 PolarHBondContact O-N 3Å; E492-G494 PolarHBondContact O-N 3.35Å; G494-W496 VanDerWaalsContact O-CD1 3.25Å; G494-W496 PolarHBondContact O-N 3.11Å
495	I	88.6	Confident	91.1	Very high	53 Å²	53	37.3 Å²	37.3	27%	0.272	19%	0.191	S	C	.	.			trans	-91.7	101.4	-178.8	-57.1	-59.8	0	0	0	109.7	G410 M490 L493	G410-I495 PolarHBondContact N-O 3.04Å; G410-I495 VanDerWaalsContact N-O 3.07Å; M490-I495 PolarHBondContact O-N 3.21Å; M490-I495 VanDerWaalsContact O-N 3.16Å; M490-I495 HydrophobicContact SD-CB 4.03Å; M490-I495 HydrophobicContact SD-CG2 4.47Å; L493-I495 HydrophobicContact CB-CG1 4.3Å; L493-I495 HydrophobicContact CD2-CG1 3.74Å; L493-I495 HydrophobicContact CG-CG1 3.83Å
496	W	89.6	Confident	91.5	Very high	36 Å²	36	37 Å²	37	14%	0.136	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.6	-179.3	-58	98.8	0	0	0	111.2	I142 S158 L407 P409 K491 G494	I142-W496 HydrophobicContact CD1-CH2 3.46Å; I142-W496 VanDerWaalsContact CD1-CH2 3.46Å; I142-W496 HydrophobicContact CD1-CZ2 4.47Å; I142-W496 HydrophobicContact CD1-CZ3 3.65Å; S158-W496 PolarHBondContact OG-O 3.04Å; L407-W496 HydrophobicContact CB-CB 4.2Å; L407-W496 HydrophobicContact CB-CE3 4.24Å; L407-W496 HydrophobicContact CD1-CB 3.69Å; L407-W496 HydrophobicContact CD1-CG 3.98Å; L407-W496 HydrophobicContact CG-CB 4.41Å; P409-W496 HydrophobicContact CB-CE3 4.46Å; P409-W496 HydrophobicContact CB-CZ3 4.09Å; K491-W496 HydrophobicContact CB-CH2 3.83Å; K491-W496 HydrophobicContact CB-CZ2 3.81Å; K491-W496 HydrophobicContact CD-CH2 4.36Å; K491-W496 HydrophobicContact CG-CH2 3.97Å; K491-W496 HydrophobicContact CG-CZ2 3.76Å; G494-W496 VanDerWaalsContact O-CD1 3.25Å; G494-W496 PolarHBondContact O-N 3.11Å
497	E	90.4	Very high	91.7	Very high	46 Å²	46	37.2 Å²	37.2	22%	0.215	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144.2	170.9	-72.3	178.5	-137	0	0	109.6	L407 V408 L499 K502	L407-E497 WeakPolarHBondContact CA-O 3.25Å; V408-E497 PolarHBondContact N-O 3.42Å; V408-E497 PolarHBondContact O-N 3.2Å; E497-L499 PolarHBondContact O-N 3.29Å; E497-K502 VanDerWaalsContact CD-CE 3.5Å; E497-K502 VanDerWaalsContact CD-NZ 3.3Å; E497-K502 IonicContact OE1-NZ 3.7Å; E497-K502 PolarHBondContact OE1-NZ 3.2Å; E497-K502 WeakPolarHBondContact OE2-CE 3.43Å; E497-K502 IonicContact OE2-NZ 3.63Å; E497-K502 PolarHBondContact OE2-NZ 2.84Å
498	P	92.8	Very high	91.9	Very high	4 Å²	4	36.8 Å²	36.8	3%	0.026	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	137.3	174.3	-20.7	31.4	0	0	0	111.9	V397 N400 V401 A500 V501 K502	V397-P498 HydrophobicContact CG1-CG 3.8Å; N400-P498 HydrophobicContact CB-CB 4.17Å; V401-P498 HydrophobicContact CG2-CB 4.22Å; V401-P498 HydrophobicContact CG2-CG 3.96Å; P498-A500 PolarHBondContact O-N 2.91Å; P498-V501 HydrophobicContact CB-CG2 4.14Å; P498-V501 HydrophobicContact CG-CG2 4.22Å; P498-V501 PolarHBondContact O-N 3.41Å; P498-V501 VanDerWaalsContact O-N 3.14Å; P498-K502 PolarHBondContact O-N 2.98Å
499	L	93.8	Very high	92.1	Very high	12 Å²	12	35.1 Å²	35.1	6%	0.063	17%	0.172	C	C	.	.	H	α-helix	trans	-57.1	-38.9	177.1	176.1	63.6	0	0	0	111.7	L137 K138 Q406 V408 E497 V501 K502 L503	L137-L499 HydrophobicContact CB-CD1 4Å; K138-L499 HydrophobicContact CG-CD2 4.32Å; Q406-L499 HydrophobicContact CB-CB 3.81Å; Q406-L499 HydrophobicContact CB-CD2 3.69Å; Q406-L499 HydrophobicContact CB-CG 4.4Å; Q406-L499 HydrophobicContact CG-CD2 4.21Å; Q406-L499 WeakPolarHBondContact O-CB 3.48Å; Q406-L499 PolarHBondContact O-N 3.43Å; V408-L499 HydrophobicContact CG2-CB 3.98Å; V408-L499 HydrophobicContact CG2-CD1 3.57Å; V408-L499 HydrophobicContact CG2-CG 4.35Å; E497-L499 PolarHBondContact O-N 3.29Å; L499-V501 VanDerWaalsContact C-N 3.28Å; L499-V501 PolarHBondContact O-N 3.45Å; L499-K502 PolarHBondContact O-N 3.3Å; L499-L503 HydrophobicContact CD1-CD1 4.11Å; L499-L503 HydrophobicContact CD1-CD2 4.36Å; L499-L503 HydrophobicContact CD1-CG 3.88Å; L499-L503 HydrophobicContact CD2-CD1 4.19Å; L499-L503 HydrophobicContact CG-CD1 3.77Å; L499-L503 HydrophobicContact CG-CG 4.02Å; L499-L503 WeakPolarHBondContact O-CB 3.43Å; L499-L503 WeakPolarHBondContact O-CG 3.44Å; L499-L503 PolarHBondContact O-N 3.23Å
500	A	92.7	Very high	92.3	Very high	18 Å²	18	34 Å²	34	15%	0.149	17%	0.166	C	C	.	.	H	α-helix	trans	-57	-40.6	179.3	0	0	0	0	0	112.5	N400 P498 Q504	N400-A500 HydrophobicContact CB-CB 4.25Å; P498-A500 PolarHBondContact O-N 2.91Å; A500-Q504 WeakPolarHBondContact O-CB 3.43Å; A500-Q504 PolarHBondContact O-N 2.78Å
501	V	93.3	Very high	92.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-62.7	-52.6	177.3	177	0	0	0	0	109.6	V91 D93 P498 L499 L503 Q504 T505	V91-V501 HydrophobicContact CB-CG2 4.21Å; V91-V501 HydrophobicContact CG2-CG2 4.45Å; D93-V501 HydrophobicContact CB-CG1 4.33Å; D93-V501 HydrophobicContact CB-CG2 4.41Å; P498-V501 HydrophobicContact CB-CG2 4.14Å; P498-V501 HydrophobicContact CG-CG2 4.22Å; P498-V501 PolarHBondContact O-N 3.41Å; P498-V501 VanDerWaalsContact O-N 3.14Å; L499-V501 VanDerWaalsContact C-N 3.28Å; L499-V501 PolarHBondContact O-N 3.45Å; V501-L503 PolarHBondContact O-N 3.46Å; V501-Q504 PolarHBondContact O-N 3.42Å; V501-T505 HydrophobicContact CG1-CG2 4.24Å; V501-T505 VanDerWaalsContact O-CG2 3.31Å; V501-T505 WeakPolarHBondContact O-CG2 3.31Å; V501-T505 PolarHBondContact O-N 2.93Å; V501-T505 PolarHBondContact O-OG1 3.34Å
502	K	93.8	Very high	92.8	Very high	7 Å²	7	34.2 Å²	34.2	3%	0.03	17%	0.169	C	C	.	.	H	α-helix	trans	-60.4	-41.2	179.4	-65.5	-62.9	-163.2	-174.1	0	113.4	L137 S414 E415 E497 P498 L499 Q504 T505 Y506	L137-K502 HydrophobicContact CD1-CB 4Å; L137-K502 HydrophobicContact CD2-CB 4.48Å; S414-K502 WeakPolarHBondContact OG-CE 3.45Å; S414-K502 PolarHBondContact OG-NZ 3.11Å; E415-K502 IonicContact OE1-NZ 3.78Å; E415-K502 PolarHBondContact OE1-NZ 3.16Å; E415-K502 IonicContact OE2-NZ 3.17Å; E415-K502 PolarHBondContact OE2-NZ 3.17Å; E497-K502 VanDerWaalsContact CD-CE 3.5Å; E497-K502 VanDerWaalsContact CD-NZ 3.3Å; E497-K502 IonicContact OE1-NZ 3.7Å; E497-K502 PolarHBondContact OE1-NZ 3.2Å; E497-K502 WeakPolarHBondContact OE2-CE 3.43Å; E497-K502 IonicContact OE2-NZ 3.63Å; E497-K502 PolarHBondContact OE2-NZ 2.84Å; P498-K502 PolarHBondContact O-N 2.98Å; L499-K502 PolarHBondContact O-N 3.3Å; K502-Q504 VanDerWaalsContact C-N 3.35Å; K502-T505 WeakPolarHBondContact CA-OG1 3.47Å; K502-T505 PolarHBondContact O-N 3.39Å; K502-T505 PolarHBondContact O-OG1 2.64Å; K502-Y506 PolarHBondContact O-N 3.37Å; K502-Y506 VanDerWaalsContact O-N 3.11Å
503	L	94.9	Very high	93.2	Very high	22 Å²	22	26.5 Å²	26.5	12%	0.115	13%	0.133	C	C	.	.	H	α-helix	trans	-63	-44.7	177	-73.8	178.1	0	0	0	111.2	I134 L137 L499 V501 K507	I134-L503 HydrophobicContact CB-CD2 4.19Å; I134-L503 HydrophobicContact CG1-CD2 4.09Å; I134-L503 HydrophobicContact CG2-CD2 3.88Å; L137-L503 HydrophobicContact CB-CD2 4.18Å; L137-L503 HydrophobicContact CD1-CD2 3.89Å; L499-L503 HydrophobicContact CD1-CD1 4.11Å; L499-L503 HydrophobicContact CD1-CD2 4.36Å; L499-L503 HydrophobicContact CD1-CG 3.88Å; L499-L503 HydrophobicContact CD2-CD1 4.19Å; L499-L503 HydrophobicContact CG-CD1 3.77Å; L499-L503 HydrophobicContact CG-CG 4.02Å; L499-L503 WeakPolarHBondContact O-CB 3.43Å; L499-L503 WeakPolarHBondContact O-CG 3.44Å; L499-L503 PolarHBondContact O-N 3.23Å; V501-L503 PolarHBondContact O-N 3.46Å; L503-K507 WeakPolarHBondContact O-CB 3.45Å; L503-K507 VanDerWaalsContact O-CG 3.25Å; L503-K507 WeakPolarHBondContact O-CG 3.29Å; L503-K507 PolarHBondContact O-N 2.97Å; L503-K507 VanDerWaalsContact O-N 3.11Å
504	Q	95.1	Very high	93.6	Very high	52 Å²	52	23.4 Å²	23.4	24%	0.243	12%	0.117	C	C	.	.	H	α-helix	trans	-69.5	-38.8	179.7	-167.9	65.3	0.8	0	0	111.6	Q87 V91 A500 V501 K502 Y506 K507 T508	Q87-Q504 VanDerWaalsContact OE1-CG 3.27Å; V91-Q504 HydrophobicContact CG1-CB 4.07Å; V91-Q504 HydrophobicContact CG1-CG 4.23Å; V91-Q504 HydrophobicContact CG2-CB 4.49Å; V91-Q504 HydrophobicContact CG2-CG 4.5Å; A500-Q504 WeakPolarHBondContact O-CB 3.43Å; A500-Q504 PolarHBondContact O-N 2.78Å; V501-Q504 PolarHBondContact O-N 3.42Å; K502-Q504 VanDerWaalsContact C-N 3.35Å; Q504-Y506 PolarHBondContact O-N 2.61Å; Q504-K507 PolarHBondContact O-N 3Å; Q504-T508 HydrophobicContact CG-CG2 4.21Å; Q504-T508 WeakPolarHBondContact O-CB 3.42Å; Q504-T508 VanDerWaalsContact O-CG2 3.32Å; Q504-T508 WeakPolarHBondContact O-CG2 3.45Å; Q504-T508 PolarHBondContact O-N 3.34Å; Q504-T508 PolarHBondContact O-OG1 3.14Å
505	T	95.4	Very high	94.1	Very high	4 Å²	4	27.6 Å²	27.6	3%	0.025	14%	0.137	C	C	.	.	H	α-helix	trans	-63.4	-41.3	178.3	57.1	0	0	0	0	112.1	Q87 V98 V501 K502 T508 A509	Q87-T505 VanDerWaalsContact NE2-CG2 3.33Å; V98-T505 HydrophobicContact CG2-CG2 3.68Å; V501-T505 HydrophobicContact CG1-CG2 4.24Å; V501-T505 VanDerWaalsContact O-CG2 3.31Å; V501-T505 WeakPolarHBondContact O-CG2 3.31Å; V501-T505 PolarHBondContact O-N 2.93Å; V501-T505 PolarHBondContact O-OG1 3.34Å; K502-T505 WeakPolarHBondContact CA-OG1 3.47Å; K502-T505 PolarHBondContact O-N 3.39Å; K502-T505 PolarHBondContact O-OG1 2.64Å; T505-T508 PolarHBondContact O-OG1 3.14Å; T505-A509 WeakPolarHBondContact O-CB 3.47Å; T505-A509 PolarHBondContact O-N 3.05Å
506	Y	95.7	Very high	94.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-71.7	-42.1	-179.9	-70.4	5.5	0	0	0	112.2	L101 M133 L137 E415 V418 L444 K502 Q504 V510	L101-Y506 HydrophobicContact CD1-CD1 3.88Å; L101-Y506 HydrophobicContact CD1-CE1 3.88Å; M133-Y506 HydrophobicContact CB-CD2 4.06Å; M133-Y506 HydrophobicContact SD-CD2 4.13Å; L137-Y506 HydrophobicContact CD1-CD2 3.44Å; L137-Y506 VanDerWaalsContact CD1-CD2 3.44Å; L137-Y506 HydrophobicContact CD1-CE2 3.48Å; L137-Y506 VanDerWaalsContact CD1-CE2 3.48Å; L137-Y506 HydrophobicContact CD1-CG 4.33Å; L137-Y506 HydrophobicContact CD2-CE2 4.03Å; L137-Y506 HydrophobicContact CG-CD2 4.23Å; L137-Y506 HydrophobicContact CG-CE2 3.9Å; E415-Y506 WeakPolarHBondContact CA-OH 3.36Å; E415-Y506 HydrophobicContact CG-CE1 4.45Å; E415-Y506 VanDerWaalsContact CG-OH 3.28Å; E415-Y506 WeakPolarHBondContact CG-OH 2.95Å; E415-Y506 PolarHBondContact OE1-OH 3.24Å; E415-Y506 VanDerWaalsContact OE1-OH 3.1Å; V418-Y506 HydrophobicContact CG1-CE2 4.3Å; V418-Y506 HydrophobicContact CG2-CE2 4.23Å; L444-Y506 HydrophobicContact CD2-CE1 4.16Å; L444-Y506 HydrophobicContact CD2-CE2 4.45Å; K502-Y506 PolarHBondContact O-N 3.37Å; K502-Y506 VanDerWaalsContact O-N 3.11Å; Q504-Y506 PolarHBondContact O-N 2.61Å; Y506-V510 WeakPolarHBondContact O-CB 3.27Å; Y506-V510 VanDerWaalsContact O-CG2 3.29Å; Y506-V510 WeakPolarHBondContact O-CG2 3.49Å; Y506-V510 PolarHBondContact O-N 3.05Å; Y506-V510 VanDerWaalsContact O-N 3.07Å
507	K	95.8	Very high	94.5	Very high	73 Å²	73	23.6 Å²	23.6	32%	0.317	12%	0.119	S	C	.	.	H	α-helix	trans	-59.2	-54.2	175.9	-74.5	173.7	-174.7	177.4	0	111.3	L130 I134 L503 Q504 A509 V510 E511	L130-K507 HydrophobicContact CD1-CG 4.16Å; I134-K507 HydrophobicContact CD1-CD 4.35Å; I134-K507 HydrophobicContact CD1-CG 3.89Å; L503-K507 WeakPolarHBondContact O-CB 3.45Å; L503-K507 VanDerWaalsContact O-CG 3.25Å; L503-K507 WeakPolarHBondContact O-CG 3.29Å; L503-K507 PolarHBondContact O-N 2.97Å; L503-K507 VanDerWaalsContact O-N 3.11Å; Q504-K507 PolarHBondContact O-N 3Å; K507-A509 PolarHBondContact O-N 3Å; K507-V510 PolarHBondContact O-N 3.11Å; K507-E511 WeakPolarHBondContact O-CB 3.38Å; K507-E511 VanDerWaalsContact O-CG 3.29Å; K507-E511 WeakPolarHBondContact O-CG 3.45Å; K507-E511 PolarHBondContact O-N 3.25Å
508	T	95.8	Very high	94.6	Very high	15 Å²	15	28.1 Å²	28.1	9%	0.092	13%	0.134	C	C	.	.	H	α-helix	trans	-64.1	-41.6	-177.1	53.9	0	0	0	0	111.6	V98 Q504 T505 T512	V98-T508 WeakPolarHBondContact CG1-OG1 3.45Å; V98-T508 WeakPolarHBondContact CG2-OG1 3.5Å; Q504-T508 HydrophobicContact CG-CG2 4.21Å; Q504-T508 WeakPolarHBondContact O-CB 3.42Å; Q504-T508 VanDerWaalsContact O-CG2 3.32Å; Q504-T508 WeakPolarHBondContact O-CG2 3.45Å; Q504-T508 PolarHBondContact O-N 3.34Å; Q504-T508 PolarHBondContact O-OG1 3.14Å; T505-T508 PolarHBondContact O-OG1 3.14Å; T508-T512 VanDerWaalsContact O-CB 3.29Å; T508-T512 WeakPolarHBondContact O-CB 2.92Å; T508-T512 PolarHBondContact O-N 3.46Å; T508-T512 PolarHBondContact O-OG1 2.9Å
509	A	96	Very high	94.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-47	178.5	0	0	0	0	0	112.5	L101 A102 T505 K507 T512 A513	L101-A509 HydrophobicContact CB-CB 3.78Å; A102-A509 HydrophobicContact CB-CB 4.28Å; T505-A509 WeakPolarHBondContact O-CB 3.47Å; T505-A509 PolarHBondContact O-N 3.05Å; K507-A509 PolarHBondContact O-N 3Å; A509-T512 PolarHBondContact O-N 3.45Å; A509-A513 PolarHBondContact O-N 2.82Å
510	V	96.3	Very high	94.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-68.5	-43.8	179.7	175.3	0	0	0	0	111.5	M105 L130 M133 Y506 K507 T512 A513 V514	M105-V510 HydrophobicContact CE-CG2 3.76Å; M105-V510 HydrophobicContact SD-CB 4.43Å; M105-V510 HydrophobicContact SD-CG2 3.62Å; L130-V510 HydrophobicContact CB-CB 4.39Å; L130-V510 HydrophobicContact CB-CG1 4.06Å; L130-V510 HydrophobicContact CB-CG2 4.33Å; L130-V510 HydrophobicContact CD1-CB 4.3Å; L130-V510 HydrophobicContact CD1-CG2 4.11Å; L130-V510 HydrophobicContact CD2-CB 4.17Å; L130-V510 HydrophobicContact CD2-CG1 4.18Å; M133-V510 HydrophobicContact CE-CG2 3.49Å; M133-V510 VanDerWaalsContact CE-CG2 3.49Å; Y506-V510 WeakPolarHBondContact O-CB 3.27Å; Y506-V510 VanDerWaalsContact O-CG2 3.29Å; Y506-V510 WeakPolarHBondContact O-CG2 3.49Å; Y506-V510 PolarHBondContact O-N 3.05Å; Y506-V510 VanDerWaalsContact O-N 3.07Å; K507-V510 PolarHBondContact O-N 3.11Å; V510-T512 VanDerWaalsContact C-N 3.28Å; V510-T512 PolarHBondContact O-N 3.08Å; V510-A513 PolarHBondContact O-N 2.95Å; V510-V514 HydrophobicContact CG1-CG2 4.27Å; V510-V514 WeakPolarHBondContact O-CB 3.41Å; V510-V514 VanDerWaalsContact O-CG2 3.31Å; V510-V514 WeakPolarHBondContact O-CG2 3.42Å; V510-V514 PolarHBondContact O-N 3.15Å
511	E	95.2	Very high	94.2	Very high	123 Å²	123	35.4 Å²	35.4	58%	0.575	17%	0.169	S	C	*	.	H	α-helix	trans	-61.6	-38.8	178.3	-75.5	179.9	-169.6	0	0	111.7	K507 V514 L515	K507-E511 WeakPolarHBondContact O-CB 3.38Å; K507-E511 VanDerWaalsContact O-CG 3.29Å; K507-E511 WeakPolarHBondContact O-CG 3.45Å; K507-E511 PolarHBondContact O-N 3.25Å; E511-V514 PolarHBondContact O-N 3.26Å; E511-L515 WeakPolarHBondContact O-CB 3.43Å; E511-L515 PolarHBondContact O-N 3.05Å
512	T	95	Very high	93.9	Very high	8 Å²	8	37 Å²	37	5%	0.049	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-48.7	173.9	-57.5	0	0	0	0	111.4	M80 I83 A102 T508 A509 V510 V514 L515 L516	M80-T512 HydrophobicContact SD-CG2 3.66Å; I83-T512 HydrophobicContact CD1-CG2 3.61Å; I83-T512 WeakPolarHBondContact CD1-OG1 3.31Å; A102-T512 HydrophobicContact CB-CG2 4.26Å; T508-T512 VanDerWaalsContact O-CB 3.29Å; T508-T512 WeakPolarHBondContact O-CB 2.92Å; T508-T512 PolarHBondContact O-N 3.46Å; T508-T512 PolarHBondContact O-OG1 2.9Å; A509-T512 PolarHBondContact O-N 3.45Å; V510-T512 VanDerWaalsContact C-N 3.28Å; V510-T512 PolarHBondContact O-N 3.08Å; T512-V514 VanDerWaalsContact C-N 3.28Å; T512-V514 PolarHBondContact O-N 3.5Å; T512-L515 PolarHBondContact O-N 3.24Å; T512-L516 HydrophobicContact CG2-CD1 4.21Å; T512-L516 PolarHBondContact O-N 2.73Å
513	A	95.3	Very high	93.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-43.3	178.4	0	0	0	0	0	110.8	M105 L106 Y126 A509 V510 L515 L516 L517	M105-A513 HydrophobicContact CB-CB 4.08Å; L106-A513 HydrophobicContact CD2-CB 4.1Å; L106-A513 HydrophobicContact CG-CB 4.03Å; Y126-A513 HydrophobicContact CD2-CB 4.31Å; Y126-A513 HydrophobicContact CE2-CB 4.28Å; A509-A513 PolarHBondContact O-N 2.82Å; V510-A513 PolarHBondContact O-N 2.95Å; A513-L515 PolarHBondContact O-N 2.99Å; A513-L516 PolarHBondContact O-N 3.18Å; A513-L517 WeakPolarHBondContact O-CB 3.01Å; A513-L517 WeakPolarHBondContact O-CG 3.06Å; A513-L517 PolarHBondContact O-N 3.31Å
514	V	95.1	Very high	92.6	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-41	176.1	165.6	0	0	0	0	112.3	I123 V510 E511 T512 R518	I123-V514 HydrophobicContact CB-CG1 4.38Å; I123-V514 HydrophobicContact CB-CG2 4.49Å; I123-V514 HydrophobicContact CG1-CG1 4.16Å; I123-V514 HydrophobicContact CG1-CG2 4.43Å; I123-V514 HydrophobicContact CG2-CB 4.36Å; I123-V514 HydrophobicContact CG2-CG1 3.48Å; I123-V514 VanDerWaalsContact CG2-CG1 3.48Å; I123-V514 HydrophobicContact CG2-CG2 4.08Å; V510-V514 HydrophobicContact CG1-CG2 4.27Å; V510-V514 WeakPolarHBondContact O-CB 3.41Å; V510-V514 VanDerWaalsContact O-CG2 3.31Å; V510-V514 WeakPolarHBondContact O-CG2 3.42Å; V510-V514 PolarHBondContact O-N 3.15Å; E511-V514 PolarHBondContact O-N 3.26Å; T512-V514 VanDerWaalsContact C-N 3.28Å; T512-V514 PolarHBondContact O-N 3.5Å; V514-R518 PolarHBondContact O-N 3.42Å
515	L	94.9	Very high	91.5	Very high	98 Å²	98	42.2 Å²	42.2	51%	0.513	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-49.3	178	177.6	63.9	0	0	0	110.9	E511 T512 A513 R518	E511-L515 WeakPolarHBondContact O-CB 3.43Å; E511-L515 PolarHBondContact O-N 3.05Å; T512-L515 PolarHBondContact O-N 3.24Å; A513-L515 PolarHBondContact O-N 2.99Å; L515-R518 WeakPolarHBondContact O-CB 3.48Å; L515-R518 PolarHBondContact O-N 3.28Å
516	L	94.3	Very high	89.6	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-69.5	-34.3	-177.5	-69.6	-178.2	0	0	0	113	A30 A76 M80 L106 T512 A513 R518 I519	A30-L516 HydrophobicContact CB-CD1 4.1Å; A76-L516 HydrophobicContact CB-CD1 4.3Å; A76-L516 HydrophobicContact CB-CD2 3.64Å; M80-L516 HydrophobicContact CG-CD1 4.27Å; M80-L516 HydrophobicContact SD-CD1 4.26Å; L106-L516 HydrophobicContact CD1-CB 4.3Å; L106-L516 HydrophobicContact CD1-CD1 3.64Å; L106-L516 HydrophobicContact CD2-CB 4.14Å; T512-L516 HydrophobicContact CG2-CD1 4.21Å; T512-L516 PolarHBondContact O-N 2.73Å; A513-L516 PolarHBondContact O-N 3.18Å; L516-R518 PolarHBondContact O-N 3.49Å; L516-I519 HydrophobicContact CD2-CD1 3.95Å; L516-I519 PolarHBondContact O-N 3.42Å
517	L	93.5	Very high	87.2	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-67.9	-22.3	173.9	-72.6	172.3	0	0	0	113.3	I27 L106 A109 L113 V122 I123 Y126 A513 I519	I27-L517 HydrophobicContact CD1-CD2 4.24Å; L106-L517 HydrophobicContact CD2-CD1 4.45Å; L106-L517 HydrophobicContact CD2-CD2 4.09Å; L106-L517 HydrophobicContact CD2-CG 3.81Å; A109-L517 HydrophobicContact CB-CD1 4.02Å; A109-L517 HydrophobicContact CB-CD2 3.97Å; L113-L517 HydrophobicContact CD1-CD2 3.99Å; V122-L517 HydrophobicContact CG1-CD1 3.9Å; I123-L517 HydrophobicContact CD1-CB 4.23Å; I123-L517 HydrophobicContact CG1-CB 4.2Å; Y126-L517 HydrophobicContact CE2-CD1 4.42Å; A513-L517 WeakPolarHBondContact O-CB 3.01Å; A513-L517 WeakPolarHBondContact O-CG 3.06Å; A513-L517 PolarHBondContact O-N 3.31Å; L517-I519 VanDerWaalsContact C-N 3.33Å
518	R	92.9	Very high	84.6	Confident	140 Å²	140	62.4 Å²	62.4	53%	0.528	32%	0.318	S	S	.	.	H	α-helix	trans	-78.1	-19.7	178.8	-167.1	172.1	-63.4	174.5	3.4	112.9	I123 R127 V514 L515 L516 D520	I123-R518 HydrophobicContact CD1-CB 4.29Å; R127-R518 VanDerWaalsContact NH2-NH2 3.18Å; V514-R518 PolarHBondContact O-N 3.42Å; L515-R518 WeakPolarHBondContact O-CB 3.48Å; L515-R518 PolarHBondContact O-N 3.28Å; L516-R518 PolarHBondContact O-N 3.49Å; R518-D520 PolarHBondContact O-N 2.97Å
519	I	92	Very high	82	Confident	55 Å²	55	71.8 Å²	71.8	28%	0.282	36%	0.357	S	S	.	.			trans	-79.3	113.5	-179.3	-57.8	170.2	0	0	0	108.8	V22 Q23 L516 L517	V22-I519 HydrophobicContact CG1-CG2 4.19Å; Q23-I519 WeakPolarHBondContact CG-O 3.47Å; L516-I519 HydrophobicContact CD2-CD1 3.95Å; L516-I519 PolarHBondContact O-N 3.42Å; L517-I519 VanDerWaalsContact C-N 3.33Å
520	D	89.8	Confident	79.1	Confident	89 Å²	89	74.6 Å²	74.6	48%	0.476	39%	0.387	S	S	.	.			trans	-103.9	-26.4	177.3	64.3	-24.7	0	0	0	113.4	S18 G19 V22 R518	S18-D520 CarbonylContact C-O 3.59Å; G19-D520 PolarHBondContact N-O 2.91Å; V22-D520 WeakPolarHBondContact CB-O 3.38Å; R518-D520 PolarHBondContact O-N 2.97Å
521	D	88.3	Confident	76.3	Confident	43 Å²	43	81.1 Å²	81.1	23%	0.23	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138.5	-178.9	-76.5	-9.9	0	0	0	112.5	R16 E17 S18 G19	R16-D521 IonicContact CZ-OD2 3.24Å; R16-D521 VanDerWaalsContact CZ-OD2 3.24Å; R16-D521 IonicContact NE-OD2 3.05Å; R16-D521 PolarHBondContact NE-OD2 3.23Å; R16-D521 IonicContact NH2-OD2 2.64Å; R16-D521 PolarHBondContact NH2-OD2 2.96Å; E17-D521 WeakPolarHBondContact O-CA 3.48Å; S18-D521 WeakPolarHBondContact CA-OD1 3.41Å; S18-D521 WeakPolarHBondContact CB-OD1 3.38Å; S18-D521 PolarHBondContact OG-OD1 3.01Å; S18-D521 PolarHBondContact OG-OD2 2.88Å; G19-D521 PolarHBondContact N-OD1 3.38Å
522	I	86.1	Confident	73.6	Confident	34 Å²	34	82.7 Å²	82.7	17%	0.174	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	118.6	166.9	-66.5	169.1	0	0	0	108.2	R16 E17 V22	R16-I522 WeakPolarHBondContact CA-O 3.48Å; E17-I522 PolarHBondContact N-O 3.37Å; E17-I522 PolarHBondContact O-N 2.64Å; V22-I522 HydrophobicContact CG1-CD1 3.75Å; V22-I522 HydrophobicContact CG1-CG1 3.65Å; V22-I522 HydrophobicContact CG2-CG1 4.43Å
523	V	84.3	Confident	70.9	Confident	84 Å²	84	91.7 Å²	91.7	51%	0.509	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	106.3	177.3	-175.4	0	0	0	0	108.4	T14 R16	T14-V523 HydrophobicContact CG2-CG1 3.33Å; R16-V523 HydrophobicContact CG-CG2 4.31Å
524	S	79	Confident	68.2	Low	47 Å²	47	96.3 Å²	96.3	33%	0.329	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	108.8	177.1	-175.2	0	0	0	0	110.2	T14 K15 H526	T14-S524 WeakPolarHBondContact CA-O 3.34Å; K15-S524 PolarHBondContact N-O 3.14Å; K15-S524 VanDerWaalsContact N-O 3.11Å; K15-S524 PolarHBondContact O-N 2.91Å; S524-H526 PolarHBondContact O-N 2.92Å
525	G	71.2	Confident	65.5	Low	61 Å²	61	107.2 Å²	107.2	63%	0.629	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	90.9	166.3	0	0	0	0	0	109.8	K527	G525-K527 PolarHBondContact O-N 2.91Å; G525-K527 VanDerWaalsContact O-N 3.14Å
526	H	55.4	Low	62.7	Low	144 Å²	144	112.2 Å²	112.2	67%	0.667	57%	0.569	S	S	*	*			trans	-74.5	104	168.6	-93.1	12.2	0	0	0	109.2	S524 K528	S524-H526 PolarHBondContact O-N 2.92Å; H526-K528 PolarHBondContact O-N 3.46Å; H526-K528 VanDerWaalsContact O-N 3.14Å
527	K	46.2	Very low	59.9	Low	202 Å²	202	116.2 Å²	116.2	88%	0.878	61%	0.61	S	S	*	*			trans	-65.6	110	161.2	-145.5	178.1	-171.8	-178.4	0	105.6	G525 K529	G525-K527 PolarHBondContact O-N 2.91Å; G525-K527 VanDerWaalsContact O-N 3.14Å; K527-K529 PolarHBondContact O-N 3.14Å
528	K	40.3	Very low	56.9	Low	155 Å²	155	119.6 Å²	119.6	67%	0.674	65%	0.646	S	S	*	*			trans	-52.5	116.2	164.1	-86.8	-173.5	172.9	-172.8	0	106.1	H526 G530	H526-K528 PolarHBondContact O-N 3.46Å; H526-K528 VanDerWaalsContact O-N 3.14Å; K528-G530 PolarHBondContact O-N 3.05Å; K528-G530 VanDerWaalsContact O-N 3.08Å
529	K	41.6	Very low	54	Low	211 Å²	211	117.5 Å²	117.5	92%	0.917	66%	0.659	S	S	*	*			trans	-55.4	115.1	155.3	-90.6	-177.3	171.1	-179.6	0	104.4	K527	K527-K529 PolarHBondContact O-N 3.14Å
530	G	34.6	Very low	51.5	Low	60 Å²	60	120.7 Å²	120.7	62%	0.619	68%	0.683	S	S	*	*			trans	-59.5	137	-165.1	0	0	0	0	0	112.7	K528 D532	K528-G530 PolarHBondContact O-N 3.05Å; K528-G530 VanDerWaalsContact O-N 3.08Å; G530-D532 PolarHBondContact O-N 3.34Å
531	D	36.9	Very low	49	Very low	138 Å²	138	124.5 Å²	124.5	74%	0.738	70%	0.703	S	S	*	*			trans	-67.9	54.6	152.1	-84.3	-39.3	0	0	0	109.8	Q533	D531-Q533 VanDerWaalsContact C-N 3.28Å; D531-Q533 PolarHBondContact O-N 3.47Å
532	D	39.7	Very low	46.5	Very low	155 Å²	155	126.9 Å²	126.9	83%	0.829	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	39.4	175.3	-102.3	-11.5	0	0	0	111	G530	G530-D532 PolarHBondContact O-N 3.34Å
533	Q	38	Very low	44	Very low	197 Å²	197	128.3 Å²	128.3	92%	0.921	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.3	10.3	170.3	-90.7	-172.1	2.4	0	0	114.6	D531	D531-Q533 VanDerWaalsContact C-N 3.28Å; D531-Q533 PolarHBondContact O-N 3.47Å
534	S	38.1	Very low	41.6	Very low	97 Å²	97	133.1 Å²	133.1	68%	0.678	77%	0.769	S	S	*	*	S	Bend	trans	-127.4	23.7	-178.4	56.2	0	0	0	0	115.3
535	R	38.3	Very low	39.5	Very low	237 Å²	237	143.4 Å²	143.4	89%	0.894	81%	0.812	S	S	*	*	S	Bend	trans	-141.3	46.3	172.3	-75.5	-169.7	173.2	177.7	-2.5	114.5
536	Q	36.7	Very low	37.9	Very low	203 Å²	203	147.6 Å²	147.6	95%	0.949	82%	0.821	S	S	*	*	S	Bend	trans	-143.9	103.6	155.5	-93.8	-176.4	14.5	0	0	108.4
537	G	34.8	Very low	36.9	Very low	85 Å²	85	147.7 Å²	147.7	88%	0.876	83%	0.829	S	S	*	*			trans	160.1	39.1	-178.6	0	0	0	0	0	113.9
538	G	30.7	Very low	36.4	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	83%	0.827	S	S	*	*			trans	-111	93.6	164.6	0	0	0	0	0	107.8
539	A	33.3	Very low	36.2	Very low	96 Å²	96	144.1 Å²	144.1	79%	0.793	84%	0.836	S	S	*	*			trans	-64.5	137.2	172.6	0	0	0	0	0	109.5	D541	A539-D541 PolarHBondContact O-N 3.3Å
540	P	39	Very low	35.9	Very low	122 Å²	122	139.9 Å²	139.9	79%	0.792	83%	0.83	S	S	*	*			trans	-73.8	124.6	170.2	27.4	-28.8	0	0	0	109.9	A542	P540-A542 PolarHBondContact O-N 3.34Å
541	D	35.7	Very low	36	Very low	168 Å²	168	145.3 Å²	145.3	90%	0.898	85%	0.845	S	S	*	*			trans	-61.7	115.4	171.3	-157.2	5.1	0	0	0	109.2	A539	A539-D541 PolarHBondContact O-N 3.3Å
542	A	36.5	Very low	35.9	Very low	93 Å²	93	145.8 Å²	145.8	77%	0.769	85%	0.852	S	S	*	*			trans	-107.2	96.4	171.8	0	0	0	0	0	108.3	P540	P540-A542 PolarHBondContact O-N 3.34Å
543	G	33.3	Very low	35.6	Very low	64 Å²	64	145.1 Å²	145.1	66%	0.66	85%	0.854	S	S	*	*			trans	-67	157.5	147.7	0	0	0	0	0	109.3
544	Q	35	Very low	35.4	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.864	85%	0.848	S	S	*	*			cis	-161.1	158.7	12.7	-92.4	169.2	-33.6	0	0	105.9
545	E	33.4	Very low	35.2	Very low	264 Å²	264	144.7 Å²	144.7	100%	1.234	86%	0.864	S	S	*	*			trans	57.7	0	155.9	-67	-176.8	160	0	0	120.2

Retrieved 545 of 545 residues in 540.5 ms (Link to these results)

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