A0A096ND09_PAPAN Loading...

Zinc finger protein 354B

AlphaFold DB , UniProt , Accession A0A096ND09, Species PAPAN (Papio anubis, Olive baboon), Gene ZNF354B, Length 612 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	47	Very low	37.8	Very low	252 Å²	252	168.5 Å²	168.5	100%	1.241	89%	0.893	S	S	*	*				0	143.7	0	-64.7	176.1	179.2	0	0	108.5
2	A	32.6	Very low	38.6	Very low	107 Å²	107	165 Å²	165	88%	0.884	88%	0.882	S	S	*	*			trans	-157.3	140.7	169.6	0	0	0	0	0	109.8
3	A	45.3	Very low	39.7	Very low	107 Å²	107	159.3 Å²	159.3	88%	0.884	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-94.8	117	-178.9	0	0	0	0	0	111.3
4	G	30.8	Very low	41	Very low	78 Å²	78	154.6 Å²	154.6	80%	0.804	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-92.9	117.3	175.8	0	0	0	0	0	112.2
5	R	38	Very low	42.4	Very low	241 Å²	241	147.4 Å²	147.4	91%	0.909	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.6	139.2	171.3	-72.6	-177.1	172.9	-164.6	-1.7	110.4	E7	R5-E7 PolarHBondContact O-N 3.06Å
6	R	34.8	Very low	44	Very low	250 Å²	250	138.9 Å²	138.9	94%	0.943	75%	0.753	S	S	*	*			trans	-81.3	108.1	156.8	-72.5	-174.6	179	-177.9	0.9	108.1	A8	R6-A8 PolarHBondContact O-N 3.3Å
7	E	35.4	Very low	45.3	Very low	182 Å²	182	137.5 Å²	137.5	85%	0.85	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-69.2	128.9	169.7	-64	-168.8	137.7	0	0	110.1	R5	R5-E7 PolarHBondContact O-N 3.06Å
8	A	37.3	Very low	46.7	Very low	94 Å²	94	135.5 Å²	135.5	78%	0.777	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-75	125.9	170.1	0	0	0	0	0	108.8	R6	R6-A8 PolarHBondContact O-N 3.3Å
9	R	35.6	Very low	47.8	Very low	239 Å²	239	131.2 Å²	131.2	90%	0.902	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-56.7	133.4	170.6	-100.8	-174.5	172.9	-177.4	-1.5	109.3	Q11	R9-Q11 PolarHBondContact O-N 2.82Å
10	P	35.8	Very low	49	Very low	115 Å²	115	125.7 Å²	125.7	75%	0.747	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-62.8	127.4	-179	25.2	-33.7	0	0	0	110.3	V12	P10-V12 PolarHBondContact O-N 2.93Å
11	Q	43	Very low	50.2	Low	189 Å²	189	123.5 Å²	123.5	88%	0.883	67%	0.672	S	S	*	*			trans	-76.9	104.2	171.7	-154.2	172.9	13.4	0	0	106.9	R9 S13	R9-Q11 PolarHBondContact O-N 2.82Å; Q11-S13 PolarHBondContact O-N 2.99Å
12	V	47.9	Very low	51.4	Low	126 Å²	126	116.3 Å²	116.3	76%	0.764	64%	0.638	S	S	*	*			trans	-68	98.3	-178.7	-177.9	0	0	0	0	109	P10 L14	P10-V12 PolarHBondContact O-N 2.93Å; V12-L14 PolarHBondContact O-N 2.97Å
13	S	53.1	Low	53.3	Low	91 Å²	91	114 Å²	114	64%	0.636	61%	0.608	S	S	*	*			trans	-74	104.2	173.8	54	0	0	0	0	109.3	Q11 T15	Q11-S13 PolarHBondContact O-N 2.99Å; S13-T15 PolarHBondContact O-N 3.25Å
14	L	57.2	Low	54.5	Low	94 Å²	94	112.6 Å²	112.6	49%	0.492	59%	0.589	S	S	.	*			trans	-56.5	123.1	167.4	-75	165.1	0	0	0	109	V12 D18 F57	V12-L14 PolarHBondContact O-N 2.97Å; L14-D18 WeakPolarHBondContact CA-OD2 3.27Å; L14-D18 HydrophobicContact CD2-CB 4.33Å; L14-F57 WeakPolarHBondContact O-CE1 3.26Å; L14-F57 WeakPolarHBondContact O-CZ 3.42Å
15	T	62.9	Low	56.2	Low	46 Å²	46	115.4 Å²	115.4	28%	0.282	58%	0.575	S	S	.	*			trans	-97.4	-176.5	177.6	79.4	0	0	0	0	111.3	S13 E17 D18	S13-T15 PolarHBondContact O-N 3.25Å; T15-E17 VanDerWaalsContact C-N 3.32Å; T15-E17 WeakPolarHBondContact CB-OE2 3.42Å; T15-E17 WeakPolarHBondContact OG1-CB 3.31Å; T15-E17 PolarHBondContact OG1-N 3.2Å; T15-E17 VanDerWaalsContact OG1-N 3.14Å; T15-E17 PolarHBondContact OG1-OE2 3.48Å; T15-D18 PolarHBondContact N-OD2 3.25Å
16	F	67.6	Low	57.4	Low	12 Å²	12	107.9 Å²	107.9	5%	0.053	55%	0.553	C	S	.	*	S	Bend	trans	-71.2	-34.3	170.6	178.3	-102.5	0	0	0	111	D18 V19 A20 M43 Y47 L50 P60 I63	F16-D18 VanDerWaalsContact C-N 3.33Å; F16-D18 PolarHBondContact O-N 3.22Å; F16-V19 CarbonylContact O-C 3.14Å; F16-V19 WeakPolarHBondContact O-CG2 3.4Å; F16-V19 PolarHBondContact O-N 3.13Å; F16-V19 VanDerWaalsContact O-N 3.13Å; F16-A20 HydrophobicContact CD1-CB 3.99Å; F16-A20 HydrophobicContact CE1-CB 3.67Å; F16-A20 HydrophobicContact CZ-CB 4.21Å; F16-A20 WeakPolarHBondContact O-CB 3.42Å; F16-A20 PolarHBondContact O-N 3.44Å; F16-M43 HydrophobicContact CE1-CE 3.96Å; F16-M43 HydrophobicContact CZ-CE 3.74Å; F16-M43 HydrophobicContact CZ-SD 4.41Å; F16-Y47 HydrophobicContact CD2-CD2 4.18Å; F16-Y47 HydrophobicContact CE2-CD2 4.46Å; F16-L50 HydrophobicContact CB-CD1 4.36Å; F16-L50 HydrophobicContact CD2-CD1 3.92Å; F16-P60 HydrophobicContact CB-CG 3.79Å; F16-P60 HydrophobicContact CD1-CB 4Å; F16-P60 HydrophobicContact CD1-CG 3.72Å; F16-P60 HydrophobicContact CD2-CG 4.28Å; F16-P60 HydrophobicContact CE1-CB 4.45Å; F16-P60 HydrophobicContact CE1-CG 4.45Å; F16-P60 HydrophobicContact CG-CB 4.42Å; F16-P60 HydrophobicContact CG-CG 3.63Å; F16-I63 HydrophobicContact CE1-CD1 4.36Å; F16-I63 HydrophobicContact CE1-CG1 4.15Å; F16-I63 HydrophobicContact CE2-CD1 3.84Å; F16-I63 HydrophobicContact CE2-CG1 3.92Å; F16-I63 HydrophobicContact CZ-CD1 3.52Å; F16-I63 HydrophobicContact CZ-CG1 3.69Å
17	E	66.7	Low	59.2	Low	114 Å²	114	100.1 Å²	100.1	53%	0.533	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-63.5	-36.7	-176.3	-63.7	61	-133.6	0	0	111.6	T15 V19 A20	T15-E17 VanDerWaalsContact C-N 3.32Å; T15-E17 WeakPolarHBondContact CB-OE2 3.42Å; T15-E17 WeakPolarHBondContact OG1-CB 3.31Å; T15-E17 PolarHBondContact OG1-N 3.2Å; T15-E17 VanDerWaalsContact OG1-N 3.14Å; T15-E17 PolarHBondContact OG1-OE2 3.48Å; E17-V19 PolarHBondContact O-N 3.49Å; E17-V19 VanDerWaalsContact O-N 3.12Å; E17-A20 PolarHBondContact O-N 3.05Å; E17-A20 VanDerWaalsContact O-N 3.16Å
18	D	69.1	Low	61.1	Low	102 Å²	102	91.9 Å²	91.9	55%	0.545	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-58.5	-23	174.8	-69.4	-41.2	0	0	0	114.2	L14 T15 F16	L14-D18 WeakPolarHBondContact CA-OD2 3.27Å; L14-D18 HydrophobicContact CD2-CB 4.33Å; T15-D18 PolarHBondContact N-OD2 3.25Å; F16-D18 VanDerWaalsContact C-N 3.33Å; F16-D18 PolarHBondContact O-N 3.22Å
19	V	69	Low	62.8	Low	54 Å²	54	94.4 Å²	94.4	33%	0.327	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-123.2	9.2	179.6	-57.1	0	0	0	0	112.9	F16 E17 N46 L50	F16-V19 CarbonylContact O-C 3.14Å; F16-V19 WeakPolarHBondContact O-CG2 3.4Å; F16-V19 PolarHBondContact O-N 3.13Å; F16-V19 VanDerWaalsContact O-N 3.13Å; E17-V19 PolarHBondContact O-N 3.49Å; E17-V19 VanDerWaalsContact O-N 3.12Å; V19-N46 HydrophobicContact CG2-CB 4.41Å; V19-N46 PolarHBondContact O-ND2 3.43Å; V19-L50 HydrophobicContact CG2-CD1 3.52Å; V19-L50 HydrophobicContact CG2-CG 4.19Å
20	A	71.6	Confident	64.6	Low	20 Å²	20	91 Å²	91	17%	0.165	47%	0.47	C	S	.	.			trans	-88.7	121.8	175.3	0	0	0	0	0	109.5	F16 E17 L22 M43	F16-A20 HydrophobicContact CD1-CB 3.99Å; F16-A20 HydrophobicContact CE1-CB 3.67Å; F16-A20 HydrophobicContact CZ-CB 4.21Å; F16-A20 WeakPolarHBondContact O-CB 3.42Å; F16-A20 PolarHBondContact O-N 3.44Å; E17-A20 PolarHBondContact O-N 3.05Å; E17-A20 VanDerWaalsContact O-N 3.16Å; A20-L22 HydrophobicContact CB-CD2 4.19Å; A20-L22 HydrophobicContact CB-CG 4.17Å; A20-M43 HydrophobicContact CB-CE 3.9Å
21	V	74.4	Confident	66.3	Low	81 Å²	81	86.9 Å²	86.9	49%	0.491	44%	0.441	S	S	.	.			trans	-80.9	124.2	156.7	-179.2	0	0	0	0	106	F23 Y39 M43	V21-F23 HydrophobicContact CG1-CD2 4.44Å; V21-F23 HydrophobicContact CG1-CE2 4.02Å; V21-F23 HydrophobicContact CG1-CZ 4.12Å; V21-Y39 HydrophobicContact CB-CE2 4.38Å; V21-Y39 HydrophobicContact CG1-CE2 4.48Å; V21-Y39 WeakPolarHBondContact O-CE2 3.39Å; V21-Y39 PolarHBondContact O-OH 2.84Å; V21-Y39 VanDerWaalsContact O-OH 3.1Å; V21-M43 WeakPolarHBondContact O-CE 3.32Å
22	L	71	Confident	67.8	Low	101 Å²	101	79.8 Å²	79.8	53%	0.529	42%	0.415	S	S	.	.			trans	-115.4	127	174.3	-61.5	178.3	0	0	0	108.7	A20 M43	A20-L22 HydrophobicContact CB-CD2 4.19Å; A20-L22 HydrophobicContact CB-CG 4.17Å; L22-M43 HydrophobicContact CD2-CE 4.29Å
23	F	72.6	Confident	68.9	Low	57 Å²	57	78.6 Å²	78.6	25%	0.25	41%	0.41	C	S	.	.			trans	-103.4	133.2	175	-74.3	-68.5	0	0	0	110	V21 E27 W28 L31 Y39 W73	V21-F23 HydrophobicContact CG1-CD2 4.44Å; V21-F23 HydrophobicContact CG1-CE2 4.02Å; V21-F23 HydrophobicContact CG1-CZ 4.12Å; F23-E27 HydrophobicContact CB-CB 4.23Å; F23-E27 HydrophobicContact CD1-CB 3.99Å; F23-W28 HydrophobicContact CB-CB 4.47Å; F23-W28 HydrophobicContact CB-CE3 4.24Å; F23-W28 HydrophobicContact CD2-CE3 4.05Å; F23-W28 HydrophobicContact CD2-CZ3 4.23Å; F23-L31 HydrophobicContact CD2-CD1 3.78Å; F23-L31 HydrophobicContact CE2-CD1 3.74Å; F23-L31 HydrophobicContact CG-CD1 4.21Å; F23-L31 HydrophobicContact CZ-CD1 4.16Å; F23-Y39 AromaticContact CD2-CD2 3.72Å; F23-Y39 HydrophobicContact CD2-CD2 3.72Å; F23-Y39 AromaticContact CD2-CE2 3.53Å; F23-Y39 HydrophobicContact CD2-CE2 3.53Å; F23-Y39 AromaticContact CE2-CD2 3.59Å; F23-Y39 HydrophobicContact CE2-CD2 3.59Å; F23-Y39 AromaticContact CE2-CE2 3.83Å; F23-Y39 HydrophobicContact CE2-CE2 3.83Å; F23-W73 VanDerWaalsContact O-CE2 3.23Å; F23-W73 WeakPolarHBondContact O-CZ2 3.12Å; F23-W73 PolarHBondContact O-NE1 3.24Å
24	T	70.3	Confident	69.5	Low	79 Å²	79	78.5 Å²	78.5	49%	0.485	41%	0.409	S	S	.	.			trans	-59.7	160.6	170.3	63.5	0	0	0	0	111.2	D26 E27 W28	T24-D26 PolarHBondContact O-N 3.39Å; T24-D26 VanDerWaalsContact O-N 3.14Å; T24-E27 WeakPolarHBondContact CB-OE2 3.32Å; T24-E27 WeakPolarHBondContact CG2-OE2 3.19Å; T24-E27 PolarHBondContact N-OE2 3.4Å; T24-E27 PolarHBondContact O-N 2.99Å; T24-E27 VanDerWaalsContact OG1-CD 3.28Å; T24-E27 VanDerWaalsContact OG1-CG 3.27Å; T24-E27 WeakPolarHBondContact OG1-CG 3.39Å; T24-E27 PolarHBondContact OG1-N 3.35Å; T24-E27 PolarHBondContact OG1-OE2 2.94Å; T24-W28 WeakPolarHBondContact O-CB 3.43Å; T24-W28 PolarHBondContact O-N 3.21Å
25	R	66.8	Low	70.1	Confident	137 Å²	137	78.7 Å²	78.7	52%	0.517	41%	0.408	S	S	.	.	H	α-helix	trans	-54.5	-36	-177.7	-165.2	177.5	-170.8	175.7	3.7	113.1	R29	R25-R29 WeakPolarHBondContact O-CD 3.28Å; R25-R29 VanDerWaalsContact O-CG 3.3Å; R25-R29 WeakPolarHBondContact O-CG 3.26Å; R25-R29 PolarHBondContact O-N 3.4Å; R25-R29 VanDerWaalsContact O-N 3.11Å
26	D	64.1	Low	70.8	Confident	83 Å²	83	79.6 Å²	79.6	44%	0.444	41%	0.406	S	S	.	.	H	α-helix	trans	-88	-23	-178.3	-66.2	-48.1	0	0	0	114.4	T24 R29 K30	T24-D26 PolarHBondContact O-N 3.39Å; T24-D26 VanDerWaalsContact O-N 3.14Å; D26-R29 WeakPolarHBondContact OD1-CD 3.38Å; D26-R29 IonicContact OD1-CZ 2.71Å; D26-R29 IonicContact OD1-NE 3.48Å; D26-R29 IonicContact OD1-NH1 3.86Å; D26-R29 PolarHBondContact OD1-NH1 2.98Å; D26-K30 VanDerWaalsContact O-CD 3.26Å; D26-K30 WeakPolarHBondContact O-CD 3.31Å; D26-K30 WeakPolarHBondContact O-CE 3.41Å; D26-K30 VanDerWaalsContact O-CG 3.24Å; D26-K30 WeakPolarHBondContact O-CG 3.34Å; D26-K30 PolarHBondContact O-N 3.46Å
27	E	71.3	Confident	71.1	Confident	86 Å²	86	83 Å²	83	40%	0.402	43%	0.425	S	S	.	.	H	α-helix	trans	-69.8	-44.7	163.4	-69.1	167.6	123.1	0	0	110.7	F23 T24 R29 K30 L31	F23-E27 HydrophobicContact CB-CB 4.23Å; F23-E27 HydrophobicContact CD1-CB 3.99Å; T24-E27 WeakPolarHBondContact CB-OE2 3.32Å; T24-E27 WeakPolarHBondContact CG2-OE2 3.19Å; T24-E27 PolarHBondContact N-OE2 3.4Å; T24-E27 PolarHBondContact O-N 2.99Å; T24-E27 VanDerWaalsContact OG1-CD 3.28Å; T24-E27 VanDerWaalsContact OG1-CG 3.27Å; T24-E27 WeakPolarHBondContact OG1-CG 3.39Å; T24-E27 PolarHBondContact OG1-N 3.35Å; T24-E27 PolarHBondContact OG1-OE2 2.94Å; E27-R29 VanDerWaalsContact C-N 3.29Å; E27-R29 PolarHBondContact O-N 3.19Å; E27-K30 WeakPolarHBondContact O-CA 3.4Å; E27-K30 WeakPolarHBondContact O-CB 3.45Å; E27-K30 PolarHBondContact O-N 3.18Å; E27-L31 PolarHBondContact O-N 3.45Å; E27-L31 VanDerWaalsContact O-N 3.17Å
28	W	76.1	Confident	71.4	Confident	9 Å²	9	82.9 Å²	82.9	3%	0.034	43%	0.427	C	S	.	.	H	α-helix	trans	-57.5	-42.2	176.9	-171	-105.3	0	0	0	112	F23 T24 K30 L31 R36 Y39 D71 P72	F23-W28 HydrophobicContact CB-CB 4.47Å; F23-W28 HydrophobicContact CB-CE3 4.24Å; F23-W28 HydrophobicContact CD2-CE3 4.05Å; F23-W28 HydrophobicContact CD2-CZ3 4.23Å; T24-W28 WeakPolarHBondContact O-CB 3.43Å; T24-W28 PolarHBondContact O-N 3.21Å; W28-K30 VanDerWaalsContact C-N 3.3Å; W28-K30 PolarHBondContact O-N 2.79Å; W28-L31 HydrophobicContact CE3-CD1 3.67Å; W28-L31 HydrophobicContact CZ3-CD1 3.89Å; W28-L31 PolarHBondContact O-N 2.8Å; W28-R36 HydrophobicContact CD2-CG 4.4Å; W28-R36 HydrophobicContact CH2-CB 3.71Å; W28-R36 HydrophobicContact CH2-CG 3.86Å; W28-R36 HydrophobicContact CZ2-CB 3.72Å; W28-R36 HydrophobicContact CZ2-CG 3.7Å; W28-R36 HydrophobicContact CZ3-CB 4.48Å; W28-R36 HydrophobicContact CZ3-CG 4.28Å; W28-R36 VanDerWaalsContact O-CZ 3.25Å; W28-R36 PolarHBondContact O-NE 3.32Å; W28-R36 VanDerWaalsContact O-NE 3.13Å; W28-R36 PolarHBondContact O-NH2 3.13Å; W28-Y39 AromaticContact CH2-CD1 3.36Å; W28-Y39 HydrophobicContact CH2-CD1 3.36Å; W28-Y39 AromaticContact CH2-CE1 3.8Å; W28-Y39 HydrophobicContact CH2-CE1 3.8Å; W28-Y39 AromaticContact CH2-CG 3.96Å; W28-Y39 HydrophobicContact CH2-CG 3.96Å; W28-Y39 AromaticContact CZ3-CD1 3.32Å; W28-Y39 HydrophobicContact CZ3-CD1 3.32Å; W28-Y39 HydrophobicContact CZ3-CD2 4.14Å; W28-Y39 AromaticContact CZ3-CE1 3.58Å; W28-Y39 HydrophobicContact CZ3-CE1 3.58Å; W28-Y39 HydrophobicContact CZ3-CE2 4.33Å; W28-Y39 AromaticContact CZ3-CG 3.59Å; W28-Y39 HydrophobicContact CZ3-CG 3.59Å; W28-D71 VanDerWaalsContact NE1-CG 3.32Å; W28-D71 PolarHBondContact NE1-OD1 2.69Å; W28-P72 HydrophobicContact CH2-CG 4.3Å; W28-P72 HydrophobicContact CZ2-CG 4.14Å
29	R	72.8	Confident	72.1	Confident	147 Å²	147	78.9 Å²	78.9	56%	0.555	40%	0.404	S	S	*	.	H	α-helix	trans	-56.9	-39	172.1	-80.1	163.2	163.3	171.2	-6.9	112.9	R25 D26 E27 L31 R36	R25-R29 WeakPolarHBondContact O-CD 3.28Å; R25-R29 VanDerWaalsContact O-CG 3.3Å; R25-R29 WeakPolarHBondContact O-CG 3.26Å; R25-R29 PolarHBondContact O-N 3.4Å; R25-R29 VanDerWaalsContact O-N 3.11Å; D26-R29 WeakPolarHBondContact OD1-CD 3.38Å; D26-R29 IonicContact OD1-CZ 2.71Å; D26-R29 IonicContact OD1-NE 3.48Å; D26-R29 IonicContact OD1-NH1 3.86Å; D26-R29 PolarHBondContact OD1-NH1 2.98Å; E27-R29 VanDerWaalsContact C-N 3.29Å; E27-R29 PolarHBondContact O-N 3.19Å; R29-L31 VanDerWaalsContact C-N 3.35Å; R29-R36 PolarHBondContact O-NH2 3.3Å
30	K	73.9	Confident	72.6	Confident	168 Å²	168	78.5 Å²	78.5	73%	0.73	40%	0.397	S	S	*	.	H	α-helix	trans	-75.6	-17.9	-179.9	-66.7	162.5	-169.2	170.6	0	113.5	D26 E27 W28	D26-K30 VanDerWaalsContact O-CD 3.26Å; D26-K30 WeakPolarHBondContact O-CD 3.31Å; D26-K30 WeakPolarHBondContact O-CE 3.41Å; D26-K30 VanDerWaalsContact O-CG 3.24Å; D26-K30 WeakPolarHBondContact O-CG 3.34Å; D26-K30 PolarHBondContact O-N 3.46Å; E27-K30 WeakPolarHBondContact O-CA 3.4Å; E27-K30 WeakPolarHBondContact O-CB 3.45Å; E27-K30 PolarHBondContact O-N 3.18Å; W28-K30 VanDerWaalsContact C-N 3.3Å; W28-K30 PolarHBondContact O-N 2.79Å
31	L	71.5	Confident	72.7	Confident	28 Å²	28	82.7 Å²	82.7	15%	0.147	42%	0.417	C	S	.	.	S	Bend	trans	-72.2	133.4	176.1	-65	179.8	0	0	0	112.1	F23 E27 W28 R29 Q35 R36	F23-L31 HydrophobicContact CD2-CD1 3.78Å; F23-L31 HydrophobicContact CE2-CD1 3.74Å; F23-L31 HydrophobicContact CG-CD1 4.21Å; F23-L31 HydrophobicContact CZ-CD1 4.16Å; E27-L31 PolarHBondContact O-N 3.45Å; E27-L31 VanDerWaalsContact O-N 3.17Å; W28-L31 HydrophobicContact CE3-CD1 3.67Å; W28-L31 HydrophobicContact CZ3-CD1 3.89Å; W28-L31 PolarHBondContact O-N 2.8Å; R29-L31 VanDerWaalsContact C-N 3.35Å; L31-Q35 HydrophobicContact CB-CB 4.27Å; L31-Q35 HydrophobicContact CD2-CB 4.25Å; L31-R36 HydrophobicContact CB-CG 3.81Å; L31-R36 HydrophobicContact CD1-CG 4.49Å; L31-R36 PolarHBondContact O-NE 3.39Å; L31-R36 PolarHBondContact O-NH2 2.85Å; L31-R36 VanDerWaalsContact O-NH2 3.07Å
32	A	73.5	Confident	73	Confident	41 Å²	41	81.6 Å²	81.6	34%	0.339	41%	0.41	S	S	.	.			trans	-69	155.8	172.3	0	0	0	0	0	111.8	S34 Q35 R36	A32-S34 PolarHBondContact O-N 3.18Å; A32-S34 VanDerWaalsContact O-N 3.12Å; A32-Q35 WeakPolarHBondContact O-CA 3.38Å; A32-Q35 WeakPolarHBondContact O-CB 3.35Å; A32-Q35 PolarHBondContact O-N 3.28Å; A32-R36 PolarHBondContact O-N 3.09Å; A32-R36 VanDerWaalsContact O-N 3.08Å
33	P	72.4	Confident	73.6	Confident	100 Å²	100	76.9 Å²	76.9	65%	0.649	39%	0.386	S	S	*	.	H	α-helix	trans	-55.6	-35	-176.6	-28.1	35.7	0	0	0	114.6	Q35 R36 N37	P33-Q35 VanDerWaalsContact C-N 3.34Å; P33-Q35 PolarHBondContact O-N 2.83Å; P33-R36 PolarHBondContact O-N 3.09Å; P33-N37 PolarHBondContact O-N 3.16Å; P33-N37 PolarHBondContact O-ND2 2.84Å
34	S	65.3	Low	73.9	Confident	90 Å²	90	75.1 Å²	75.1	63%	0.629	38%	0.378	S	S	*	.	H	α-helix	trans	-66.5	-32.5	175.4	51.6	0	0	0	0	113.5	A32 L38	A32-S34 PolarHBondContact O-N 3.18Å; A32-S34 VanDerWaalsContact O-N 3.12Å; S34-L38 PolarHBondContact O-N 3.46Å; S34-L38 VanDerWaalsContact O-N 3.13Å
35	Q	68.9	Low	74.3	Confident	97 Å²	97	76.9 Å²	76.9	45%	0.453	38%	0.381	S	S	.	.	H	α-helix	trans	-76	-39.8	175.9	-64	170.3	-59.9	0	0	111.2	L31 A32 P33 N37 L38 Y39	L31-Q35 HydrophobicContact CB-CB 4.27Å; L31-Q35 HydrophobicContact CD2-CB 4.25Å; A32-Q35 WeakPolarHBondContact O-CA 3.38Å; A32-Q35 WeakPolarHBondContact O-CB 3.35Å; A32-Q35 PolarHBondContact O-N 3.28Å; P33-Q35 VanDerWaalsContact C-N 3.34Å; P33-Q35 PolarHBondContact O-N 2.83Å; Q35-N37 VanDerWaalsContact C-N 3.33Å; Q35-N37 PolarHBondContact O-N 3.23Å; Q35-L38 PolarHBondContact O-N 3.23Å; Q35-Y39 PolarHBondContact O-N 3.43Å
36	R	78.4	Confident	74.9	Confident	65 Å²	65	72.6 Å²	72.6	25%	0.245	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-38.6	174.3	-61.5	-174	-160.4	-176.5	7.3	112.1	W28 R29 L31 A32 P33 Y39 R40	W28-R36 HydrophobicContact CD2-CG 4.4Å; W28-R36 HydrophobicContact CH2-CB 3.71Å; W28-R36 HydrophobicContact CH2-CG 3.86Å; W28-R36 HydrophobicContact CZ2-CB 3.72Å; W28-R36 HydrophobicContact CZ2-CG 3.7Å; W28-R36 HydrophobicContact CZ3-CB 4.48Å; W28-R36 HydrophobicContact CZ3-CG 4.28Å; W28-R36 VanDerWaalsContact O-CZ 3.25Å; W28-R36 PolarHBondContact O-NE 3.32Å; W28-R36 VanDerWaalsContact O-NE 3.13Å; W28-R36 PolarHBondContact O-NH2 3.13Å; R29-R36 PolarHBondContact O-NH2 3.3Å; L31-R36 HydrophobicContact CB-CG 3.81Å; L31-R36 HydrophobicContact CD1-CG 4.49Å; L31-R36 PolarHBondContact O-NE 3.39Å; L31-R36 PolarHBondContact O-NH2 2.85Å; L31-R36 VanDerWaalsContact O-NH2 3.07Å; A32-R36 PolarHBondContact O-N 3.09Å; A32-R36 VanDerWaalsContact O-N 3.08Å; P33-R36 PolarHBondContact O-N 3.09Å; R36-Y39 PolarHBondContact O-N 3.26Å; R36-R40 PolarHBondContact O-N 3.43Å
37	N	72.9	Confident	75.6	Confident	85 Å²	85	70.2 Å²	70.2	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-44.4	172.8	-73.7	-19.1	0	0	0	112.2	P33 Q35 Y39 R40 D41	P33-N37 PolarHBondContact O-N 3.16Å; P33-N37 PolarHBondContact O-ND2 2.84Å; Q35-N37 VanDerWaalsContact C-N 3.33Å; Q35-N37 PolarHBondContact O-N 3.23Å; N37-Y39 VanDerWaalsContact C-N 3.31Å; N37-Y39 PolarHBondContact O-N 3.02Å; N37-R40 WeakPolarHBondContact O-CB 3.42Å; N37-R40 PolarHBondContact O-N 2.92Å; N37-D41 PolarHBondContact O-N 3.24Å
38	L	73.9	Confident	75.9	Confident	110 Å²	110	73.6 Å²	73.6	58%	0.576	36%	0.363	S	S	*	.	H	α-helix	trans	-60.9	-39.9	175.4	179	61.8	0	0	0	112.2	S34 Q35 D41 V42	S34-L38 PolarHBondContact O-N 3.46Å; S34-L38 VanDerWaalsContact O-N 3.13Å; Q35-L38 PolarHBondContact O-N 3.23Å; L38-D41 PolarHBondContact O-N 3.28Å; L38-V42 HydrophobicContact CD1-CG2 4.22Å; L38-V42 WeakPolarHBondContact O-CG2 3.49Å; L38-V42 PolarHBondContact O-N 2.84Å
39	Y	83.5	Confident	75.8	Confident	18 Å²	18	77.2 Å²	77.2	7%	0.071	38%	0.383	C	S	.	.	H	α-helix	trans	-60.8	-46.7	173.2	173.2	-90.5	0	0	0	111.8	V21 F23 W28 Q35 R36 N37 D41 V42 M43 L66 P72	V21-Y39 HydrophobicContact CB-CE2 4.38Å; V21-Y39 HydrophobicContact CG1-CE2 4.48Å; V21-Y39 WeakPolarHBondContact O-CE2 3.39Å; V21-Y39 PolarHBondContact O-OH 2.84Å; V21-Y39 VanDerWaalsContact O-OH 3.1Å; F23-Y39 AromaticContact CD2-CD2 3.72Å; F23-Y39 HydrophobicContact CD2-CD2 3.72Å; F23-Y39 AromaticContact CD2-CE2 3.53Å; F23-Y39 HydrophobicContact CD2-CE2 3.53Å; F23-Y39 AromaticContact CE2-CD2 3.59Å; F23-Y39 HydrophobicContact CE2-CD2 3.59Å; F23-Y39 AromaticContact CE2-CE2 3.83Å; F23-Y39 HydrophobicContact CE2-CE2 3.83Å; W28-Y39 AromaticContact CH2-CD1 3.36Å; W28-Y39 HydrophobicContact CH2-CD1 3.36Å; W28-Y39 AromaticContact CH2-CE1 3.8Å; W28-Y39 HydrophobicContact CH2-CE1 3.8Å; W28-Y39 AromaticContact CH2-CG 3.96Å; W28-Y39 HydrophobicContact CH2-CG 3.96Å; W28-Y39 AromaticContact CZ3-CD1 3.32Å; W28-Y39 HydrophobicContact CZ3-CD1 3.32Å; W28-Y39 HydrophobicContact CZ3-CD2 4.14Å; W28-Y39 AromaticContact CZ3-CE1 3.58Å; W28-Y39 HydrophobicContact CZ3-CE1 3.58Å; W28-Y39 HydrophobicContact CZ3-CE2 4.33Å; W28-Y39 AromaticContact CZ3-CG 3.59Å; W28-Y39 HydrophobicContact CZ3-CG 3.59Å; Q35-Y39 PolarHBondContact O-N 3.43Å; R36-Y39 PolarHBondContact O-N 3.26Å; N37-Y39 VanDerWaalsContact C-N 3.31Å; N37-Y39 PolarHBondContact O-N 3.02Å; Y39-D41 PolarHBondContact O-N 3.24Å; Y39-V42 PolarHBondContact O-N 2.95Å; Y39-M43 HydrophobicContact CD1-CG 4.09Å; Y39-M43 HydrophobicContact CD2-CG 4.07Å; Y39-M43 HydrophobicContact CE1-CG 3.97Å; Y39-M43 HydrophobicContact CE2-CE 4.38Å; Y39-M43 HydrophobicContact CE2-CG 3.95Å; Y39-M43 HydrophobicContact CE2-SD 4.31Å; Y39-M43 HydrophobicContact CG-CG 4.18Å; Y39-M43 WeakPolarHBondContact O-CB 3.34Å; Y39-M43 WeakPolarHBondContact O-CG 3.48Å; Y39-M43 PolarHBondContact O-N 3.21Å; Y39-L66 HydrophobicContact CD1-CD1 4.39Å; Y39-L66 HydrophobicContact CD1-CD2 4.37Å; Y39-L66 HydrophobicContact CE1-CD1 3.97Å; Y39-L66 HydrophobicContact CE1-CD2 4.31Å; Y39-P72 HydrophobicContact CE1-CG 3.95Å
40	R	78.6	Confident	75.6	Confident	47 Å²	47	70.8 Å²	70.8	18%	0.177	36%	0.359	C	S	.	.	H	α-helix	trans	-55.9	-49.5	175.3	176.2	173.8	-72.7	135.8	-1.1	111.1	R36 N37 V42 L44 L66 G69 E70	R36-R40 PolarHBondContact O-N 3.43Å; N37-R40 WeakPolarHBondContact O-CB 3.42Å; N37-R40 PolarHBondContact O-N 2.92Å; R40-V42 PolarHBondContact O-N 3.02Å; R40-L44 HydrophobicContact CG-CD1 3.77Å; R40-L44 HydrophobicContact CG-CG 4.42Å; R40-L44 WeakPolarHBondContact O-CB 3.46Å; R40-L44 WeakPolarHBondContact O-CG 3.49Å; R40-L44 PolarHBondContact O-N 3.47Å; R40-L44 VanDerWaalsContact O-N 3.07Å; R40-L66 HydrophobicContact CB-CD2 4.05Å; R40-L66 VanDerWaalsContact CD-O 3.31Å; R40-L66 WeakPolarHBondContact CD-O 3.45Å; R40-L66 HydrophobicContact CG-CB 4.36Å; R40-L66 HydrophobicContact CG-CD2 4.18Å; R40-L66 PolarHBondContact NE-O 3.08Å; R40-G69 PolarHBondContact NH2-O 3.18Å; R40-E70 PolarHBondContact NH2-O 3.07Å
41	D	75.6	Confident	75.4	Confident	107 Å²	107	66.1 Å²	66.1	57%	0.572	35%	0.345	S	S	*	.	H	α-helix	trans	-59.5	-48.5	179.7	-72.4	-20.8	0	0	0	111.8	N37 L38 Y39 L44 E45	N37-D41 PolarHBondContact O-N 3.24Å; L38-D41 PolarHBondContact O-N 3.28Å; Y39-D41 PolarHBondContact O-N 3.24Å; D41-L44 PolarHBondContact O-N 3.07Å; D41-E45 WeakPolarHBondContact O-CB 3.37Å; D41-E45 PolarHBondContact O-N 3.21Å
42	V	80.2	Confident	75.4	Confident	59 Å²	59	69.5 Å²	69.5	36%	0.358	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-45.4	-179.4	170.2	0	0	0	0	112.2	L38 Y39 R40 L44 E45 N46	L38-V42 HydrophobicContact CD1-CG2 4.22Å; L38-V42 WeakPolarHBondContact O-CG2 3.49Å; L38-V42 PolarHBondContact O-N 2.84Å; Y39-V42 PolarHBondContact O-N 2.95Å; R40-V42 PolarHBondContact O-N 3.02Å; V42-L44 VanDerWaalsContact C-N 3.33Å; V42-L44 PolarHBondContact O-N 2.95Å; V42-E45 PolarHBondContact O-N 2.96Å; V42-N46 PolarHBondContact O-N 3.06Å; V42-N46 PolarHBondContact O-OD1 3.34Å
43	M	82.2	Confident	75.2	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-66.4	-36.8	-178.9	-67.3	-68.9	-84.8	0	0	111.6	F16 A20 V21 L22 Y39 Y47 I63 L66	F16-M43 HydrophobicContact CE1-CE 3.96Å; F16-M43 HydrophobicContact CZ-CE 3.74Å; F16-M43 HydrophobicContact CZ-SD 4.41Å; A20-M43 HydrophobicContact CB-CE 3.9Å; V21-M43 WeakPolarHBondContact O-CE 3.32Å; L22-M43 HydrophobicContact CD2-CE 4.29Å; Y39-M43 HydrophobicContact CD1-CG 4.09Å; Y39-M43 HydrophobicContact CD2-CG 4.07Å; Y39-M43 HydrophobicContact CE1-CG 3.97Å; Y39-M43 HydrophobicContact CE2-CE 4.38Å; Y39-M43 HydrophobicContact CE2-CG 3.95Å; Y39-M43 HydrophobicContact CE2-SD 4.31Å; Y39-M43 HydrophobicContact CG-CG 4.18Å; Y39-M43 WeakPolarHBondContact O-CB 3.34Å; Y39-M43 WeakPolarHBondContact O-CG 3.48Å; Y39-M43 PolarHBondContact O-N 3.21Å; M43-Y47 PolarHBondContact O-N 2.83Å; M43-Y47 VanDerWaalsContact O-N 3.07Å; M43-I63 HydrophobicContact CB-CD1 4.19Å; M43-I63 WeakPolarHBondContact O-CD1 3.42Å; M43-L66 HydrophobicContact CB-CD1 3.84Å; M43-L66 HydrophobicContact CG-CD1 4.4Å
44	L	79.8	Confident	74.3	Confident	19 Å²	19	71.9 Å²	71.9	10%	0.099	39%	0.388	C	S	.	.	H	α-helix	trans	-71.6	-32	174.2	-65.1	178	0	0	0	112.9	R40 D41 V42 R48 I63 L66 Q67	R40-L44 HydrophobicContact CG-CD1 3.77Å; R40-L44 HydrophobicContact CG-CG 4.42Å; R40-L44 WeakPolarHBondContact O-CB 3.46Å; R40-L44 WeakPolarHBondContact O-CG 3.49Å; R40-L44 PolarHBondContact O-N 3.47Å; R40-L44 VanDerWaalsContact O-N 3.07Å; D41-L44 PolarHBondContact O-N 3.07Å; V42-L44 VanDerWaalsContact C-N 3.33Å; V42-L44 PolarHBondContact O-N 2.95Å; L44-R48 WeakPolarHBondContact O-CB 3.32Å; L44-R48 WeakPolarHBondContact O-CD 3.32Å; L44-R48 VanDerWaalsContact O-CG 3.26Å; L44-R48 WeakPolarHBondContact O-CG 3.27Å; L44-R48 PolarHBondContact O-N 3.37Å; L44-R48 VanDerWaalsContact O-N 3.16Å; L44-I63 HydrophobicContact CD2-CD1 4.2Å; L44-I63 HydrophobicContact CD2-CG2 4.05Å; L44-L66 HydrophobicContact CD2-CB 4.25Å; L44-Q67 HydrophobicContact CD1-CG 4.36Å; L44-Q67 HydrophobicContact CD2-CG 3.47Å; L44-Q67 VanDerWaalsContact CD2-CG 3.47Å
45	E	79.8	Confident	73.8	Confident	117 Å²	117	71.3 Å²	71.3	55%	0.547	38%	0.377	S	S	.	.	H	α-helix	trans	-70.2	-45	172.4	-172.8	163.1	-156.1	0	0	111.4	D41 V42 Y47 R48 N49	D41-E45 WeakPolarHBondContact O-CB 3.37Å; D41-E45 PolarHBondContact O-N 3.21Å; V42-E45 PolarHBondContact O-N 2.96Å; E45-Y47 PolarHBondContact O-N 3.13Å; E45-R48 PolarHBondContact O-N 2.9Å; E45-N49 WeakPolarHBondContact O-CB 3.38Å; E45-N49 VanDerWaalsContact O-CG 3.23Å; E45-N49 PolarHBondContact O-N 3.43Å; E45-N49 PolarHBondContact O-ND2 3.03Å; E45-N49 VanDerWaalsContact O-ND2 3.15Å
46	N	77.7	Confident	73	Confident	47 Å²	47	73 Å²	73	25%	0.251	40%	0.396	S	S	.	.	H	α-helix	trans	-57.1	-47	174.8	-75.5	5.3	0	0	0	111.8	V19 V42 R48 N49 L50	V19-N46 HydrophobicContact CG2-CB 4.41Å; V19-N46 PolarHBondContact O-ND2 3.43Å; V42-N46 PolarHBondContact O-N 3.06Å; V42-N46 PolarHBondContact O-OD1 3.34Å; N46-R48 PolarHBondContact O-N 2.92Å; N46-N49 PolarHBondContact O-N 3.46Å; N46-L50 PolarHBondContact O-N 2.84Å
47	Y	79.7	Confident	72.1	Confident	32 Å²	32	73 Å²	73	13%	0.125	40%	0.398	C	S	.	.	H	α-helix	trans	-61.4	-44.5	176.3	179.7	-100.6	0	0	0	112.7	F16 M43 E45 N49 L50 V51 K59 P60 I63	F16-Y47 HydrophobicContact CD2-CD2 4.18Å; F16-Y47 HydrophobicContact CE2-CD2 4.46Å; M43-Y47 PolarHBondContact O-N 2.83Å; M43-Y47 VanDerWaalsContact O-N 3.07Å; E45-Y47 PolarHBondContact O-N 3.13Å; Y47-N49 VanDerWaalsContact C-N 3.29Å; Y47-N49 PolarHBondContact O-N 3.46Å; Y47-L50 PolarHBondContact O-N 2.84Å; Y47-V51 HydrophobicContact CD1-CG2 4.23Å; Y47-V51 HydrophobicContact CD2-CG2 4.48Å; Y47-V51 HydrophobicContact CE1-CG2 3.69Å; Y47-V51 HydrophobicContact CE2-CG2 3.96Å; Y47-V51 WeakPolarHBondContact O-CG2 3.36Å; Y47-V51 PolarHBondContact O-N 3.36Å; Y47-K59 HydrophobicContact CE1-CG 4.39Å; Y47-K59 HydrophobicContact CE2-CG 4.43Å; Y47-K59 WeakPolarHBondContact OH-CB 3.34Å; Y47-P60 HydrophobicContact CD2-CG 4.46Å; Y47-P60 VanDerWaalsContact CE2-CD 3.42Å; Y47-P60 HydrophobicContact CE2-CG 4.43Å; Y47-I63 HydrophobicContact CD1-CG2 3.77Å; Y47-I63 HydrophobicContact CD2-CG1 4.09Å; Y47-I63 HydrophobicContact CD2-CG2 4.25Å; Y47-I63 HydrophobicContact CE1-CG2 4.19Å; Y47-I63 HydrophobicContact CG-CB 4.49Å; Y47-I63 HydrophobicContact CG-CD1 4.44Å; Y47-I63 HydrophobicContact CG-CG1 4.05Å; Y47-I63 HydrophobicContact CG-CG2 3.8Å
48	R	77.4	Confident	71.5	Confident	157 Å²	157	75.4 Å²	75.4	59%	0.592	42%	0.416	S	S	*	.	H	α-helix	trans	-61.6	-37.8	176.4	-76.8	169.3	176.2	156.3	0.6	112	L44 E45 N46 S52	L44-R48 WeakPolarHBondContact O-CB 3.32Å; L44-R48 WeakPolarHBondContact O-CD 3.32Å; L44-R48 VanDerWaalsContact O-CG 3.26Å; L44-R48 WeakPolarHBondContact O-CG 3.27Å; L44-R48 PolarHBondContact O-N 3.37Å; L44-R48 VanDerWaalsContact O-N 3.16Å; E45-R48 PolarHBondContact O-N 2.9Å; N46-R48 PolarHBondContact O-N 2.92Å; R48-S52 VanDerWaalsContact O-CB 3.29Å; R48-S52 WeakPolarHBondContact O-CB 3.23Å; R48-S52 PolarHBondContact O-N 3.28Å; R48-S52 PolarHBondContact O-OG 3.06Å
49	N	74.1	Confident	71.5	Confident	86 Å²	86	74.5 Å²	74.5	46%	0.46	41%	0.407	S	S	.	.	H	α-helix	trans	-67.3	-43.8	177.3	-70.3	-31.1	0	0	0	111.3	E45 N46 Y47 S52 L53	E45-N49 WeakPolarHBondContact O-CB 3.38Å; E45-N49 VanDerWaalsContact O-CG 3.23Å; E45-N49 PolarHBondContact O-N 3.43Å; E45-N49 PolarHBondContact O-ND2 3.03Å; E45-N49 VanDerWaalsContact O-ND2 3.15Å; N46-N49 PolarHBondContact O-N 3.46Å; Y47-N49 VanDerWaalsContact C-N 3.29Å; Y47-N49 PolarHBondContact O-N 3.46Å; N49-S52 CarbonylContact O-C 3.54Å; N49-S52 WeakPolarHBondContact O-CB 3.35Å; N49-S52 PolarHBondContact O-N 3.4Å; N49-S52 VanDerWaalsContact O-N 3.16Å; N49-L53 PolarHBondContact O-N 3.15Å
50	L	68.8	Low	71.2	Confident	12 Å²	12	74.8 Å²	74.8	6%	0.063	41%	0.412	C	S	.	.	H	α-helix	trans	-60.9	-46.6	175	-78.7	175.1	0	0	0	113.1	F16 V19 N46 Y47 S52 L53 F57	F16-L50 HydrophobicContact CB-CD1 4.36Å; F16-L50 HydrophobicContact CD2-CD1 3.92Å; V19-L50 HydrophobicContact CG2-CD1 3.52Å; V19-L50 HydrophobicContact CG2-CG 4.19Å; N46-L50 PolarHBondContact O-N 2.84Å; Y47-L50 PolarHBondContact O-N 2.84Å; L50-S52 PolarHBondContact O-N 2.96Å; L50-L53 HydrophobicContact CD2-CD1 4.49Å; L50-L53 WeakPolarHBondContact O-CB 3.39Å; L50-L53 PolarHBondContact O-N 2.95Å; L50-F57 HydrophobicContact CB-CD2 4.4Å; L50-F57 HydrophobicContact CB-CE2 3.97Å; L50-F57 HydrophobicContact CD2-CE2 4.31Å
51	V	69.8	Low	70.9	Confident	70 Å²	70	79.3 Å²	79.3	42%	0.424	43%	0.433	S	S	.	.	H	α-helix	trans	-61.1	-35.2	174.4	172.8	0	0	0	0	111.1	Y47 L53 G54	Y47-V51 HydrophobicContact CD1-CG2 4.23Å; Y47-V51 HydrophobicContact CD2-CG2 4.48Å; Y47-V51 HydrophobicContact CE1-CG2 3.69Å; Y47-V51 HydrophobicContact CE2-CG2 3.96Å; Y47-V51 WeakPolarHBondContact O-CG2 3.36Å; Y47-V51 PolarHBondContact O-N 3.36Å; V51-L53 PolarHBondContact O-N 3.48Å; V51-G54 PolarHBondContact O-N 3.23Å; V51-G54 VanDerWaalsContact O-N 3.1Å
52	S	71.1	Confident	70.9	Confident	99 Å²	99	76 Å²	76	69%	0.692	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-8.7	177.6	-55.7	0	0	0	0	113.9	R48 N49 L50 G54	R48-S52 VanDerWaalsContact O-CB 3.29Å; R48-S52 WeakPolarHBondContact O-CB 3.23Å; R48-S52 PolarHBondContact O-N 3.28Å; R48-S52 PolarHBondContact O-OG 3.06Å; N49-S52 CarbonylContact O-C 3.54Å; N49-S52 WeakPolarHBondContact O-CB 3.35Å; N49-S52 PolarHBondContact O-N 3.4Å; N49-S52 VanDerWaalsContact O-N 3.16Å; L50-S52 PolarHBondContact O-N 2.96Å; S52-G54 VanDerWaalsContact C-N 3.32Å
53	L	68.4	Low	70.9	Confident	124 Å²	124	73.1 Å²	73.1	65%	0.649	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	0.7	170.2	-65.9	171.6	0	0	0	112.9	N49 L50 V51 L55	N49-L53 PolarHBondContact O-N 3.15Å; L50-L53 HydrophobicContact CD2-CD1 4.49Å; L50-L53 WeakPolarHBondContact O-CB 3.39Å; L50-L53 PolarHBondContact O-N 2.95Å; V51-L53 PolarHBondContact O-N 3.48Å; L53-L55 VanDerWaalsContact C-N 3.31Å; L53-L55 PolarHBondContact O-N 2.81Å
54	G	54.2	Low	70.8	Confident	67 Å²	67	74.7 Å²	74.7	69%	0.691	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	12.1	172.9	0	0	0	0	0	115.2	V51 S52	V51-G54 PolarHBondContact O-N 3.23Å; V51-G54 VanDerWaalsContact O-N 3.1Å; S52-G54 VanDerWaalsContact C-N 3.32Å
55	L	55.4	Low	70.6	Confident	78 Å²	78	74.6 Å²	74.6	41%	0.408	41%	0.409	S	S	.	.			trans	-81.5	134	177.3	-66.3	172.7	0	0	0	110.6	L53 F57	L53-L55 VanDerWaalsContact C-N 3.31Å; L53-L55 PolarHBondContact O-N 2.81Å; L55-F57 HydrophobicContact CB-CD2 4Å; L55-F57 HydrophobicContact CB-CE1 4.38Å; L55-F57 HydrophobicContact CB-CE2 3.39Å; L55-F57 HydrophobicContact CB-CZ 3.62Å; L55-F57 HydrophobicContact CD1-CE2 3.95Å; L55-F57 HydrophobicContact CD1-CZ 3.67Å; L55-F57 HydrophobicContact CG-CE2 4.31Å; L55-F57 HydrophobicContact CG-CZ 4.29Å; L55-F57 PolarHBondContact O-N 3.05Å; L55-F57 VanDerWaalsContact O-N 3.13Å
56	P	50.9	Low	70.6	Confident	131 Å²	131	69.1 Å²	69.1	85%	0.851	38%	0.384	S	S	*	.			trans	-77.9	98.3	-178.8	30.8	-33.8	0	0	0	111
57	F	60.9	Low	70.7	Confident	65 Å²	65	71.3 Å²	71.3	29%	0.285	39%	0.392	S	S	.	.			trans	-110.3	137.2	176.6	-61.9	-62.6	0	0	0	112.4	L14 L50 L55	L14-F57 WeakPolarHBondContact O-CE1 3.26Å; L14-F57 WeakPolarHBondContact O-CZ 3.42Å; L50-F57 HydrophobicContact CB-CD2 4.4Å; L50-F57 HydrophobicContact CB-CE2 3.97Å; L50-F57 HydrophobicContact CD2-CE2 4.31Å; L55-F57 HydrophobicContact CB-CD2 4Å; L55-F57 HydrophobicContact CB-CE1 4.38Å; L55-F57 HydrophobicContact CB-CE2 3.39Å; L55-F57 HydrophobicContact CB-CZ 3.62Å; L55-F57 HydrophobicContact CD1-CE2 3.95Å; L55-F57 HydrophobicContact CD1-CZ 3.67Å; L55-F57 HydrophobicContact CG-CE2 4.31Å; L55-F57 HydrophobicContact CG-CZ 4.29Å; L55-F57 PolarHBondContact O-N 3.05Å; L55-F57 VanDerWaalsContact O-N 3.13Å
58	T	58.9	Low	70.3	Confident	136 Å²	136	76.6 Å²	76.6	83%	0.834	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-68.9	133.2	159.8	46.6	0	0	0	0	109.2	P60	T58-P60 VanDerWaalsContact O-CD 3.24Å; T58-P60 WeakPolarHBondContact O-CD 3.47Å
59	K	74.4	Confident	69.8	Low	91 Å²	91	71.4 Å²	71.4	40%	0.396	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-65.2	117.1	-175.1	-177.2	-173.1	178	-159.4	0	110.9	Y47 I63 S64	Y47-K59 HydrophobicContact CE1-CG 4.39Å; Y47-K59 HydrophobicContact CE2-CG 4.43Å; Y47-K59 WeakPolarHBondContact OH-CB 3.34Å; K59-I63 HydrophobicContact CG-CG2 4.25Å; K59-S64 WeakPolarHBondContact CD-OG 3.41Å; K59-S64 WeakPolarHBondContact CE-OG 3.41Å; K59-S64 PolarHBondContact NZ-OG 3.34Å
60	P	76.8	Confident	69.7	Low	24 Å²	24	70.4 Å²	70.4	16%	0.156	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-60.9	141.4	-176.5	-25	34.5	0	0	0	113	F16 Y47 T58 V62 I63 S64	F16-P60 HydrophobicContact CB-CG 3.79Å; F16-P60 HydrophobicContact CD1-CB 4Å; F16-P60 HydrophobicContact CD1-CG 3.72Å; F16-P60 HydrophobicContact CD2-CG 4.28Å; F16-P60 HydrophobicContact CE1-CB 4.45Å; F16-P60 HydrophobicContact CE1-CG 4.45Å; F16-P60 HydrophobicContact CG-CB 4.42Å; F16-P60 HydrophobicContact CG-CG 3.63Å; Y47-P60 HydrophobicContact CD2-CG 4.46Å; Y47-P60 VanDerWaalsContact CE2-CD 3.42Å; Y47-P60 HydrophobicContact CE2-CG 4.43Å; T58-P60 VanDerWaalsContact O-CD 3.24Å; T58-P60 WeakPolarHBondContact O-CD 3.47Å; P60-V62 VanDerWaalsContact C-N 3.27Å; P60-V62 PolarHBondContact O-N 2.84Å; P60-I63 HydrophobicContact CB-CB 4.48Å; P60-I63 HydrophobicContact CB-CG1 4.25Å; P60-I63 HydrophobicContact CG-CG1 4.38Å; P60-I63 WeakPolarHBondContact O-CA 3.48Å; P60-I63 WeakPolarHBondContact O-CB 3.4Å; P60-I63 PolarHBondContact O-N 2.7Å; P60-S64 PolarHBondContact O-N 3.41Å; P60-S64 VanDerWaalsContact O-N 3.15Å
61	K	73.7	Confident	69.6	Low	143 Å²	143	73.1 Å²	73.1	62%	0.622	42%	0.421	S	S	*	.	H	α-helix	trans	-57.1	-39.7	-177.1	-167.2	176.3	179	-174	0	112.2	I63 S64 L65	K61-I63 VanDerWaalsContact C-N 3.33Å; K61-I63 PolarHBondContact O-N 2.95Å; K61-S64 WeakPolarHBondContact O-CB 3.46Å; K61-S64 PolarHBondContact O-N 3.07Å; K61-S64 VanDerWaalsContact O-N 3.14Å; K61-L65 PolarHBondContact O-N 3.42Å
62	V	74.3	Confident	69.5	Low	36 Å²	36	70.3 Å²	70.3	22%	0.218	40%	0.404	C	S	.	.	H	α-helix	trans	-58.3	-40.8	174	173.6	0	0	0	0	112.2	P60 L65 L66 P72	P60-V62 VanDerWaalsContact C-N 3.27Å; P60-V62 PolarHBondContact O-N 2.84Å; V62-L65 PolarHBondContact O-N 2.97Å; V62-L66 HydrophobicContact CG1-CD1 3.89Å; V62-L66 HydrophobicContact CG1-CG 4.36Å; V62-L66 VanDerWaalsContact O-CB 3.31Å; V62-L66 WeakPolarHBondContact O-CB 3.46Å; V62-L66 VanDerWaalsContact O-CG 3.24Å; V62-L66 WeakPolarHBondContact O-CG 3.37Å; V62-L66 PolarHBondContact O-N 3.42Å; V62-P72 HydrophobicContact CG1-CB 4.21Å
63	I	80.8	Confident	69	Low	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-68	-36.1	176.7	-68.1	-58.5	0	0	0	111.4	F16 M43 L44 Y47 K59 P60 K61 Q67	F16-I63 HydrophobicContact CE1-CD1 4.36Å; F16-I63 HydrophobicContact CE1-CG1 4.15Å; F16-I63 HydrophobicContact CE2-CD1 3.84Å; F16-I63 HydrophobicContact CE2-CG1 3.92Å; F16-I63 HydrophobicContact CZ-CD1 3.52Å; F16-I63 HydrophobicContact CZ-CG1 3.69Å; M43-I63 HydrophobicContact CB-CD1 4.19Å; M43-I63 WeakPolarHBondContact O-CD1 3.42Å; L44-I63 HydrophobicContact CD2-CD1 4.2Å; L44-I63 HydrophobicContact CD2-CG2 4.05Å; Y47-I63 HydrophobicContact CD1-CG2 3.77Å; Y47-I63 HydrophobicContact CD2-CG1 4.09Å; Y47-I63 HydrophobicContact CD2-CG2 4.25Å; Y47-I63 HydrophobicContact CE1-CG2 4.19Å; Y47-I63 HydrophobicContact CG-CB 4.49Å; Y47-I63 HydrophobicContact CG-CD1 4.44Å; Y47-I63 HydrophobicContact CG-CG1 4.05Å; Y47-I63 HydrophobicContact CG-CG2 3.8Å; K59-I63 HydrophobicContact CG-CG2 4.25Å; P60-I63 HydrophobicContact CB-CB 4.48Å; P60-I63 HydrophobicContact CB-CG1 4.25Å; P60-I63 HydrophobicContact CG-CG1 4.38Å; P60-I63 WeakPolarHBondContact O-CA 3.48Å; P60-I63 WeakPolarHBondContact O-CB 3.4Å; P60-I63 PolarHBondContact O-N 2.7Å; K61-I63 VanDerWaalsContact C-N 3.33Å; K61-I63 PolarHBondContact O-N 2.95Å; I63-Q67 VanDerWaalsContact O-CG 3.28Å; I63-Q67 WeakPolarHBondContact O-CG 3.43Å; I63-Q67 PolarHBondContact O-N 3.31Å
64	S	80.3	Confident	67.9	Low	34 Å²	34	71 Å²	71	24%	0.238	39%	0.386	C	S	.	.	H	α-helix	trans	-65	-48.9	173.8	-71.3	0	0	0	0	112.4	K59 P60 K61 L66 Q67 Q68	K59-S64 WeakPolarHBondContact CD-OG 3.41Å; K59-S64 WeakPolarHBondContact CE-OG 3.41Å; K59-S64 PolarHBondContact NZ-OG 3.34Å; P60-S64 PolarHBondContact O-N 3.41Å; P60-S64 VanDerWaalsContact O-N 3.15Å; K61-S64 WeakPolarHBondContact O-CB 3.46Å; K61-S64 PolarHBondContact O-N 3.07Å; K61-S64 VanDerWaalsContact O-N 3.14Å; S64-L66 VanDerWaalsContact C-N 3.35Å; S64-L66 PolarHBondContact O-N 3.46Å; S64-Q67 PolarHBondContact O-N 3.23Å; S64-Q68 WeakPolarHBondContact O-CG 3.3Å; S64-Q68 PolarHBondContact O-N 3.2Å; S64-Q68 PolarHBondContact O-OE1 2.84Å
65	L	76.4	Confident	67.1	Low	18 Å²	18	72.6 Å²	72.6	9%	0.094	38%	0.382	C	S	.	.	H	α-helix	trans	-58.7	-45.2	175.9	-67.7	174.2	0	0	0	111.7	K61 V62 Q67 Q68 G69 E70	K61-L65 PolarHBondContact O-N 3.42Å; V62-L65 PolarHBondContact O-N 2.97Å; L65-Q67 VanDerWaalsContact C-N 3.31Å; L65-Q67 PolarHBondContact O-N 3.18Å; L65-Q68 PolarHBondContact O-N 3.37Å; L65-Q68 VanDerWaalsContact O-N 3.12Å; L65-G69 PolarHBondContact O-N 2.77Å; L65-E70 HydrophobicContact CB-CB 4.38Å; L65-E70 HydrophobicContact CD2-CB 4.37Å; L65-E70 PolarHBondContact O-N 3.24Å
66	L	77.9	Confident	66.4	Low	1 Å²	1	77.2 Å²	77.2	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-63.6	-32.4	177.9	-75.8	175.3	0	0	0	113.2	Y39 R40 M43 L44 V62 S64 G69 P72	Y39-L66 HydrophobicContact CD1-CD1 4.39Å; Y39-L66 HydrophobicContact CD1-CD2 4.37Å; Y39-L66 HydrophobicContact CE1-CD1 3.97Å; Y39-L66 HydrophobicContact CE1-CD2 4.31Å; R40-L66 HydrophobicContact CB-CD2 4.05Å; R40-L66 VanDerWaalsContact CD-O 3.31Å; R40-L66 WeakPolarHBondContact CD-O 3.45Å; R40-L66 HydrophobicContact CG-CB 4.36Å; R40-L66 HydrophobicContact CG-CD2 4.18Å; R40-L66 PolarHBondContact NE-O 3.08Å; M43-L66 HydrophobicContact CB-CD1 3.84Å; M43-L66 HydrophobicContact CG-CD1 4.4Å; L44-L66 HydrophobicContact CD2-CB 4.25Å; V62-L66 HydrophobicContact CG1-CD1 3.89Å; V62-L66 HydrophobicContact CG1-CG 4.36Å; V62-L66 VanDerWaalsContact O-CB 3.31Å; V62-L66 WeakPolarHBondContact O-CB 3.46Å; V62-L66 VanDerWaalsContact O-CG 3.24Å; V62-L66 WeakPolarHBondContact O-CG 3.37Å; V62-L66 PolarHBondContact O-N 3.42Å; S64-L66 VanDerWaalsContact C-N 3.35Å; S64-L66 PolarHBondContact O-N 3.46Å; L66-G69 PolarHBondContact O-N 2.78Å; L66-P72 HydrophobicContact CD2-CG 4Å; L66-P72 HydrophobicContact CG-CG 4.4Å
67	Q	79.9	Confident	65.4	Low	93 Å²	93	78.6 Å²	78.6	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-72.8	-31.7	173.1	-74.6	177.9	0.2	0	0	113	L44 I63 S64 L65 G69	L44-Q67 HydrophobicContact CD1-CG 4.36Å; L44-Q67 HydrophobicContact CD2-CG 3.47Å; L44-Q67 VanDerWaalsContact CD2-CG 3.47Å; I63-Q67 VanDerWaalsContact O-CG 3.28Å; I63-Q67 WeakPolarHBondContact O-CG 3.43Å; I63-Q67 PolarHBondContact O-N 3.31Å; S64-Q67 PolarHBondContact O-N 3.23Å; L65-Q67 VanDerWaalsContact C-N 3.31Å; L65-Q67 PolarHBondContact O-N 3.18Å; Q67-G69 PolarHBondContact O-N 2.84Å
68	Q	72.8	Confident	63.9	Low	144 Å²	144	81.4 Å²	81.4	67%	0.673	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-2.9	175.5	-70.4	167.7	-43.7	0	0	113.1	S64 L65 E70	S64-Q68 WeakPolarHBondContact O-CG 3.3Å; S64-Q68 PolarHBondContact O-N 3.2Å; S64-Q68 PolarHBondContact O-OE1 2.84Å; L65-Q68 PolarHBondContact O-N 3.37Å; L65-Q68 VanDerWaalsContact O-N 3.12Å; Q68-E70 VanDerWaalsContact C-N 3.29Å; Q68-E70 HydrophobicContact CB-CG 4.24Å
69	G	66.6	Low	62.5	Low	47 Å²	47	81.2 Å²	81.2	49%	0.485	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	2.5	-177.9	0	0	0	0	0	114.1	R40 L65 L66 Q67	R40-G69 PolarHBondContact NH2-O 3.18Å; L65-G69 PolarHBondContact O-N 2.77Å; L66-G69 PolarHBondContact O-N 2.78Å; Q67-G69 PolarHBondContact O-N 2.84Å
70	E	71.2	Confident	60.3	Low	66 Å²	66	82.5 Å²	82.5	31%	0.308	44%	0.437	S	S	.	.			trans	-81.2	163	-178.5	-59.3	-128.7	119.1	0	0	112.9	R40 L65 Q68 K74	R40-E70 PolarHBondContact NH2-O 3.07Å; L65-E70 HydrophobicContact CB-CB 4.38Å; L65-E70 HydrophobicContact CD2-CB 4.37Å; L65-E70 PolarHBondContact O-N 3.24Å; Q68-E70 VanDerWaalsContact C-N 3.29Å; Q68-E70 HydrophobicContact CB-CG 4.24Å; E70-K74 IonicContact OE1-NZ 2.91Å; E70-K74 PolarHBondContact OE1-NZ 2.91Å; E70-K74 WeakPolarHBondContact OE2-CD 3.33Å; E70-K74 IonicContact OE2-NZ 2.63Å
71	D	67.5	Low	57.9	Low	69 Å²	69	85.1 Å²	85.1	37%	0.369	47%	0.468	S	S	.	.			trans	-72	144.5	170	-85.6	-33.1	0	0	0	110.5	W28 W73	W28-D71 VanDerWaalsContact NE1-CG 3.32Å; W28-D71 PolarHBondContact NE1-OD1 2.69Å; D71-W73 PolarHBondContact O-N 3.43Å
72	P	66.4	Low	55.6	Low	10 Å²	10	85.4 Å²	85.4	7%	0.065	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-14.4	-179.4	-27.9	36.2	0	0	0	116.8	W28 Y39 V62 L66	W28-P72 HydrophobicContact CH2-CG 4.3Å; W28-P72 HydrophobicContact CZ2-CG 4.14Å; Y39-P72 HydrophobicContact CE1-CG 3.95Å; V62-P72 HydrophobicContact CG1-CB 4.21Å; L66-P72 HydrophobicContact CD2-CG 4Å; L66-P72 HydrophobicContact CG-CG 4.4Å
73	W	61.8	Low	53.4	Low	125 Å²	125	88.5 Å²	88.5	47%	0.473	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	29.9	-166.8	-63.7	110.1	0	0	0	113.6	F23 D71	F23-W73 VanDerWaalsContact O-CE2 3.23Å; F23-W73 WeakPolarHBondContact O-CZ2 3.12Å; F23-W73 PolarHBondContact O-NE1 3.24Å; D71-W73 PolarHBondContact O-N 3.43Å
74	K	45.9	Very low	50.9	Low	113 Å²	113	92.8 Å²	92.8	49%	0.491	53%	0.529	S	S	.	.			trans	-89.9	146.9	168.4	-95	-174.9	170.2	-168.7	0	111.2	E70	E70-K74 IonicContact OE1-NZ 2.91Å; E70-K74 PolarHBondContact OE1-NZ 2.91Å; E70-K74 WeakPolarHBondContact OE2-CD 3.33Å; E70-K74 IonicContact OE2-NZ 2.63Å
75	V	37.3	Very low	48.5	Very low	101 Å²	101	99.4 Å²	99.4	61%	0.612	56%	0.561	S	S	*	*			trans	70.6	76.8	-177.7	-164.1	0	0	0	0	114.5
76	E	39.8	Very low	46.1	Very low	174 Å²	174	102.4 Å²	102.4	81%	0.813	60%	0.596	S	S	*	*				-100	159.3	124.4	-71	176.8	149.4	0	0	107.4
77	K	30.3	Very low	43.6	Very low	160 Å²	160	108.2 Å²	108.2	70%	0.696	64%	0.635	S	S	*	*			trans	85.7	128.5	-157.5	-63.2	-163.5	137.3	-70.1	0	114.7
78	D	29.4	Very low	41	Very low	125 Å²	125	112.5 Å²	112.5	67%	0.668	65%	0.653	S	S	*	*			cis	-149.8	140.6	-13.4	-77.7	-50.4	0	0	0	107.8
79	S	28.4	Very low	38.8	Very low	131 Å²	131	111.1 Å²	111.1	92%	0.916	66%	0.659	S	S	*	*	S	Bend	trans	-173.3	50.6	159.6	45.3	0	0	0	0	115.9
80	S	28.1	Very low	36.7	Very low	119 Å²	119	115.2 Å²	115.2	83%	0.832	68%	0.675	S	S	*	*	S	Bend	trans	-160.8	132.1	148.6	57	0	0	0	0	108.7
81	G	26.5	Very low	35.3	Very low	79 Å²	79	117 Å²	117	81%	0.814	69%	0.692	S	S	*	*			trans	-80.2	149.4	179	0	0	0	0	0	112.2
82	D	26.2	Very low	33.3	Very low	149 Å²	149	122.9 Å²	122.9	80%	0.797	71%	0.714	S	S	*	*				168	145.7	96.6	-165.6	-3.3	0	0	0	110.2
83	S	28.6	Very low	31.2	Very low	100 Å²	100	130 Å²	130	70%	0.699	75%	0.749	S	S	*	*			trans	57.8	152	157	-72.6	0	0	0	0	121
84	S	28.2	Very low	29.4	Very low	90 Å²	90	129.9 Å²	129.9	63%	0.629	76%	0.762	S	S	*	*			cis	-165.1	162.9	-28.8	63.7	0	0	0	0	108.5
85	L	30.4	Very low	28.5	Very low	174 Å²	174	133.5 Å²	133.5	91%	0.911	78%	0.778	S	S	*	*			trans	63.5	126.8	170	-50.2	171.9	0	0	0	115.1
86	G	25.2	Very low	27.9	Very low	80 Å²	80	133.7 Å²	133.7	83%	0.825	78%	0.783	S	S	*	*				108	139.2	71.3	0	0	0	0	0	108.8
87	C	25.1	Very low	27.2	Very low	123 Å²	123	130.4 Å²	130.4	83%	0.831	78%	0.776	S	S	*	*			cis	-146.1	-166.5	7.6	-162.1	0	0	0	0	111.2
88	K	25.5	Very low	27.2	Very low	183 Å²	183	130.4 Å²	130.4	80%	0.796	78%	0.778	S	S	*	*			trans	-66.3	164.6	-180	-60.3	154.8	-173.4	172	0	110.6
89	S	27.3	Very low	27.1	Very low	115 Å²	115	129.6 Å²	129.6	80%	0.804	78%	0.778	S	S	*	*				-166.6	164.9	53.7	-66.1	0	0	0	0	115.3
90	T	21.5	Very low	27.2	Very low	133 Å²	133	130.7 Å²	130.7	82%	0.816	77%	0.768	S	S	*	*			trans	-120	-164.2	165.5	52.2	0	0	0	0	108.7
91	P	41.1	Very low	27.1	Very low	105 Å²	105	131.1 Å²	131.1	68%	0.682	76%	0.761	S	S	*	*				-128.2	177.6	-72.1	38.4	-23.5	0	0	0	113
92	K	25.5	Very low	27.1	Very low	191 Å²	191	131.6 Å²	131.6	83%	0.83	75%	0.752	S	S	*	*			trans	169.6	132.9	140.5	-93.5	154.2	-172.3	178.9	0	110.1
93	M	22.6	Very low	27	Very low	159 Å²	159	133.2 Å²	133.2	78%	0.783	75%	0.752	S	S	*	*				64.5	136.2	82.5	-61.7	-85.5	95.8	0	0	112.5
94	T	25.1	Very low	27.3	Very low	123 Å²	123	137.6 Å²	137.6	76%	0.755	76%	0.762	S	S	*	*			cis	-144.7	161.6	43.1	43.3	0	0	0	0	117
95	K	27.3	Very low	27.5	Very low	190 Å²	190	142 Å²	142	83%	0.826	77%	0.772	S	S	*	*			trans	17.2	147.7	141.3	-57.8	178.9	-179.4	179.8	0	119.6
96	S	23.2	Very low	27.6	Very low	104 Å²	104	141.5 Å²	141.5	73%	0.727	77%	0.766	S	S	*	*			cis	-152.6	161.2	36.7	-155.3	0	0	0	0	116.2
97	T	26.1	Very low	27.7	Very low	106 Å²	106	146.7 Å²	146.7	65%	0.65	77%	0.771	S	S	*	*			trans	-43.8	171.5	159.3	27.4	0	0	0	0	115.5
98	Q	29.9	Very low	28	Very low	160 Å²	160	151.8 Å²	151.8	75%	0.748	77%	0.772	S	S	*	*			cis	-158.2	169.6	18.9	-120.2	138.4	-69.7	0	0	106.2
99	T	27.7	Very low	28.1	Very low	107 Å²	107	152.6 Å²	152.6	66%	0.656	78%	0.776	S	S	*	*			cis	-172.9	-176.5	-22.7	30.5	0	0	0	0	104.9
100	Q	29.6	Very low	28	Very low	155 Å²	155	158.4 Å²	158.4	72%	0.724	78%	0.78	S	S	*	*			cis	-165.1	173.6	-4.6	-121.8	166.7	-72.9	0	0	106.4
101	D	27.1	Very low	28.2	Very low	128 Å²	128	159.6 Å²	159.6	68%	0.684	78%	0.781	S	S	*	*			cis	-159.4	-177.1	-6.7	-147.5	-32.2	0	0	0	110
102	S	25.2	Very low	27.4	Very low	89 Å²	89	164.1 Å²	164.1	62%	0.622	79%	0.79	S	S	*	*			trans	59.6	104.8	145.1	-165	0	0	0	0	121.4
103	F	25.7	Very low	27.3	Very low	182 Å²	182	166.3 Å²	166.3	80%	0.798	79%	0.793	S	S	*	*	S	Bend		-162.6	40	119.6	-132.1	-87.6	0	0	0	115.5
104	Q	34.3	Very low	27.3	Very low	193 Å²	193	164.6 Å²	164.6	90%	0.902	79%	0.791	S	S	*	*	S	Bend	trans	-123.2	-7.4	176.2	-76	-161.6	-18.5	0	0	116.3	Q106	Q104-Q106 VanDerWaalsContact C-N 3.32Å; Q104-Q106 PolarHBondContact O-N 3.46Å
105	E	32.6	Very low	27.4	Very low	181 Å²	181	165.8 Å²	165.8	85%	0.846	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	20.4	-171.3	-158.2	70.4	-129.1	0	0	114.5
106	Q	31.3	Very low	27.7	Very low	165 Å²	165	161.9 Å²	161.9	77%	0.771	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	-2.2	-172.2	-143.1	178.5	11	0	0	116.6	Q104	Q104-Q106 VanDerWaalsContact C-N 3.32Å; Q104-Q106 PolarHBondContact O-N 3.46Å
107	M	28.1	Very low	27.6	Very low	189 Å²	189	166.3 Å²	166.3	93%	0.931	78%	0.783	S	S	*	*	S	Bend	trans	-114.7	23.2	179.8	-82.7	-69.2	-170.6	0	0	114.5
108	R	32.3	Very low	27.4	Very low	230 Å²	230	168.8 Å²	168.8	87%	0.868	79%	0.792	S	S	*	*	S	Bend	trans	-134.4	72.7	172.9	-79.4	-175	169.5	175.6	-2.8	112.7
109	K	26.9	Very low	26.9	Very low	200 Å²	200	169.4 Å²	169.4	87%	0.87	79%	0.792	S	S	*	*			trans	175.4	105.8	150	-94.4	144.6	-170	171.8	0	111.4
110	R	25.8	Very low	26.7	Very low	236 Å²	236	171.6 Å²	171.6	89%	0.891	80%	0.799	S	S	*	*			trans	-169	106.1	142.1	-109.3	171.9	-172.6	-164.7	0.6	110.2
111	L	24.4	Very low	26.6	Very low	159 Å²	159	168.5 Å²	168.5	83%	0.832	79%	0.792	S	S	*	*			trans	66.2	129.3	160.9	-59.8	135.5	0	0	0	115.9
112	K	24.8	Very low	26.5	Very low	199 Å²	199	171.7 Å²	171.7	87%	0.865	80%	0.803	S	S	*	*			cis	50.7	114.1	15.5	-68.6	-167.1	176.3	-170	0	112.8
113	R	22.9	Very low	26.4	Very low	238 Å²	238	179.2 Å²	179.2	90%	0.898	82%	0.818	S	S	*	*			cis	-133.1	-173.8	37.2	-131	-175.9	-66.9	-157.9	1	108.3
114	V	23.5	Very low	27.4	Very low	123 Å²	123	175.2 Å²	175.2	75%	0.745	81%	0.81	S	S	*	*			cis	-141.6	156	12.4	-170.7	0	0	0	0	109.5
115	E	25.8	Very low	26.7	Very low	147 Å²	147	171.8 Å²	171.8	69%	0.687	81%	0.806	S	S	*	*			trans	-129	150.8	153.6	-129.5	-162.2	-115.1	0	0	106.3	W117	E115-W117 PolarHBondContact OE2-NE1 3.27Å
116	P	34.1	Very low	26.4	Very low	108 Å²	108	169.5 Å²	169.5	70%	0.701	80%	0.798	S	S	*	*				-148.9	157.1	66.3	37	-16.2	0	0	0	118.5
117	W	22	Very low	25.8	Very low	198 Å²	198	170.2 Å²	170.2	75%	0.75	80%	0.795	S	S	*	*			trans	36.9	129.2	138.4	-64.9	70.3	0	0	0	123.4	E115	E115-W117 PolarHBondContact OE2-NE1 3.27Å
118	N	20.6	Very low	25.8	Very low	158 Å²	158	170 Å²	170	85%	0.845	79%	0.792	S	S	*	*				-167.9	163.4	107.5	-103.2	-29.3	0	0	0	115.3
119	F	20.3	Very low	25.4	Very low	172 Å²	172	166 Å²	166	75%	0.754	78%	0.783	S	S	*	*			trans	-74.1	173.2	172	-119.6	-131.5	0	0	0	110.7	P121	F119-P121 VanDerWaalsContact CD1-CD 3.43Å; F119-P121 HydrophobicContact CD1-CG 4.46Å; F119-P121 HydrophobicContact CE1-CG 4.13Å
120	I	22.7	Very low	25.2	Very low	154 Å²	154	166.8 Å²	166.8	79%	0.79	79%	0.786	S	S	*	*			cis	-149.4	149.4	48.1	-72.8	172.2	0	0	0	110.7
121	P	29.2	Very low	25.2	Very low	90 Å²	90	162.6 Å²	162.6	58%	0.584	78%	0.781	S	S	*	*			trans	-92.4	148.2	169.8	35.9	-34.2	0	0	0	113.9	F119	F119-P121 VanDerWaalsContact CD1-CD 3.43Å; F119-P121 HydrophobicContact CD1-CG 4.46Å; F119-P121 HydrophobicContact CE1-CG 4.13Å
122	E	23.1	Very low	25.4	Very low	195 Å²	195	163 Å²	163	91%	0.911	78%	0.776	S	S	*	*			trans	-105.8	164.3	160.5	-72.7	-154.9	139.7	0	0	112.6
123	R	24.6	Very low	25.4	Very low	247 Å²	247	163.4 Å²	163.4	93%	0.932	78%	0.778	S	S	*	*			trans	-120.8	176.4	-160.9	-104.5	-159.2	174.8	-162.3	2.4	113.3
124	P	45.2	Very low	25.5	Very low	97 Å²	97	160.2 Å²	160.2	63%	0.63	77%	0.773	S	S	*	*			trans	-110.1	171.3	-156.2	42	-37.5	0	0	0	115.9
125	C	20.5	Very low	25.7	Very low	121 Å²	121	162.9 Å²	162.9	82%	0.818	78%	0.777	S	S	*	*			trans	-137.1	120.6	150.2	-125.8	0	0	0	0	106.6
126	I	25.5	Very low	25.8	Very low	133 Å²	133	162.5 Å²	162.5	68%	0.682	78%	0.78	S	S	*	*				75	108.8	51.5	-58.7	168.3	0	0	0	112
127	Y	20.3	Very low	25.4	Very low	180 Å²	180	167.1 Å²	167.1	71%	0.706	79%	0.789	S	S	*	*				-167.8	118	106.7	-157.9	-107.3	0	0	0	110.9	E129	Y127-E129 HydrophobicContact CD1-CB 4.39Å; Y127-E129 HydrophobicContact CE1-CB 3.69Å; Y127-E129 PolarHBondContact OH-OE2 3.34Å; Y127-E129 VanDerWaalsContact OH-OE2 3.1Å
128	E	26.9	Very low	25.6	Very low	186 Å²	186	165.4 Å²	165.4	87%	0.869	79%	0.794	S	S	*	*			trans	-92.3	125.6	156.6	-72.3	-168.2	132.3	0	0	107.5
129	E	23.6	Very low	26	Very low	146 Å²	146	165.5 Å²	165.5	68%	0.682	79%	0.79	S	S	*	*			trans	-179.9	117.5	141	-107.8	-178.7	164.7	0	0	112.7	Y127	Y127-E129 HydrophobicContact CD1-CB 4.39Å; Y127-E129 HydrophobicContact CE1-CB 3.69Å; Y127-E129 PolarHBondContact OH-OE2 3.34Å; Y127-E129 VanDerWaalsContact OH-OE2 3.1Å
130	K	24.4	Very low	26.2	Very low	215 Å²	215	163.5 Å²	163.5	94%	0.935	79%	0.787	S	S	*	*				-165	93.6	123.1	-108	160.2	-173.6	166.6	0	110.6
131	L	24.4	Very low	26.3	Very low	148 Å²	148	163.9 Å²	163.9	78%	0.775	79%	0.79	S	S	*	*			trans	-70.9	151.1	178.1	-157.6	76.2	0	0	0	111.1
132	K	28.3	Very low	26.2	Very low	167 Å²	167	167.5 Å²	167.5	73%	0.726	80%	0.799	S	S	*	*			trans	40.2	100	157.4	-75.4	169.6	-179.5	179.1	0	118.3
133	K	24.8	Very low	26.3	Very low	209 Å²	209	165.5 Å²	165.5	91%	0.909	79%	0.793	S	S	*	*			trans	-169.2	126.7	137	-101.6	155	-172.8	-179.5	0	107.5
134	Q	24.9	Very low	26.2	Very low	170 Å²	170	162.7 Å²	162.7	79%	0.794	79%	0.788	S	S	*	*			cis	-122.2	145	-0.7	-64.8	163.1	-80.1	0	0	110.2
135	Q	28	Very low	25.2	Very low	180 Å²	180	163 Å²	163	84%	0.841	79%	0.792	S	S	*	*			trans	-83.4	119.8	144.9	-74.8	172.1	-95.8	0	0	106.1
136	D	27.8	Very low	25.4	Very low	139 Å²	139	163.2 Å²	163.2	74%	0.743	79%	0.79	S	S	*	*			trans	-161.2	156.3	155.7	-114.4	-38.5	0	0	0	110.2
137	K	27.2	Very low	25.3	Very low	204 Å²	204	161.3 Å²	161.3	89%	0.887	79%	0.793	S	S	*	*			trans	61	51.4	-176.7	-56	179.4	-178.1	176.9	0	114.7
138	N	25.6	Very low	25.6	Very low	162 Å²	162	161.3 Å²	161.3	87%	0.866	80%	0.8	S	S	*	*			trans	-80.9	110.4	144.3	173.5	41.6	0	0	0	108.6
139	E	28.2	Very low	25.8	Very low	161 Å²	161	159 Å²	159	75%	0.752	80%	0.798	S	S	*	*			trans	-160.3	150.5	155	-132	-176.3	-126.2	0	0	111.8
140	N	24.3	Very low	26	Very low	129 Å²	129	161.3 Å²	161.3	69%	0.69	81%	0.806	S	S	*	*			trans	62.5	118.5	177.5	-63.7	-75.9	0	0	0	115.3
141	L	26.1	Very low	26.2	Very low	162 Å²	162	159.2 Å²	159.2	85%	0.848	80%	0.803	S	S	*	*			cis	-151.1	163.1	42.3	-149.7	70.3	0	0	0	113.2
142	Q	25.8	Very low	26.3	Very low	166 Å²	166	159.8 Å²	159.8	78%	0.776	81%	0.806	S	S	*	*			trans	-65.3	153.4	-173.5	-67.7	178.9	-29.3	0	0	115.6
143	I	25.3	Very low	26.1	Very low	154 Å²	154	157.8 Å²	157.8	79%	0.79	81%	0.808	S	S	*	*			trans	-89.2	131.5	164.1	-59	174.1	0	0	0	108.8
144	F	23.1	Very low	26.1	Very low	188 Å²	188	154.2 Å²	154.2	83%	0.825	80%	0.803	S	S	*	*			trans	-108	111.7	156	-96.4	-84.9	0	0	0	109.5
145	S	23.8	Very low	26.1	Very low	104 Å²	104	153 Å²	153	73%	0.727	80%	0.803	S	S	*	*			trans	-90.4	147.3	170.5	50.5	0	0	0	0	110.1
146	V	24.9	Very low	26	Very low	125 Å²	125	154.7 Å²	154.7	76%	0.758	80%	0.801	S	S	*	*			trans	-121.9	107.8	169.9	178.2	0	0	0	0	107.5
147	A	24.9	Very low	25.9	Very low	92 Å²	92	152.6 Å²	152.6	76%	0.76	80%	0.797	S	S	*	*			trans	-79.9	136.2	169.9	0	0	0	0	0	109.5
148	H	26.6	Very low	25.9	Very low	181 Å²	181	150.5 Å²	150.5	84%	0.838	79%	0.79	S	S	*	*			trans	-89.3	114.9	169.9	-83.3	-83.1	0	0	0	109.9
149	T	29.2	Very low	26	Very low	136 Å²	136	151 Å²	151	83%	0.834	79%	0.785	S	S	*	*			trans	-68.8	147.5	169.8	36.1	0	0	0	0	111.4
150	K	28.8	Very low	25.8	Very low	196 Å²	196	150.3 Å²	150.3	85%	0.852	79%	0.787	S	S	*	*			trans	-80.2	153	173	-60.3	176.1	-178.3	172.4	0	109.8
151	I	27.6	Very low	25.8	Very low	170 Å²	170	150.5 Å²	150.5	87%	0.872	79%	0.792	S	S	*	*			trans	-108.7	138.4	160.4	-65	177.7	0	0	0	107.4
152	L	27.2	Very low	25.7	Very low	160 Å²	160	150.6 Å²	150.6	84%	0.838	79%	0.788	S	S	*	*			trans	-100.6	171.1	-179.5	-69.7	169.7	0	0	0	111.4
153	T	23.5	Very low	25.6	Very low	126 Å²	126	151.6 Å²	151.6	77%	0.773	79%	0.79	S	S	*	*			trans	-123.7	119.1	175.5	49.8	0	0	0	0	111.2
154	V	25.4	Very low	25.5	Very low	133 Å²	133	147.1 Å²	147.1	81%	0.806	78%	0.782	S	S	*	*			trans	71.7	138.7	151	-176.9	0	0	0	0	114.1
155	D	25.2	Very low	25.7	Very low	146 Å²	146	146.3 Å²	146.3	78%	0.781	78%	0.781	S	S	*	*			cis	-150.3	179.9	19.5	-145.3	-24.1	0	0	0	114.4
156	R	25.8	Very low	25.7	Very low	214 Å²	214	148.2 Å²	148.2	81%	0.808	78%	0.783	S	S	*	*			trans	83.3	98.5	146.6	-110.5	-179	173.2	168	-2.1	122.7
157	S	25.1	Very low	25.5	Very low	95 Å²	95	152 Å²	152	66%	0.664	79%	0.79	S	S	*	*				85.2	149.1	122.3	70.2	0	0	0	0	124.2
158	H	27.3	Very low	25.4	Very low	160 Å²	160	157 Å²	157	74%	0.741	79%	0.79	S	S	*	*			trans	84.3	102.4	161.4	-71.9	-74	0	0	0	123.4
159	K	27.2	Very low	25.3	Very low	172 Å²	172	155.1 Å²	155.1	75%	0.748	79%	0.786	S	S	*	*			trans	59.3	114	131.6	-67	-174.3	175.1	-176.7	0	122.9
160	N	24.1	Very low	25	Very low	148 Å²	148	158.9 Å²	158.9	79%	0.791	79%	0.79	S	S	*	*				76.5	158.5	129.5	-65	14.6	0	0	0	123
161	V	25.4	Very low	24.8	Very low	133 Å²	133	154.4 Å²	154.4	81%	0.806	78%	0.784	S	S	*	*			trans	80.1	87.9	165.9	-160.6	0	0	0	0	118.8
162	E	24.3	Very low	24.5	Very low	164 Å²	164	153.3 Å²	153.3	77%	0.766	78%	0.784	S	S	*	*				37.8	148.5	114.8	-106.3	174.5	-154.8	0	0	124.9
163	F	23.6	Very low	24.3	Very low	187 Å²	187	155 Å²	155	82%	0.82	79%	0.786	S	S	*	*			trans	60.3	156.1	170.1	-82.4	-106.2	0	0	0	117.5
164	G	22.7	Very low	24.3	Very low	60 Å²	60	156 Å²	156	62%	0.619	78%	0.784	S	S	*	*			cis	166.2	152	-10.6	0	0	0	0	0	113.7
165	Q	26.6	Very low	24.2	Very low	171 Å²	171	158.8 Å²	158.8	80%	0.799	79%	0.786	S	S	*	*			trans	74.3	154.4	166.1	-55.9	-174.4	-5.9	0	0	120.1
166	N	23.9	Very low	24.2	Very low	144 Å²	144	159.8 Å²	159.8	77%	0.77	79%	0.786	S	S	*	*			trans	-92.2	172.3	174.3	-50.9	-85.3	0	0	0	110.1
167	F	21.9	Very low	24.1	Very low	204 Å²	204	158.2 Å²	158.2	90%	0.895	79%	0.787	S	S	*	*				-155.5	168.9	126	-112.8	-71.4	0	0	0	112.9
168	Y	21.8	Very low	24.1	Very low	198 Å²	198	164.1 Å²	164.1	78%	0.776	80%	0.795	S	S	*	*			trans	-102.8	152.2	-165.6	-108.5	-120	0	0	0	113.8
169	L	25.5	Very low	23.8	Very low	141 Å²	141	166.1 Å²	166.1	74%	0.738	80%	0.802	S	S	*	*			trans	19.3	129.4	143.1	-93.8	158.5	0	0	0	119.9
170	K	22	Very low	23.6	Very low	214 Å²	214	162.6 Å²	162.6	93%	0.93	81%	0.805	S	S	*	*			trans	-137.2	142.5	136.8	-113	172.4	-175.1	174.5	0	111.1
171	S	24.3	Very low	23.7	Very low	102 Å²	102	167.3 Å²	167.3	71%	0.713	81%	0.812	S	S	*	*			trans	-113.5	155.7	-177.1	47.7	0	0	0	0	110.9
172	V	22.2	Very low	23.6	Very low	147 Å²	147	169.5 Å²	169.5	89%	0.891	81%	0.813	S	S	*	*			trans	-132.8	140.8	168.7	-178.6	0	0	0	0	108.1
173	F	23.6	Very low	24.1	Very low	197 Å²	197	172 Å²	172	86%	0.864	82%	0.821	S	S	*	*			trans	-110.5	-161.8	-176.9	-129.2	-94.6	0	0	0	110.3
174	I	22.1	Very low	24	Very low	145 Å²	145	169 Å²	169	74%	0.744	82%	0.819	S	S	*	*			trans	84.1	129.5	175.6	-60	174.1	0	0	0	113.2
175	K	23.5	Very low	24.2	Very low	192 Å²	192	171.8 Å²	171.8	84%	0.835	83%	0.826	S	S	*	*			cis	-146.9	164	-9.3	-123.6	172.7	-166.1	174.3	0	109.7
176	Q	24.6	Very low	24.3	Very low	167 Å²	167	167.7 Å²	167.7	78%	0.78	82%	0.816	S	S	*	*			trans	-85.1	146.7	166	-68.1	-178.8	-0.6	0	0	111
177	Q	24.9	Very low	24.6	Very low	181 Å²	181	170.2 Å²	170.2	85%	0.846	82%	0.82	S	S	*	*			trans	-129.8	145.2	149.7	-96.9	-178.3	-19.5	0	0	108.8
178	R	23.8	Very low	25.1	Very low	220 Å²	220	164 Å²	164	83%	0.83	80%	0.801	S	S	*	*			trans	-107.7	137.9	172.4	-70.5	177.5	175.2	170.1	-2.4	108.4
179	F	22.4	Very low	25.5	Very low	202 Å²	202	159.3 Å²	159.3	89%	0.886	79%	0.786	S	S	*	*			trans	-128.8	166.5	158	-98.6	-84.3	0	0	0	110.2
180	A	23.3	Very low	25.8	Very low	97 Å²	97	159 Å²	159	80%	0.802	78%	0.784	S	S	*	*			trans	-78.7	170.2	-154.4	0	0	0	0	0	115.6
181	R	24.8	Very low	26.4	Very low	247 Å²	247	155.9 Å²	155.9	93%	0.932	77%	0.773	S	S	*	*			trans	-80.7	122.7	175.2	-77.2	175.2	163.6	178.6	-4.7	111.3
182	E	24.5	Very low	26.6	Very low	179 Å²	179	158 Å²	158	84%	0.836	77%	0.765	S	S	*	*			trans	-106.3	144.2	150.1	-67.4	-165.1	139	0	0	110.6	T184	E182-T184 PolarHBondContact O-N 3.4Å
183	K	33.8	Very low	27.1	Very low	216 Å²	216	155.9 Å²	155.9	94%	0.939	75%	0.749	S	S	*	*			trans	-85.6	90.9	-175.9	-69	176.4	-178.1	170.5	0	110.8
184	T	22.7	Very low	27.4	Very low	125 Å²	125	149.6 Å²	149.6	77%	0.767	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-92.7	136.3	169.1	45.5	0	0	0	0	111.6	E182	E182-T184 PolarHBondContact O-N 3.4Å
185	P	26.5	Very low	27.8	Very low	119 Å²	119	150.2 Å²	150.2	77%	0.773	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-63.9	154.2	-178.1	-25.5	35.4	0	0	0	114.7	K187	P185-K187 PolarHBondContact O-N 2.8Å
186	S	27.7	Very low	28.2	Very low	84 Å²	84	148.1 Å²	148.1	59%	0.587	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-61.6	131.3	179.1	-179.6	0	0	0	0	112.2	C188 E189	S186-C188 PolarHBondContact O-N 3.17Å; S186-E189 PolarHBondContact O-N 2.96Å
187	K	31	Very low	28.6	Very low	197 Å²	197	147.2 Å²	147.2	86%	0.857	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	4.5	178.7	-147	167.3	-172.1	169.2	0	114.4	P185	P185-K187 PolarHBondContact O-N 2.8Å
188	C	31.6	Very low	28.8	Very low	73 Å²	73	144.6 Å²	144.6	49%	0.493	71%	0.705	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.2	-13.9	178.7	-158.9	0	0	0	0	113.8	S186	S186-C188 PolarHBondContact O-N 3.17Å
189	E	31.3	Very low	29.1	Very low	101 Å²	101	137.7 Å²	137.7	47%	0.472	69%	0.691	S	S	.	*	S	Bend	trans	-73.4	-44.5	-177.5	-144.4	77	-96.8	0	0	112.6	S186 Q191 R192	S186-E189 PolarHBondContact O-N 2.96Å; E189-Q191 VanDerWaalsContact C-N 3.27Å; E189-Q191 PolarHBondContact O-N 3.43Å; E189-R192 WeakPolarHBondContact O-CB 3.29Å; E189-R192 PolarHBondContact O-N 3.1Å; E189-R192 IonicContact OE1-CZ 3.85Å; E189-R192 IonicContact OE1-NH1 3.71Å; E189-R192 PolarHBondContact OE1-NH1 2.79Å
190	I	31.9	Very low	29.5	Very low	135 Å²	135	134.4 Å²	134.4	69%	0.692	68%	0.682	S	S	*	*	H	α-helix	trans	-60.2	-36.4	-173.8	-60.6	175.6	0	0	0	111.7	R192	I190-R192 VanDerWaalsContact C-N 3.32Å; I190-R192 PolarHBondContact O-N 2.79Å
191	Q	33.5	Very low	30	Very low	148 Å²	148	136.9 Å²	136.9	69%	0.692	68%	0.682	S	S	*	*	H	α-helix	trans	-71.5	-19.4	178.3	-97.3	-177.2	-13.3	0	0	114.5	E189 F195	E189-Q191 VanDerWaalsContact C-N 3.27Å; E189-Q191 PolarHBondContact O-N 3.43Å; Q191-F195 PolarHBondContact O-N 3.14Å
192	R	29.2	Very low	30.3	Very low	146 Å²	146	132.6 Å²	132.6	55%	0.551	68%	0.676	S	S	*	*	H	α-helix	trans	-70.2	-39.4	176.6	-74.4	179.9	171.6	144.2	-2.9	112.1	E189 I190 F195 K196	E189-R192 WeakPolarHBondContact O-CB 3.29Å; E189-R192 PolarHBondContact O-N 3.1Å; E189-R192 IonicContact OE1-CZ 3.85Å; E189-R192 IonicContact OE1-NH1 3.71Å; E189-R192 PolarHBondContact OE1-NH1 2.79Å; I190-R192 VanDerWaalsContact C-N 3.32Å; I190-R192 PolarHBondContact O-N 2.79Å; R192-F195 PolarHBondContact O-N 2.85Å; R192-K196 PolarHBondContact O-N 3.08Å
193	N	31.6	Very low	30.7	Very low	102 Å²	102	131.1 Å²	131.1	55%	0.545	67%	0.674	S	S	.	*	H	α-helix	trans	-71.6	-39.5	-175.5	-69.4	-9.6	0	0	0	111.6	F195 K196 Q197	N193-F195 PolarHBondContact O-N 3.34Å; N193-K196 PolarHBondContact O-N 3.4Å; N193-Q197 PolarHBondContact O-N 3.2Å; N193-Q197 VanDerWaalsContact O-N 3.09Å
194	S	30.1	Very low	30.6	Very low	65 Å²	65	130 Å²	130	46%	0.455	67%	0.672	S	S	.	*	H	α-helix	trans	-62.9	-25.1	172	-49	0	0	0	0	113.8	N198	S194-N198 PolarHBondContact O-ND2 3.01Å
195	F	32	Very low	30.9	Very low	159 Å²	159	129.1 Å²	129.1	70%	0.697	67%	0.671	S	S	*	*	H	α-helix	trans	-85.1	-38	175	-108	-87.5	0	0	0	113.2	Q191 R192 N193 Q197 N198 S199	Q191-F195 PolarHBondContact O-N 3.14Å; R192-F195 PolarHBondContact O-N 2.85Å; N193-F195 PolarHBondContact O-N 3.34Å; F195-Q197 PolarHBondContact O-N 3.46Å; F195-N198 PolarHBondContact O-N 2.87Å; F195-S199 PolarHBondContact O-N 3.2Å
196	K	31	Very low	31.8	Very low	148 Å²	148	133.4 Å²	133.4	64%	0.643	68%	0.677	S	S	*	*	H	α-helix	trans	-64.8	-35.1	174.2	-80.1	-173.5	171.8	-176.3	0	113.1	R192 N193 N198 S199	R192-K196 PolarHBondContact O-N 3.08Å; N193-K196 PolarHBondContact O-N 3.4Å; K196-N198 VanDerWaalsContact C-N 3.28Å; K196-N198 PolarHBondContact O-N 2.95Å; K196-S199 PolarHBondContact O-OG 3.41Å
197	Q	32.4	Very low	32.1	Very low	148 Å²	148	137.1 Å²	137.1	69%	0.692	69%	0.689	S	S	*	*	H	α-helix	trans	-68.5	-26.4	175.1	-75.4	178.8	-30.3	0	0	113.1	N193 F195	N193-Q197 PolarHBondContact O-N 3.2Å; N193-Q197 VanDerWaalsContact O-N 3.09Å; F195-Q197 PolarHBondContact O-N 3.46Å
198	N	30.8	Very low	32.2	Very low	125 Å²	125	137 Å²	137	67%	0.668	69%	0.689	S	S	*	*	H	α-helix	trans	-91.5	-11.7	178.8	-80.4	-73.9	0	0	0	114.5	S194 F195 K196	S194-N198 PolarHBondContact O-ND2 3.01Å; F195-N198 PolarHBondContact O-N 2.87Å; K196-N198 VanDerWaalsContact C-N 3.28Å; K196-N198 PolarHBondContact O-N 2.95Å
199	S	29.6	Very low	32.6	Very low	75 Å²	75	140.3 Å²	140.3	52%	0.524	71%	0.707	S	S	.	*	H	α-helix	trans	-81.1	-27.8	173.9	56.9	0	0	0	0	113.5	F195 K196	F195-S199 PolarHBondContact O-N 3.2Å; K196-S199 PolarHBondContact O-OG 3.41Å
200	N	30.1	Very low	33	Very low	133 Å²	133	139.9 Å²	139.9	71%	0.711	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-1.7	-170.4	-68.1	11.1	0	0	0	114.1
201	L	33.6	Very low	33.9	Very low	150 Å²	150	139.5 Å²	139.5	79%	0.785	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	15.9	177.1	-92.4	166.9	0	0	0	114.1
202	L	32	Very low	34.9	Very low	156 Å²	156	139.5 Å²	139.5	82%	0.817	71%	0.714	S	S	*	*	S	Bend	trans	-138.1	44	176.9	-153.4	77.6	0	0	0	114.5
203	N	31.7	Very low	36.2	Very low	148 Å²	148	140.9 Å²	140.9	79%	0.791	72%	0.719	S	S	*	*	S	Bend	trans	-153.5	122	155.1	-114.3	-22	0	0	0	111.2
204	Q	31.9	Very low	37.7	Very low	193 Å²	193	140.2 Å²	140.2	90%	0.902	71%	0.709	S	S	*	*			trans	66.4	141.5	-173.1	-43	-176.5	22.4	0	0	112.9
205	S	29.3	Very low	39.6	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	71%	0.712	S	S	*	*			cis	-119.8	-173.6	7	66	0	0	0	0	112.7	I207	S205-I207 PolarHBondContact O-N 3.26Å
206	K	45.1	Very low	41.6	Very low	209 Å²	209	135.1 Å²	135.1	91%	0.909	68%	0.678	S	S	*	*			trans	-77.7	116.6	-179.8	-62.8	172.6	-176.1	170.3	0	110.8
207	I	34.8	Very low	43.3	Very low	162 Å²	162	133 Å²	133	83%	0.831	68%	0.683	S	S	*	*			trans	-109.8	145	165	-64.7	178.6	0	0	0	109.7	S205	S205-I207 PolarHBondContact O-N 3.26Å
208	K	31.9	Very low	45	Very low	196 Å²	196	130.4 Å²	130.4	85%	0.852	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-79.2	172.2	-161.2	-63.2	174.5	-177.9	174.8	0	113.4	A210	K208-A210 PolarHBondContact O-N 3.36Å
209	T	41.2	Very low	47	Very low	142 Å²	142	126.3 Å²	126.3	87%	0.871	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-46	120.7	-178.4	42	0	0	0	0	115.2
210	A	38.8	Very low	48.8	Very low	92 Å²	92	128.9 Å²	128.9	76%	0.76	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-96.3	130.2	157.9	0	0	0	0	0	109.8	K208	K208-A210 PolarHBondContact O-N 3.36Å
211	E	51.1	Low	50.7	Low	127 Å²	127	128.4 Å²	128.4	59%	0.593	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-67.6	132.8	-169.9	-60.6	-176.1	145.2	0	0	113.9	R213	E211-R213 VanDerWaalsContact C-N 3.3Å; E211-R213 PolarHBondContact O-N 3.14Å; E211-R213 VanDerWaalsContact O-N 3.12Å; E211-R213 IonicContact OE2-CZ 3.21Å; E211-R213 IonicContact OE2-NE 3.42Å; E211-R213 PolarHBondContact OE2-NE 2.99Å; E211-R213 IonicContact OE2-NH2 2.67Å; E211-R213 PolarHBondContact OE2-NH2 3.41Å
212	K	54	Low	52.2	Low	148 Å²	148	123.6 Å²	123.6	64%	0.643	63%	0.632	S	S	*	*			trans	-87.5	70.6	169.4	-57.9	176.2	-172.1	163.6	0	109.8	Y214 S222 F223	K212-Y214 PolarHBondContact O-N 3.06Å; K212-S222 VanDerWaalsContact CB-CB 3.41Å; K212-F223 CarbonylContact C-O 3.59Å
213	R	58.1	Low	54.2	Low	175 Å²	175	118.6 Å²	118.6	66%	0.66	60%	0.603	S	S	*	*			trans	-61.6	-8.6	-162.5	-159.9	170.6	-80.7	-171.4	-6.3	116.8	E211	E211-R213 VanDerWaalsContact C-N 3.3Å; E211-R213 PolarHBondContact O-N 3.14Å; E211-R213 VanDerWaalsContact O-N 3.12Å; E211-R213 IonicContact OE2-CZ 3.21Å; E211-R213 IonicContact OE2-NE 3.42Å; E211-R213 PolarHBondContact OE2-NE 2.99Å; E211-R213 IonicContact OE2-NH2 2.67Å; E211-R213 PolarHBondContact OE2-NH2 3.41Å
214	Y	61.9	Low	55.9	Low	88 Å²	88	117.4 Å²	117.4	35%	0.345	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.6	96.4	-179.7	-58.1	-77.2	0	0	0	113.5	K212 S222 F223 I224 N226	K212-Y214 PolarHBondContact O-N 3.06Å; Y214-S222 CarbonylContact O-C 3.58Å; Y214-S222 WeakPolarHBondContact O-CA 3.44Å; Y214-F223 PolarHBondContact N-O 2.88Å; Y214-F223 VanDerWaalsContact N-O 3.08Å; Y214-F223 PolarHBondContact O-N 3.02Å; Y214-I224 WeakPolarHBondContact CD2-O 3.38Å; Y214-N226 HydrophobicContact CD1-CB 3.86Å; Y214-N226 HydrophobicContact CD2-CB 4.29Å; Y214-N226 VanDerWaalsContact CD2-N 3.32Å; Y214-N226 HydrophobicContact CE1-CB 3.82Å; Y214-N226 HydrophobicContact CE2-CB 4.23Å; Y214-N226 HydrophobicContact CG-CB 4.1Å
215	K	69.3	Low	57.5	Low	116 Å²	116	113.7 Å²	113.7	50%	0.504	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.8	140	177.9	-170.3	176.4	179.2	-175.5	0	112.5	E220 L229	K215-E220 WeakPolarHBondContact CE-OE1 3.46Å; K215-E220 IonicContact NZ-OE1 3.34Å; K215-E220 PolarHBondContact NZ-OE1 3.49Å; K215-L229 WeakPolarHBondContact O-CD2 3.41Å
216	C	74.7	Confident	59	Low	0 Å²	0	111.9 Å²	111.9	0%	0	56%	0.56	C	S	.	*			trans	-82.8	122	170	-176.3	0	0	0	0	111.3	T218 E220 K221 F223 L229 H232 H236	C216-T218 VanDerWaalsContact C-N 3.3Å; C216-T218 PolarHBondContact O-N 2.77Å; C216-E220 WeakPolarHBondContact O-CA 3.33Å; C216-E220 PolarHBondContact O-N 3.4Å; C216-K221 VanDerWaalsContact CB-O 3.26Å; C216-K221 WeakPolarHBondContact CB-O 3.28Å; C216-K221 PolarHBondContact N-O 3.1Å; C216-F223 HydrophobicContact CB-CE2 4.44Å; C216-L229 HydrophobicContact CB-CD1 3.56Å; C216-H232 VanDerWaalsContact SG-CD2 3.58Å; C216-H232 PolarHBondContact SG-NE2 2.84Å; C216-H236 PolarHBondContact SG-NE2 2.87Å
217	S	66.8	Low	59.8	Low	105 Å²	105	105.3 Å²	105.3	73%	0.734	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.2	175.9	45.8	0	0	0	0	114.1
218	T	67.4	Low	61.3	Low	92 Å²	92	99.9 Å²	99.9	56%	0.564	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-20.4	-172.6	-32.4	0	0	0	0	114.7	C216 H236	C216-T218 VanDerWaalsContact C-N 3.3Å; C216-T218 PolarHBondContact O-N 2.77Å; T218-H236 HydrophobicContact CG2-CB 4.18Å
219	C	73.7	Confident	63.2	Low	40 Å²	40	91 Å²	91	27%	0.27	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.9	23.3	179.4	75.7	0	0	0	0	114.5	K221 H232 H236	C219-K221 PolarHBondContact O-N 3.1Å; C219-H232 VanDerWaalsContact SG-CE1 3.58Å; C219-H232 PolarHBondContact SG-NE2 2.85Å; C219-H236 PolarHBondContact SG-CE1 3.1Å; C219-H236 PolarHBondContact SG-NE2 2.82Å; C219-H236 VanDerWaalsContact SG-NE2 3.35Å
220	E	67.8	Low	64.3	Low	128 Å²	128	91.3 Å²	91.3	60%	0.598	46%	0.464	S	S	*	.			trans	59.4	-2.3	172	-53.9	-145.5	108.3	0	0	118.3	K215 C216 S222	K215-E220 WeakPolarHBondContact CE-OE1 3.46Å; K215-E220 IonicContact NZ-OE1 3.34Å; K215-E220 PolarHBondContact NZ-OE1 3.49Å; C216-E220 WeakPolarHBondContact O-CA 3.33Å; C216-E220 PolarHBondContact O-N 3.4Å; E220-S222 PolarHBondContact O-N 3.47Å; E220-S222 PolarHBondContact O-OG 2.97Å
221	K	69.8	Low	65.6	Low	124 Å²	124	92.8 Å²	92.8	54%	0.539	45%	0.453	S	S	.	.			trans	-63.9	120.6	178.2	-71.1	166.4	-165.3	159.3	0	110.4	C216 C219 F223	C216-K221 VanDerWaalsContact CB-O 3.26Å; C216-K221 WeakPolarHBondContact CB-O 3.28Å; C216-K221 PolarHBondContact N-O 3.1Å; C219-K221 PolarHBondContact O-N 3.1Å; K221-F223 HydrophobicContact CB-CE2 3.8Å; K221-F223 HydrophobicContact CB-CZ 4.02Å; K221-F223 VanDerWaalsContact O-CD2 3.29Å; K221-F223 WeakPolarHBondContact O-CD2 3.47Å; K221-F223 WeakPolarHBondContact O-CE2 3.39Å
222	S	65.5	Low	66.5	Low	48 Å²	48	88 Å²	88	34%	0.336	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.1	178.2	-50.1	0	0	0	0	112.4	K212 Y214 E220	K212-S222 VanDerWaalsContact CB-CB 3.41Å; Y214-S222 CarbonylContact O-C 3.58Å; Y214-S222 WeakPolarHBondContact O-CA 3.44Å; E220-S222 PolarHBondContact O-N 3.47Å; E220-S222 PolarHBondContact O-OG 2.97Å
223	F	73.6	Confident	67.1	Low	51 Å²	51	82.6 Å²	82.6	22%	0.224	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	154.4	-175.1	-61.7	-92.1	0	0	0	110.8	K212 Y214 C216 K221 L229 H232	K212-F223 CarbonylContact C-O 3.59Å; Y214-F223 PolarHBondContact N-O 2.88Å; Y214-F223 VanDerWaalsContact N-O 3.08Å; Y214-F223 PolarHBondContact O-N 3.02Å; C216-F223 HydrophobicContact CB-CE2 4.44Å; K221-F223 HydrophobicContact CB-CE2 3.8Å; K221-F223 HydrophobicContact CB-CZ 4.02Å; K221-F223 VanDerWaalsContact O-CD2 3.29Å; K221-F223 WeakPolarHBondContact O-CD2 3.47Å; K221-F223 WeakPolarHBondContact O-CE2 3.39Å; F223-L229 HydrophobicContact CB-CB 4.36Å; F223-L229 HydrophobicContact CD2-CB 4.06Å; F223-L229 HydrophobicContact CD2-CD1 3.95Å; F223-L229 HydrophobicContact CE2-CD1 4.18Å; F223-L229 HydrophobicContact CG-CB 4.4Å; F223-H232 HydrophobicContact CE1-CB 4.09Å; F223-H232 HydrophobicContact CE2-CB 3.91Å; F223-H232 AromaticContact CE2-CD2 3.33Å; F223-H232 WeakPolarHBondContact CE2-CD2 3.23Å; F223-H232 AromaticContact CE2-CG 3.62Å; F223-H232 HydrophobicContact CZ-CB 3.53Å; F223-H232 AromaticContact CZ-CD2 3.5Å; F223-H232 AromaticContact CZ-CG 3.31Å; F223-H232 AromaticContact CZ-ND1 3.81Å
224	I	66.6	Low	67.5	Low	123 Å²	123	78 Å²	78	63%	0.631	39%	0.393	S	S	*	.	S	Bend	trans	-75.5	-34	179.5	-55.7	172.9	0	0	0	110.9	Y214	Y214-I224 WeakPolarHBondContact CD2-O 3.38Å
225	H	67.2	Low	67.5	Low	116 Å²	116	78 Å²	78	54%	0.537	40%	0.399	S	S	.	.	S	Bend	trans	-124.9	137.8	-179	-57.5	142.3	0	0	0	112.2	S227 S228 L229	H225-S227 PolarHBondContact O-N 3.15Å; H225-S228 WeakPolarHBondContact O-CA 3.22Å; H225-S228 WeakPolarHBondContact O-CB 3.42Å; H225-S228 PolarHBondContact O-N 3.18Å; H225-L229 PolarHBondContact O-N 2.83Å
226	N	59.6	Low	67.3	Low	67 Å²	67	76 Å²	76	36%	0.358	39%	0.391	S	S	.	.	H	α-helix	trans	-55.8	-37.5	176.5	-168.3	-1.3	0	0	0	112.4	Y214 S228 L229 R230	Y214-N226 HydrophobicContact CD1-CB 3.86Å; Y214-N226 HydrophobicContact CD2-CB 4.29Å; Y214-N226 VanDerWaalsContact CD2-N 3.32Å; Y214-N226 HydrophobicContact CE1-CB 3.82Å; Y214-N226 HydrophobicContact CE2-CB 4.23Å; Y214-N226 HydrophobicContact CG-CB 4.1Å; N226-S228 PolarHBondContact O-N 3.23Å; N226-L229 CarbonylContact O-C 3.54Å; N226-L229 WeakPolarHBondContact O-CB 3.31Å; N226-L229 PolarHBondContact O-N 3.05Å; N226-L229 VanDerWaalsContact O-N 3.08Å; N226-R230 WeakPolarHBondContact O-CG 3.47Å; N226-R230 PolarHBondContact O-N 3.4Å
227	S	61.8	Low	66.7	Low	71 Å²	71	80 Å²	80	50%	0.497	42%	0.416	S	S	.	.	H	α-helix	trans	-59.4	-28.7	174.2	62.5	0	0	0	0	113.7	H225 K231	H225-S227 PolarHBondContact O-N 3.15Å; S227-K231 WeakPolarHBondContact O-CB 3.42Å; S227-K231 VanDerWaalsContact O-CG 3.26Å; S227-K231 WeakPolarHBondContact O-CG 3.49Å; S227-K231 PolarHBondContact O-N 2.72Å
228	S	67.7	Low	66.2	Low	48 Å²	48	77.3 Å²	77.3	34%	0.336	40%	0.404	S	S	.	.	H	α-helix	trans	-80.5	-38.1	173.7	-60.4	0	0	0	0	111.9	H225 N226 K231 H232	H225-S228 WeakPolarHBondContact O-CA 3.22Å; H225-S228 WeakPolarHBondContact O-CB 3.42Å; H225-S228 PolarHBondContact O-N 3.18Å; N226-S228 PolarHBondContact O-N 3.23Å; S228-K231 PolarHBondContact O-N 3.32Å; S228-H232 WeakPolarHBondContact O-CB 3.43Å; S228-H232 PolarHBondContact O-N 3.39Å
229	L	70.9	Confident	65.7	Low	11 Å²	11	77.2 Å²	77.2	6%	0.058	40%	0.397	C	S	.	.	H	α-helix	trans	-59.9	-46.6	170.8	172.7	59.1	0	0	0	111.3	K215 C216 F223 H225 N226 K231 H232 Q233	K215-L229 WeakPolarHBondContact O-CD2 3.41Å; C216-L229 HydrophobicContact CB-CD1 3.56Å; F223-L229 HydrophobicContact CB-CB 4.36Å; F223-L229 HydrophobicContact CD2-CB 4.06Å; F223-L229 HydrophobicContact CD2-CD1 3.95Å; F223-L229 HydrophobicContact CE2-CD1 4.18Å; F223-L229 HydrophobicContact CG-CB 4.4Å; H225-L229 PolarHBondContact O-N 2.83Å; N226-L229 CarbonylContact O-C 3.54Å; N226-L229 WeakPolarHBondContact O-CB 3.31Å; N226-L229 PolarHBondContact O-N 3.05Å; N226-L229 VanDerWaalsContact O-N 3.08Å; L229-K231 PolarHBondContact O-N 3.3Å; L229-H232 CarbonylContact O-C 3.26Å; L229-H232 WeakPolarHBondContact O-CA 3.37Å; L229-H232 WeakPolarHBondContact O-CB 3.48Å; L229-H232 PolarHBondContact O-N 3.2Å; L229-Q233 HydrophobicContact CD1-CG 3.93Å; L229-Q233 HydrophobicContact CG-CG 4.35Å; L229-Q233 WeakPolarHBondContact O-CG 3.49Å; L229-Q233 PolarHBondContact O-N 3.45Å
230	R	64.3	Low	65.3	Low	148 Å²	148	81.4 Å²	81.4	56%	0.558	41%	0.411	S	S	*	.	H	α-helix	trans	-60.6	-44.5	176	-68.4	-65.2	-170.4	-140.7	7.2	112.3	N226 H232 Q233 K234	N226-R230 WeakPolarHBondContact O-CG 3.47Å; N226-R230 PolarHBondContact O-N 3.4Å; R230-H232 PolarHBondContact O-N 3.39Å; R230-Q233 PolarHBondContact O-N 3.38Å; R230-K234 PolarHBondContact O-N 2.83Å
231	K	66	Low	65	Low	123 Å²	123	80 Å²	80	54%	0.535	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-25.3	173.1	-77.1	172.7	-176.3	176.9	0	113.5	S227 S228 L229 Q253	S227-K231 WeakPolarHBondContact O-CB 3.42Å; S227-K231 VanDerWaalsContact O-CG 3.26Å; S227-K231 WeakPolarHBondContact O-CG 3.49Å; S227-K231 PolarHBondContact O-N 2.72Å; S228-K231 PolarHBondContact O-N 3.32Å; L229-K231 PolarHBondContact O-N 3.3Å; K231-Q253 PolarHBondContact O-NE2 2.92Å
232	H	69.6	Low	65.1	Low	25 Å²	25	77.7 Å²	77.7	12%	0.116	40%	0.397	C	S	.	.	H	α-helix	trans	-83.4	-41.6	174.7	168.4	67	0	0	0	112.5	C216 C219 F223 S228 L229 R230 K234 N235 H236	C216-H232 VanDerWaalsContact SG-CD2 3.58Å; C216-H232 PolarHBondContact SG-NE2 2.84Å; C219-H232 VanDerWaalsContact SG-CE1 3.58Å; C219-H232 PolarHBondContact SG-NE2 2.85Å; F223-H232 HydrophobicContact CE1-CB 4.09Å; F223-H232 HydrophobicContact CE2-CB 3.91Å; F223-H232 AromaticContact CE2-CD2 3.33Å; F223-H232 WeakPolarHBondContact CE2-CD2 3.23Å; F223-H232 AromaticContact CE2-CG 3.62Å; F223-H232 HydrophobicContact CZ-CB 3.53Å; F223-H232 AromaticContact CZ-CD2 3.5Å; F223-H232 AromaticContact CZ-CG 3.31Å; F223-H232 AromaticContact CZ-ND1 3.81Å; S228-H232 WeakPolarHBondContact O-CB 3.43Å; S228-H232 PolarHBondContact O-N 3.39Å; L229-H232 CarbonylContact O-C 3.26Å; L229-H232 WeakPolarHBondContact O-CA 3.37Å; L229-H232 WeakPolarHBondContact O-CB 3.48Å; L229-H232 PolarHBondContact O-N 3.2Å; R230-H232 PolarHBondContact O-N 3.39Å; H232-K234 PolarHBondContact O-N 3.21Å; H232-N235 WeakPolarHBondContact O-CB 3.43Å; H232-N235 PolarHBondContact O-N 2.99Å; H232-H236 AromaticContact CD2-NE2 3.82Å; H232-H236 AromaticContact CE1-CE1 3.81Å; H232-H236 AromaticContact CE1-NE2 3.38Å; H232-H236 PolarHBondContact CE1-NE2 3.01Å; H232-H236 AromaticContact NE2-CD2 3.99Å; H232-H236 AromaticContact NE2-CE1 3.85Å; H232-H236 AromaticContact NE2-NE2 3.03Å; H232-H236 PolarHBondContact NE2-NE2 3.33Å
233	Q	66.6	Low	65.3	Low	36 Å²	36	82.3 Å²	82.3	17%	0.168	41%	0.411	C	S	.	.	H	α-helix	trans	-59.1	-34.2	177.3	-76.8	175.8	-41.8	0	0	112.3	L229 R230 N235 H236 T237	L229-Q233 HydrophobicContact CD1-CG 3.93Å; L229-Q233 HydrophobicContact CG-CG 4.35Å; L229-Q233 WeakPolarHBondContact O-CG 3.49Å; L229-Q233 PolarHBondContact O-N 3.45Å; R230-Q233 PolarHBondContact O-N 3.38Å; Q233-N235 PolarHBondContact O-N 3.3Å; Q233-H236 PolarHBondContact O-N 2.98Å; Q233-T237 PolarHBondContact O-N 3.16Å
234	K	66.9	Low	65.3	Low	79 Å²	79	79.9 Å²	79.9	34%	0.343	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-9	171.9	-69.3	-165.3	174.9	-156.8	0	115.5	R230 H232	R230-K234 PolarHBondContact O-N 2.83Å; H232-K234 PolarHBondContact O-N 3.21Å
235	N	62.5	Low	65.4	Low	87 Å²	87	83.2 Å²	83.2	47%	0.465	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-15.7	170.7	-57.5	-43.2	0	0	0	112.7	H232 Q233 S252	H232-N235 WeakPolarHBondContact O-CB 3.43Å; H232-N235 PolarHBondContact O-N 2.99Å; Q233-N235 PolarHBondContact O-N 3.3Å; N235-S252 PolarHBondContact OD1-OG 3.34Å
236	H	63.5	Low	65.4	Low	75 Å²	75	83 Å²	83	35%	0.347	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-36.2	172.7	-57.3	-52.2	0	0	0	111.7	C216 T218 C219 H232 Q233 G238	C216-H236 PolarHBondContact SG-NE2 2.87Å; T218-H236 HydrophobicContact CG2-CB 4.18Å; C219-H236 PolarHBondContact SG-CE1 3.1Å; C219-H236 PolarHBondContact SG-NE2 2.82Å; C219-H236 VanDerWaalsContact SG-NE2 3.35Å; H232-H236 AromaticContact CD2-NE2 3.82Å; H232-H236 AromaticContact CE1-CE1 3.81Å; H232-H236 AromaticContact CE1-NE2 3.38Å; H232-H236 PolarHBondContact CE1-NE2 3.01Å; H232-H236 AromaticContact NE2-CD2 3.99Å; H232-H236 AromaticContact NE2-CE1 3.85Å; H232-H236 AromaticContact NE2-NE2 3.03Å; H232-H236 PolarHBondContact NE2-NE2 3.33Å; Q233-H236 PolarHBondContact O-N 2.98Å; H236-G238 PolarHBondContact O-N 3.33Å
237	T	62.1	Low	66.1	Low	84 Å²	84	82 Å²	82	52%	0.515	41%	0.407	S	S	.	.	S	Bend	trans	-72.4	-10	176.8	61.4	0	0	0	0	113.8	Q233 E239	Q233-T237 PolarHBondContact O-N 3.16Å; T237-E239 PolarHBondContact O-N 2.8Å; T237-E239 VanDerWaalsContact O-N 3.12Å; T237-E239 WeakPolarHBondContact OG1-CG 3.46Å; T237-E239 PolarHBondContact OG1-OE2 2.86Å
238	G	57.9	Low	66.5	Low	48 Å²	48	85 Å²	85	50%	0.495	42%	0.417	S	S	.	.			trans	70.6	-0.5	-179.4	0	0	0	0	0	115.4	H236 K240	H236-G238 PolarHBondContact O-N 3.33Å; G238-K240 PolarHBondContact O-N 3.41Å
239	E	56.7	Low	66.6	Low	89 Å²	89	88.5 Å²	88.5	42%	0.416	43%	0.427	S	S	.	.			trans	-66.1	90.3	-172.9	-68.5	177.4	115.4	0	0	113.4	T237 L241	T237-E239 PolarHBondContact O-N 2.8Å; T237-E239 VanDerWaalsContact O-N 3.12Å; T237-E239 WeakPolarHBondContact OG1-CG 3.46Å; T237-E239 PolarHBondContact OG1-OE2 2.86Å; E239-L241 VanDerWaalsContact C-N 3.28Å; E239-L241 HydrophobicContact CB-CG 4.29Å; E239-L241 PolarHBondContact O-N 3.43Å; E239-L241 VanDerWaalsContact O-N 3.09Å
240	K	64.2	Low	66.6	Low	128 Å²	128	89.6 Å²	89.6	56%	0.557	44%	0.437	S	S	*	.			trans	-86.9	63.9	176.3	-69	164.1	-177.8	168.6	0	111.4	G238 F242 A250 F251	G238-K240 PolarHBondContact O-N 3.41Å; K240-F242 PolarHBondContact O-N 2.88Å; K240-A250 HydrophobicContact CB-CB 3.51Å; K240-A250 HydrophobicContact CD-CB 4.28Å; K240-A250 WeakPolarHBondContact CD-O 3.19Å; K240-A250 HydrophobicContact CG-CB 4.4Å; K240-F251 CarbonylContact C-O 3.49Å; K240-F251 VanDerWaalsContact C-O 3.31Å; K240-F251 WeakPolarHBondContact CA-O 3.44Å
241	L	63	Low	67.1	Low	100 Å²	100	84.9 Å²	84.9	52%	0.524	42%	0.421	S	S	.	.			trans	-60.2	-29.4	-174.8	-62.1	171.1	0	0	0	113.7	E239 F251	E239-L241 VanDerWaalsContact C-N 3.28Å; E239-L241 HydrophobicContact CB-CG 4.29Å; E239-L241 PolarHBondContact O-N 3.43Å; E239-L241 VanDerWaalsContact O-N 3.09Å; L241-F251 PolarHBondContact N-O 3.03Å
242	F	70.3	Confident	67.2	Low	74 Å²	74	80.3 Å²	80.3	33%	0.325	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	98	-172.7	-58.7	-77.7	0	0	0	111	K240 A250 F251 Q253 S254 L257	K240-F242 PolarHBondContact O-N 2.88Å; F242-A250 CarbonylContact O-C 3.51Å; F242-A250 WeakPolarHBondContact O-CA 3.48Å; F242-F251 HydrophobicContact CB-CB 4.44Å; F242-F251 PolarHBondContact N-O 3.43Å; F242-F251 PolarHBondContact O-N 3.48Å; F242-Q253 VanDerWaalsContact CD2-C 3.44Å; F242-S254 VanDerWaalsContact CD2-N 3.31Å; F242-L257 HydrophobicContact CB-CB 3.97Å; F242-L257 HydrophobicContact CB-CD2 3.8Å
243	K	69.7	Low	67.2	Low	145 Å²	145	82.1 Å²	82.1	63%	0.63	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.5	-179.9	-60.9	-179.6	-177.2	175.8	0	112.1	A250	K243-A250 HydrophobicContact CG-CB 3.93Å
244	C	74.1	Confident	67	Low	0 Å²	0	83.1 Å²	83.1	0%	0	42%	0.424	C	S	.	.			trans	-73.7	123.5	171	176.3	0	0	0	0	110.4	E246 L248 K249 L257 H264	C244-E246 VanDerWaalsContact C-N 3.25Å; C244-E246 PolarHBondContact O-N 2.98Å; C244-L248 WeakPolarHBondContact O-CA 3.41Å; C244-L248 PolarHBondContact O-N 2.57Å; C244-K249 WeakPolarHBondContact CB-O 3.27Å; C244-K249 PolarHBondContact N-O 3.21Å; C244-L257 VanDerWaalsContact CA-CD1 3.47Å; C244-L257 HydrophobicContact CB-CD1 3.57Å; C244-H264 PolarHBondContact SG-NE2 2.89Å
245	K	68.9	Low	67	Low	193 Å²	193	82.7 Å²	82.7	84%	0.839	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-30.3	179.6	-65	-174.2	176.7	-175.9	0	113.1
246	E	67.9	Low	67.4	Low	112 Å²	112	79.9 Å²	79.9	52%	0.523	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-25.1	-171.3	-61.5	156.2	125.3	0	0	114	C244 H264	C244-E246 VanDerWaalsContact C-N 3.25Å; C244-E246 PolarHBondContact O-N 2.98Å; E246-H264 IonicContact OE2-CD2 3.29Å; E246-H264 PolarHBondContact OE2-CD2 2.66Å; E246-H264 IonicContact OE2-CG 2.92Å
247	C	74.4	Confident	67.9	Low	45 Å²	45	77.2 Å²	77.2	30%	0.304	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.8	15	179.6	79.4	0	0	0	0	114.9	K249 H260 H264	C247-K249 PolarHBondContact O-N 3.42Å; C247-H260 PolarHBondContact SG-NE2 3.4Å; C247-H264 PolarHBondContact SG-NE2 3.49Å; C247-H264 VanDerWaalsContact SG-NE2 3.43Å
248	L	68.7	Low	68.1	Low	136 Å²	136	77.3 Å²	77.3	71%	0.712	40%	0.404	S	S	*	.			trans	58.3	1.2	173.9	-53.6	-179.9	0	0	0	117.1	C244 A250	C244-L248 WeakPolarHBondContact O-CA 3.41Å; C244-L248 PolarHBondContact O-N 2.57Å; L248-A250 PolarHBondContact O-N 3.23Å
249	K	70.6	Confident	68.6	Low	121 Å²	121	79 Å²	79	53%	0.526	40%	0.399	S	S	.	.			trans	-58.1	132.7	173.5	-73.5	176.6	-174	160.5	0	110.9	C244 C247 F251	C244-K249 WeakPolarHBondContact CB-O 3.27Å; C244-K249 PolarHBondContact N-O 3.21Å; C247-K249 PolarHBondContact O-N 3.42Å; K249-F251 HydrophobicContact CB-CE2 3.78Å; K249-F251 HydrophobicContact CB-CZ 4.04Å; K249-F251 WeakPolarHBondContact O-CE2 3.32Å
250	A	70.1	Confident	69.4	Low	33 Å²	33	75.9 Å²	75.9	27%	0.273	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.6	-169.4	0	0	0	0	0	111.2	K240 F242 K243 L248	K240-A250 HydrophobicContact CB-CB 3.51Å; K240-A250 HydrophobicContact CD-CB 4.28Å; K240-A250 WeakPolarHBondContact CD-O 3.19Å; K240-A250 HydrophobicContact CG-CB 4.4Å; F242-A250 CarbonylContact O-C 3.51Å; F242-A250 WeakPolarHBondContact O-CA 3.48Å; K243-A250 HydrophobicContact CG-CB 3.93Å; L248-A250 PolarHBondContact O-N 3.23Å
251	F	75	Confident	69.7	Low	50 Å²	50	72.8 Å²	72.8	22%	0.219	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	146.7	-171.3	-59.4	-93.7	0	0	0	111.3	K240 L241 F242 K249 Q253 A256 L257 H260	K240-F251 CarbonylContact C-O 3.49Å; K240-F251 VanDerWaalsContact C-O 3.31Å; K240-F251 WeakPolarHBondContact CA-O 3.44Å; L241-F251 PolarHBondContact N-O 3.03Å; F242-F251 HydrophobicContact CB-CB 4.44Å; F242-F251 PolarHBondContact N-O 3.43Å; F242-F251 PolarHBondContact O-N 3.48Å; K249-F251 HydrophobicContact CB-CE2 3.78Å; K249-F251 HydrophobicContact CB-CZ 4.04Å; K249-F251 WeakPolarHBondContact O-CE2 3.32Å; F251-Q253 VanDerWaalsContact C-N 3.25Å; F251-Q253 PolarHBondContact O-N 3.45Å; F251-A256 HydrophobicContact CB-CB 4.25Å; F251-A256 HydrophobicContact CD1-CB 3.88Å; F251-A256 HydrophobicContact CG-CB 4.33Å; F251-L257 HydrophobicContact CB-CB 4.39Å; F251-L257 HydrophobicContact CD2-CB 3.98Å; F251-L257 HydrophobicContact CD2-CD1 4.04Å; F251-L257 HydrophobicContact CE2-CD1 4.2Å; F251-L257 HydrophobicContact CG-CB 4.34Å; F251-H260 HydrophobicContact CE1-CB 4.11Å; F251-H260 HydrophobicContact CE2-CB 4.02Å; F251-H260 AromaticContact CE2-CD2 3.38Å; F251-H260 WeakPolarHBondContact CE2-CD2 3.24Å; F251-H260 AromaticContact CE2-CG 3.92Å; F251-H260 HydrophobicContact CZ-CB 3.55Å; F251-H260 AromaticContact CZ-CD2 3.35Å; F251-H260 WeakPolarHBondContact CZ-CD2 3.37Å; F251-H260 AromaticContact CZ-CG 3.48Å; F251-H260 VanDerWaalsContact CZ-CG 3.48Å
252	S	68.7	Low	70.3	Confident	27 Å²	27	70.9 Å²	70.9	19%	0.189	36%	0.358	C	S	.	.	S	Bend	trans	-76.8	-8.4	175.5	55.1	0	0	0	0	113.7	N235	N235-S252 PolarHBondContact OD1-OG 3.34Å
253	Q	69.6	Low	70.1	Confident	62 Å²	62	71.6 Å²	71.6	29%	0.29	37%	0.368	S	S	.	.	S	Bend	trans	-141.5	136.3	-178.6	-57.7	-174.8	11	0	0	111.3	K231 F242 F251 S255 A256 L257	K231-Q253 PolarHBondContact O-NE2 2.92Å; F242-Q253 VanDerWaalsContact CD2-C 3.44Å; F251-Q253 VanDerWaalsContact C-N 3.25Å; F251-Q253 PolarHBondContact O-N 3.45Å; Q253-S255 VanDerWaalsContact C-N 3.32Å; Q253-S255 PolarHBondContact O-N 2.89Å; Q253-A256 HydrophobicContact CB-CB 4.45Å; Q253-A256 WeakPolarHBondContact O-CB 3.45Å; Q253-A256 PolarHBondContact O-N 3.05Å; Q253-A256 VanDerWaalsContact O-N 3.13Å; Q253-L257 PolarHBondContact O-N 2.88Å
254	S	63.2	Low	70.1	Confident	58 Å²	58	68.4 Å²	68.4	41%	0.406	36%	0.355	S	S	.	.	H	α-helix	trans	-60.3	-38.2	178.6	51.1	0	0	0	0	112.9	F242 A256 L257 I258	F242-S254 VanDerWaalsContact CD2-N 3.31Å; S254-A256 VanDerWaalsContact C-N 3.27Å; S254-A256 PolarHBondContact O-N 3.18Å; S254-L257 WeakPolarHBondContact O-CB 3.23Å; S254-L257 PolarHBondContact O-N 2.95Å; S254-L257 VanDerWaalsContact O-N 3.12Å; S254-I258 WeakPolarHBondContact O-CG1 3.18Å; S254-I258 PolarHBondContact O-N 3.35Å
255	S	65.6	Low	69.7	Low	69 Å²	69	72 Å²	72	48%	0.483	38%	0.378	S	S	.	.	H	α-helix	trans	-58.1	-37.5	174.7	52.8	0	0	0	0	112.8	Q253 Q259	Q253-S255 VanDerWaalsContact C-N 3.32Å; Q253-S255 PolarHBondContact O-N 2.89Å; S255-Q259 WeakPolarHBondContact O-CB 3.26Å; S255-Q259 PolarHBondContact O-N 3.12Å
256	A	71.1	Confident	69.5	Low	28 Å²	28	64.6 Å²	64.6	23%	0.231	36%	0.356	C	S	.	.	H	α-helix	trans	-74	-32.7	176.5	0	0	0	0	0	112.2	F251 Q253 S254 H260	F251-A256 HydrophobicContact CB-CB 4.25Å; F251-A256 HydrophobicContact CD1-CB 3.88Å; F251-A256 HydrophobicContact CG-CB 4.33Å; Q253-A256 HydrophobicContact CB-CB 4.45Å; Q253-A256 WeakPolarHBondContact O-CB 3.45Å; Q253-A256 PolarHBondContact O-N 3.05Å; Q253-A256 VanDerWaalsContact O-N 3.13Å; S254-A256 VanDerWaalsContact C-N 3.27Å; S254-A256 PolarHBondContact O-N 3.18Å; A256-H260 WeakPolarHBondContact O-CB 3.37Å; A256-H260 PolarHBondContact O-N 3.17Å
257	L	73.5	Confident	69.2	Low	19 Å²	19	63.5 Å²	63.5	10%	0.099	35%	0.351	C	S	.	.	H	α-helix	trans	-65.4	-51.3	170.3	170	59.3	0	0	0	111.3	F242 C244 F251 Q253 S254 Q259 H260 Q261	F242-L257 HydrophobicContact CB-CB 3.97Å; F242-L257 HydrophobicContact CB-CD2 3.8Å; C244-L257 VanDerWaalsContact CA-CD1 3.47Å; C244-L257 HydrophobicContact CB-CD1 3.57Å; F251-L257 HydrophobicContact CB-CB 4.39Å; F251-L257 HydrophobicContact CD2-CB 3.98Å; F251-L257 HydrophobicContact CD2-CD1 4.04Å; F251-L257 HydrophobicContact CE2-CD1 4.2Å; F251-L257 HydrophobicContact CG-CB 4.34Å; Q253-L257 PolarHBondContact O-N 2.88Å; S254-L257 WeakPolarHBondContact O-CB 3.23Å; S254-L257 PolarHBondContact O-N 2.95Å; S254-L257 VanDerWaalsContact O-N 3.12Å; L257-Q259 VanDerWaalsContact C-N 3.28Å; L257-Q259 PolarHBondContact O-N 2.89Å; L257-H260 CarbonylContact O-C 3.31Å; L257-H260 WeakPolarHBondContact O-CA 3.27Å; L257-H260 WeakPolarHBondContact O-CB 3.25Å; L257-H260 PolarHBondContact O-N 3.5Å; L257-Q261 HydrophobicContact CD1-CG 3.97Å; L257-Q261 HydrophobicContact CG-CG 4.46Å; L257-Q261 WeakPolarHBondContact O-CG 3.47Å; L257-Q261 PolarHBondContact O-N 2.86Å
258	I	66.6	Low	69.3	Low	87 Å²	87	67.2 Å²	67.2	45%	0.446	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-42.3	178.4	-65.7	162.8	0	0	0	110.3	S254 H260 Q261 R262	S254-I258 WeakPolarHBondContact O-CG1 3.18Å; S254-I258 PolarHBondContact O-N 3.35Å; I258-H260 VanDerWaalsContact C-N 3.25Å; I258-H260 PolarHBondContact O-N 2.98Å; I258-Q261 PolarHBondContact O-N 3.16Å; I258-R262 PolarHBondContact O-N 3.14Å
259	Q	69.1	Low	69.3	Low	84 Å²	84	63.9 Å²	63.9	39%	0.393	35%	0.348	S	S	.	.	H	α-helix	trans	-58.9	-36	173.3	-174.9	177.4	12	0	0	112.7	S255 L257 H281	S255-Q259 WeakPolarHBondContact O-CB 3.26Å; S255-Q259 PolarHBondContact O-N 3.12Å; L257-Q259 VanDerWaalsContact C-N 3.28Å; L257-Q259 PolarHBondContact O-N 2.89Å; Q259-H281 VanDerWaalsContact CG-CD2 3.45Å; Q259-H281 WeakPolarHBondContact CG-CD2 3.31Å; Q259-H281 VanDerWaalsContact CG-NE2 3.33Å; Q259-H281 WeakPolarHBondContact CG-NE2 3.19Å; Q259-H281 PolarHBondContact NE2-CD2 3.04Å; Q259-H281 PolarHBondContact NE2-CE1 2.99Å; Q259-H281 VanDerWaalsContact NE2-CE1 3.28Å; Q259-H281 VanDerWaalsContact NE2-CG 3.32Å; Q259-H281 PolarHBondContact NE2-ND1 2.83Å; Q259-H281 PolarHBondContact NE2-NE2 3.09Å
260	H	73.5	Confident	69.4	Low	23 Å²	23	62.1 Å²	62.1	11%	0.106	34%	0.339	C	S	.	.	H	α-helix	trans	-77.6	-36.1	176.2	172.2	43.4	0	0	0	112.9	C247 F251 A256 L257 I258 R262 T263 H264	C247-H260 PolarHBondContact SG-NE2 3.4Å; F251-H260 HydrophobicContact CE1-CB 4.11Å; F251-H260 HydrophobicContact CE2-CB 4.02Å; F251-H260 AromaticContact CE2-CD2 3.38Å; F251-H260 WeakPolarHBondContact CE2-CD2 3.24Å; F251-H260 AromaticContact CE2-CG 3.92Å; F251-H260 HydrophobicContact CZ-CB 3.55Å; F251-H260 AromaticContact CZ-CD2 3.35Å; F251-H260 WeakPolarHBondContact CZ-CD2 3.37Å; F251-H260 AromaticContact CZ-CG 3.48Å; F251-H260 VanDerWaalsContact CZ-CG 3.48Å; A256-H260 WeakPolarHBondContact O-CB 3.37Å; A256-H260 PolarHBondContact O-N 3.17Å; L257-H260 CarbonylContact O-C 3.31Å; L257-H260 WeakPolarHBondContact O-CA 3.27Å; L257-H260 WeakPolarHBondContact O-CB 3.25Å; L257-H260 PolarHBondContact O-N 3.5Å; I258-H260 VanDerWaalsContact C-N 3.25Å; I258-H260 PolarHBondContact O-N 2.98Å; H260-R262 PolarHBondContact O-N 3.02Å; H260-T263 PolarHBondContact CE1-OG1 3.2Å; H260-T263 PolarHBondContact ND1-OG1 3.16Å; H260-T263 WeakPolarHBondContact O-CA 3.27Å; H260-T263 VanDerWaalsContact O-CB 3.31Å; H260-T263 WeakPolarHBondContact O-CB 3.25Å; H260-T263 PolarHBondContact O-N 2.87Å; H260-T263 PolarHBondContact O-OG1 2.84Å; H260-H264 AromaticContact CE1-CE1 3.76Å; H260-H264 AromaticContact CE1-NE2 3.37Å; H260-H264 PolarHBondContact CE1-NE2 3.28Å; H260-H264 AromaticContact NE2-NE2 3.32Å; H260-H264 PolarHBondContact NE2-NE2 3.36Å
261	Q	69.2	Low	68.8	Low	62 Å²	62	65.4 Å²	65.4	29%	0.29	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-32.5	176.4	-71.5	173.3	-79.9	0	0	112.1	L257 I258 T263 H264 T265	L257-Q261 HydrophobicContact CD1-CG 3.97Å; L257-Q261 HydrophobicContact CG-CG 4.46Å; L257-Q261 WeakPolarHBondContact O-CG 3.47Å; L257-Q261 PolarHBondContact O-N 2.86Å; I258-Q261 PolarHBondContact O-N 3.16Å; Q261-T263 PolarHBondContact O-N 3.03Å; Q261-H264 PolarHBondContact O-N 3.41Å; Q261-T265 PolarHBondContact O-N 2.95Å
262	R	75.8	Confident	68.6	Low	60 Å²	60	63 Å²	63	23%	0.226	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-9.3	169.2	-65	-175	176.2	147.5	8.8	115	I258 H260 G266 E267	I258-R262 PolarHBondContact O-N 3.14Å; H260-R262 PolarHBondContact O-N 3.02Å; R262-G266 WeakPolarHBondContact O-CA 3.48Å; R262-G266 PolarHBondContact O-N 3.4Å; R262-G266 VanDerWaalsContact O-N 3.14Å; R262-E267 HydrophobicContact CB-CB 4.34Å; R262-E267 HydrophobicContact CG-CB 4.03Å; R262-E267 IonicContact NE-OE2 2.77Å; R262-E267 PolarHBondContact NE-OE2 3.42Å
263	T	67.7	Low	68.3	Low	89 Å²	89	72 Å²	72	55%	0.546	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-15.3	169.6	69.6	0	0	0	0	113.3	H260 Q261	H260-T263 PolarHBondContact CE1-OG1 3.2Å; H260-T263 PolarHBondContact ND1-OG1 3.16Å; H260-T263 WeakPolarHBondContact O-CA 3.27Å; H260-T263 VanDerWaalsContact O-CB 3.31Å; H260-T263 WeakPolarHBondContact O-CB 3.25Å; H260-T263 PolarHBondContact O-N 2.87Å; H260-T263 PolarHBondContact O-OG1 2.84Å; Q261-T263 PolarHBondContact O-N 3.03Å
264	H	68.1	Low	67.4	Low	78 Å²	78	74.7 Å²	74.7	36%	0.361	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-49.5	170.2	-53.8	-56.2	0	0	0	110.7	C244 E246 C247 H260 Q261 G266	C244-H264 PolarHBondContact SG-NE2 2.89Å; E246-H264 IonicContact OE2-CD2 3.29Å; E246-H264 PolarHBondContact OE2-CD2 2.66Å; E246-H264 IonicContact OE2-CG 2.92Å; C247-H264 PolarHBondContact SG-NE2 3.49Å; C247-H264 VanDerWaalsContact SG-NE2 3.43Å; H260-H264 AromaticContact CE1-CE1 3.76Å; H260-H264 AromaticContact CE1-NE2 3.37Å; H260-H264 PolarHBondContact CE1-NE2 3.28Å; H260-H264 AromaticContact NE2-NE2 3.32Å; H260-H264 PolarHBondContact NE2-NE2 3.36Å; Q261-H264 PolarHBondContact O-N 3.41Å; H264-G266 VanDerWaalsContact C-N 3.26Å; H264-G266 PolarHBondContact O-N 3.32Å
265	T	65.7	Low	67.3	Low	76 Å²	76	73.7 Å²	73.7	47%	0.466	38%	0.381	S	S	.	.	S	Bend	trans	-72	-17.1	177.8	71.2	0	0	0	0	113.8	Q261 E267	Q261-T265 PolarHBondContact O-N 2.95Å; T265-E267 WeakPolarHBondContact CB-OE1 3.13Å; T265-E267 PolarHBondContact O-N 3.23Å; T265-E267 VanDerWaalsContact OG1-CD 3.27Å; T265-E267 WeakPolarHBondContact OG1-CG 3.21Å; T265-E267 PolarHBondContact OG1-OE1 3.17Å
266	G	64.9	Low	67	Low	37 Å²	37	73.1 Å²	73.1	38%	0.381	39%	0.386	S	S	.	.			trans	73.6	2	177.9	0	0	0	0	0	115.6	R262 H264 K268	R262-G266 WeakPolarHBondContact O-CA 3.48Å; R262-G266 PolarHBondContact O-N 3.4Å; R262-G266 VanDerWaalsContact O-N 3.14Å; H264-G266 VanDerWaalsContact C-N 3.26Å; H264-G266 PolarHBondContact O-N 3.32Å; G266-K268 WeakPolarHBondContact O-CE 3.48Å; G266-K268 PolarHBondContact O-NZ 2.97Å
267	E	63.2	Low	66.7	Low	89 Å²	89	76.4 Å²	76.4	42%	0.416	40%	0.395	S	S	.	.			trans	-52.5	139.1	-178.7	-82	165.9	-130.2	0	0	114.2	R262 T265	R262-E267 HydrophobicContact CB-CB 4.34Å; R262-E267 HydrophobicContact CG-CB 4.03Å; R262-E267 IonicContact NE-OE2 2.77Å; R262-E267 PolarHBondContact NE-OE2 3.42Å; T265-E267 WeakPolarHBondContact CB-OE1 3.13Å; T265-E267 PolarHBondContact O-N 3.23Å; T265-E267 VanDerWaalsContact OG1-CD 3.27Å; T265-E267 WeakPolarHBondContact OG1-CG 3.21Å; T265-E267 PolarHBondContact OG1-OE1 3.17Å
268	K	75.2	Confident	66.4	Low	123 Å²	123	77.6 Å²	77.6	54%	0.535	41%	0.408	S	S	.	.			trans	-134.4	67.3	179.6	-69.9	157.5	-164	138.5	0	112.1	G266 Y270 A278 F279	G266-K268 WeakPolarHBondContact O-CE 3.48Å; G266-K268 PolarHBondContact O-NZ 2.97Å; K268-Y270 PolarHBondContact O-N 2.9Å; K268-Y270 VanDerWaalsContact O-N 3.13Å; K268-A278 HydrophobicContact CB-CB 3.55Å; K268-A278 HydrophobicContact CD-CB 4.39Å; K268-F279 CarbonylContact C-O 3.58Å; K268-F279 VanDerWaalsContact CA-O 3.3Å; K268-F279 WeakPolarHBondContact CA-O 3.29Å
269	P	69.4	Low	66.7	Low	66 Å²	66	75.7 Å²	75.7	43%	0.429	40%	0.396	S	S	.	.			trans	-65.5	-20.1	-170	-22	35.2	0	0	0	115	I271	P269-I271 PolarHBondContact O-N 3.49Å
270	Y	71.7	Confident	66.8	Low	85 Å²	85	73.1 Å²	73.1	33%	0.333	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	89.5	-173.6	-56.2	-80	0	0	0	110.6	K268 F279 S280 H281 S282	K268-Y270 PolarHBondContact O-N 2.9Å; K268-Y270 VanDerWaalsContact O-N 3.13Å; Y270-F279 WeakPolarHBondContact CB-O 3.46Å; Y270-F279 WeakPolarHBondContact CD2-O 3.45Å; Y270-F279 PolarHBondContact N-O 3.11Å; Y270-F279 PolarHBondContact O-N 2.83Å; Y270-S280 WeakPolarHBondContact CD2-O 3.15Å; Y270-S280 WeakPolarHBondContact CE2-O 3.48Å; Y270-H281 VanDerWaalsContact CD2-CA 3.48Å; Y270-S282 VanDerWaalsContact CD2-N 3.25Å
271	I	58.3	Low	66.7	Low	101 Å²	101	74.3 Å²	74.3	52%	0.518	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132.1	-179	-54.3	179	0	0	0	111	P269 K273 A278	P269-I271 PolarHBondContact O-N 3.49Å; I271-K273 PolarHBondContact O-N 3.3Å; I271-A278 HydrophobicContact CG1-CB 4.05Å
272	C	70.3	Confident	66.2	Low	1 Å²	1	74.7 Å²	74.7	1%	0.007	40%	0.402	C	S	.	.			trans	-73.5	109.5	172	178.1	0	0	0	0	110.7	E274 C275 G276 K277 F279 L285	C272-E274 PolarHBondContact O-N 3.35Å; C272-C275 PolarHBondContact O-N 3.36Å; C272-G276 WeakPolarHBondContact O-CA 3.48Å; C272-G276 PolarHBondContact O-N 3.48Å; C272-K277 HydrophobicContact CB-CB 4.31Å; C272-K277 WeakPolarHBondContact CB-O 3.44Å; C272-K277 PolarHBondContact N-O 3.06Å; C272-F279 HydrophobicContact CB-CE2 4.4Å; C272-L285 HydrophobicContact CB-CD1 3.5Å; C272-L285 VanDerWaalsContact CB-CD1 3.5Å
273	K	62.6	Low	65.7	Low	215 Å²	215	74.3 Å²	74.3	94%	0.935	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.6	178	-61.8	-168.7	178.7	-171.1	0	113.1	I271	I271-K273 PolarHBondContact O-N 3.3Å
274	E	50.6	Low	65.8	Low	118 Å²	118	72 Å²	72	55%	0.551	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-19.5	-176.8	-59.2	170.6	149	0	0	114.4	C272 L289 H292	C272-E274 PolarHBondContact O-N 3.35Å; E274-L289 VanDerWaalsContact OE2-CD2 3.26Å; E274-L289 WeakPolarHBondContact OE2-CD2 3.47Å; E274-H292 WeakPolarHBondContact OE2-CB 3.48Å; E274-H292 IonicContact OE2-CD2 3.31Å; E274-H292 PolarHBondContact OE2-CD2 2.82Å; E274-H292 IonicContact OE2-CG 3.14Å
275	C	61.9	Low	65.8	Low	38 Å²	38	69.5 Å²	69.5	26%	0.257	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153	20.9	176.9	80.9	0	0	0	0	116.9	C272 K277 H288 H292	C272-C275 PolarHBondContact O-N 3.36Å; C275-K277 PolarHBondContact O-N 3.04Å; C275-H288 PolarHBondContact SG-NE2 3.44Å; C275-H292 WeakPolarHBondContact CB-NE2 3.41Å; C275-H292 PolarHBondContact SG-NE2 2.91Å
276	G	57.7	Low	65.5	Low	56 Å²	56	68.7 Å²	68.7	58%	0.577	39%	0.385	S	S	*	.			trans	67.8	1.7	174.5	0	0	0	0	0	115.8	C272 A278	C272-G276 WeakPolarHBondContact O-CA 3.48Å; C272-G276 PolarHBondContact O-N 3.48Å; G276-A278 PolarHBondContact O-N 2.83Å
277	K	64.7	Low	65.5	Low	97 Å²	97	73.2 Å²	73.2	42%	0.422	40%	0.395	S	S	.	.			trans	-72.9	119.3	-176.9	-77.2	-171.2	173.8	-168.6	0	111.8	C272 C275 F279	C272-K277 HydrophobicContact CB-CB 4.31Å; C272-K277 WeakPolarHBondContact CB-O 3.44Å; C272-K277 PolarHBondContact N-O 3.06Å; C275-K277 PolarHBondContact O-N 3.04Å; K277-F279 HydrophobicContact CB-CE2 3.59Å; K277-F279 HydrophobicContact CB-CZ 3.95Å; K277-F279 HydrophobicContact CD-CZ 4.49Å; K277-F279 VanDerWaalsContact O-CD2 3.24Å; K277-F279 WeakPolarHBondContact O-CD2 3.42Å; K277-F279 WeakPolarHBondContact O-CE2 3.34Å
278	A	67.4	Low	65.7	Low	44 Å²	44	69.7 Å²	69.7	36%	0.364	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.3	177.4	0	0	0	0	0	112.2	K268 I271 G276	K268-A278 HydrophobicContact CB-CB 3.55Å; K268-A278 HydrophobicContact CD-CB 4.39Å; I271-A278 HydrophobicContact CG1-CB 4.05Å; G276-A278 PolarHBondContact O-N 2.83Å
279	F	74.2	Confident	64.9	Low	47 Å²	47	66.9 Å²	66.9	21%	0.206	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146.4	177.5	-61.2	-92.9	0	0	0	111.9	K268 Y270 C272 K277 H281 L285 H288	K268-F279 CarbonylContact C-O 3.58Å; K268-F279 VanDerWaalsContact CA-O 3.3Å; K268-F279 WeakPolarHBondContact CA-O 3.29Å; Y270-F279 WeakPolarHBondContact CB-O 3.46Å; Y270-F279 WeakPolarHBondContact CD2-O 3.45Å; Y270-F279 PolarHBondContact N-O 3.11Å; Y270-F279 PolarHBondContact O-N 2.83Å; C272-F279 HydrophobicContact CB-CE2 4.4Å; K277-F279 HydrophobicContact CB-CE2 3.59Å; K277-F279 HydrophobicContact CB-CZ 3.95Å; K277-F279 HydrophobicContact CD-CZ 4.49Å; K277-F279 VanDerWaalsContact O-CD2 3.24Å; K277-F279 WeakPolarHBondContact O-CD2 3.42Å; K277-F279 WeakPolarHBondContact O-CE2 3.34Å; F279-H281 VanDerWaalsContact C-N 3.28Å; F279-H281 PolarHBondContact O-N 3.19Å; F279-L285 HydrophobicContact CB-CB 4.4Å; F279-L285 HydrophobicContact CD2-CB 4.06Å; F279-L285 HydrophobicContact CD2-CD1 4.07Å; F279-L285 HydrophobicContact CE2-CD1 4.23Å; F279-L285 HydrophobicContact CG-CB 4.36Å; F279-H288 HydrophobicContact CE1-CB 4.16Å; F279-H288 HydrophobicContact CE2-CB 4.11Å; F279-H288 AromaticContact CE2-CD2 3.18Å; F279-H288 WeakPolarHBondContact CE2-CD2 3.48Å; F279-H288 AromaticContact CE2-CG 3.84Å; F279-H288 AromaticContact CE2-NE2 3.99Å; F279-H288 HydrophobicContact CZ-CB 3.63Å; F279-H288 AromaticContact CZ-CD2 3.23Å; F279-H288 WeakPolarHBondContact CZ-CD2 3.25Å; F279-H288 AromaticContact CZ-CG 3.43Å; F279-H288 VanDerWaalsContact CZ-CG 3.43Å; F279-H288 AromaticContact CZ-NE2 3.99Å
280	S	70.4	Confident	64.6	Low	30 Å²	30	69.6 Å²	69.6	21%	0.21	37%	0.37	C	S	.	.	S	Bend	trans	-69.1	-23.2	176.1	58.9	0	0	0	0	113.8	Y270	Y270-S280 WeakPolarHBondContact CD2-O 3.15Å; Y270-S280 WeakPolarHBondContact CE2-O 3.48Å
281	H	71.6	Confident	63.9	Low	49 Å²	49	69 Å²	69	23%	0.227	38%	0.375	C	S	.	.	S	Bend	trans	-134.3	139.8	-175.5	-32	134.7	0	0	0	112.1	Q259 Y270 F279 A283 S284 L285	Q259-H281 VanDerWaalsContact CG-CD2 3.45Å; Q259-H281 WeakPolarHBondContact CG-CD2 3.31Å; Q259-H281 VanDerWaalsContact CG-NE2 3.33Å; Q259-H281 WeakPolarHBondContact CG-NE2 3.19Å; Q259-H281 PolarHBondContact NE2-CD2 3.04Å; Q259-H281 PolarHBondContact NE2-CE1 2.99Å; Q259-H281 VanDerWaalsContact NE2-CE1 3.28Å; Q259-H281 VanDerWaalsContact NE2-CG 3.32Å; Q259-H281 PolarHBondContact NE2-ND1 2.83Å; Q259-H281 PolarHBondContact NE2-NE2 3.09Å; Y270-H281 VanDerWaalsContact CD2-CA 3.48Å; F279-H281 VanDerWaalsContact C-N 3.28Å; F279-H281 PolarHBondContact O-N 3.19Å; H281-A283 VanDerWaalsContact C-N 3.29Å; H281-A283 PolarHBondContact O-N 3.16Å; H281-S284 PolarHBondContact ND1-OG 3.47Å; H281-S284 WeakPolarHBondContact O-CA 3.33Å; H281-S284 WeakPolarHBondContact O-CB 3.43Å; H281-S284 PolarHBondContact O-N 3.19Å; H281-L285 PolarHBondContact O-N 3.01Å; H281-L285 VanDerWaalsContact O-N 3.16Å
282	S	59.7	Low	63.9	Low	69 Å²	69	67.4 Å²	67.4	48%	0.483	37%	0.366	S	S	.	.	H	α-helix	trans	-56.1	-40.2	173.4	55.4	0	0	0	0	112.8	Y270 S284 L285 C286	Y270-S282 VanDerWaalsContact CD2-N 3.25Å; S282-S284 PolarHBondContact O-N 3.4Å; S282-L285 WeakPolarHBondContact O-CB 3.46Å; S282-L285 PolarHBondContact O-N 3.34Å; S282-C286 WeakPolarHBondContact O-CB 3.37Å; S282-C286 PolarHBondContact O-N 3.47Å
283	A	64.5	Low	63.2	Low	52 Å²	52	70.9 Å²	70.9	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-65.4	-23.3	175.9	0	0	0	0	0	113.6	H281 K287	H281-A283 VanDerWaalsContact C-N 3.29Å; H281-A283 PolarHBondContact O-N 3.16Å; A283-K287 VanDerWaalsContact O-CD 3.27Å; A283-K287 WeakPolarHBondContact O-CD 3.29Å; A283-K287 WeakPolarHBondContact O-CG 3.18Å; A283-K287 PolarHBondContact O-N 3.17Å
284	S	70.3	Confident	62.6	Low	40 Å²	40	67.1 Å²	67.1	28%	0.28	38%	0.382	S	S	.	.	H	α-helix	trans	-78.7	-40.5	172.4	-60.4	0	0	0	0	111.1	H281 S282 K287 H288	H281-S284 PolarHBondContact ND1-OG 3.47Å; H281-S284 WeakPolarHBondContact O-CA 3.33Å; H281-S284 WeakPolarHBondContact O-CB 3.43Å; H281-S284 PolarHBondContact O-N 3.19Å; S282-S284 PolarHBondContact O-N 3.4Å; S284-K287 PolarHBondContact O-N 2.98Å; S284-H288 PolarHBondContact O-N 3.27Å
285	L	66.8	Low	62.6	Low	26 Å²	26	68.4 Å²	68.4	14%	0.136	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-48	172	172	58.1	0	0	0	111.5	C272 F279 H281 S282 K287 H288 L289	C272-L285 HydrophobicContact CB-CD1 3.5Å; C272-L285 VanDerWaalsContact CB-CD1 3.5Å; F279-L285 HydrophobicContact CB-CB 4.4Å; F279-L285 HydrophobicContact CD2-CB 4.06Å; F279-L285 HydrophobicContact CD2-CD1 4.07Å; F279-L285 HydrophobicContact CE2-CD1 4.23Å; F279-L285 HydrophobicContact CG-CB 4.36Å; H281-L285 PolarHBondContact O-N 3.01Å; H281-L285 VanDerWaalsContact O-N 3.16Å; S282-L285 WeakPolarHBondContact O-CB 3.46Å; S282-L285 PolarHBondContact O-N 3.34Å; L285-K287 VanDerWaalsContact C-N 3.3Å; L285-K287 PolarHBondContact O-N 3.07Å; L285-H288 CarbonylContact O-C 3.57Å; L285-H288 WeakPolarHBondContact O-CA 3.18Å; L285-H288 WeakPolarHBondContact O-CB 3.37Å; L285-H288 PolarHBondContact O-N 3.28Å; L285-L289 HydrophobicContact CD1-CD1 4.33Å; L285-L289 HydrophobicContact CD1-CD2 4.18Å; L285-L289 HydrophobicContact CD1-CG 4Å; L285-L289 HydrophobicContact CG-CD1 4.21Å; L285-L289 HydrophobicContact CG-CG 4.36Å; L285-L289 PolarHBondContact O-N 3.27Å
286	C	61.3	Low	62.2	Low	59 Å²	59	73 Å²	73	40%	0.399	40%	0.403	S	S	.	.	H	α-helix	trans	-56.3	-41.5	175.8	178.1	0	0	0	0	112.4	S282 H288 R290	S282-C286 WeakPolarHBondContact O-CB 3.37Å; S282-C286 PolarHBondContact O-N 3.47Å; C286-H288 PolarHBondContact O-N 2.91Å; C286-R290 WeakPolarHBondContact O-CG 3.27Å; C286-R290 PolarHBondContact O-N 2.64Å
287	K	63.8	Low	61.9	Low	132 Å²	132	74.3 Å²	74.3	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-69.4	-9.9	174.2	-71.2	168	-170.6	172.7	0	114.2	A283 S284 L285	A283-K287 VanDerWaalsContact O-CD 3.27Å; A283-K287 WeakPolarHBondContact O-CD 3.29Å; A283-K287 WeakPolarHBondContact O-CG 3.18Å; A283-K287 PolarHBondContact O-N 3.17Å; S284-K287 PolarHBondContact O-N 2.98Å; L285-K287 VanDerWaalsContact C-N 3.3Å; L285-K287 PolarHBondContact O-N 3.07Å
288	H	67.6	Low	61.7	Low	16 Å²	16	72.5 Å²	72.5	7%	0.074	39%	0.394	C	S	.	.	H	α-helix	trans	-103.7	-34	176.5	168.2	46.5	0	0	0	112.9	C275 F279 S284 L285 C286 R290 T291 H292	C275-H288 PolarHBondContact SG-NE2 3.44Å; F279-H288 HydrophobicContact CE1-CB 4.16Å; F279-H288 HydrophobicContact CE2-CB 4.11Å; F279-H288 AromaticContact CE2-CD2 3.18Å; F279-H288 WeakPolarHBondContact CE2-CD2 3.48Å; F279-H288 AromaticContact CE2-CG 3.84Å; F279-H288 AromaticContact CE2-NE2 3.99Å; F279-H288 HydrophobicContact CZ-CB 3.63Å; F279-H288 AromaticContact CZ-CD2 3.23Å; F279-H288 WeakPolarHBondContact CZ-CD2 3.25Å; F279-H288 AromaticContact CZ-CG 3.43Å; F279-H288 VanDerWaalsContact CZ-CG 3.43Å; F279-H288 AromaticContact CZ-NE2 3.99Å; S284-H288 PolarHBondContact O-N 3.27Å; L285-H288 CarbonylContact O-C 3.57Å; L285-H288 WeakPolarHBondContact O-CA 3.18Å; L285-H288 WeakPolarHBondContact O-CB 3.37Å; L285-H288 PolarHBondContact O-N 3.28Å; C286-H288 PolarHBondContact O-N 2.91Å; H288-R290 PolarHBondContact O-N 2.86Å; H288-T291 PolarHBondContact ND1-OG1 3.25Å; H288-T291 WeakPolarHBondContact O-CA 3.42Å; H288-T291 WeakPolarHBondContact O-CB 3.38Å; H288-T291 PolarHBondContact O-N 3.43Å; H288-T291 PolarHBondContact O-OG1 2.92Å; H288-H292 AromaticContact CE1-CD2 3.96Å
289	L	57.7	Low	61.1	Low	64 Å²	64	79 Å²	79	34%	0.335	41%	0.409	S	S	.	.	H	α-helix	trans	-56.7	-36	169.9	-65	170.6	0	0	0	110.7	E274 L285 T291 H292 T293	E274-L289 VanDerWaalsContact OE2-CD2 3.26Å; E274-L289 WeakPolarHBondContact OE2-CD2 3.47Å; L285-L289 HydrophobicContact CD1-CD1 4.33Å; L285-L289 HydrophobicContact CD1-CD2 4.18Å; L285-L289 HydrophobicContact CD1-CG 4Å; L285-L289 HydrophobicContact CG-CD1 4.21Å; L285-L289 HydrophobicContact CG-CG 4.36Å; L285-L289 PolarHBondContact O-N 3.27Å; L289-T291 PolarHBondContact O-N 3.22Å; L289-H292 PolarHBondContact O-N 3.36Å; L289-T293 PolarHBondContact O-N 3.31Å
290	R	63.2	Low	60.8	Low	123 Å²	123	76.9 Å²	76.9	46%	0.464	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	9.5	167.4	-60.9	-178.4	-165.4	-151.2	-0	116.2	C286 H288 T293 Y298	C286-R290 WeakPolarHBondContact O-CG 3.27Å; C286-R290 PolarHBondContact O-N 2.64Å; H288-R290 PolarHBondContact O-N 2.86Å; R290-T293 WeakPolarHBondContact CA-OG1 3.29Å; R290-Y298 PolarHBondContact NH1-OH 3.03Å
291	T	57.1	Low	60.6	Low	71 Å²	71	85.1 Å²	85.1	44%	0.436	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-0.2	170.7	65.6	0	0	0	0	112.7	H288 L289	H288-T291 PolarHBondContact ND1-OG1 3.25Å; H288-T291 WeakPolarHBondContact O-CA 3.42Å; H288-T291 WeakPolarHBondContact O-CB 3.38Å; H288-T291 PolarHBondContact O-N 3.43Å; H288-T291 PolarHBondContact O-OG1 2.92Å; L289-T291 PolarHBondContact O-N 3.22Å
292	H	59.1	Low	60.2	Low	69 Å²	69	87.9 Å²	87.9	32%	0.319	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-40	167.4	-63.1	-63	0	0	0	110.6	E274 C275 H288 L289 V294 K351	E274-H292 WeakPolarHBondContact OE2-CB 3.48Å; E274-H292 IonicContact OE2-CD2 3.31Å; E274-H292 PolarHBondContact OE2-CD2 2.82Å; E274-H292 IonicContact OE2-CG 3.14Å; C275-H292 WeakPolarHBondContact CB-NE2 3.41Å; C275-H292 PolarHBondContact SG-NE2 2.91Å; H288-H292 AromaticContact CE1-CD2 3.96Å; L289-H292 PolarHBondContact O-N 3.36Å; H292-V294 PolarHBondContact O-N 3.41Å; H292-K351 PolarHBondContact NE2-NZ 3.42Å
293	T	55.7	Low	60.8	Low	74 Å²	74	87 Å²	87	45%	0.454	44%	0.438	S	S	.	.	S	Bend	trans	-64.2	120.1	162.5	60.1	0	0	0	0	109.7	L289 R290 E295	L289-T293 PolarHBondContact O-N 3.31Å; R290-T293 WeakPolarHBondContact CA-OG1 3.29Å; T293-E295 PolarHBondContact O-N 3.05Å
294	V	50.7	Low	60.6	Low	135 Å²	135	86.4 Å²	86.4	82%	0.818	44%	0.436	S	S	*	.			trans	-74.4	-7.8	-172.7	-179.7	0	0	0	0	113.1	H292 K296	H292-V294 PolarHBondContact O-N 3.41Å; V294-K296 PolarHBondContact O-N 3.42Å
295	E	49.4	Very low	60.2	Low	146 Å²	146	90.4 Å²	90.4	68%	0.682	45%	0.449	S	S	*	.			trans	-64.5	114	-179.1	-62.9	-167.7	162.9	0	0	113.6	T293 C297	T293-E295 PolarHBondContact O-N 3.05Å; E295-C297 VanDerWaalsContact C-N 3.26Å; E295-C297 PolarHBondContact O-N 3.41Å; E295-C297 PolarHBondContact O-SG 3.21Å; E295-C297 VanDerWaalsContact O-SG 3.36Å
296	K	52.8	Low	59.7	Low	134 Å²	134	91.6 Å²	91.6	58%	0.583	46%	0.459	S	S	*	.			trans	-83.4	68.1	171.1	-63.2	170.7	-175.9	170.7	0	109.7	V294 Y298 F307	V294-K296 PolarHBondContact O-N 3.42Å; K296-Y298 PolarHBondContact O-N 2.83Å; K296-F307 CarbonylContact C-O 3.6Å; K296-F307 VanDerWaalsContact C-O 3.26Å
297	C	53.2	Low	59.8	Low	83 Å²	83	91.2 Å²	91.2	56%	0.561	45%	0.451	S	S	*	.			trans	-56.4	-10.7	-166	-43.3	0	0	0	0	117	E295	E295-C297 VanDerWaalsContact C-N 3.26Å; E295-C297 PolarHBondContact O-N 3.41Å; E295-C297 PolarHBondContact O-SG 3.21Å; E295-C297 VanDerWaalsContact O-SG 3.36Å
298	Y	59.4	Low	59.3	Low	60 Å²	60	87.9 Å²	87.9	24%	0.235	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	91.2	-175.9	-56.6	-74	0	0	0	111.2	R290 K296 F307 R309 R310	R290-Y298 PolarHBondContact NH1-OH 3.03Å; K296-Y298 PolarHBondContact O-N 2.83Å; Y298-F307 WeakPolarHBondContact CB-O 3.47Å; Y298-F307 PolarHBondContact N-O 3.3Å; Y298-F307 PolarHBondContact O-N 3.39Å; Y298-R309 VanDerWaalsContact CD2-C 3.47Å; Y298-R310 HydrophobicContact CD1-CB 3.85Å; Y298-R310 HydrophobicContact CD1-CG 4.05Å; Y298-R310 HydrophobicContact CD2-CB 4.37Å; Y298-R310 VanDerWaalsContact CD2-N 3.27Å; Y298-R310 HydrophobicContact CE1-CB 3.77Å; Y298-R310 HydrophobicContact CE1-CG 4.12Å; Y298-R310 HydrophobicContact CE2-CB 4.27Å; Y298-R310 HydrophobicContact CG-CB 4.16Å
299	R	54.7	Low	58.8	Low	181 Å²	181	93.6 Å²	93.6	68%	0.683	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.8	176	-161	-173.4	-68.4	-149.4	2.1	111.3	G304	R299-G304 VanDerWaalsContact CG-O 3.25Å; R299-G304 WeakPolarHBondContact CG-O 3.23Å
300	C	69.2	Low	58.6	Low	1 Å²	1	99.3 Å²	99.3	1%	0.007	48%	0.482	C	S	.	.			trans	-71.4	131	165.5	169.2	0	0	0	0	109.9	E302 C303 G304 K305 F307 L313 H316 H320	C300-E302 PolarHBondContact SG-N 3.47Å; C300-E302 VanDerWaalsContact SG-N 3.41Å; C300-E302 PolarHBondContact SG-OE2 2.85Å; C300-C303 PolarHBondContact SG-N 3.36Å; C300-C303 VanDerWaalsContact SG-N 3.39Å; C300-C303 VanDerWaalsContact SG-SG 3.63Å; C300-G304 VanDerWaalsContact O-CA 3.29Å; C300-G304 WeakPolarHBondContact O-CA 3.46Å; C300-G304 PolarHBondContact O-N 3.06Å; C300-K305 WeakPolarHBondContact CB-O 3.13Å; C300-K305 PolarHBondContact N-O 3Å; C300-F307 HydrophobicContact CB-CE2 4.36Å; C300-L313 HydrophobicContact CB-CD1 3.58Å; C300-H316 PolarHBondContact SG-NE2 3.31Å; C300-H320 PolarHBondContact SG-NE2 3.33Å; C300-H320 VanDerWaalsContact SG-NE2 3.4Å
301	K	66	Low	58.2	Low	203 Å²	203	97 Å²	97	88%	0.883	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-37.5	177.2	-69.9	-167.9	174.3	-168.2	0	111.8
302	E	62.8	Low	58.7	Low	108 Å²	108	94.8 Å²	94.8	51%	0.505	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-22.8	-174.7	-55.1	103.7	146.4	0	0	114.7	C300 Q317 H320	C300-E302 PolarHBondContact SG-N 3.47Å; C300-E302 VanDerWaalsContact SG-N 3.41Å; C300-E302 PolarHBondContact SG-OE2 2.85Å; E302-Q317 PolarHBondContact OE2-NE2 2.88Å; E302-H320 IonicContact OE2-CD2 3.33Å
303	C	71.7	Confident	59.1	Low	51 Å²	51	92.4 Å²	92.4	35%	0.345	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.6	19.7	-179.5	74.7	0	0	0	0	115.4	C300 K305 H316	C300-C303 PolarHBondContact SG-N 3.36Å; C300-C303 VanDerWaalsContact SG-N 3.39Å; C300-C303 VanDerWaalsContact SG-SG 3.63Å; C303-K305 PolarHBondContact O-N 3.24Å; C303-H316 PolarHBondContact SG-NE2 2.88Å
304	G	59.9	Low	59.6	Low	38 Å²	38	94.8 Å²	94.8	39%	0.392	47%	0.47	S	S	.	.			trans	68.4	-10.7	172.8	0	0	0	0	0	117.2	R299 C300 S306	R299-G304 VanDerWaalsContact CG-O 3.25Å; R299-G304 WeakPolarHBondContact CG-O 3.23Å; C300-G304 VanDerWaalsContact O-CA 3.29Å; C300-G304 WeakPolarHBondContact O-CA 3.46Å; C300-G304 PolarHBondContact O-N 3.06Å; G304-S306 PolarHBondContact O-N 3.24Å
305	K	62.7	Low	60.4	Low	125 Å²	125	94 Å²	94	54%	0.543	46%	0.46	S	S	.	.			trans	-61.3	126.8	-175.7	-69.3	173.2	-170.6	164.4	0	111.7	C300 C303 F307	C300-K305 WeakPolarHBondContact CB-O 3.13Å; C300-K305 PolarHBondContact N-O 3Å; C303-K305 PolarHBondContact O-N 3.24Å; K305-F307 HydrophobicContact CB-CE2 3.83Å; K305-F307 HydrophobicContact CB-CZ 4.09Å; K305-F307 WeakPolarHBondContact O-CD2 3.45Å; K305-F307 VanDerWaalsContact O-CE2 3.22Å; K305-F307 WeakPolarHBondContact O-CE2 3.4Å
306	S	55.5	Low	61.3	Low	50 Å²	50	88 Å²	88	35%	0.35	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.7	-176.4	-58.6	0	0	0	0	113	G304	G304-S306 PolarHBondContact O-N 3.24Å
307	F	63.2	Low	62.1	Low	51 Å²	51	84.8 Å²	84.8	22%	0.224	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	144.2	-176.2	-59.5	-93.8	0	0	0	111.3	K296 Y298 C300 K305 R309 L313 H316	K296-F307 CarbonylContact C-O 3.6Å; K296-F307 VanDerWaalsContact C-O 3.26Å; Y298-F307 WeakPolarHBondContact CB-O 3.47Å; Y298-F307 PolarHBondContact N-O 3.3Å; Y298-F307 PolarHBondContact O-N 3.39Å; C300-F307 HydrophobicContact CB-CE2 4.36Å; K305-F307 HydrophobicContact CB-CE2 3.83Å; K305-F307 HydrophobicContact CB-CZ 4.09Å; K305-F307 WeakPolarHBondContact O-CD2 3.45Å; K305-F307 VanDerWaalsContact O-CE2 3.22Å; K305-F307 WeakPolarHBondContact O-CE2 3.4Å; F307-R309 VanDerWaalsContact C-N 3.25Å; F307-R309 PolarHBondContact O-N 2.81Å; F307-L313 HydrophobicContact CB-CB 4.34Å; F307-L313 HydrophobicContact CD2-CB 3.93Å; F307-L313 HydrophobicContact CD2-CD1 4Å; F307-L313 HydrophobicContact CE2-CD1 4.1Å; F307-L313 HydrophobicContact CG-CB 4.23Å; F307-H316 HydrophobicContact CE1-CB 4.06Å; F307-H316 HydrophobicContact CE2-CB 4.13Å; F307-H316 AromaticContact CE2-CD2 3.35Å; F307-H316 WeakPolarHBondContact CE2-CD2 3.37Å; F307-H316 AromaticContact CE2-CG 3.91Å; F307-H316 HydrophobicContact CZ-CB 3.54Å; F307-H316 AromaticContact CZ-CD2 3.34Å; F307-H316 WeakPolarHBondContact CZ-CD2 3.48Å; F307-H316 AromaticContact CZ-CG 3.43Å; F307-H316 VanDerWaalsContact CZ-CG 3.43Å
308	S	54.4	Low	62.9	Low	63 Å²	63	86.4 Å²	86.4	44%	0.441	42%	0.417	S	S	.	.	S	Bend	trans	-79	-4.2	173.5	55.7	0	0	0	0	113.8
309	R	56.1	Low	63.2	Low	136 Å²	136	88.6 Å²	88.6	51%	0.513	43%	0.431	S	S	.	.	S	Bend	trans	-143.8	130.8	-178.8	-63.2	-177.6	177.5	173.3	-0.7	111.5	Y298 F307 S311 G312 L313	Y298-R309 VanDerWaalsContact CD2-C 3.47Å; F307-R309 VanDerWaalsContact C-N 3.25Å; F307-R309 PolarHBondContact O-N 2.81Å; R309-S311 PolarHBondContact O-N 3.1Å; R309-S311 VanDerWaalsContact O-N 3.16Å; R309-G312 WeakPolarHBondContact O-CA 3.36Å; R309-G312 PolarHBondContact O-N 2.86Å; R309-L313 PolarHBondContact O-N 3.06Å
310	R	54.1	Low	63.8	Low	184 Å²	184	83.5 Å²	83.5	69%	0.694	42%	0.415	S	S	*	.	H	α-helix	trans	-56.1	-30.3	176.1	-162.1	171.9	-175.2	152.3	2.3	113.4	Y298 L313 F314	Y298-R310 HydrophobicContact CD1-CB 3.85Å; Y298-R310 HydrophobicContact CD1-CG 4.05Å; Y298-R310 HydrophobicContact CD2-CB 4.37Å; Y298-R310 VanDerWaalsContact CD2-N 3.27Å; Y298-R310 HydrophobicContact CE1-CB 3.77Å; Y298-R310 HydrophobicContact CE1-CG 4.12Å; Y298-R310 HydrophobicContact CE2-CB 4.27Å; Y298-R310 HydrophobicContact CG-CB 4.16Å; R310-L313 PolarHBondContact O-N 2.79Å; R310-F314 WeakPolarHBondContact O-CB 3.47Å; R310-F314 PolarHBondContact O-N 3.33Å
311	S	54.9	Low	63.4	Low	75 Å²	75	87.5 Å²	87.5	52%	0.524	45%	0.448	S	S	.	.	H	α-helix	trans	-69.2	-31.4	173.8	61.2	0	0	0	0	113.6	R309 I315	R309-S311 PolarHBondContact O-N 3.1Å; R309-S311 VanDerWaalsContact O-N 3.16Å; S311-I315 WeakPolarHBondContact O-CD1 3.23Å; S311-I315 VanDerWaalsContact O-CG1 3.28Å; S311-I315 WeakPolarHBondContact O-CG1 3.37Å; S311-I315 PolarHBondContact O-N 2.49Å; S311-I315 VanDerWaalsContact O-N 3.1Å
312	G	66.4	Low	63	Low	24 Å²	24	85.1 Å²	85.1	25%	0.247	44%	0.44	C	S	.	.	H	α-helix	trans	-70.7	-43.8	174.1	0	0	0	0	0	111.2	R309 I315 H316	R309-G312 WeakPolarHBondContact O-CA 3.36Å; R309-G312 PolarHBondContact O-N 2.86Å; G312-I315 PolarHBondContact O-N 3.09Å; G312-H316 WeakPolarHBondContact O-CB 3.43Å; G312-H316 PolarHBondContact O-N 3.16Å
313	L	68.9	Low	62.5	Low	18 Å²	18	83.9 Å²	83.9	9%	0.094	46%	0.456	C	S	.	.	H	α-helix	trans	-58.4	-47.5	171.2	174.2	58.8	0	0	0	111.5	C300 F307 R309 R310 I315 H316 Q317	C300-L313 HydrophobicContact CB-CD1 3.58Å; F307-L313 HydrophobicContact CB-CB 4.34Å; F307-L313 HydrophobicContact CD2-CB 3.93Å; F307-L313 HydrophobicContact CD2-CD1 4Å; F307-L313 HydrophobicContact CE2-CD1 4.1Å; F307-L313 HydrophobicContact CG-CB 4.23Å; R309-L313 PolarHBondContact O-N 3.06Å; R310-L313 PolarHBondContact O-N 2.79Å; L313-I315 PolarHBondContact O-N 2.7Å; L313-H316 CarbonylContact O-C 3.57Å; L313-H316 WeakPolarHBondContact O-CB 3.35Å; L313-H316 PolarHBondContact O-N 2.67Å; L313-H316 VanDerWaalsContact O-N 3.1Å; L313-Q317 HydrophobicContact CD1-CG 3.83Å; L313-Q317 HydrophobicContact CG-CG 4.33Å; L313-Q317 WeakPolarHBondContact O-CG 3.39Å; L313-Q317 PolarHBondContact O-N 3.25Å
314	F	66.6	Low	61	Low	125 Å²	125	87 Å²	87	55%	0.548	47%	0.469	S	S	.	.	H	α-helix	trans	-61.1	-41.3	179.3	-179.9	-108	0	0	0	113.4	R310 H316 Q317 K318	R310-F314 WeakPolarHBondContact O-CB 3.47Å; R310-F314 PolarHBondContact O-N 3.33Å; F314-H316 VanDerWaalsContact C-N 3.32Å; F314-Q317 PolarHBondContact O-N 2.81Å; F314-K318 PolarHBondContact O-N 3.33Å
315	I	66.5	Low	60.5	Low	118 Å²	118	91.2 Å²	91.2	61%	0.605	49%	0.49	S	S	*	.	H	α-helix	trans	-64.4	-39.6	173.8	-69.4	165	0	0	0	110.6	S311 G312 L313 K318	S311-I315 WeakPolarHBondContact O-CD1 3.23Å; S311-I315 VanDerWaalsContact O-CG1 3.28Å; S311-I315 WeakPolarHBondContact O-CG1 3.37Å; S311-I315 PolarHBondContact O-N 2.49Å; S311-I315 VanDerWaalsContact O-N 3.1Å; G312-I315 PolarHBondContact O-N 3.09Å; L313-I315 PolarHBondContact O-N 2.7Å; I315-K318 PolarHBondContact O-N 3.14Å
316	H	69.3	Low	59.7	Low	19 Å²	19	92 Å²	92	9%	0.088	50%	0.5	C	S	.	.	H	α-helix	trans	-68.2	-39.6	177.8	168.9	49.6	0	0	0	113.2	C300 C303 F307 G312 L313 F314 K318 I319 H320	C300-H316 PolarHBondContact SG-NE2 3.31Å; C303-H316 PolarHBondContact SG-NE2 2.88Å; F307-H316 HydrophobicContact CE1-CB 4.06Å; F307-H316 HydrophobicContact CE2-CB 4.13Å; F307-H316 AromaticContact CE2-CD2 3.35Å; F307-H316 WeakPolarHBondContact CE2-CD2 3.37Å; F307-H316 AromaticContact CE2-CG 3.91Å; F307-H316 HydrophobicContact CZ-CB 3.54Å; F307-H316 AromaticContact CZ-CD2 3.34Å; F307-H316 WeakPolarHBondContact CZ-CD2 3.48Å; F307-H316 AromaticContact CZ-CG 3.43Å; F307-H316 VanDerWaalsContact CZ-CG 3.43Å; G312-H316 WeakPolarHBondContact O-CB 3.43Å; G312-H316 PolarHBondContact O-N 3.16Å; L313-H316 CarbonylContact O-C 3.57Å; L313-H316 WeakPolarHBondContact O-CB 3.35Å; L313-H316 PolarHBondContact O-N 2.67Å; L313-H316 VanDerWaalsContact O-N 3.1Å; F314-H316 VanDerWaalsContact C-N 3.32Å; H316-K318 PolarHBondContact O-N 3.04Å; H316-I319 VanDerWaalsContact O-CB 3.23Å; H316-I319 WeakPolarHBondContact O-CB 3.05Å; H316-I319 WeakPolarHBondContact O-CG1 3.38Å; H316-I319 PolarHBondContact O-N 3.03Å; H316-H320 AromaticContact CE1-CE1 3.64Å; H316-H320 AromaticContact CE1-NE2 3.3Å; H316-H320 PolarHBondContact CE1-NE2 3.5Å; H316-H320 VanDerWaalsContact CE1-NE2 3.3Å; H316-H320 AromaticContact NE2-CE1 3.96Å; H316-H320 AromaticContact NE2-NE2 3.24Å; H316-H320 PolarHBondContact NE2-NE2 3.38Å
317	Q	68.5	Low	59	Low	67 Å²	67	99.8 Å²	99.8	31%	0.313	53%	0.528	S	S	.	.	H	α-helix	trans	-64.8	-26.3	177.1	-71.1	-176.7	-77.5	0	0	112.7	E302 L313 F314 I319 H320 A321	E302-Q317 PolarHBondContact OE2-NE2 2.88Å; L313-Q317 HydrophobicContact CD1-CG 3.83Å; L313-Q317 HydrophobicContact CG-CG 4.33Å; L313-Q317 WeakPolarHBondContact O-CG 3.39Å; L313-Q317 PolarHBondContact O-N 3.25Å; F314-Q317 PolarHBondContact O-N 2.81Å; Q317-I319 PolarHBondContact O-N 2.92Å; Q317-H320 PolarHBondContact O-N 3.14Å; Q317-A321 PolarHBondContact O-N 3.21Å; Q317-A321 VanDerWaalsContact O-N 3.1Å
318	K	70.3	Confident	57.5	Low	118 Å²	118	107 Å²	107	51%	0.513	56%	0.555	S	S	.	*	H	α-helix	trans	-64.6	-17.8	170.3	-70.4	-164	171.8	-154.6	0	114.1	F314 I315 H316 Q322	F314-K318 PolarHBondContact O-N 3.33Å; I315-K318 PolarHBondContact O-N 3.14Å; H316-K318 PolarHBondContact O-N 3.04Å; K318-Q322 WeakPolarHBondContact O-CG 3.33Å; K318-Q322 PolarHBondContact O-N 3.01Å
319	I	64.9	Low	56.3	Low	106 Å²	106	111.1 Å²	111.1	54%	0.544	57%	0.572	S	S	.	*	H	α-helix	trans	-74.7	-39.6	173.8	-52.5	175	0	0	0	109.9	H316 Q317 Q322	H316-I319 VanDerWaalsContact O-CB 3.23Å; H316-I319 WeakPolarHBondContact O-CB 3.05Å; H316-I319 WeakPolarHBondContact O-CG1 3.38Å; H316-I319 PolarHBondContact O-N 3.03Å; Q317-I319 PolarHBondContact O-N 2.92Å; I319-Q322 PolarHBondContact O-N 2.86Å
320	H	68.4	Low	55.3	Low	73 Å²	73	108.8 Å²	108.8	34%	0.338	57%	0.574	S	S	.	*	H	α-helix	trans	-68.7	-36.6	174.1	-55.1	-49.7	0	0	0	111.6	C300 E302 H316 Q317 Q322	C300-H320 PolarHBondContact SG-NE2 3.33Å; C300-H320 VanDerWaalsContact SG-NE2 3.4Å; E302-H320 IonicContact OE2-CD2 3.33Å; H316-H320 AromaticContact CE1-CE1 3.64Å; H316-H320 AromaticContact CE1-NE2 3.3Å; H316-H320 PolarHBondContact CE1-NE2 3.5Å; H316-H320 VanDerWaalsContact CE1-NE2 3.3Å; H316-H320 AromaticContact NE2-CE1 3.96Å; H316-H320 AromaticContact NE2-NE2 3.24Å; H316-H320 PolarHBondContact NE2-NE2 3.38Å; Q317-H320 PolarHBondContact O-N 3.14Å; H320-Q322 PolarHBondContact O-N 3.25Å
321	A	59.8	Low	54.1	Low	86 Å²	86	102.8 Å²	102.8	71%	0.711	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	2.6	176	0	0	0	0	0	114.8	Q317	Q317-A321 PolarHBondContact O-N 3.21Å; Q317-A321 VanDerWaalsContact O-N 3.1Å
322	Q	57.1	Low	53.3	Low	152 Å²	152	110.6 Å²	110.6	71%	0.71	59%	0.588	S	S	*	*	S	Bend	trans	-129.6	81.9	175.2	-69.8	-171	-39	0	0	108.6	K318 I319 H320 N324	K318-Q322 WeakPolarHBondContact O-CG 3.33Å; K318-Q322 PolarHBondContact O-N 3.01Å; I319-Q322 PolarHBondContact O-N 2.86Å; H320-Q322 PolarHBondContact O-N 3.25Å; Q322-N324 PolarHBondContact O-N 3.25Å
323	G	53.2	Low	51.6	Low	82 Å²	82	119.1 Å²	119.1	85%	0.845	62%	0.618	S	S	*	*			trans	-61.9	89.3	-164.8	0	0	0	0	0	115.9
324	N	40	Very low	49.6	Very low	116 Å²	116	123.1 Å²	123.1	62%	0.62	65%	0.654	S	S	*	*			trans	-154.8	120.6	150.2	-167.7	-44.6	0	0	0	109.9	Q322 N326	Q322-N324 PolarHBondContact O-N 3.25Å; N324-N326 VanDerWaalsContact C-N 3.29Å; N324-N326 PolarHBondContact O-N 2.84Å; N324-N326 PolarHBondContact OD1-N 2.76Å
325	P	49.5	Very low	47.7	Very low	128 Å²	128	122.6 Å²	122.6	83%	0.831	67%	0.666	S	S	*	*			trans	-65.4	-24.5	180	-23.5	34.7	0	0	0	115.1
326	N	47.1	Very low	46.2	Very low	141 Å²	141	122.9 Å²	122.9	75%	0.754	68%	0.678	S	S	*	*			trans	-109.2	72.1	-160.7	-93.3	-25.7	0	0	0	114.5	N324	N324-N326 VanDerWaalsContact C-N 3.29Å; N324-N326 PolarHBondContact O-N 2.84Å; N324-N326 PolarHBondContact OD1-N 2.76Å
327	K	38.9	Very low	43.9	Very low	214 Å²	214	127.6 Å²	127.6	93%	0.93	71%	0.712	S	S	*	*			trans	-159.2	49.3	152	-115.8	160.5	-169.1	172.9	0	115.7
328	Y	32.7	Very low	42.2	Very low	203 Å²	203	130 Å²	130	80%	0.796	74%	0.736	S	S	*	*			trans	-136.8	93.6	160.7	-174.2	-110.8	0	0	0	111.7	P330	Y328-P330 HydrophobicContact CD1-CG 4.16Å; Y328-P330 HydrophobicContact CE1-CG 3.58Å; Y328-P330 VanDerWaalsContact O-CD 3.29Å; Y328-P330 WeakPolarHBondContact O-CD 3.27Å
329	N	29.7	Very low	40	Very low	149 Å²	149	130.4 Å²	130.4	80%	0.797	75%	0.749	S	S	*	*			trans	-114.4	87.4	179.2	-174	12.6	0	0	0	112.1	G331	N329-G331 VanDerWaalsContact C-N 3.32Å; N329-G331 PolarHBondContact O-N 3.14Å; N329-G331 WeakPolarHBondContact OD1-CA 3.42Å; N329-G331 PolarHBondContact OD1-N 3.12Å
330	P	35.1	Very low	38.2	Very low	86 Å²	86	130.3 Å²	130.3	56%	0.558	76%	0.758	S	S	*	*			trans	-79.1	85.6	157.1	33.8	-31.5	0	0	0	108.4	Y328 R332	Y328-P330 HydrophobicContact CD1-CG 4.16Å; Y328-P330 HydrophobicContact CE1-CG 3.58Å; Y328-P330 VanDerWaalsContact O-CD 3.29Å; Y328-P330 WeakPolarHBondContact O-CD 3.27Å; P330-R332 PolarHBondContact O-N 3.13Å; P330-R332 VanDerWaalsContact O-N 3.1Å
331	G	28.4	Very low	36.4	Very low	58 Å²	58	134.7 Å²	134.7	60%	0.598	78%	0.782	S	S	*	*			trans	-56.6	114.4	-179.3	0	0	0	0	0	112.7	N329	N329-G331 VanDerWaalsContact C-N 3.32Å; N329-G331 PolarHBondContact O-N 3.14Å; N329-G331 WeakPolarHBondContact OD1-CA 3.42Å; N329-G331 PolarHBondContact OD1-N 3.12Å
332	R	38.3	Very low	34.8	Very low	239 Å²	239	136.3 Å²	136.3	90%	0.902	79%	0.788	S	S	*	*			trans	6.5	145.6	146.1	-62.7	-175.9	-175.1	-152.6	3.1	117.2	P330	P330-R332 PolarHBondContact O-N 3.13Å; P330-R332 VanDerWaalsContact O-N 3.1Å
333	K	29.7	Very low	33.3	Very low	203 Å²	203	132.4 Å²	132.4	88%	0.883	79%	0.789	S	S	*	*			cis	-128.8	135.1	38	-58.7	176.8	-177.2	178.9	0	113.4
334	A	27.3	Very low	32.1	Very low	102 Å²	102	134.7 Å²	134.7	84%	0.843	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-98.3	127.6	138.8	0	0	0	0	0	106
335	S	27.8	Very low	31.5	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-92.7	128.1	169	45.8	0	0	0	0	108.8
336	S	33.8	Very low	30.7	Very low	124 Å²	124	138.4 Å²	138.4	87%	0.867	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-76.7	126.4	173.5	47.7	0	0	0	0	110.9
337	C	21.2	Very low	29.9	Very low	118 Å²	118	138.8 Å²	138.8	80%	0.797	79%	0.793	S	S	*	*			trans	-147.1	142.5	145.3	-163.1	0	0	0	0	108.5
338	S	32	Very low	30.2	Very low	116 Å²	116	137.4 Å²	137.4	81%	0.811	79%	0.789	S	S	*	*			trans	-124.2	100.7	-178.5	51.3	0	0	0	0	108.9
339	T	25.1	Very low	30.2	Very low	128 Å²	128	135.2 Å²	135.2	79%	0.785	79%	0.791	S	S	*	*			trans	-148.5	155	171.5	-9.4	0	0	0	0	112.4
340	S	27.7	Very low	30.6	Very low	104 Å²	104	139 Å²	139	73%	0.727	79%	0.793	S	S	*	*			trans	-56.9	148.1	-167.8	-48.8	0	0	0	0	117.3
341	L	29.1	Very low	31.3	Very low	164 Å²	164	141.7 Å²	141.7	86%	0.859	80%	0.797	S	S	*	*			trans	35.7	119.4	136.9	-78.5	157.3	0	0	0	120.4
342	S	26.1	Very low	32.2	Very low	120 Å²	120	145.9 Å²	145.9	84%	0.839	80%	0.798	S	S	*	*				141.4	155.4	112.2	69.1	0	0	0	0	115
343	G	27.4	Very low	33.5	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	78%	0.783	S	S	*	*			trans	40.9	99.9	158.9	0	0	0	0	0	121.4
344	S	26.3	Very low	35.4	Very low	131 Å²	131	133 Å²	133	92%	0.916	76%	0.757	S	S	*	*				-174.6	149.1	118.8	-88.5	0	0	0	0	115.8
345	Q	29.2	Very low	37.5	Very low	155 Å²	155	132.2 Å²	132.2	72%	0.724	74%	0.739	S	S	*	*			trans	-61.8	172.1	-167.2	-57.8	172.6	-8.1	0	0	118.8
346	K	32.3	Very low	39.9	Very low	167 Å²	167	126.8 Å²	126.8	73%	0.726	70%	0.7	S	S	*	*			trans	106.4	120.4	136.2	-88.4	153.8	178.9	157.3	0	121.7
347	I	30.6	Very low	41.9	Very low	148 Å²	148	127.9 Å²	127.9	76%	0.759	70%	0.696	S	S	*	*			trans	90.7	132.8	139.1	-63.4	162.1	0	0	0	120.3
348	H	44.4	Very low	44.2	Very low	186 Å²	186	127.4 Å²	127.4	86%	0.861	68%	0.682	S	S	*	*			trans	-57.1	133.9	171.3	-80.6	-86.4	0	0	0	113.8
349	L	33	Very low	46.3	Very low	157 Å²	157	124.2 Å²	124.2	82%	0.822	66%	0.66	S	S	*	*			trans	-121.1	96.7	155.8	-94	90	0	0	0	114
350	R	38.3	Very low	48.6	Very low	227 Å²	227	120.4 Å²	120.4	86%	0.857	65%	0.646	S	S	*	*			trans	-28.9	134.3	152.2	-177.1	179.4	-177.2	-178.7	2.3	111.9	K352	R350-K352 PolarHBondContact O-N 3.16Å
351	K	49	Very low	50.7	Low	144 Å²	144	119.5 Å²	119.5	63%	0.626	63%	0.633	S	S	*	*			trans	-69.9	75.3	-177	-154.8	166.7	-153.9	153.7	0	111.5	H292 S353	H292-K351 PolarHBondContact NE2-NZ 3.42Å; K351-S353 PolarHBondContact O-N 2.95Å; K351-S353 VanDerWaalsContact O-N 3.07Å
352	K	48.5	Very low	52.8	Low	145 Å²	145	116.5 Å²	116.5	63%	0.63	62%	0.622	S	S	*	*			trans	-54.2	107	-163.2	-144.5	169.8	-173.1	176.4	0	111.7	R350 Y354	R350-K352 PolarHBondContact O-N 3.16Å; K352-Y354 WeakPolarHBondContact O-CD2 3.26Å; K352-Y354 WeakPolarHBondContact O-CE2 3.28Å
353	S	64.1	Low	55.3	Low	82 Å²	82	112.9 Å²	112.9	57%	0.573	59%	0.591	S	S	*	*			trans	-66.2	137.1	151.6	40.3	0	0	0	0	107.5	K351 L355	K351-S353 PolarHBondContact O-N 2.95Å; K351-S353 VanDerWaalsContact O-N 3.07Å; S353-L355 PolarHBondContact O-N 3.1Å
354	Y	70.6	Confident	57.6	Low	90 Å²	90	119 Å²	119	35%	0.353	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.4	96	-174.6	-69.3	-95.7	0	0	0	108.1	K352 F363 G366 L369	K352-Y354 WeakPolarHBondContact O-CD2 3.26Å; K352-Y354 WeakPolarHBondContact O-CE2 3.28Å; Y354-F363 PolarHBondContact N-O 2.83Å; Y354-F363 WeakPolarHBondContact O-CB 3.49Å; Y354-F363 WeakPolarHBondContact O-CD2 3.26Å; Y354-F363 PolarHBondContact O-N 3.38Å; Y354-G366 VanDerWaalsContact CD2-N 3.25Å; Y354-G366 VanDerWaalsContact CE1-CA 3.45Å; Y354-G366 VanDerWaalsContact CE2-N 3.3Å; Y354-L369 HydrophobicContact CD1-CD2 4.38Å
355	L	70.3	Confident	60.3	Low	86 Å²	86	114.6 Å²	114.6	45%	0.45	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.9	138.2	177.5	-171	70.3	0	0	0	110.1	S353 G360 N361 T362 L369	S353-L355 PolarHBondContact O-N 3.1Å; L355-G360 WeakPolarHBondContact CD1-O 3.47Å; L355-N361 CarbonylContact C-O 3.26Å; L355-T362 HydrophobicContact CD1-CG2 3.65Å; L355-L369 VanDerWaalsContact O-CD2 3.31Å; L355-L369 WeakPolarHBondContact O-CD2 3.37Å
356	C	79.4	Confident	62.6	Low	0 Å²	0	108.4 Å²	108.4	0%	0	54%	0.544	C	S	.	.			trans	-85.5	114.6	163.4	-170.3	0	0	0	0	109.2	E358 C359 G360 N361 F363 L369 H372 H376	C356-E358 PolarHBondContact O-N 3.11Å; C356-C359 PolarHBondContact O-N 2.87Å; C356-G360 WeakPolarHBondContact O-CA 3.32Å; C356-G360 PolarHBondContact O-N 3.17Å; C356-N361 HydrophobicContact CB-CB 4.38Å; C356-N361 PolarHBondContact N-O 3.41Å; C356-F363 HydrophobicContact CB-CE2 4.14Å; C356-L369 HydrophobicContact CB-CD1 3.63Å; C356-H372 VanDerWaalsContact SG-CD2 3.54Å; C356-H372 PolarHBondContact SG-NE2 3.34Å; C356-H372 VanDerWaalsContact SG-NE2 3.4Å; C356-H376 VanDerWaalsContact SG-CD2 3.58Å
357	N	74.8	Confident	64.8	Low	147 Å²	147	103.4 Å²	103.4	79%	0.786	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.1	-177.3	-64.6	-0.3	0	0	0	112.1
358	E	71	Confident	67.1	Low	108 Å²	108	98 Å²	98	51%	0.505	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-18.3	-175.6	-62.4	152.2	114.7	0	0	113.5	C356 H376	C356-E358 PolarHBondContact O-N 3.11Å; E358-H376 VanDerWaalsContact OE1-CB 3.24Å; E358-H376 WeakPolarHBondContact OE1-CB 3.44Å; E358-H376 IonicContact OE1-CG 3.14Å; E358-H376 IonicContact OE2-CD2 3.21Å; E358-H376 PolarHBondContact OE2-CD2 3.08Å; E358-H376 VanDerWaalsContact OE2-CD2 3.28Å; E358-H376 IonicContact OE2-CG 3.67Å
359	C	74.9	Confident	68.9	Low	49 Å²	49	90 Å²	90	33%	0.331	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.1	15.4	-177.8	69.9	0	0	0	0	116	C356 N361 H372 H376	C356-C359 PolarHBondContact O-N 2.87Å; C359-N361 PolarHBondContact O-N 3.17Å; C359-N361 PolarHBondContact SG-ND2 2.96Å; C359-H372 PolarHBondContact SG-NE2 2.73Å; C359-H376 WeakPolarHBondContact CB-NE2 3.33Å; C359-H376 PolarHBondContact SG-NE2 3.3Å; C359-H376 VanDerWaalsContact SG-NE2 3.38Å
360	G	74	Confident	71	Confident	49 Å²	49	89.1 Å²	89.1	51%	0.505	46%	0.455	S	S	.	.			trans	68.4	-2.6	174.4	0	0	0	0	0	116.7	L355 C356 T362	L355-G360 WeakPolarHBondContact CD1-O 3.47Å; C356-G360 WeakPolarHBondContact O-CA 3.32Å; C356-G360 PolarHBondContact O-N 3.17Å; G360-T362 PolarHBondContact O-N 3.14Å
361	N	71.7	Confident	73	Confident	84 Å²	84	82.3 Å²	82.3	45%	0.449	43%	0.43	S	S	.	.			trans	-65.8	134.4	-177.3	-83.6	-65.9	0	0	0	112.3	L355 C356 C359 F363	L355-N361 CarbonylContact C-O 3.26Å; C356-N361 HydrophobicContact CB-CB 4.38Å; C356-N361 PolarHBondContact N-O 3.41Å; C359-N361 PolarHBondContact O-N 3.17Å; C359-N361 PolarHBondContact SG-ND2 2.96Å; N361-F363 HydrophobicContact CB-CD2 4.5Å; N361-F363 HydrophobicContact CB-CE2 3.48Å; N361-F363 VanDerWaalsContact CB-CE2 3.48Å; N361-F363 HydrophobicContact CB-CZ 3.73Å; N361-F363 WeakPolarHBondContact O-CD2 3.4Å; N361-F363 WeakPolarHBondContact O-CE2 3.47Å
362	T	72.1	Confident	74.4	Confident	102 Å²	102	76.6 Å²	76.6	63%	0.626	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.1	-177.4	54.9	0	0	0	0	112.6	L355 G360	L355-T362 HydrophobicContact CD1-CG2 3.65Å; G360-T362 PolarHBondContact O-N 3.14Å
363	F	79.3	Confident	75.8	Confident	43 Å²	43	73.1 Å²	73.1	19%	0.189	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	141.5	-175.8	-63.7	-85.5	0	0	0	113.3	Y354 C356 N361 S365 L369 H372	Y354-F363 PolarHBondContact N-O 2.83Å; Y354-F363 WeakPolarHBondContact O-CB 3.49Å; Y354-F363 WeakPolarHBondContact O-CD2 3.26Å; Y354-F363 PolarHBondContact O-N 3.38Å; C356-F363 HydrophobicContact CB-CE2 4.14Å; N361-F363 HydrophobicContact CB-CD2 4.5Å; N361-F363 HydrophobicContact CB-CE2 3.48Å; N361-F363 VanDerWaalsContact CB-CE2 3.48Å; N361-F363 HydrophobicContact CB-CZ 3.73Å; N361-F363 WeakPolarHBondContact O-CD2 3.4Å; N361-F363 WeakPolarHBondContact O-CE2 3.47Å; F363-S365 PolarHBondContact O-N 2.71Å; F363-L369 HydrophobicContact CB-CB 4.03Å; F363-L369 HydrophobicContact CD2-CB 4.05Å; F363-L369 HydrophobicContact CD2-CD1 3.72Å; F363-L369 HydrophobicContact CE2-CD1 4.08Å; F363-L369 HydrophobicContact CG-CB 4.17Å; F363-H372 HydrophobicContact CE1-CB 3.83Å; F363-H372 AromaticContact CE1-CG 4Å; F363-H372 HydrophobicContact CE2-CB 3.98Å; F363-H372 AromaticContact CE2-CD2 3.18Å; F363-H372 WeakPolarHBondContact CE2-CD2 3.34Å; F363-H372 AromaticContact CE2-CG 3.59Å; F363-H372 AromaticContact CE2-NE2 3.7Å; F363-H372 HydrophobicContact CZ-CB 3.5Å; F363-H372 AromaticContact CZ-CD2 3.29Å; F363-H372 WeakPolarHBondContact CZ-CD2 3.47Å; F363-H372 AromaticContact CZ-CE1 3.96Å; F363-H372 AromaticContact CZ-CG 3.18Å; F363-H372 AromaticContact CZ-ND1 3.64Å; F363-H372 AromaticContact CZ-NE2 3.74Å
364	K	76.7	Confident	76.7	Confident	200 Å²	200	71 Å²	71	87%	0.87	37%	0.371	S	S	*	.	S	Bend	trans	-70.7	-10.4	-179.6	67.4	-167.5	177.1	-168.8	0	115.1
365	S	82.1	Confident	77	Confident	38 Å²	38	72.1 Å²	72.1	27%	0.266	38%	0.382	S	S	.	.	S	Bend	trans	-160.6	154.5	176.4	64.9	0	0	0	0	111	F363 S367 S368 L369	F363-S365 PolarHBondContact O-N 2.71Å; S365-S367 VanDerWaalsContact C-N 3.26Å; S365-S367 PolarHBondContact O-N 2.81Å; S365-S368 PolarHBondContact O-N 3.21Å; S365-S368 PolarHBondContact OG-N 3.31Å; S365-S368 PolarHBondContact OG-OG 3.04Å; S365-L369 PolarHBondContact O-N 3.39Å
366	G	77.9	Confident	77.2	Confident	24 Å²	24	72.6 Å²	72.6	25%	0.247	38%	0.382	C	S	.	.	H	α-helix	trans	-62	-32.5	176.9	0	0	0	0	0	113	Y354 S368 L369 R370	Y354-G366 VanDerWaalsContact CD2-N 3.25Å; Y354-G366 VanDerWaalsContact CE1-CA 3.45Å; Y354-G366 VanDerWaalsContact CE2-N 3.3Å; G366-S368 VanDerWaalsContact C-N 3.33Å; G366-S368 PolarHBondContact O-N 3.08Å; G366-L369 PolarHBondContact O-N 3.07Å; G366-R370 WeakPolarHBondContact O-CB 3.37Å; G366-R370 PolarHBondContact O-N 3.06Å
367	S	78.3	Confident	77.1	Confident	62 Å²	62	76.4 Å²	76.4	43%	0.434	41%	0.405	S	S	.	.	H	α-helix	trans	-60.7	-41.3	172.1	-33.3	0	0	0	0	111.8	S365 R370 Y371	S365-S367 VanDerWaalsContact C-N 3.26Å; S365-S367 PolarHBondContact O-N 2.81Å; S367-R370 PolarHBondContact O-N 3.34Å; S367-Y371 WeakPolarHBondContact O-CD2 3.47Å; S367-Y371 VanDerWaalsContact O-CG 3.31Å; S367-Y371 PolarHBondContact O-N 3.34Å
368	S	79.3	Confident	77.2	Confident	36 Å²	36	71.1 Å²	71.1	25%	0.252	39%	0.386	S	S	.	.	H	α-helix	trans	-71.6	-37	177.7	-71.4	0	0	0	0	112.8	S365 G366 H372	S365-S368 PolarHBondContact O-N 3.21Å; S365-S368 PolarHBondContact OG-N 3.31Å; S365-S368 PolarHBondContact OG-OG 3.04Å; G366-S368 VanDerWaalsContact C-N 3.33Å; G366-S368 PolarHBondContact O-N 3.08Å; S368-H372 PolarHBondContact O-N 3Å
369	L	81.1	Confident	77.5	Confident	17 Å²	17	70.1 Å²	70.1	9%	0.089	38%	0.381	C	S	.	.	H	α-helix	trans	-61.8	-48.6	169.9	173.3	62.8	0	0	0	110.5	Y354 L355 C356 F363 S365 G366 Y371 H372 Q373	Y354-L369 HydrophobicContact CD1-CD2 4.38Å; L355-L369 VanDerWaalsContact O-CD2 3.31Å; L355-L369 WeakPolarHBondContact O-CD2 3.37Å; C356-L369 HydrophobicContact CB-CD1 3.63Å; F363-L369 HydrophobicContact CB-CB 4.03Å; F363-L369 HydrophobicContact CD2-CB 4.05Å; F363-L369 HydrophobicContact CD2-CD1 3.72Å; F363-L369 HydrophobicContact CE2-CD1 4.08Å; F363-L369 HydrophobicContact CG-CB 4.17Å; S365-L369 PolarHBondContact O-N 3.39Å; G366-L369 PolarHBondContact O-N 3.07Å; L369-Y371 VanDerWaalsContact C-N 3.31Å; L369-Y371 PolarHBondContact O-N 3.05Å; L369-H372 CarbonylContact O-C 3.59Å; L369-H372 WeakPolarHBondContact O-CA 3.45Å; L369-H372 WeakPolarHBondContact O-CB 3.31Å; L369-H372 PolarHBondContact O-N 3.37Å; L369-Q373 HydrophobicContact CD1-CG 3.87Å; L369-Q373 HydrophobicContact CG-CG 4.08Å; L369-Q373 WeakPolarHBondContact O-CG 3.46Å; L369-Q373 PolarHBondContact O-N 3.07Å
370	R	77.9	Confident	78	Confident	138 Å²	138	73.6 Å²	73.6	52%	0.521	39%	0.39	S	S	.	.	H	α-helix	trans	-59.4	-38.5	-179.7	-170.1	175.2	67.6	-172.1	3.8	112.7	G366 S367 H372 R374	G366-R370 WeakPolarHBondContact O-CB 3.37Å; G366-R370 PolarHBondContact O-N 3.06Å; S367-R370 PolarHBondContact O-N 3.34Å; R370-H372 VanDerWaalsContact C-N 3.26Å; R370-H372 PolarHBondContact O-N 3.45Å; R370-R374 WeakPolarHBondContact O-CG 3.47Å
371	Y	79.2	Confident	78.4	Confident	84 Å²	84	74.5 Å²	74.5	33%	0.329	39%	0.388	S	S	.	.	H	α-helix	trans	-69.3	-22	173.1	-64.9	-44.3	0	0	0	113.9	S367 L369 Q393	S367-Y371 WeakPolarHBondContact O-CD2 3.47Å; S367-Y371 VanDerWaalsContact O-CG 3.31Å; S367-Y371 PolarHBondContact O-N 3.34Å; L369-Y371 VanDerWaalsContact C-N 3.31Å; L369-Y371 PolarHBondContact O-N 3.05Å; Y371-Q393 HydrophobicContact CD1-CG 4.21Å; Y371-Q393 HydrophobicContact CG-CG 4.39Å
372	H	79.6	Confident	79	Confident	24 Å²	24	73.5 Å²	73.5	11%	0.111	38%	0.379	C	S	.	.	H	α-helix	trans	-87.3	-37.3	176.5	166.5	74.1	0	0	0	112.6	C356 C359 F363 S368 L369 R370 R374 I375	C356-H372 VanDerWaalsContact SG-CD2 3.54Å; C356-H372 PolarHBondContact SG-NE2 3.34Å; C356-H372 VanDerWaalsContact SG-NE2 3.4Å; C359-H372 PolarHBondContact SG-NE2 2.73Å; F363-H372 HydrophobicContact CE1-CB 3.83Å; F363-H372 AromaticContact CE1-CG 4Å; F363-H372 HydrophobicContact CE2-CB 3.98Å; F363-H372 AromaticContact CE2-CD2 3.18Å; F363-H372 WeakPolarHBondContact CE2-CD2 3.34Å; F363-H372 AromaticContact CE2-CG 3.59Å; F363-H372 AromaticContact CE2-NE2 3.7Å; F363-H372 HydrophobicContact CZ-CB 3.5Å; F363-H372 AromaticContact CZ-CD2 3.29Å; F363-H372 WeakPolarHBondContact CZ-CD2 3.47Å; F363-H372 AromaticContact CZ-CE1 3.96Å; F363-H372 AromaticContact CZ-CG 3.18Å; F363-H372 AromaticContact CZ-ND1 3.64Å; F363-H372 AromaticContact CZ-NE2 3.74Å; S368-H372 PolarHBondContact O-N 3Å; L369-H372 CarbonylContact O-C 3.59Å; L369-H372 WeakPolarHBondContact O-CA 3.45Å; L369-H372 WeakPolarHBondContact O-CB 3.31Å; L369-H372 PolarHBondContact O-N 3.37Å; R370-H372 VanDerWaalsContact C-N 3.26Å; R370-H372 PolarHBondContact O-N 3.45Å; H372-R374 PolarHBondContact O-N 3.33Å; H372-I375 WeakPolarHBondContact O-CB 3.41Å; H372-I375 VanDerWaalsContact O-CG1 3.31Å; H372-I375 WeakPolarHBondContact O-CG1 3.49Å; H372-I375 PolarHBondContact O-N 3.32Å
373	Q	77.4	Confident	79.6	Confident	73 Å²	73	76 Å²	76	34%	0.341	38%	0.382	S	S	.	.	H	α-helix	trans	-56.9	-31.9	174.2	-70.7	174.7	-73.3	0	0	112	L369 I375 H376 T377	L369-Q373 HydrophobicContact CD1-CG 3.87Å; L369-Q373 HydrophobicContact CG-CG 4.08Å; L369-Q373 WeakPolarHBondContact O-CG 3.46Å; L369-Q373 PolarHBondContact O-N 3.07Å; Q373-I375 PolarHBondContact O-N 3.36Å; Q373-H376 WeakPolarHBondContact O-CA 3.4Å; Q373-H376 PolarHBondContact O-N 3.3Å; Q373-T377 PolarHBondContact O-N 3.48Å; Q373-T377 PolarHBondContact O-OG1 3.13Å
374	R	83.3	Confident	79.9	Confident	36 Å²	36	74.1 Å²	74.1	14%	0.136	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-11.4	170.9	-65	-171.1	170.7	159.9	2.4	115.7	R370 H372 G378 E379 S392	R370-R374 WeakPolarHBondContact O-CG 3.47Å; H372-R374 PolarHBondContact O-N 3.33Å; R374-G378 CarbonylContact O-C 3.57Å; R374-G378 WeakPolarHBondContact O-CA 3.45Å; R374-G378 PolarHBondContact O-N 3.05Å; R374-E379 HydrophobicContact CB-CB 3.93Å; R374-E379 HydrophobicContact CG-CB 3.6Å; R374-E379 HydrophobicContact CG-CG 4.49Å; R374-E379 IonicContact CZ-OE2 3.55Å; R374-E379 IonicContact NE-OE2 2.7Å; R374-E379 PolarHBondContact NE-OE2 2.6Å; R374-E379 IonicContact NH2-OE2 3.71Å; R374-E379 PolarHBondContact O-N 2.82Å; R374-S392 PolarHBondContact NH1-O 2.83Å
375	I	76.6	Confident	80.2	Confident	115 Å²	115	69.7 Å²	69.7	59%	0.59	37%	0.368	S	S	*	.	H	α-helix	trans	-79.7	-35	171.1	-56.5	176.5	0	0	0	109.8	H372 Q373	H372-I375 WeakPolarHBondContact O-CB 3.41Å; H372-I375 VanDerWaalsContact O-CG1 3.31Å; H372-I375 WeakPolarHBondContact O-CG1 3.49Å; H372-I375 PolarHBondContact O-N 3.32Å; Q373-I375 PolarHBondContact O-N 3.36Å
376	H	75.3	Confident	79.9	Confident	96 Å²	96	73.7 Å²	73.7	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-82.9	-48.9	177.6	-55	-54.3	0	0	0	111.7	C356 E358 C359 Q373 G378	C356-H376 VanDerWaalsContact SG-CD2 3.58Å; E358-H376 VanDerWaalsContact OE1-CB 3.24Å; E358-H376 WeakPolarHBondContact OE1-CB 3.44Å; E358-H376 IonicContact OE1-CG 3.14Å; E358-H376 IonicContact OE2-CD2 3.21Å; E358-H376 PolarHBondContact OE2-CD2 3.08Å; E358-H376 VanDerWaalsContact OE2-CD2 3.28Å; E358-H376 IonicContact OE2-CG 3.67Å; C359-H376 WeakPolarHBondContact CB-NE2 3.33Å; C359-H376 PolarHBondContact SG-NE2 3.3Å; C359-H376 VanDerWaalsContact SG-NE2 3.38Å; Q373-H376 WeakPolarHBondContact O-CA 3.4Å; Q373-H376 PolarHBondContact O-N 3.3Å; H376-G378 PolarHBondContact O-N 2.96Å
377	T	76.6	Confident	79.9	Confident	79 Å²	79	74.8 Å²	74.8	49%	0.485	39%	0.386	S	S	.	.	S	Bend	trans	-73.4	-6.7	177.2	67.8	0	0	0	0	113.7	Q373 E379	Q373-T377 PolarHBondContact O-N 3.48Å; Q373-T377 PolarHBondContact O-OG1 3.13Å; T377-E379 PolarHBondContact O-N 2.88Å; T377-E379 WeakPolarHBondContact OG1-CB 3.49Å; T377-E379 WeakPolarHBondContact OG1-CG 3.37Å; T377-E379 PolarHBondContact OG1-OE1 3.39Å
378	G	76.4	Confident	80	Confident	37 Å²	37	74.3 Å²	74.3	38%	0.381	39%	0.391	S	S	.	.			trans	67.7	-2.2	-177.1	0	0	0	0	0	115.5	R374 H376 K380	R374-G378 CarbonylContact O-C 3.57Å; R374-G378 WeakPolarHBondContact O-CA 3.45Å; R374-G378 PolarHBondContact O-N 3.05Å; H376-G378 PolarHBondContact O-N 2.96Å; G378-K380 WeakPolarHBondContact O-CG 3.44Å; G378-K380 PolarHBondContact O-N 3Å
379	E	78.9	Confident	80.1	Confident	86 Å²	86	80.2 Å²	80.2	40%	0.402	41%	0.407	S	S	.	.			trans	-47.8	122.6	-176.7	-100.8	177.1	-106.9	0	0	113.7	R374 T377 S392	R374-E379 HydrophobicContact CB-CB 3.93Å; R374-E379 HydrophobicContact CG-CB 3.6Å; R374-E379 HydrophobicContact CG-CG 4.49Å; R374-E379 IonicContact CZ-OE2 3.55Å; R374-E379 IonicContact NE-OE2 2.7Å; R374-E379 PolarHBondContact NE-OE2 2.6Å; R374-E379 IonicContact NH2-OE2 3.71Å; R374-E379 PolarHBondContact O-N 2.82Å; T377-E379 PolarHBondContact O-N 2.88Å; T377-E379 WeakPolarHBondContact OG1-CB 3.49Å; T377-E379 WeakPolarHBondContact OG1-CG 3.37Å; T377-E379 PolarHBondContact OG1-OE1 3.39Å; E379-S392 WeakPolarHBondContact O-CB 3.46Å
380	K	83.6	Confident	80.3	Confident	122 Å²	122	81.2 Å²	81.2	53%	0.53	42%	0.418	S	S	.	.			trans	-130.3	75.1	175.6	-70.9	152.9	-173	163.9	0	111	G378 F382 A390 F391	G378-K380 WeakPolarHBondContact O-CG 3.44Å; G378-K380 PolarHBondContact O-N 3Å; K380-F382 PolarHBondContact O-N 3.37Å; K380-A390 HydrophobicContact CB-CB 3.44Å; K380-A390 VanDerWaalsContact CB-CB 3.44Å; K380-A390 HydrophobicContact CD-CB 4.22Å; K380-A390 WeakPolarHBondContact CD-O 3.36Å; K380-A390 HydrophobicContact CG-CB 4.34Å; K380-F391 CarbonylContact C-O 3.58Å; K380-F391 VanDerWaalsContact C-O 3.22Å; K380-F391 VanDerWaalsContact CA-O 3.28Å; K380-F391 WeakPolarHBondContact CA-O 3.32Å
381	P	83.3	Confident	80.6	Confident	69 Å²	69	76.9 Å²	76.9	45%	0.448	40%	0.403	S	S	.	.			trans	-70.1	-17.6	-172.3	-22.6	37.1	0	0	0	114.7
382	F	84.9	Confident	80.7	Confident	62 Å²	62	74.4 Å²	74.4	27%	0.272	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	91.6	-176.2	-54.8	-73.2	0	0	0	109.5	K380 A390 F391 S394 L397	K380-F382 PolarHBondContact O-N 3.37Å; F382-A390 CarbonylContact O-C 3.6Å; F382-A390 WeakPolarHBondContact O-CA 3.49Å; F382-F391 HydrophobicContact CB-CB 4.4Å; F382-F391 WeakPolarHBondContact CD2-O 3.2Å; F382-F391 PolarHBondContact N-O 3.26Å; F382-F391 VanDerWaalsContact N-O 3.08Å; F382-F391 PolarHBondContact O-N 2.74Å; F382-S394 VanDerWaalsContact CE2-N 3.32Å; F382-L397 HydrophobicContact CB-CB 4.11Å; F382-L397 HydrophobicContact CB-CD2 3.82Å
383	K	82.9	Confident	80.8	Confident	156 Å²	156	77 Å²	77	68%	0.678	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	136	176.2	-61.7	-178.4	-178.5	178.5	0	110.5	A390	K383-A390 HydrophobicContact CG-CB 4Å
384	C	86.9	Confident	81	Confident	3 Å²	3	76.1 Å²	76.1	2%	0.02	41%	0.412	C	S	.	.			trans	-75.5	131.3	166.5	-177.7	0	0	0	0	109.6	G388 R389 L397	C384-G388 VanDerWaalsContact O-CA 3.26Å; C384-G388 WeakPolarHBondContact O-CA 3.49Å; C384-G388 PolarHBondContact O-N 3.33Å; C384-R389 PolarHBondContact N-O 3.32Å; C384-L397 HydrophobicContact CB-CD1 3.56Å
385	S	82.7	Confident	80.8	Confident	107 Å²	107	77.5 Å²	77.5	75%	0.748	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-47	176.9	41.5	0	0	0	0	112.4
386	E	76.8	Confident	81	Confident	122 Å²	122	74.1 Å²	74.1	57%	0.57	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-26.8	-168.8	-64	176.1	-135.4	0	0	114.7	H404	E386-H404 WeakPolarHBondContact OE2-CB 3.46Å; E386-H404 IonicContact OE2-CD2 3.65Å; E386-H404 IonicContact OE2-CE1 3.28Å; E386-H404 IonicContact OE2-CG 3.6Å; E386-H404 IonicContact OE2-ND1 3.71Å
387	C	77.6	Confident	81.4	Confident	47 Å²	47	70.4 Å²	70.4	32%	0.318	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.9	10.5	-176.3	72.1	0	0	0	0	114.8	R389 H400 H404	C387-R389 PolarHBondContact O-N 3.46Å; C387-H400 PolarHBondContact SG-NE2 2.82Å; C387-H404 WeakPolarHBondContact CB-NE2 3.39Å; C387-H404 PolarHBondContact SG-NE2 3.3Å
388	G	79.4	Confident	81.6	Confident	52 Å²	52	70.9 Å²	70.9	54%	0.536	40%	0.399	S	S	.	.			trans	65	-4.7	178.4	0	0	0	0	0	116	C384 A390	C384-G388 VanDerWaalsContact O-CA 3.26Å; C384-G388 WeakPolarHBondContact O-CA 3.49Å; C384-G388 PolarHBondContact O-N 3.33Å; G388-A390 PolarHBondContact O-N 3.43Å
389	R	82	Confident	81.7	Confident	160 Å²	160	73.1 Å²	73.1	60%	0.604	40%	0.4	S	S	*	.			trans	-65.6	130.2	-174.1	-75	-176.3	169	-158.1	-1	111.6	C384 C387 F391 H400	C384-R389 PolarHBondContact N-O 3.32Å; C387-R389 PolarHBondContact O-N 3.46Å; R389-F391 HydrophobicContact CB-CE2 3.83Å; R389-F391 HydrophobicContact CB-CZ 4.12Å; R389-F391 VanDerWaalsContact O-CE2 3.32Å; R389-F391 WeakPolarHBondContact O-CE2 3.39Å; R389-H400 WeakPolarHBondContact CD-NE2 3.41Å
390	A	84.9	Confident	81.8	Confident	37 Å²	37	69.7 Å²	69.7	31%	0.306	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.6	-172.6	0	0	0	0	0	112.3	K380 F382 K383 G388	K380-A390 HydrophobicContact CB-CB 3.44Å; K380-A390 VanDerWaalsContact CB-CB 3.44Å; K380-A390 HydrophobicContact CD-CB 4.22Å; K380-A390 WeakPolarHBondContact CD-O 3.36Å; K380-A390 HydrophobicContact CG-CB 4.34Å; F382-A390 CarbonylContact O-C 3.6Å; F382-A390 WeakPolarHBondContact O-CA 3.49Å; K383-A390 HydrophobicContact CG-CB 4Å; G388-A390 PolarHBondContact O-N 3.43Å
391	F	84.4	Confident	81.7	Confident	47 Å²	47	66.8 Å²	66.8	21%	0.206	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	148.1	-176.8	-59	-92.2	0	0	0	111.9	K380 F382 R389 Q393 L397 H400	K380-F391 CarbonylContact C-O 3.58Å; K380-F391 VanDerWaalsContact C-O 3.22Å; K380-F391 VanDerWaalsContact CA-O 3.28Å; K380-F391 WeakPolarHBondContact CA-O 3.32Å; F382-F391 HydrophobicContact CB-CB 4.4Å; F382-F391 WeakPolarHBondContact CD2-O 3.2Å; F382-F391 PolarHBondContact N-O 3.26Å; F382-F391 VanDerWaalsContact N-O 3.08Å; F382-F391 PolarHBondContact O-N 2.74Å; R389-F391 HydrophobicContact CB-CE2 3.83Å; R389-F391 HydrophobicContact CB-CZ 4.12Å; R389-F391 VanDerWaalsContact O-CE2 3.32Å; R389-F391 WeakPolarHBondContact O-CE2 3.39Å; F391-Q393 VanDerWaalsContact C-N 3.35Å; F391-L397 HydrophobicContact CB-CB 4.44Å; F391-L397 HydrophobicContact CD2-CB 4.04Å; F391-L397 HydrophobicContact CD2-CD1 3.96Å; F391-L397 HydrophobicContact CE2-CD1 4.14Å; F391-L397 HydrophobicContact CG-CB 4.38Å; F391-H400 HydrophobicContact CE1-CB 4.21Å; F391-H400 HydrophobicContact CE2-CB 4.05Å; F391-H400 AromaticContact CE2-CD2 3.25Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.2Å; F391-H400 AromaticContact CE2-CG 3.86Å; F391-H400 HydrophobicContact CZ-CB 3.66Å; F391-H400 AromaticContact CZ-CD2 3.21Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.33Å; F391-H400 AromaticContact CZ-CG 3.44Å; F391-H400 VanDerWaalsContact CZ-CG 3.44Å; F391-H400 AromaticContact CZ-NE2 3.91Å
392	S	81.9	Confident	81.7	Confident	32 Å²	32	66.2 Å²	66.2	22%	0.224	36%	0.361	C	S	.	.	S	Bend	trans	-80.5	-14	177.5	56.6	0	0	0	0	113.9	R374 E379	R374-S392 PolarHBondContact NH1-O 2.83Å; E379-S392 WeakPolarHBondContact O-CB 3.46Å
393	Q	81.6	Confident	81.4	Confident	80 Å²	80	68.7 Å²	68.7	37%	0.374	38%	0.376	S	S	.	.	S	Bend	trans	-136.6	135.1	-179.6	-59.5	-179.9	35.1	0	0	111.4	Y371 F391 A395 S396 L397	Y371-Q393 HydrophobicContact CD1-CG 4.21Å; Y371-Q393 HydrophobicContact CG-CG 4.39Å; F391-Q393 VanDerWaalsContact C-N 3.35Å; Q393-A395 VanDerWaalsContact C-N 3.34Å; Q393-A395 PolarHBondContact O-N 3.27Å; Q393-S396 WeakPolarHBondContact O-CB 3.17Å; Q393-S396 PolarHBondContact O-N 3.14Å; Q393-S396 VanDerWaalsContact O-N 3.07Å; Q393-L397 PolarHBondContact O-N 2.83Å
394	S	80.4	Confident	81.1	Confident	54 Å²	54	65.5 Å²	65.5	38%	0.378	36%	0.363	S	S	.	.	H	α-helix	trans	-63	-36	-179.2	51	0	0	0	0	113.3	F382 S396 L397 I398	F382-S394 VanDerWaalsContact CE2-N 3.32Å; S394-S396 PolarHBondContact O-N 2.86Å; S394-L397 WeakPolarHBondContact O-CB 3.36Å; S394-L397 PolarHBondContact O-N 3.48Å; S394-I398 WeakPolarHBondContact O-CG1 3.2Å; S394-I398 PolarHBondContact O-N 3.4Å
395	A	79.4	Confident	80.7	Confident	64 Å²	64	69.4 Å²	69.4	53%	0.529	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-26.3	175	0	0	0	0	0	113.1	Q393 Q399	Q393-A395 VanDerWaalsContact C-N 3.34Å; Q393-A395 PolarHBondContact O-N 3.27Å; A395-Q399 WeakPolarHBondContact O-CB 3.33Å; A395-Q399 PolarHBondContact O-N 3.47Å; A395-Q399 VanDerWaalsContact O-N 3.17Å
396	S	81.7	Confident	80.4	Confident	44 Å²	44	66 Å²	66	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-79	-33.1	173.9	-55.3	0	0	0	0	112.5	Q393 S394 H400	Q393-S396 WeakPolarHBondContact O-CB 3.17Å; Q393-S396 PolarHBondContact O-N 3.14Å; Q393-S396 VanDerWaalsContact O-N 3.07Å; S394-S396 PolarHBondContact O-N 2.86Å; S396-H400 WeakPolarHBondContact O-CB 3.16Å; S396-H400 PolarHBondContact O-N 3.12Å
397	L	82.9	Confident	80.5	Confident	18 Å²	18	64.9 Å²	64.9	9%	0.094	36%	0.363	C	S	.	.	H	α-helix	trans	-65.9	-49.3	170.8	174	59.7	0	0	0	110.8	F382 C384 F391 Q393 S394 Q399 H400 E401	F382-L397 HydrophobicContact CB-CB 4.11Å; F382-L397 HydrophobicContact CB-CD2 3.82Å; C384-L397 HydrophobicContact CB-CD1 3.56Å; F391-L397 HydrophobicContact CB-CB 4.44Å; F391-L397 HydrophobicContact CD2-CB 4.04Å; F391-L397 HydrophobicContact CD2-CD1 3.96Å; F391-L397 HydrophobicContact CE2-CD1 4.14Å; F391-L397 HydrophobicContact CG-CB 4.38Å; Q393-L397 PolarHBondContact O-N 2.83Å; S394-L397 WeakPolarHBondContact O-CB 3.36Å; S394-L397 PolarHBondContact O-N 3.48Å; L397-Q399 PolarHBondContact O-N 2.92Å; L397-H400 CarbonylContact O-C 3.58Å; L397-H400 WeakPolarHBondContact O-CA 3.15Å; L397-H400 VanDerWaalsContact O-CB 3.3Å; L397-H400 WeakPolarHBondContact O-CB 3.15Å; L397-H400 PolarHBondContact O-N 2.9Å; L397-E401 HydrophobicContact CD1-CG 3.94Å; L397-E401 WeakPolarHBondContact CD1-OE1 3.39Å; L397-E401 HydrophobicContact CG-CG 4.32Å; L397-E401 VanDerWaalsContact CG-OE1 3.25Å; L397-E401 WeakPolarHBondContact CG-OE1 3.43Å; L397-E401 WeakPolarHBondContact O-CG 3.47Å; L397-E401 PolarHBondContact O-N 3.26Å
398	I	81.4	Confident	80.7	Confident	89 Å²	89	68.3 Å²	68.3	46%	0.456	37%	0.373	S	S	.	.	H	α-helix	trans	-59.9	-32.7	176.6	-63.8	163.5	0	0	0	112	S394 H400 E401	S394-I398 WeakPolarHBondContact O-CG1 3.2Å; S394-I398 PolarHBondContact O-N 3.4Å; I398-H400 VanDerWaalsContact C-N 3.35Å; I398-E401 WeakPolarHBondContact CA-OE2 3.24Å
399	Q	78.4	Confident	80.8	Confident	84 Å²	84	69.2 Å²	69.2	39%	0.393	37%	0.369	S	S	.	.	H	α-helix	trans	-73.1	-27.5	172.2	-176.5	177	-2.2	0	0	112.8	A395 L397 S421	A395-Q399 WeakPolarHBondContact O-CB 3.33Å; A395-Q399 PolarHBondContact O-N 3.47Å; A395-Q399 VanDerWaalsContact O-N 3.17Å; L397-Q399 PolarHBondContact O-N 2.92Å; Q399-S421 VanDerWaalsContact NE2-CB 3.35Å; Q399-S421 PolarHBondContact NE2-OG 3.16Å; Q399-S421 VanDerWaalsContact NE2-OG 3.16Å
400	H	81.4	Confident	80.8	Confident	15 Å²	15	65.4 Å²	65.4	7%	0.069	36%	0.355	C	S	.	.	H	α-helix	trans	-80.8	-39.6	179.6	178.2	37.9	0	0	0	112.9	C387 R389 F391 S396 L397 I398 R402 I403	C387-H400 PolarHBondContact SG-NE2 2.82Å; R389-H400 WeakPolarHBondContact CD-NE2 3.41Å; F391-H400 HydrophobicContact CE1-CB 4.21Å; F391-H400 HydrophobicContact CE2-CB 4.05Å; F391-H400 AromaticContact CE2-CD2 3.25Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.2Å; F391-H400 AromaticContact CE2-CG 3.86Å; F391-H400 HydrophobicContact CZ-CB 3.66Å; F391-H400 AromaticContact CZ-CD2 3.21Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.33Å; F391-H400 AromaticContact CZ-CG 3.44Å; F391-H400 VanDerWaalsContact CZ-CG 3.44Å; F391-H400 AromaticContact CZ-NE2 3.91Å; S396-H400 WeakPolarHBondContact O-CB 3.16Å; S396-H400 PolarHBondContact O-N 3.12Å; L397-H400 CarbonylContact O-C 3.58Å; L397-H400 WeakPolarHBondContact O-CA 3.15Å; L397-H400 VanDerWaalsContact O-CB 3.3Å; L397-H400 WeakPolarHBondContact O-CB 3.15Å; L397-H400 PolarHBondContact O-N 2.9Å; I398-H400 VanDerWaalsContact C-N 3.35Å; H400-R402 PolarHBondContact O-N 3.25Å; H400-I403 WeakPolarHBondContact O-CB 3.2Å; H400-I403 VanDerWaalsContact O-CG1 3.32Å; H400-I403 WeakPolarHBondContact O-CG1 3.44Å; H400-I403 PolarHBondContact O-N 3.08Å
401	E	80.8	Confident	80.6	Confident	60 Å²	60	72.3 Å²	72.3	28%	0.28	37%	0.373	S	S	.	.	H	α-helix	trans	-57.4	-32.5	178.7	-71.1	159.3	162.9	0	0	111.6	L397 I398 I403 H404 T405	L397-E401 HydrophobicContact CD1-CG 3.94Å; L397-E401 WeakPolarHBondContact CD1-OE1 3.39Å; L397-E401 HydrophobicContact CG-CG 4.32Å; L397-E401 VanDerWaalsContact CG-OE1 3.25Å; L397-E401 WeakPolarHBondContact CG-OE1 3.43Å; L397-E401 WeakPolarHBondContact O-CG 3.47Å; L397-E401 PolarHBondContact O-N 3.26Å; I398-E401 WeakPolarHBondContact CA-OE2 3.24Å; E401-I403 PolarHBondContact O-N 3.18Å; E401-H404 WeakPolarHBondContact O-CB 3.3Å; E401-H404 PolarHBondContact O-N 3.13Å; E401-T405 PolarHBondContact O-N 3.07Å; E401-T405 VanDerWaalsContact O-N 3.1Å
402	R	83.5	Confident	80.5	Confident	58 Å²	58	70.2 Å²	70.2	22%	0.219	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-9.5	170.1	-64.8	-176.6	175.9	150.1	9.4	115.9	H400 G406 E407 T420	H400-R402 PolarHBondContact O-N 3.25Å; R402-G406 CarbonylContact O-C 3.52Å; R402-G406 PolarHBondContact O-N 3Å; R402-E407 HydrophobicContact CB-CB 4.09Å; R402-E407 HydrophobicContact CG-CB 3.9Å; R402-E407 IonicContact NE-OE2 3.6Å; R402-E407 PolarHBondContact NE-OE2 3.21Å; R402-E407 PolarHBondContact O-N 2.89Å; R402-T420 HydrophobicContact CB-CG2 4.1Å; R402-T420 PolarHBondContact NH1-O 2.75Å; R402-T420 VanDerWaalsContact NH1-O 3.17Å
403	I	78.3	Confident	80.4	Confident	113 Å²	113	76.4 Å²	76.4	58%	0.579	40%	0.395	S	S	*	.	H	α-helix	trans	-78.8	-35.5	170.3	-58.9	-175.6	0	0	0	109.9	H400 E401	H400-I403 WeakPolarHBondContact O-CB 3.2Å; H400-I403 VanDerWaalsContact O-CG1 3.32Å; H400-I403 WeakPolarHBondContact O-CG1 3.44Å; H400-I403 PolarHBondContact O-N 3.08Å; E401-I403 PolarHBondContact O-N 3.18Å
404	H	76.8	Confident	80.2	Confident	90 Å²	90	76.5 Å²	76.5	42%	0.417	40%	0.396	S	S	.	.	H	α-helix	trans	-80	-50.5	179	-54.7	-62.3	0	0	0	111.5	E386 C387 E401 G406	E386-H404 WeakPolarHBondContact OE2-CB 3.46Å; E386-H404 IonicContact OE2-CD2 3.65Å; E386-H404 IonicContact OE2-CE1 3.28Å; E386-H404 IonicContact OE2-CG 3.6Å; E386-H404 IonicContact OE2-ND1 3.71Å; C387-H404 WeakPolarHBondContact CB-NE2 3.39Å; C387-H404 PolarHBondContact SG-NE2 3.3Å; E401-H404 WeakPolarHBondContact O-CB 3.3Å; E401-H404 PolarHBondContact O-N 3.13Å; H404-G406 PolarHBondContact O-N 3.21Å; H404-G406 VanDerWaalsContact O-N 3.08Å
405	T	78.8	Confident	80.1	Confident	85 Å²	85	76.3 Å²	76.3	52%	0.521	39%	0.394	S	S	.	.	S	Bend	trans	-70	-4.8	176.4	67.6	0	0	0	0	113.8	E401 E407	E401-T405 PolarHBondContact O-N 3.07Å; E401-T405 VanDerWaalsContact O-N 3.1Å; T405-E407 PolarHBondContact O-N 2.96Å; T405-E407 WeakPolarHBondContact OG1-CG 3.12Å
406	G	76.3	Confident	80.1	Confident	34 Å²	34	75.6 Å²	75.6	35%	0.351	39%	0.393	S	S	.	.			trans	66.8	-0.7	-177.4	0	0	0	0	0	115.4	R402 H404 K408	R402-G406 CarbonylContact O-C 3.52Å; R402-G406 PolarHBondContact O-N 3Å; H404-G406 PolarHBondContact O-N 3.21Å; H404-G406 VanDerWaalsContact O-N 3.08Å; G406-K408 WeakPolarHBondContact O-CG 3.47Å; G406-K408 PolarHBondContact O-N 2.9Å
407	E	78.3	Confident	79.8	Confident	99 Å²	99	79.8 Å²	79.8	46%	0.463	41%	0.405	S	S	.	.			trans	-53.1	125.3	-173.3	-91.4	-168.8	-170.1	0	0	113.3	R402 T405 P409	R402-E407 HydrophobicContact CB-CB 4.09Å; R402-E407 HydrophobicContact CG-CB 3.9Å; R402-E407 IonicContact NE-OE2 3.6Å; R402-E407 PolarHBondContact NE-OE2 3.21Å; R402-E407 PolarHBondContact O-N 2.89Å; T405-E407 PolarHBondContact O-N 2.96Å; T405-E407 WeakPolarHBondContact OG1-CG 3.12Å; E407-P409 WeakPolarHBondContact O-CD 3.21Å
408	K	81.7	Confident	79.8	Confident	120 Å²	120	80.1 Å²	80.1	52%	0.522	41%	0.414	S	S	.	.			trans	-126.1	71.8	177	-72.6	151.9	-169.3	156.7	0	110.9	G406 Y410 F419	G406-K408 WeakPolarHBondContact O-CG 3.47Å; G406-K408 PolarHBondContact O-N 2.9Å; K408-Y410 PolarHBondContact O-N 3.2Å; K408-Y410 VanDerWaalsContact O-N 3.12Å; K408-F419 CarbonylContact C-O 3.56Å; K408-F419 WeakPolarHBondContact CA-O 3.39Å
409	P	82.2	Confident	79.8	Confident	71 Å²	71	78 Å²	78	46%	0.461	40%	0.401	S	S	.	.			trans	-64.8	-18.4	-173.6	-21.8	34.7	0	0	0	114.2	E407	E407-P409 WeakPolarHBondContact O-CD 3.21Å
410	Y	82.3	Confident	79.8	Confident	79 Å²	79	75.7 Å²	75.7	31%	0.31	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	90.2	-177	-53	-78.8	0	0	0	109.7	K408 F419 S421 I422	K408-Y410 PolarHBondContact O-N 3.2Å; K408-Y410 VanDerWaalsContact O-N 3.12Å; Y410-F419 WeakPolarHBondContact CD2-O 3.3Å; Y410-F419 PolarHBondContact N-O 3.08Å; Y410-F419 WeakPolarHBondContact O-CD2 3.25Å; Y410-F419 PolarHBondContact O-N 3.05Å; Y410-S421 VanDerWaalsContact CD2-C 3.44Å; Y410-S421 VanDerWaalsContact CD2-CA 3.42Å; Y410-I422 HydrophobicContact CD1-CB 3.77Å; Y410-I422 HydrophobicContact CD1-CD1 4.42Å; Y410-I422 HydrophobicContact CD1-CG1 4.18Å; Y410-I422 HydrophobicContact CE1-CB 3.77Å; Y410-I422 HydrophobicContact CE1-CD1 4.38Å; Y410-I422 HydrophobicContact CE1-CG1 4.41Å; Y410-I422 HydrophobicContact CG-CB 4.21Å
411	R	80.9	Confident	79.7	Confident	182 Å²	182	75.6 Å²	75.6	69%	0.687	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	150.2	174.4	-63	-171.2	-176.7	-162.2	1.8	111.6	L425	R411-L425 WeakPolarHBondContact O-CD2 3.39Å
412	C	82.1	Confident	79.5	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.02	40%	0.402	C	S	.	.			trans	-91.2	119.9	171.5	171	0	0	0	0	109.8	E414 C415 G416 K417 F419 L425 H432	C412-E414 PolarHBondContact O-N 2.88Å; C412-E414 PolarHBondContact SG-OE2 3.19Å; C412-C415 PolarHBondContact O-N 2.81Å; C412-C415 VanDerWaalsContact SG-SG 3.62Å; C412-G416 VanDerWaalsContact O-CA 3.28Å; C412-G416 WeakPolarHBondContact O-CA 3.33Å; C412-G416 PolarHBondContact O-N 2.84Å; C412-K417 WeakPolarHBondContact CB-O 3.39Å; C412-K417 PolarHBondContact N-O 3.1Å; C412-F419 HydrophobicContact CB-CE2 4.3Å; C412-L425 HydrophobicContact CB-CD1 3.58Å; C412-H432 VanDerWaalsContact SG-CD2 3.5Å; C412-H432 PolarHBondContact SG-NE2 3.46Å
413	N	79.6	Confident	79	Confident	162 Å²	162	78.3 Å²	78.3	87%	0.866	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.4	-179.5	-59.9	19.2	0	0	0	112.1
414	E	77.9	Confident	78.9	Confident	83 Å²	83	79.4 Å²	79.4	39%	0.388	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-16.9	-176.4	-59.3	113.4	163.9	0	0	114	C412 R429 H432	C412-E414 PolarHBondContact O-N 2.88Å; C412-E414 PolarHBondContact SG-OE2 3.19Å; E414-R429 IonicContact OE1-CZ 3.9Å; E414-R429 VanDerWaalsContact OE1-CZ 3.29Å; E414-R429 IonicContact OE1-NE 2.71Å; E414-R429 PolarHBondContact OE1-NE 2.9Å; E414-R429 IonicContact OE1-NH2 3.87Å; E414-R429 PolarHBondContact OE1-NH2 3.32Å; E414-R429 IonicContact OE2-NE 3.66Å; E414-R429 PolarHBondContact OE2-NE 3.37Å; E414-H432 HydrophobicContact CB-CB 4.13Å; E414-H432 HydrophobicContact CG-CB 4.25Å; E414-H432 IonicContact OE2-CD2 3.85Å
415	C	78.4	Confident	79.1	Confident	49 Å²	49	76 Å²	76	33%	0.331	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.7	16.2	-179	72.6	0	0	0	0	115.9	C412 K417 H428 H432	C412-C415 PolarHBondContact O-N 2.81Å; C412-C415 VanDerWaalsContact SG-SG 3.62Å; C415-K417 PolarHBondContact O-N 3.07Å; C415-H428 PolarHBondContact SG-NE2 3.49Å; C415-H432 PolarHBondContact SG-CE1 3.24Å; C415-H432 PolarHBondContact SG-NE2 3.34Å
416	G	77.9	Confident	78.9	Confident	50 Å²	50	76.3 Å²	76.3	52%	0.515	40%	0.401	S	S	.	.			trans	70.2	-19.3	179.9	0	0	0	0	0	116.7	C412 G418	C412-G416 VanDerWaalsContact O-CA 3.28Å; C412-G416 WeakPolarHBondContact O-CA 3.33Å; C412-G416 PolarHBondContact O-N 2.84Å; G416-G418 PolarHBondContact O-N 2.91Å
417	K	76.8	Confident	78.6	Confident	131 Å²	131	79.2 Å²	79.2	57%	0.57	40%	0.401	S	S	*	.			trans	-57.2	126.7	-171.3	-71.3	175.2	-176.5	167.3	0	112.4	C412 C415 F419	C412-K417 WeakPolarHBondContact CB-O 3.39Å; C412-K417 PolarHBondContact N-O 3.1Å; C415-K417 PolarHBondContact O-N 3.07Å; K417-F419 HydrophobicContact CB-CE2 4.01Å; K417-F419 HydrophobicContact CB-CZ 4.14Å; K417-F419 WeakPolarHBondContact O-CD2 3.2Å; K417-F419 WeakPolarHBondContact O-CE2 3.04Å
418	G	81.9	Confident	78.5	Confident	26 Å²	26	75.6 Å²	75.6	27%	0.268	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	142.2	-176.4	0	0	0	0	0	114.1	G416	G416-G418 PolarHBondContact O-N 2.91Å
419	F	81.1	Confident	78	Confident	43 Å²	43	74.7 Å²	74.7	19%	0.189	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.1	-178.6	-59	-86.9	0	0	0	112.2	K408 Y410 C412 K417 S421 R424 L425 H428	K408-F419 CarbonylContact C-O 3.56Å; K408-F419 WeakPolarHBondContact CA-O 3.39Å; Y410-F419 WeakPolarHBondContact CD2-O 3.3Å; Y410-F419 PolarHBondContact N-O 3.08Å; Y410-F419 WeakPolarHBondContact O-CD2 3.25Å; Y410-F419 PolarHBondContact O-N 3.05Å; C412-F419 HydrophobicContact CB-CE2 4.3Å; K417-F419 HydrophobicContact CB-CE2 4.01Å; K417-F419 HydrophobicContact CB-CZ 4.14Å; K417-F419 WeakPolarHBondContact O-CD2 3.2Å; K417-F419 WeakPolarHBondContact O-CE2 3.04Å; F419-S421 VanDerWaalsContact C-N 3.27Å; F419-S421 PolarHBondContact O-N 3.17Å; F419-R424 HydrophobicContact CB-CB 4.26Å; F419-R424 HydrophobicContact CD1-CB 4.01Å; F419-R424 HydrophobicContact CG-CB 4.41Å; F419-L425 HydrophobicContact CB-CB 4.27Å; F419-L425 HydrophobicContact CD2-CB 3.94Å; F419-L425 HydrophobicContact CD2-CD1 3.84Å; F419-L425 HydrophobicContact CD2-CG 4.49Å; F419-L425 HydrophobicContact CE2-CD1 4.05Å; F419-L425 HydrophobicContact CG-CB 4.25Å; F419-H428 HydrophobicContact CE1-CB 3.95Å; F419-H428 HydrophobicContact CE2-CB 3.92Å; F419-H428 AromaticContact CE2-CD2 3.29Å; F419-H428 WeakPolarHBondContact CE2-CD2 3.14Å; F419-H428 AromaticContact CE2-CG 3.69Å; F419-H428 HydrophobicContact CZ-CB 3.46Å; F419-H428 VanDerWaalsContact CZ-CB 3.46Å; F419-H428 AromaticContact CZ-CD2 3.31Å; F419-H428 WeakPolarHBondContact CZ-CD2 3.22Å; F419-H428 AromaticContact CZ-CG 3.25Å; F419-H428 AromaticContact CZ-ND1 3.91Å; F419-H428 AromaticContact CZ-NE2 3.96Å
420	T	79.8	Confident	77.4	Confident	36 Å²	36	72.6 Å²	72.6	22%	0.221	36%	0.362	C	S	.	.	S	Bend	trans	-73.9	-13.8	177.8	59.7	0	0	0	0	113.9	R402	R402-T420 HydrophobicContact CB-CG2 4.1Å; R402-T420 PolarHBondContact NH1-O 2.75Å; R402-T420 VanDerWaalsContact NH1-O 3.17Å
421	S	78.4	Confident	76.7	Confident	14 Å²	14	74.9 Å²	74.9	10%	0.098	38%	0.379	C	S	.	.	S	Bend	trans	-152	141.7	-176.3	50.8	0	0	0	0	113.2	Q399 Y410 F419 S423 R424 L425	Q399-S421 VanDerWaalsContact NE2-CB 3.35Å; Q399-S421 PolarHBondContact NE2-OG 3.16Å; Q399-S421 VanDerWaalsContact NE2-OG 3.16Å; Y410-S421 VanDerWaalsContact CD2-C 3.44Å; Y410-S421 VanDerWaalsContact CD2-CA 3.42Å; F419-S421 VanDerWaalsContact C-N 3.27Å; F419-S421 PolarHBondContact O-N 3.17Å; S421-S423 VanDerWaalsContact C-N 3.28Å; S421-S423 PolarHBondContact O-N 3.49Å; S421-R424 WeakPolarHBondContact O-CB 3.26Å; S421-R424 PolarHBondContact O-N 3.28Å; S421-R424 VanDerWaalsContact OG-CG 3.24Å; S421-R424 WeakPolarHBondContact OG-CG 3.47Å; S421-L425 PolarHBondContact O-N 3.27Å
422	I	75.9	Confident	76	Confident	86 Å²	86	69.7 Å²	69.7	44%	0.441	36%	0.362	S	S	.	.	H	α-helix	trans	-61.5	-31.9	-177.5	-164.8	165.6	0	0	0	113.5	Y410 R424 L425 N426	Y410-I422 HydrophobicContact CD1-CB 3.77Å; Y410-I422 HydrophobicContact CD1-CD1 4.42Å; Y410-I422 HydrophobicContact CD1-CG1 4.18Å; Y410-I422 HydrophobicContact CE1-CB 3.77Å; Y410-I422 HydrophobicContact CE1-CD1 4.38Å; Y410-I422 HydrophobicContact CE1-CG1 4.41Å; Y410-I422 HydrophobicContact CG-CB 4.21Å; I422-R424 VanDerWaalsContact C-N 3.28Å; I422-R424 PolarHBondContact O-N 3Å; I422-L425 PolarHBondContact O-N 2.98Å; I422-N426 WeakPolarHBondContact O-CB 3.46Å; I422-N426 PolarHBondContact O-N 3.39Å
423	S	74.5	Confident	75.2	Confident	89 Å²	89	72.2 Å²	72.2	62%	0.622	38%	0.377	S	S	*	.	H	α-helix	trans	-66	-29.4	175	-49.5	0	0	0	0	112.8	S421 R427	S421-S423 VanDerWaalsContact C-N 3.28Å; S421-S423 PolarHBondContact O-N 3.49Å; S423-R427 WeakPolarHBondContact O-CB 3.18Å; S423-R427 PolarHBondContact O-N 3.18Å
424	R	75.9	Confident	74.3	Confident	136 Å²	136	67.1 Å²	67.1	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-76.7	-39.8	173.5	-67.2	-72.9	-178.6	126.2	-1	111	F419 S421 I422 R427 H428	F419-R424 HydrophobicContact CB-CB 4.26Å; F419-R424 HydrophobicContact CD1-CB 4.01Å; F419-R424 HydrophobicContact CG-CB 4.41Å; S421-R424 WeakPolarHBondContact O-CB 3.26Å; S421-R424 PolarHBondContact O-N 3.28Å; S421-R424 VanDerWaalsContact OG-CG 3.24Å; S421-R424 WeakPolarHBondContact OG-CG 3.47Å; I422-R424 VanDerWaalsContact C-N 3.28Å; I422-R424 PolarHBondContact O-N 3Å; R424-R427 PolarHBondContact O-N 3.38Å; R424-H428 WeakPolarHBondContact O-CB 3.37Å; R424-H428 PolarHBondContact O-N 3.28Å
425	L	80	Confident	73.4	Confident	19 Å²	19	69.3 Å²	69.3	10%	0.099	37%	0.373	C	S	.	.	H	α-helix	trans	-60.5	-52.5	172.3	171.4	60	0	0	0	111.7	R411 C412 F419 S421 I422 R427 H428 R429	R411-L425 WeakPolarHBondContact O-CD2 3.39Å; C412-L425 HydrophobicContact CB-CD1 3.58Å; F419-L425 HydrophobicContact CB-CB 4.27Å; F419-L425 HydrophobicContact CD2-CB 3.94Å; F419-L425 HydrophobicContact CD2-CD1 3.84Å; F419-L425 HydrophobicContact CD2-CG 4.49Å; F419-L425 HydrophobicContact CE2-CD1 4.05Å; F419-L425 HydrophobicContact CG-CB 4.25Å; S421-L425 PolarHBondContact O-N 3.27Å; I422-L425 PolarHBondContact O-N 2.98Å; L425-R427 PolarHBondContact O-N 3.04Å; L425-H428 CarbonylContact O-C 3.43Å; L425-H428 WeakPolarHBondContact O-CA 3.3Å; L425-H428 WeakPolarHBondContact O-CB 3.45Å; L425-H428 PolarHBondContact O-N 2.8Å; L425-R429 HydrophobicContact CD1-CG 4.02Å; L425-R429 HydrophobicContact CG-CG 4.47Å; L425-R429 PolarHBondContact O-N 2.92Å
426	N	75.3	Confident	72.3	Confident	90 Å²	90	72.8 Å²	72.8	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-57.7	-38.8	179.5	-72.5	-5.9	0	0	0	111.8	I422 H428 R429	I422-N426 WeakPolarHBondContact O-CB 3.46Å; I422-N426 PolarHBondContact O-N 3.39Å; N426-H428 VanDerWaalsContact C-N 3.32Å; N426-R429 PolarHBondContact O-N 3.44Å
427	R	70.4	Confident	71.7	Confident	96 Å²	96	75.2 Å²	75.2	36%	0.362	38%	0.383	S	S	.	.	H	α-helix	trans	-70.1	-27	174.8	-169.5	178.6	75.5	170.5	9.6	113.3	S423 R424 L425 I430 S448	S423-R427 WeakPolarHBondContact O-CB 3.18Å; S423-R427 PolarHBondContact O-N 3.18Å; R424-R427 PolarHBondContact O-N 3.38Å; L425-R427 PolarHBondContact O-N 3.04Å; R427-I430 HydrophobicContact CG-CD1 4.29Å; R427-S448 VanDerWaalsContact CD-O 3.26Å; R427-S448 WeakPolarHBondContact CD-O 3.25Å; R427-S448 WeakPolarHBondContact CG-O 3.49Å
428	H	75.9	Confident	71.3	Confident	22 Å²	22	73 Å²	73	10%	0.102	37%	0.372	C	S	.	.	H	α-helix	trans	-77	-38.6	174.1	168.8	60.7	0	0	0	112.3	C415 F419 R424 L425 N426 I430 I431 H432	C415-H428 PolarHBondContact SG-NE2 3.49Å; F419-H428 HydrophobicContact CE1-CB 3.95Å; F419-H428 HydrophobicContact CE2-CB 3.92Å; F419-H428 AromaticContact CE2-CD2 3.29Å; F419-H428 WeakPolarHBondContact CE2-CD2 3.14Å; F419-H428 AromaticContact CE2-CG 3.69Å; F419-H428 HydrophobicContact CZ-CB 3.46Å; F419-H428 VanDerWaalsContact CZ-CB 3.46Å; F419-H428 AromaticContact CZ-CD2 3.31Å; F419-H428 WeakPolarHBondContact CZ-CD2 3.22Å; F419-H428 AromaticContact CZ-CG 3.25Å; F419-H428 AromaticContact CZ-ND1 3.91Å; F419-H428 AromaticContact CZ-NE2 3.96Å; R424-H428 WeakPolarHBondContact O-CB 3.37Å; R424-H428 PolarHBondContact O-N 3.28Å; L425-H428 CarbonylContact O-C 3.43Å; L425-H428 WeakPolarHBondContact O-CA 3.3Å; L425-H428 WeakPolarHBondContact O-CB 3.45Å; L425-H428 PolarHBondContact O-N 2.8Å; N426-H428 VanDerWaalsContact C-N 3.32Å; H428-I430 PolarHBondContact O-N 3.31Å; H428-I430 VanDerWaalsContact O-N 3.13Å; H428-I431 VanDerWaalsContact O-CB 3.26Å; H428-I431 WeakPolarHBondContact O-CB 3.31Å; H428-I431 WeakPolarHBondContact O-CG1 3.38Å; H428-I431 PolarHBondContact O-N 3.25Å; H428-H432 AromaticContact CD2-NE2 3.82Å; H428-H432 AromaticContact CE1-CE1 3.83Å; H428-H432 AromaticContact CE1-NE2 3.37Å; H428-H432 PolarHBondContact CE1-NE2 3.24Å; H428-H432 AromaticContact NE2-CD2 3.98Å; H428-H432 AromaticContact NE2-CE1 3.83Å; H428-H432 AromaticContact NE2-NE2 3.01Å; H428-H432 PolarHBondContact NE2-NE2 3Å
429	R	71.6	Confident	70.6	Confident	101 Å²	101	74 Å²	74	38%	0.381	37%	0.373	S	S	.	.	H	α-helix	trans	-57.8	-27.7	179.6	-70.7	-167.3	63.6	-119.8	-9.1	114.1	E414 L425 N426 I431 H432 T433	E414-R429 IonicContact OE1-CZ 3.9Å; E414-R429 VanDerWaalsContact OE1-CZ 3.29Å; E414-R429 IonicContact OE1-NE 2.71Å; E414-R429 PolarHBondContact OE1-NE 2.9Å; E414-R429 IonicContact OE1-NH2 3.87Å; E414-R429 PolarHBondContact OE1-NH2 3.32Å; E414-R429 IonicContact OE2-NE 3.66Å; E414-R429 PolarHBondContact OE2-NE 3.37Å; L425-R429 HydrophobicContact CD1-CG 4.02Å; L425-R429 HydrophobicContact CG-CG 4.47Å; L425-R429 PolarHBondContact O-N 2.92Å; N426-R429 PolarHBondContact O-N 3.44Å; R429-I431 PolarHBondContact O-N 3.11Å; R429-I431 VanDerWaalsContact O-N 3.11Å; R429-H432 PolarHBondContact O-N 3.13Å; R429-T433 PolarHBondContact O-N 3.41Å
430	I	69.3	Low	70.6	Confident	28 Å²	28	72 Å²	72	14%	0.144	36%	0.364	C	S	.	.	H	α-helix	trans	-50.3	-33.1	170.6	-59.7	169	0	0	0	112.3	R427 H428 H432 G434 E435 L437	R427-I430 HydrophobicContact CG-CD1 4.29Å; H428-I430 PolarHBondContact O-N 3.31Å; H428-I430 VanDerWaalsContact O-N 3.13Å; I430-H432 VanDerWaalsContact C-N 3.29Å; I430-H432 PolarHBondContact O-N 2.83Å; I430-G434 PolarHBondContact O-N 2.87Å; I430-E435 WeakPolarHBondContact CG2-O 3.49Å; I430-L437 HydrophobicContact CD1-CD1 3.44Å; I430-L437 VanDerWaalsContact CD1-CD1 3.44Å; I430-L437 HydrophobicContact CD1-CG 3.96Å; I430-L437 HydrophobicContact CG1-CD1 4.11Å; I430-L437 HydrophobicContact CG1-CG 4.31Å
431	I	67.3	Low	70.4	Confident	127 Å²	127	77.1 Å²	77.1	65%	0.651	39%	0.39	S	S	*	.	H	α-helix	trans	-68.3	-30.9	-179.5	-57.1	178.2	0	0	0	111.2	H428 R429	H428-I431 VanDerWaalsContact O-CB 3.26Å; H428-I431 WeakPolarHBondContact O-CB 3.31Å; H428-I431 WeakPolarHBondContact O-CG1 3.38Å; H428-I431 PolarHBondContact O-N 3.25Å; R429-I431 PolarHBondContact O-N 3.11Å; R429-I431 VanDerWaalsContact O-N 3.11Å
432	H	66.6	Low	70.5	Confident	72 Å²	72	82.5 Å²	82.5	33%	0.333	41%	0.414	S	S	.	.	H	α-helix	trans	-91.7	-39.3	-179.8	-50.9	-54.2	0	0	0	112.4	C412 E414 C415 H428 R429 I430 G434	C412-H432 VanDerWaalsContact SG-CD2 3.5Å; C412-H432 PolarHBondContact SG-NE2 3.46Å; E414-H432 HydrophobicContact CB-CB 4.13Å; E414-H432 HydrophobicContact CG-CB 4.25Å; E414-H432 IonicContact OE2-CD2 3.85Å; C415-H432 PolarHBondContact SG-CE1 3.24Å; C415-H432 PolarHBondContact SG-NE2 3.34Å; H428-H432 AromaticContact CD2-NE2 3.82Å; H428-H432 AromaticContact CE1-CE1 3.83Å; H428-H432 AromaticContact CE1-NE2 3.37Å; H428-H432 PolarHBondContact CE1-NE2 3.24Å; H428-H432 AromaticContact NE2-CD2 3.98Å; H428-H432 AromaticContact NE2-CE1 3.83Å; H428-H432 AromaticContact NE2-NE2 3.01Å; H428-H432 PolarHBondContact NE2-NE2 3Å; R429-H432 PolarHBondContact O-N 3.13Å; I430-H432 VanDerWaalsContact C-N 3.29Å; I430-H432 PolarHBondContact O-N 2.83Å; H432-G434 VanDerWaalsContact C-N 3.27Å; H432-G434 PolarHBondContact O-N 3.24Å
433	T	64.7	Low	70.7	Confident	56 Å²	56	81 Å²	81	34%	0.344	41%	0.411	S	S	.	.	H	α-helix	trans	-76.6	-13.4	-178.5	64.1	0	0	0	0	113.6	R429 E435	R429-T433 PolarHBondContact O-N 3.41Å; T433-E435 PolarHBondContact O-N 2.81Å; T433-E435 PolarHBondContact OG1-OE2 3.24Å
434	G	60	Low	70.6	Confident	56 Å²	56	78.4 Å²	78.4	58%	0.577	40%	0.397	S	S	*	.			trans	66.2	2.5	-175.5	0	0	0	0	0	114.4	I430 H432 K436	I430-G434 PolarHBondContact O-N 2.87Å; H432-G434 VanDerWaalsContact C-N 3.27Å; H432-G434 PolarHBondContact O-N 3.24Å; G434-K436 VanDerWaalsContact C-N 3.34Å; G434-K436 PolarHBondContact O-N 3.04Å
435	E	60.8	Low	70.4	Confident	128 Å²	128	77.9 Å²	77.9	60%	0.598	40%	0.399	S	S	*	.			trans	-68	88.4	-176.7	-73.1	-173.8	120.3	0	0	111.2	I430 T433 L437	I430-E435 WeakPolarHBondContact CG2-O 3.49Å; T433-E435 PolarHBondContact O-N 2.81Å; T433-E435 PolarHBondContact OG1-OE2 3.24Å; E435-L437 VanDerWaalsContact C-N 3.3Å; E435-L437 PolarHBondContact O-N 3.41Å
436	K	54.9	Low	69.9	Low	123 Å²	123	79.4 Å²	79.4	54%	0.535	42%	0.415	S	S	.	.			trans	-53.8	79.8	176.6	-91.6	172.7	157.3	-167	0	112.9	G434 T439 G444 A446	G434-K436 VanDerWaalsContact C-N 3.34Å; G434-K436 PolarHBondContact O-N 3.04Å; K436-T439 HydrophobicContact CB-CG2 3.78Å; K436-T439 HydrophobicContact CD-CG2 3.47Å; K436-T439 VanDerWaalsContact CD-CG2 3.47Å; K436-T439 HydrophobicContact CG-CG2 3.6Å; K436-G444 WeakPolarHBondContact CE-O 3.14Å; K436-G444 PolarHBondContact NZ-O 3.35Å; K436-A446 HydrophobicContact CG-CB 3.78Å
437	L	63.9	Low	69.8	Low	100 Å²	100	76.8 Å²	76.8	52%	0.524	40%	0.4	S	S	.	.	S	Bend	trans	-67.3	-35.2	178.4	-65.3	-163.2	0	0	0	113.2	I430 E435	I430-L437 HydrophobicContact CD1-CD1 3.44Å; I430-L437 VanDerWaalsContact CD1-CD1 3.44Å; I430-L437 HydrophobicContact CD1-CG 3.96Å; I430-L437 HydrophobicContact CG1-CD1 4.11Å; I430-L437 HydrophobicContact CG1-CG 4.31Å; E435-L437 VanDerWaalsContact C-N 3.3Å; E435-L437 PolarHBondContact O-N 3.41Å
438	Y	69.2	Low	69.7	Low	86 Å²	86	74.4 Å²	74.4	34%	0.337	40%	0.398	S	S	.	.	S	Bend	trans	-143.3	104	179.8	-57.7	-74.9	0	0	0	108.4	L447 H450	Y438-L447 PolarHBondContact O-N 3.02Å; Y438-H450 HydrophobicContact CD1-CB 3.96Å; Y438-H450 AromaticContact CD1-CD2 3.91Å; Y438-H450 HydrophobicContact CE1-CB 3.63Å; Y438-H450 AromaticContact CE1-CD2 3.81Å
439	T	68.3	Low	69.4	Low	45 Å²	45	75 Å²	75	28%	0.276	41%	0.405	S	S	.	.	B	Isolated β-bridge	trans	-97.7	139.4	173.2	36.6	0	0	0	0	110.8	K436 K445	K436-T439 HydrophobicContact CB-CG2 3.78Å; K436-T439 HydrophobicContact CD-CG2 3.47Å; K436-T439 VanDerWaalsContact CD-CG2 3.47Å; K436-T439 HydrophobicContact CG-CG2 3.6Å; T439-K445 WeakPolarHBondContact CA-O 3.2Å
440	C	79.3	Confident	69.5	Low	1 Å²	1	75.1 Å²	75.1	1%	0.007	41%	0.41	C	S	.	.			trans	-69.3	130.6	153.5	-175.9	0	0	0	0	109.1	E442 G444 K445 L453 H456 H460	C440-E442 VanDerWaalsContact C-N 3.35Å; C440-G444 WeakPolarHBondContact O-CA 3.46Å; C440-G444 PolarHBondContact O-N 2.95Å; C440-K445 PolarHBondContact N-O 2.94Å; C440-L453 HydrophobicContact CB-CD1 4Å; C440-H456 WeakPolarHBondContact CB-NE2 3.41Å; C440-H460 VanDerWaalsContact SG-CD2 3.52Å
441	N	77	Confident	69.9	Low	144 Å²	144	77.3 Å²	77.3	77%	0.77	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-31.6	178.7	-64.9	-24	0	0	0	112
442	E	79.9	Confident	70.4	Confident	127 Å²	127	73.8 Å²	73.8	59%	0.593	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-39	-174.1	-62.6	-179.8	-111.9	0	0	113.6	C440 H460	C440-E442 VanDerWaalsContact C-N 3.35Å; E442-H460 VanDerWaalsContact CD-CB 3.48Å; E442-H460 VanDerWaalsContact OE1-CB 3.29Å; E442-H460 WeakPolarHBondContact OE1-CB 3.33Å; E442-H460 IonicContact OE1-CD2 3.83Å; E442-H460 IonicContact OE1-CG 3.93Å; E442-H460 WeakPolarHBondContact OE2-CB 3.37Å; E442-H460 IonicContact OE2-CG 3.33Å
443	C	79.4	Confident	71.1	Confident	56 Å²	56	71 Å²	71	38%	0.378	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	8.8	179.8	70.2	0	0	0	0	114.5	K445 H456 H460	C443-K445 PolarHBondContact O-N 3.34Å; C443-H456 PolarHBondContact SG-NE2 3.01Å; C443-H460 WeakPolarHBondContact CB-NE2 3.41Å; C443-H460 PolarHBondContact SG-NE2 3.49Å
444	G	72.1	Confident	71.9	Confident	33 Å²	33	71.6 Å²	71.6	34%	0.34	40%	0.4	S	S	.	.			trans	63.8	2.4	176.9	0	0	0	0	0	116.1	K436 C440	K436-G444 WeakPolarHBondContact CE-O 3.14Å; K436-G444 PolarHBondContact NZ-O 3.35Å; C440-G444 WeakPolarHBondContact O-CA 3.46Å; C440-G444 PolarHBondContact O-N 2.95Å
445	K	71.7	Confident	72.9	Confident	125 Å²	125	72 Å²	72	54%	0.543	39%	0.388	S	S	.	.			trans	-70.6	128.6	-170.2	-171	166.5	-171.4	162.2	0	111.9	T439 C440 C443	T439-K445 WeakPolarHBondContact CA-O 3.2Å; C440-K445 PolarHBondContact N-O 2.94Å; C443-K445 PolarHBondContact O-N 3.34Å
446	A	70.8	Confident	74	Confident	52 Å²	52	67 Å²	67	43%	0.43	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-79.1	134.5	176.2	0	0	0	0	0	111.3	K436	K436-A446 HydrophobicContact CG-CB 3.78Å
447	L	73.5	Confident	75.3	Confident	34 Å²	34	63.5 Å²	63.5	18%	0.178	35%	0.35	C	S	.	.			trans	-131	149.2	-179.4	-70.1	174.1	0	0	0	112.8	Y438 S449 L453 H456	Y438-L447 PolarHBondContact O-N 3.02Å; L447-S449 VanDerWaalsContact C-N 3.33Å; L447-S449 PolarHBondContact O-N 3.23Å; L447-L453 HydrophobicContact CD1-CB 4.24Å; L447-L453 HydrophobicContact CD1-CD1 4.06Å; L447-H456 HydrophobicContact CD1-CB 3.55Å; L447-H456 WeakPolarHBondContact CD1-CD2 3.42Å
448	S	68.3	Low	76.4	Confident	46 Å²	46	61.6 Å²	61.6	32%	0.322	34%	0.336	S	S	.	.	S	Bend	trans	-83.7	-3.2	-167.2	77.6	0	0	0	0	115	R427	R427-S448 VanDerWaalsContact CD-O 3.26Å; R427-S448 WeakPolarHBondContact CD-O 3.25Å; R427-S448 WeakPolarHBondContact CG-O 3.49Å
449	S	69.8	Low	77.1	Confident	36 Å²	36	61.4 Å²	61.4	25%	0.252	34%	0.34	S	S	.	.			trans	-164.3	147.7	179.2	-167.2	0	0	0	0	111.8	L447 S451 T452 L453	L447-S449 VanDerWaalsContact C-N 3.33Å; L447-S449 PolarHBondContact O-N 3.23Å; S449-S451 VanDerWaalsContact C-N 3.32Å; S449-S451 PolarHBondContact O-N 3.12Å; S449-T452 PolarHBondContact N-OG1 2.84Å; S449-T452 PolarHBondContact O-N 2.88Å; S449-T452 PolarHBondContact O-OG1 3.41Å; S449-L453 PolarHBondContact O-N 3.1Å; S449-L453 VanDerWaalsContact O-N 3.09Å
450	H	72.6	Confident	77.8	Confident	103 Å²	103	63.5 Å²	63.5	48%	0.477	35%	0.347	S	S	.	.	H	α-helix	trans	-54.2	-43.6	175.3	-168.7	-94.6	0	0	0	113	Y438 T452 L453 I454	Y438-H450 HydrophobicContact CD1-CB 3.96Å; Y438-H450 AromaticContact CD1-CD2 3.91Å; Y438-H450 HydrophobicContact CE1-CB 3.63Å; Y438-H450 AromaticContact CE1-CD2 3.81Å; H450-T452 VanDerWaalsContact C-N 3.26Å; H450-T452 PolarHBondContact O-N 3.33Å; H450-L453 WeakPolarHBondContact O-CA 3.09Å; H450-L453 WeakPolarHBondContact O-CB 3.45Å; H450-L453 PolarHBondContact O-N 3.26Å; H450-I454 PolarHBondContact O-N 3.22Å
451	S	77.1	Confident	78	Confident	73 Å²	73	67.1 Å²	67.1	51%	0.51	37%	0.369	S	S	.	.	H	α-helix	trans	-65.4	-29.2	178.8	56.6	0	0	0	0	113.1	S449 I455	S449-S451 VanDerWaalsContact C-N 3.32Å; S449-S451 PolarHBondContact O-N 3.12Å; S451-I455 WeakPolarHBondContact O-CD1 3.24Å; S451-I455 VanDerWaalsContact O-CG1 3.27Å; S451-I455 WeakPolarHBondContact O-CG1 3.4Å; S451-I455 PolarHBondContact O-N 2.84Å
452	T	78.6	Confident	78.2	Confident	54 Å²	54	61.7 Å²	61.7	33%	0.331	35%	0.347	S	S	.	.	H	α-helix	trans	-76.3	-24.2	171.3	50.7	0	0	0	0	113.1	S449 H450 H456	S449-T452 PolarHBondContact N-OG1 2.84Å; S449-T452 PolarHBondContact O-N 2.88Å; S449-T452 PolarHBondContact O-OG1 3.41Å; H450-T452 VanDerWaalsContact C-N 3.26Å; H450-T452 PolarHBondContact O-N 3.33Å; T452-H456 VanDerWaalsContact O-CB 3.23Å; T452-H456 WeakPolarHBondContact O-CB 3.46Å; T452-H456 PolarHBondContact O-N 3.16Å
453	L	81.2	Confident	78.5	Confident	13 Å²	13	60.3 Å²	60.3	7%	0.068	34%	0.341	C	S	.	.	H	α-helix	trans	-70.2	-53.4	172.2	176.5	60.2	0	0	0	111.1	C440 L447 S449 H450 I455 H456 E457	C440-L453 HydrophobicContact CB-CD1 4Å; L447-L453 HydrophobicContact CD1-CB 4.24Å; L447-L453 HydrophobicContact CD1-CD1 4.06Å; S449-L453 PolarHBondContact O-N 3.1Å; S449-L453 VanDerWaalsContact O-N 3.09Å; H450-L453 WeakPolarHBondContact O-CA 3.09Å; H450-L453 WeakPolarHBondContact O-CB 3.45Å; H450-L453 PolarHBondContact O-N 3.26Å; L453-I455 PolarHBondContact O-N 3.33Å; L453-I455 VanDerWaalsContact O-N 3.16Å; L453-H456 CarbonylContact O-C 3.54Å; L453-H456 WeakPolarHBondContact O-CA 3.49Å; L453-H456 WeakPolarHBondContact O-CB 3.41Å; L453-H456 PolarHBondContact O-N 3.07Å; L453-E457 HydrophobicContact CD1-CG 3.92Å; L453-E457 WeakPolarHBondContact CD1-OE1 3.26Å; L453-E457 HydrophobicContact CG-CG 4.32Å; L453-E457 WeakPolarHBondContact CG-OE1 3.23Å; L453-E457 PolarHBondContact O-N 3Å
454	I	81.4	Confident	78.8	Confident	69 Å²	69	62.9 Å²	62.9	35%	0.354	35%	0.345	S	S	.	.	H	α-helix	trans	-55.1	-38.1	176.9	-56.8	-56.4	0	0	0	112.3	H450 H456 E457	H450-I454 PolarHBondContact O-N 3.22Å; I454-H456 VanDerWaalsContact C-N 3.32Å; I454-E457 WeakPolarHBondContact CA-OE2 3.33Å; I454-E457 WeakPolarHBondContact CD1-OE2 3.32Å
455	I	81.6	Confident	79.4	Confident	65 Å²	65	64.8 Å²	64.8	33%	0.333	35%	0.352	S	S	.	.	H	α-helix	trans	-72.4	-25.8	176.8	-69.7	170.5	0	0	0	112.4	S451 L453 Q477	S451-I455 WeakPolarHBondContact O-CD1 3.24Å; S451-I455 VanDerWaalsContact O-CG1 3.27Å; S451-I455 WeakPolarHBondContact O-CG1 3.4Å; S451-I455 PolarHBondContact O-N 2.84Å; L453-I455 PolarHBondContact O-N 3.33Å; L453-I455 VanDerWaalsContact O-N 3.16Å; I455-Q477 HydrophobicContact CG2-CG 3.77Å
456	H	83.1	Confident	80.1	Confident	23 Å²	23	60 Å²	60	11%	0.106	33%	0.334	C	S	.	.	H	α-helix	trans	-84.8	-33.9	178.1	168.3	58.5	0	0	0	112.7	C440 C443 L447 T452 L453 I454 R458 I459	C440-H456 WeakPolarHBondContact CB-NE2 3.41Å; C443-H456 PolarHBondContact SG-NE2 3.01Å; L447-H456 HydrophobicContact CD1-CB 3.55Å; L447-H456 WeakPolarHBondContact CD1-CD2 3.42Å; T452-H456 VanDerWaalsContact O-CB 3.23Å; T452-H456 WeakPolarHBondContact O-CB 3.46Å; T452-H456 PolarHBondContact O-N 3.16Å; L453-H456 CarbonylContact O-C 3.54Å; L453-H456 WeakPolarHBondContact O-CA 3.49Å; L453-H456 WeakPolarHBondContact O-CB 3.41Å; L453-H456 PolarHBondContact O-N 3.07Å; I454-H456 VanDerWaalsContact C-N 3.32Å; H456-R458 PolarHBondContact O-N 2.99Å; H456-I459 WeakPolarHBondContact O-CA 3.33Å; H456-I459 WeakPolarHBondContact O-CB 3.47Å; H456-I459 VanDerWaalsContact O-CG1 3.25Å; H456-I459 WeakPolarHBondContact O-CG1 3.31Å; H456-I459 PolarHBondContact O-N 3.39Å
457	E	82.3	Confident	80.9	Confident	49 Å²	49	65.1 Å²	65.1	23%	0.229	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-32.3	176.6	-72.6	160.5	157	0	0	111.7	L453 I454 I459 H460 T461	L453-E457 HydrophobicContact CD1-CG 3.92Å; L453-E457 WeakPolarHBondContact CD1-OE1 3.26Å; L453-E457 HydrophobicContact CG-CG 4.32Å; L453-E457 WeakPolarHBondContact CG-OE1 3.23Å; L453-E457 PolarHBondContact O-N 3Å; I454-E457 WeakPolarHBondContact CA-OE2 3.33Å; I454-E457 WeakPolarHBondContact CD1-OE2 3.32Å; E457-I459 PolarHBondContact O-N 2.92Å; E457-H460 PolarHBondContact O-N 2.61Å; E457-T461 PolarHBondContact O-N 3.15Å; E457-T461 VanDerWaalsContact O-N 3.1Å
458	R	86.9	Confident	81.8	Confident	60 Å²	60	63.7 Å²	63.7	23%	0.226	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-12.6	167.3	-62.8	-177.5	-179.6	158.2	7.2	115.1	H456 G462 E463 R476	H456-R458 PolarHBondContact O-N 2.99Å; R458-G462 PolarHBondContact O-N 3.3Å; R458-E463 HydrophobicContact CB-CB 4.15Å; R458-E463 HydrophobicContact CG-CB 3.89Å; R458-E463 IonicContact NE-OE2 3.35Å; R458-R476 HydrophobicContact CB-CB 4.48Å; R458-R476 HydrophobicContact CB-CG 4.48Å; R458-R476 PolarHBondContact NH1-O 3.36Å; R458-R476 WeakPolarHBondContact O-CD 3.15Å; R458-R476 PolarHBondContact O-NE 3.26Å
459	I	84.1	Confident	82.7	Confident	82 Å²	82	71.6 Å²	71.6	42%	0.421	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-44.4	169.4	-60.9	-175.1	0	0	0	109.7	H456 E457 R476	H456-I459 WeakPolarHBondContact O-CA 3.33Å; H456-I459 WeakPolarHBondContact O-CB 3.47Å; H456-I459 VanDerWaalsContact O-CG1 3.25Å; H456-I459 WeakPolarHBondContact O-CG1 3.31Å; H456-I459 PolarHBondContact O-N 3.39Å; E457-I459 PolarHBondContact O-N 2.92Å; I459-R476 PolarHBondContact O-NH2 3.01Å
460	H	82.7	Confident	83.5	Confident	88 Å²	88	74.9 Å²	74.9	41%	0.407	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-51.3	-176.8	-52.3	-67.3	0	0	0	112.1	C440 E442 C443 E457 G462	C440-H460 VanDerWaalsContact SG-CD2 3.52Å; E442-H460 VanDerWaalsContact CD-CB 3.48Å; E442-H460 VanDerWaalsContact OE1-CB 3.29Å; E442-H460 WeakPolarHBondContact OE1-CB 3.33Å; E442-H460 IonicContact OE1-CD2 3.83Å; E442-H460 IonicContact OE1-CG 3.93Å; E442-H460 WeakPolarHBondContact OE2-CB 3.37Å; E442-H460 IonicContact OE2-CG 3.33Å; C443-H460 WeakPolarHBondContact CB-NE2 3.41Å; C443-H460 PolarHBondContact SG-NE2 3.49Å; E457-H460 PolarHBondContact O-N 2.61Å; H460-G462 PolarHBondContact O-N 2.86Å
461	T	83.5	Confident	84.3	Confident	77 Å²	77	72.4 Å²	72.4	47%	0.472	38%	0.38	S	S	.	.	S	Bend	trans	-66.6	-5.5	178	70.6	0	0	0	0	113.9	E457 E463	E457-T461 PolarHBondContact O-N 3.15Å; E457-T461 VanDerWaalsContact O-N 3.1Å; T461-E463 PolarHBondContact O-N 3.23Å; T461-E463 WeakPolarHBondContact OG1-CB 3.42Å; T461-E463 WeakPolarHBondContact OG1-CG 3.18Å; T461-E463 PolarHBondContact OG1-OE1 3.43Å
462	G	82.5	Confident	84.7	Confident	31 Å²	31	71.5 Å²	71.5	32%	0.32	38%	0.383	S	S	.	.			trans	70	-7.4	-178.6	0	0	0	0	0	115.1	R458 H460 K464	R458-G462 PolarHBondContact O-N 3.3Å; H460-G462 PolarHBondContact O-N 2.86Å; G462-K464 WeakPolarHBondContact O-CG 3.45Å; G462-K464 PolarHBondContact O-N 3.13Å
463	E	84.6	Confident	85.1	Confident	97 Å²	97	75.2 Å²	75.2	45%	0.453	39%	0.394	S	S	.	.			trans	-48.8	126	-173.6	-91.7	179.5	-132.4	0	0	114	R458 T461 R476	R458-E463 HydrophobicContact CB-CB 4.15Å; R458-E463 HydrophobicContact CG-CB 3.89Å; R458-E463 IonicContact NE-OE2 3.35Å; T461-E463 PolarHBondContact O-N 3.23Å; T461-E463 WeakPolarHBondContact OG1-CB 3.42Å; T461-E463 WeakPolarHBondContact OG1-CG 3.18Å; T461-E463 PolarHBondContact OG1-OE1 3.43Å; E463-R476 WeakPolarHBondContact O-CG 3.45Å
464	K	86.8	Confident	85.5	Confident	110 Å²	110	76.2 Å²	76.2	48%	0.478	40%	0.404	S	S	.	.			trans	-127.7	73.9	177.1	-70.9	152.5	-175.7	170.3	0	110.7	G462 C466 A474 F475 R476	G462-K464 WeakPolarHBondContact O-CG 3.45Å; G462-K464 PolarHBondContact O-N 3.13Å; K464-C466 PolarHBondContact O-N 3.16Å; K464-A474 HydrophobicContact CB-CB 3.53Å; K464-A474 HydrophobicContact CD-CB 4.24Å; K464-A474 WeakPolarHBondContact CD-O 3.33Å; K464-A474 HydrophobicContact CG-CB 4.38Å; K464-F475 CarbonylContact C-O 3.51Å; K464-F475 VanDerWaalsContact C-O 3.26Å; K464-F475 WeakPolarHBondContact CA-O 3.24Å; K464-R476 HydrophobicContact CG-CG 4.17Å
465	P	84.5	Confident	85.8	Confident	73 Å²	73	75.2 Å²	75.2	47%	0.474	40%	0.397	S	S	.	.			trans	-64.8	-23.1	-173.4	-22.6	35.1	0	0	0	114.1	K467	P465-K467 PolarHBondContact O-N 2.95Å
466	C	86.5	Confident	85.9	Confident	26 Å²	26	76.5 Å²	76.5	18%	0.176	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	86.6	-174.9	-59.5	0	0	0	0	110.3	K464 F475 S478 L481	K464-C466 PolarHBondContact O-N 3.16Å; C466-F475 HydrophobicContact CB-CB 4.28Å; C466-F475 WeakPolarHBondContact CB-O 3.5Å; C466-F475 PolarHBondContact N-O 3.07Å; C466-F475 PolarHBondContact O-N 3.22Å; C466-S478 PolarHBondContact SG-N 3.41Å; C466-S478 VanDerWaalsContact SG-N 3.41Å; C466-L481 HydrophobicContact CB-CB 3.94Å; C466-L481 HydrophobicContact CB-CD2 3.8Å; C466-L481 HydrophobicContact CB-CG 4.49Å
467	K	88.2	Confident	86	Confident	159 Å²	159	79.5 Å²	79.5	69%	0.691	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	138.6	177.3	-62.7	-174.7	178.8	-179.4	0	112.2	P465 A474	P465-K467 PolarHBondContact O-N 2.95Å; K467-A474 HydrophobicContact CG-CB 3.94Å
468	C	90.8	Very high	86.1	Confident	4 Å²	4	80.7 Å²	80.7	3%	0.027	43%	0.426	C	S	.	.			trans	-83.1	124	171.8	-170.7	0	0	0	0	110.9	V470 G472 K473 F475 L481	C468-V470 VanDerWaalsContact C-N 3.29Å; C468-V470 PolarHBondContact O-N 3.46Å; C468-G472 WeakPolarHBondContact O-CA 3.49Å; C468-G472 PolarHBondContact O-N 3.07Å; C468-K473 VanDerWaalsContact CB-O 3.23Å; C468-K473 WeakPolarHBondContact CB-O 3.48Å; C468-K473 PolarHBondContact N-O 3.44Å; C468-F475 HydrophobicContact CB-CE2 4.49Å; C468-L481 HydrophobicContact CB-CD1 3.59Å
469	K	87.1	Confident	86.1	Confident	211 Å²	211	80.8 Å²	80.8	92%	0.917	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.9	179.1	-66.4	-169.1	176.8	-170.8	0	113.9
470	V	88.2	Confident	86.2	Confident	105 Å²	105	78.4 Å²	78.4	64%	0.636	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-35.4	-172.6	-177.2	0	0	0	0	113	C468 H488	C468-V470 VanDerWaalsContact C-N 3.29Å; C468-V470 PolarHBondContact O-N 3.46Å; V470-H488 HydrophobicContact CG1-CB 4.2Å; V470-H488 HydrophobicContact CG2-CB 4.42Å
471	C	87.9	Confident	86.5	Confident	51 Å²	51	75.3 Å²	75.3	35%	0.345	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.5	14.6	-171.2	69.6	0	0	0	0	114.2	K473 H484 H488	C471-K473 PolarHBondContact O-N 3.49Å; C471-H484 PolarHBondContact SG-NE2 3.14Å; C471-H488 PolarHBondContact SG-NE2 3.35Å; C471-H488 VanDerWaalsContact SG-NE2 3.43Å
472	G	85.4	Confident	86.6	Confident	55 Å²	55	76 Å²	76	57%	0.567	41%	0.414	S	S	*	.			trans	68.1	-20.6	-179.1	0	0	0	0	0	116.3	C468 A474	C468-G472 WeakPolarHBondContact O-CA 3.49Å; C468-G472 PolarHBondContact O-N 3.07Å; G472-A474 PolarHBondContact O-N 2.9Å
473	K	87.1	Confident	86.8	Confident	132 Å²	132	78.8 Å²	78.8	57%	0.574	42%	0.419	S	S	*	.			trans	-56.8	130.5	-172.2	-68	-177.6	-178.3	179.2	0	111.8	C468 C471 F475	C468-K473 VanDerWaalsContact CB-O 3.23Å; C468-K473 WeakPolarHBondContact CB-O 3.48Å; C468-K473 PolarHBondContact N-O 3.44Å; C471-K473 PolarHBondContact O-N 3.49Å; K473-F475 HydrophobicContact CB-CE2 4.07Å; K473-F475 HydrophobicContact CB-CZ 4.28Å; K473-F475 VanDerWaalsContact O-CE2 3.29Å; K473-F475 WeakPolarHBondContact O-CE2 3.4Å
474	A	89.3	Confident	86.9	Confident	34 Å²	34	75 Å²	75	28%	0.281	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.7	-169.1	0	0	0	0	0	112.5	K464 K467 G472	K464-A474 HydrophobicContact CB-CB 3.53Å; K464-A474 HydrophobicContact CD-CB 4.24Å; K464-A474 WeakPolarHBondContact CD-O 3.33Å; K464-A474 HydrophobicContact CG-CB 4.38Å; K467-A474 HydrophobicContact CG-CB 3.94Å; G472-A474 PolarHBondContact O-N 2.9Å
475	F	88.1	Confident	86.9	Confident	47 Å²	47	73.6 Å²	73.6	21%	0.206	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147	-172.1	-60	-91.5	0	0	0	112.5	K464 C466 C468 K473 Q477 A480 L481 H484	K464-F475 CarbonylContact C-O 3.51Å; K464-F475 VanDerWaalsContact C-O 3.26Å; K464-F475 WeakPolarHBondContact CA-O 3.24Å; C466-F475 HydrophobicContact CB-CB 4.28Å; C466-F475 WeakPolarHBondContact CB-O 3.5Å; C466-F475 PolarHBondContact N-O 3.07Å; C466-F475 PolarHBondContact O-N 3.22Å; C468-F475 HydrophobicContact CB-CE2 4.49Å; K473-F475 HydrophobicContact CB-CE2 4.07Å; K473-F475 HydrophobicContact CB-CZ 4.28Å; K473-F475 VanDerWaalsContact O-CE2 3.29Å; K473-F475 WeakPolarHBondContact O-CE2 3.4Å; F475-Q477 VanDerWaalsContact C-N 3.26Å; F475-Q477 PolarHBondContact O-N 3.45Å; F475-A480 HydrophobicContact CB-CB 4.27Å; F475-A480 HydrophobicContact CD1-CB 3.97Å; F475-A480 HydrophobicContact CG-CB 4.4Å; F475-L481 HydrophobicContact CB-CB 4.29Å; F475-L481 HydrophobicContact CD2-CB 4.01Å; F475-L481 HydrophobicContact CD2-CD1 3.88Å; F475-L481 HydrophobicContact CE2-CD1 4.12Å; F475-L481 HydrophobicContact CG-CB 4.31Å; F475-H484 HydrophobicContact CE1-CB 4Å; F475-H484 HydrophobicContact CE2-CB 3.9Å; F475-H484 AromaticContact CE2-CD2 3.37Å; F475-H484 WeakPolarHBondContact CE2-CD2 3.43Å; F475-H484 AromaticContact CE2-CG 3.68Å; F475-H484 HydrophobicContact CZ-CB 3.48Å; F475-H484 VanDerWaalsContact CZ-CB 3.48Å; F475-H484 AromaticContact CZ-CD2 3.45Å; F475-H484 VanDerWaalsContact CZ-CD2 3.45Å; F475-H484 WeakPolarHBondContact CZ-CD2 3.43Å; F475-H484 AromaticContact CZ-CG 3.29Å; F475-H484 AromaticContact CZ-ND1 3.93Å
476	R	84.4	Confident	87.1	Confident	92 Å²	92	72.4 Å²	72.4	35%	0.347	38%	0.383	S	S	.	.	S	Bend	trans	-69.9	-20.8	177.5	-60.5	-175.7	165.1	125.2	-9.4	113.5	R458 I459 E463 K464	R458-R476 HydrophobicContact CB-CB 4.48Å; R458-R476 HydrophobicContact CB-CG 4.48Å; R458-R476 PolarHBondContact NH1-O 3.36Å; R458-R476 WeakPolarHBondContact O-CD 3.15Å; R458-R476 PolarHBondContact O-NE 3.26Å; I459-R476 PolarHBondContact O-NH2 3.01Å; E463-R476 WeakPolarHBondContact O-CG 3.45Å; K464-R476 HydrophobicContact CG-CG 4.17Å
477	Q	85.1	Confident	87	Confident	86 Å²	86	76.3 Å²	76.3	40%	0.402	40%	0.4	S	S	.	.	S	Bend	trans	-139	145.9	-175.4	-60.1	179.2	23.5	0	0	111	I455 F475 S479 A480 L481	I455-Q477 HydrophobicContact CG2-CG 3.77Å; F475-Q477 VanDerWaalsContact C-N 3.26Å; F475-Q477 PolarHBondContact O-N 3.45Å; Q477-S479 WeakPolarHBondContact CB-OG 3.38Å; Q477-S479 PolarHBondContact OE1-OG 3.46Å; Q477-A480 PolarHBondContact O-N 3.13Å; Q477-L481 PolarHBondContact O-N 3.19Å
478	S	85.3	Confident	86.9	Confident	74 Å²	74	72.4 Å²	72.4	52%	0.517	38%	0.384	S	S	.	.	H	α-helix	trans	-68.5	-33.5	177.7	51.1	0	0	0	0	113.1	C466 A480 L481 I482	C466-S478 PolarHBondContact SG-N 3.41Å; C466-S478 VanDerWaalsContact SG-N 3.41Å; S478-A480 VanDerWaalsContact C-N 3.31Å; S478-A480 PolarHBondContact O-N 2.97Å; S478-L481 PolarHBondContact O-N 3.41Å; S478-I482 VanDerWaalsContact O-CG1 3.31Å; S478-I482 WeakPolarHBondContact O-CG1 3.39Å; S478-I482 PolarHBondContact O-N 3.4Å
479	S	84.9	Confident	86.6	Confident	63 Å²	63	76.3 Å²	76.3	44%	0.441	41%	0.407	S	S	.	.	H	α-helix	trans	-54.8	-44.5	172.1	48.3	0	0	0	0	112.7	Q477 I482 Q483	Q477-S479 WeakPolarHBondContact CB-OG 3.38Å; Q477-S479 PolarHBondContact OE1-OG 3.46Å; S479-I482 PolarHBondContact O-N 2.95Å; S479-Q483 WeakPolarHBondContact O-CB 3.35Å; S479-Q483 PolarHBondContact O-N 3.03Å
480	A	86.9	Confident	86.5	Confident	32 Å²	32	68.3 Å²	68.3	26%	0.264	39%	0.385	S	S	.	.	H	α-helix	trans	-70.2	-37.1	177.5	0	0	0	0	0	112.1	F475 Q477 S478 H484	F475-A480 HydrophobicContact CB-CB 4.27Å; F475-A480 HydrophobicContact CD1-CB 3.97Å; F475-A480 HydrophobicContact CG-CB 4.4Å; Q477-A480 PolarHBondContact O-N 3.13Å; S478-A480 VanDerWaalsContact C-N 3.31Å; S478-A480 PolarHBondContact O-N 2.97Å; A480-H484 WeakPolarHBondContact O-CB 3.32Å; A480-H484 PolarHBondContact O-N 3.45Å
481	L	88.8	Confident	86.5	Confident	23 Å²	23	67.4 Å²	67.4	12%	0.12	37%	0.374	C	S	.	.	H	α-helix	trans	-62.3	-46.8	171.9	172.8	60.7	0	0	0	111.4	C466 C468 F475 Q477 S478 Q483 H484 Q485	C466-L481 HydrophobicContact CB-CB 3.94Å; C466-L481 HydrophobicContact CB-CD2 3.8Å; C466-L481 HydrophobicContact CB-CG 4.49Å; C468-L481 HydrophobicContact CB-CD1 3.59Å; F475-L481 HydrophobicContact CB-CB 4.29Å; F475-L481 HydrophobicContact CD2-CB 4.01Å; F475-L481 HydrophobicContact CD2-CD1 3.88Å; F475-L481 HydrophobicContact CE2-CD1 4.12Å; F475-L481 HydrophobicContact CG-CB 4.31Å; Q477-L481 PolarHBondContact O-N 3.19Å; S478-L481 PolarHBondContact O-N 3.41Å; L481-Q483 PolarHBondContact O-N 3.49Å; L481-H484 CarbonylContact O-C 3.17Å; L481-H484 WeakPolarHBondContact O-CA 3.4Å; L481-H484 WeakPolarHBondContact O-CB 3.37Å; L481-H484 PolarHBondContact O-N 2.9Å; L481-H484 VanDerWaalsContact O-N 3.08Å; L481-Q485 HydrophobicContact CD1-CG 4.01Å; L481-Q485 HydrophobicContact CG-CG 4.36Å; L481-Q485 WeakPolarHBondContact O-CG 3.43Å; L481-Q485 PolarHBondContact O-N 3.05Å
482	I	85.9	Confident	86.5	Confident	91 Å²	91	71.4 Å²	71.4	47%	0.467	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-44.8	178.6	-67.6	162.8	0	0	0	110.7	S478 S479 H484 Q485 R486	S478-I482 VanDerWaalsContact O-CG1 3.31Å; S478-I482 WeakPolarHBondContact O-CG1 3.39Å; S478-I482 PolarHBondContact O-N 3.4Å; S479-I482 PolarHBondContact O-N 2.95Å; I482-H484 PolarHBondContact O-N 3.01Å; I482-Q485 PolarHBondContact O-N 3.15Å; I482-R486 PolarHBondContact O-N 3Å
483	Q	86	Confident	86.6	Confident	90 Å²	90	72.2 Å²	72.2	42%	0.421	38%	0.377	S	S	.	.	H	α-helix	trans	-60.5	-35.4	174.5	-174.4	-177.4	1.6	0	0	112.2	S479 L481 C505	S479-Q483 WeakPolarHBondContact O-CB 3.35Å; S479-Q483 PolarHBondContact O-N 3.03Å; L481-Q483 PolarHBondContact O-N 3.49Å; Q483-C505 HydrophobicContact CG-CB 4.39Å; Q483-C505 PolarHBondContact NE2-SG 3.18Å
484	H	87.9	Confident	86.7	Confident	18 Å²	18	69.5 Å²	69.5	8%	0.083	36%	0.364	C	S	.	.	H	α-helix	trans	-74.3	-36	175.1	173.6	61.6	0	0	0	113.2	C471 F475 A480 L481 I482 R486 M487 H488	C471-H484 PolarHBondContact SG-NE2 3.14Å; F475-H484 HydrophobicContact CE1-CB 4Å; F475-H484 HydrophobicContact CE2-CB 3.9Å; F475-H484 AromaticContact CE2-CD2 3.37Å; F475-H484 WeakPolarHBondContact CE2-CD2 3.43Å; F475-H484 AromaticContact CE2-CG 3.68Å; F475-H484 HydrophobicContact CZ-CB 3.48Å; F475-H484 VanDerWaalsContact CZ-CB 3.48Å; F475-H484 AromaticContact CZ-CD2 3.45Å; F475-H484 VanDerWaalsContact CZ-CD2 3.45Å; F475-H484 WeakPolarHBondContact CZ-CD2 3.43Å; F475-H484 AromaticContact CZ-CG 3.29Å; F475-H484 AromaticContact CZ-ND1 3.93Å; A480-H484 WeakPolarHBondContact O-CB 3.32Å; A480-H484 PolarHBondContact O-N 3.45Å; L481-H484 CarbonylContact O-C 3.17Å; L481-H484 WeakPolarHBondContact O-CA 3.4Å; L481-H484 WeakPolarHBondContact O-CB 3.37Å; L481-H484 PolarHBondContact O-N 2.9Å; L481-H484 VanDerWaalsContact O-N 3.08Å; I482-H484 PolarHBondContact O-N 3.01Å; H484-R486 PolarHBondContact O-N 2.94Å; H484-M487 PolarHBondContact ND1-SD 3.46Å; H484-M487 WeakPolarHBondContact O-CA 3.48Å; H484-M487 WeakPolarHBondContact O-CB 3.38Å; H484-M487 VanDerWaalsContact O-CG 3.3Å; H484-M487 WeakPolarHBondContact O-CG 3.46Å; H484-M487 PolarHBondContact O-N 2.77Å; H484-H488 AromaticContact CD2-NE2 3.85Å; H484-H488 AromaticContact CE1-CE1 3.93Å; H484-H488 AromaticContact CE1-NE2 3.52Å; H484-H488 AromaticContact NE2-CE1 3.81Å; H484-H488 AromaticContact NE2-NE2 3.06Å; H484-H488 PolarHBondContact NE2-NE2 3.46Å
485	Q	87.4	Confident	86.7	Confident	80 Å²	80	74.1 Å²	74.1	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-60.4	-32.7	178.6	-76.4	173.2	-78.2	0	0	112.2	L481 I482 M487 H488 T489	L481-Q485 HydrophobicContact CD1-CG 4.01Å; L481-Q485 HydrophobicContact CG-CG 4.36Å; L481-Q485 WeakPolarHBondContact O-CG 3.43Å; L481-Q485 PolarHBondContact O-N 3.05Å; I482-Q485 PolarHBondContact O-N 3.15Å; Q485-M487 PolarHBondContact O-N 3.42Å; Q485-M487 VanDerWaalsContact O-N 3.07Å; Q485-H488 PolarHBondContact O-N 3.02Å; Q485-T489 PolarHBondContact O-N 3.17Å; Q485-T489 VanDerWaalsContact O-N 3.13Å
486	R	88.3	Confident	86.9	Confident	48 Å²	48	71.9 Å²	71.9	18%	0.181	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-11.4	169.9	-61.3	-171.6	175.3	146.2	5.6	115.1	I482 H484 T489 E491 R504	I482-R486 PolarHBondContact O-N 3Å; H484-R486 PolarHBondContact O-N 2.94Å; R486-T489 WeakPolarHBondContact CA-OG1 3.29Å; R486-E491 HydrophobicContact CB-CB 3.94Å; R486-E491 HydrophobicContact CG-CB 3.76Å; R486-E491 WeakPolarHBondContact CG-OE2 3.43Å; R486-E491 IonicContact NE-OE2 3.02Å; R486-E491 PolarHBondContact NE-OE2 2.91Å; R486-E491 VanDerWaalsContact NE-OE2 3.14Å; R486-R504 HydrophobicContact CB-CG 3.62Å; R486-R504 PolarHBondContact NH1-O 3.22Å; R486-R504 VanDerWaalsContact O-CZ 3.23Å; R486-R504 PolarHBondContact O-NE 3.43Å; R486-R504 PolarHBondContact O-NH2 3.5Å
487	M	84.8	Confident	87.2	Confident	108 Å²	108	74.5 Å²	74.5	53%	0.532	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-35.9	168.6	-62.2	-177.3	57.8	0	0	111.5	H484 Q485	H484-M487 PolarHBondContact ND1-SD 3.46Å; H484-M487 WeakPolarHBondContact O-CA 3.48Å; H484-M487 WeakPolarHBondContact O-CB 3.38Å; H484-M487 VanDerWaalsContact O-CG 3.3Å; H484-M487 WeakPolarHBondContact O-CG 3.46Å; H484-M487 PolarHBondContact O-N 2.77Å; Q485-M487 PolarHBondContact O-N 3.42Å; Q485-M487 VanDerWaalsContact O-N 3.07Å
488	H	85.4	Confident	87.3	Confident	77 Å²	77	75.2 Å²	75.2	36%	0.356	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-41.9	-178.8	-50.6	-57.4	0	0	0	111.8	V470 C471 H484 Q485 G490	V470-H488 HydrophobicContact CG1-CB 4.2Å; V470-H488 HydrophobicContact CG2-CB 4.42Å; C471-H488 PolarHBondContact SG-NE2 3.35Å; C471-H488 VanDerWaalsContact SG-NE2 3.43Å; H484-H488 AromaticContact CD2-NE2 3.85Å; H484-H488 AromaticContact CE1-CE1 3.93Å; H484-H488 AromaticContact CE1-NE2 3.52Å; H484-H488 AromaticContact NE2-CE1 3.81Å; H484-H488 AromaticContact NE2-NE2 3.06Å; H484-H488 PolarHBondContact NE2-NE2 3.46Å; Q485-H488 PolarHBondContact O-N 3.02Å; H488-G490 PolarHBondContact O-N 3.36Å
489	T	85.3	Confident	87.6	Confident	85 Å²	85	73.8 Å²	73.8	52%	0.521	38%	0.381	S	S	.	.	S	Bend	trans	-78.4	-0.9	179.6	62.5	0	0	0	0	114.2	Q485 R486 E491	Q485-T489 PolarHBondContact O-N 3.17Å; Q485-T489 VanDerWaalsContact O-N 3.13Å; R486-T489 WeakPolarHBondContact CA-OG1 3.29Å; T489-E491 PolarHBondContact O-N 2.83Å; T489-E491 WeakPolarHBondContact OG1-CG 3.32Å; T489-E491 PolarHBondContact OG1-OE1 3.31Å
490	G	84.5	Confident	87.7	Confident	44 Å²	44	72.4 Å²	72.4	45%	0.454	38%	0.377	S	S	.	.			trans	68.6	-10.3	-176	0	0	0	0	0	115.7	H488 R492	H488-G490 PolarHBondContact O-N 3.36Å; G490-R492 WeakPolarHBondContact O-CG 3.42Å; G490-R492 PolarHBondContact O-N 3.18Å
491	E	87.1	Confident	87.8	Confident	86 Å²	86	76.9 Å²	76.9	40%	0.402	39%	0.391	S	S	.	.			trans	-46.8	127	-175	-86	170.7	-110.5	0	0	114.7	R486 T489 P493	R486-E491 HydrophobicContact CB-CB 3.94Å; R486-E491 HydrophobicContact CG-CB 3.76Å; R486-E491 WeakPolarHBondContact CG-OE2 3.43Å; R486-E491 IonicContact NE-OE2 3.02Å; R486-E491 PolarHBondContact NE-OE2 2.91Å; R486-E491 VanDerWaalsContact NE-OE2 3.14Å; T489-E491 PolarHBondContact O-N 2.83Å; T489-E491 WeakPolarHBondContact OG1-CG 3.32Å; T489-E491 PolarHBondContact OG1-OE1 3.31Å; E491-P493 HydrophobicContact CB-CG 4.48Å
492	R	87.8	Confident	87.9	Confident	135 Å²	135	78.2 Å²	78.2	51%	0.509	40%	0.4	S	S	.	.			trans	-131.4	70	175.9	-67.3	163.5	82	134.4	5.4	111.3	G490 Y494 T502 F503	G490-R492 WeakPolarHBondContact O-CG 3.42Å; G490-R492 PolarHBondContact O-N 3.18Å; R492-Y494 PolarHBondContact O-N 2.6Å; R492-Y494 VanDerWaalsContact O-N 3.08Å; R492-T502 WeakPolarHBondContact CB-OG1 3.48Å; R492-T502 VanDerWaalsContact CZ-O 3.25Å; R492-T502 PolarHBondContact NE-O 2.98Å; R492-T502 PolarHBondContact NE-OG1 3.26Å; R492-T502 PolarHBondContact NH2-O 3.01Å; R492-F503 CarbonylContact C-O 3.19Å; R492-F503 WeakPolarHBondContact CA-O 3.24Å
493	P	87.6	Confident	88	Confident	72 Å²	72	75.6 Å²	75.6	47%	0.468	39%	0.385	S	S	.	.			trans	-70.2	-6.4	-168.1	-20.3	35	0	0	0	116	E491	E491-P493 HydrophobicContact CB-CG 4.48Å
494	Y	90.4	Very high	88.1	Confident	74 Å²	74	75 Å²	75	29%	0.29	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	94.7	-174.7	-56.6	-87.6	0	0	0	109.6	R492 T502 F503 N506	R492-Y494 PolarHBondContact O-N 2.6Å; R492-Y494 VanDerWaalsContact O-N 3.08Å; Y494-T502 CarbonylContact O-C 3.48Å; Y494-T502 WeakPolarHBondContact O-CA 3.45Å; Y494-F503 WeakPolarHBondContact CD2-O 3.41Å; Y494-F503 PolarHBondContact N-O 3.48Å; Y494-F503 VanDerWaalsContact N-O 3.1Å; Y494-F503 PolarHBondContact O-N 3.32Å; Y494-N506 HydrophobicContact CD1-CB 3.84Å; Y494-N506 HydrophobicContact CE1-CB 3.7Å; Y494-N506 HydrophobicContact CG-CB 4.48Å
495	K	89.2	Confident	88	Confident	132 Å²	132	75 Å²	75	57%	0.574	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	138.5	176.4	-171.7	176.2	178.6	-176.2	0	110.6	T502 L509	K495-T502 HydrophobicContact CB-CG2 4.32Å; K495-T502 HydrophobicContact CG-CG2 4.28Å; K495-L509 WeakPolarHBondContact O-CD2 3.26Å
496	C	92.3	Very high	88	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	39%	0.385	C	S	.	.			trans	-82	126.6	162.5	175.9	0	0	0	0	108.9	G500 K501 F503 L509 H516	C496-G500 CarbonylContact O-C 3.12Å; C496-G500 WeakPolarHBondContact O-CA 3.34Å; C496-G500 PolarHBondContact O-N 3.02Å; C496-K501 WeakPolarHBondContact CB-O 3.36Å; C496-K501 PolarHBondContact N-O 2.83Å; C496-F503 HydrophobicContact CB-CE2 4.26Å; C496-L509 HydrophobicContact CB-CD1 3.6Å; C496-H516 PolarHBondContact SG-NE2 2.86Å
497	N	90.2	Very high	87.9	Confident	147 Å²	147	76.4 Å²	76.4	79%	0.786	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-34.1	-178.2	-66.7	-4.4	0	0	0	111.7
498	E	88.4	Confident	88.1	Confident	100 Å²	100	73.8 Å²	73.8	47%	0.467	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-33.7	-172.3	-61	138.1	-94.1	0	0	113.6	H516	E498-H516 WeakPolarHBondContact OE2-CB 3.49Å; E498-H516 IonicContact OE2-CD2 3.7Å; E498-H516 PolarHBondContact OE2-CD2 3.06Å; E498-H516 IonicContact OE2-CG 3.78Å
499	C	90	Very high	88.4	Confident	44 Å²	44	70.9 Å²	70.9	30%	0.297	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	12.7	-177.7	75.5	0	0	0	0	114.2	K501 H512 H516	C499-K501 PolarHBondContact O-N 2.9Å; C499-H512 PolarHBondContact SG-NE2 3.24Å; C499-H516 WeakPolarHBondContact CB-CE1 3.5Å; C499-H516 PolarHBondContact SG-CE1 3.36Å; C499-H516 PolarHBondContact SG-NE2 3.17Å
500	G	87.9	Confident	88.5	Confident	34 Å²	34	69.1 Å²	69.1	35%	0.351	37%	0.371	S	S	.	.			trans	68.9	-16.5	178.5	0	0	0	0	0	116.7	C496 T502	C496-G500 CarbonylContact O-C 3.12Å; C496-G500 WeakPolarHBondContact O-CA 3.34Å; C496-G500 PolarHBondContact O-N 3.02Å; G500-T502 PolarHBondContact O-N 2.91Å
501	K	89.6	Confident	88.7	Confident	126 Å²	126	70 Å²	70	55%	0.548	37%	0.365	S	S	.	.			trans	-58.8	131.8	-173.8	-69	174.9	-174.5	170.4	0	111.6	C496 C499 F503	C496-K501 WeakPolarHBondContact CB-O 3.36Å; C496-K501 PolarHBondContact N-O 2.83Å; C499-K501 PolarHBondContact O-N 2.9Å; K501-F503 HydrophobicContact CB-CE2 3.95Å; K501-F503 HydrophobicContact CB-CZ 4.11Å; K501-F503 WeakPolarHBondContact O-CD2 3.15Å; K501-F503 VanDerWaalsContact O-CE2 3.23Å; K501-F503 WeakPolarHBondContact O-CE2 3.37Å
502	T	89.6	Confident	88.9	Confident	52 Å²	52	66.9 Å²	66.9	32%	0.319	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	149.2	-175.8	61.6	0	0	0	0	112.3	R492 Y494 K495 G500	R492-T502 WeakPolarHBondContact CB-OG1 3.48Å; R492-T502 VanDerWaalsContact CZ-O 3.25Å; R492-T502 PolarHBondContact NE-O 2.98Å; R492-T502 PolarHBondContact NE-OG1 3.26Å; R492-T502 PolarHBondContact NH2-O 3.01Å; Y494-T502 CarbonylContact O-C 3.48Å; Y494-T502 WeakPolarHBondContact O-CA 3.45Å; K495-T502 HydrophobicContact CB-CG2 4.32Å; K495-T502 HydrophobicContact CG-CG2 4.28Å; G500-T502 PolarHBondContact O-N 2.91Å
503	F	89.4	Confident	89	Confident	36 Å²	36	63.6 Å²	63.6	16%	0.158	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151	-174.9	-62.3	-87.4	0	0	0	112.6	R492 Y494 C496 K501 L509 H512	R492-F503 CarbonylContact C-O 3.19Å; R492-F503 WeakPolarHBondContact CA-O 3.24Å; Y494-F503 WeakPolarHBondContact CD2-O 3.41Å; Y494-F503 PolarHBondContact N-O 3.48Å; Y494-F503 VanDerWaalsContact N-O 3.1Å; Y494-F503 PolarHBondContact O-N 3.32Å; C496-F503 HydrophobicContact CB-CE2 4.26Å; K501-F503 HydrophobicContact CB-CE2 3.95Å; K501-F503 HydrophobicContact CB-CZ 4.11Å; K501-F503 WeakPolarHBondContact O-CD2 3.15Å; K501-F503 VanDerWaalsContact O-CE2 3.23Å; K501-F503 WeakPolarHBondContact O-CE2 3.37Å; F503-L509 HydrophobicContact CB-CB 4.25Å; F503-L509 HydrophobicContact CD2-CB 4.04Å; F503-L509 HydrophobicContact CD2-CD1 3.9Å; F503-L509 HydrophobicContact CE2-CD1 4.15Å; F503-L509 HydrophobicContact CG-CB 4.26Å; F503-H512 HydrophobicContact CE1-CB 3.97Å; F503-H512 HydrophobicContact CE2-CB 4.08Å; F503-H512 AromaticContact CE2-CD2 3.27Å; F503-H512 WeakPolarHBondContact CE2-CD2 3.14Å; F503-H512 AromaticContact CE2-CG 3.76Å; F503-H512 HydrophobicContact CZ-CB 3.57Å; F503-H512 AromaticContact CZ-CD2 3.26Å; F503-H512 WeakPolarHBondContact CZ-CD2 3.49Å; F503-H512 AromaticContact CZ-CG 3.29Å; F503-H512 AromaticContact CZ-ND1 3.98Å; F503-H512 AromaticContact CZ-NE2 3.92Å
504	R	87.1	Confident	89.1	Confident	78 Å²	78	62.8 Å²	62.8	29%	0.294	33%	0.328	S	S	.	.	S	Bend	trans	-76.4	-27	-177.3	-175.7	168.1	-70.8	134.7	-4.3	114	R486	R486-R504 HydrophobicContact CB-CG 3.62Å; R486-R504 PolarHBondContact NH1-O 3.22Å; R486-R504 VanDerWaalsContact O-CZ 3.23Å; R486-R504 PolarHBondContact O-NE 3.43Å; R486-R504 PolarHBondContact O-NH2 3.5Å
505	C	85.1	Confident	88.9	Confident	18 Å²	18	65.3 Å²	65.3	12%	0.122	35%	0.345	C	S	.	.	S	Bend	trans	-146.3	148.7	179.4	52.4	0	0	0	0	111.7	Q483 S507 S508 L509	Q483-C505 HydrophobicContact CG-CB 4.39Å; Q483-C505 PolarHBondContact NE2-SG 3.18Å; C505-S507 PolarHBondContact O-N 3.16Å; C505-S508 PolarHBondContact O-N 3.37Å; C505-S508 PolarHBondContact SG-OG 3.16Å; C505-S508 VanDerWaalsContact SG-OG 3.39Å; C505-L509 PolarHBondContact O-N 3.3Å
506	N	87.8	Confident	88.9	Confident	84 Å²	84	63 Å²	63	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-58.1	-33.8	-175	-157.8	108.3	0	0	0	113.5	Y494 S508 L509 S510	Y494-N506 HydrophobicContact CD1-CB 3.84Å; Y494-N506 HydrophobicContact CE1-CB 3.7Å; Y494-N506 HydrophobicContact CG-CB 4.48Å; N506-S508 VanDerWaalsContact C-N 3.28Å; N506-S508 PolarHBondContact O-N 2.96Å; N506-L509 PolarHBondContact O-N 3.47Å; N506-S510 PolarHBondContact ND2-OG 3.28Å; N506-S510 VanDerWaalsContact ND2-OG 3.16Å; N506-S510 PolarHBondContact O-N 3.41Å; N506-S510 PolarHBondContact O-OG 3.32Å
507	S	86.6	Confident	88.6	Confident	72 Å²	72	66.8 Å²	66.8	50%	0.503	36%	0.36	S	S	.	.	H	α-helix	trans	-63.9	-32.7	178.1	48.6	0	0	0	0	112.9	C505 N511	C505-S507 PolarHBondContact O-N 3.16Å; S507-N511 WeakPolarHBondContact O-CB 3.28Å; S507-N511 VanDerWaalsContact O-CG 3.3Å; S507-N511 PolarHBondContact O-N 3.32Å
508	S	88.9	Confident	88.4	Confident	53 Å²	53	61.9 Å²	61.9	37%	0.371	34%	0.344	S	S	.	.	H	α-helix	trans	-72.7	-37.1	173.4	-61.5	0	0	0	0	111.9	C505 N506 H512	C505-S508 PolarHBondContact O-N 3.37Å; C505-S508 PolarHBondContact SG-OG 3.16Å; C505-S508 VanDerWaalsContact SG-OG 3.39Å; N506-S508 VanDerWaalsContact C-N 3.28Å; N506-S508 PolarHBondContact O-N 2.96Å; S508-H512 VanDerWaalsContact O-CB 3.25Å; S508-H512 WeakPolarHBondContact O-CB 3.49Å; S508-H512 PolarHBondContact O-N 3.28Å
509	L	91.5	Very high	88.4	Confident	16 Å²	16	62 Å²	62	8%	0.084	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-51.5	172.1	172.7	59.3	0	0	0	110.8	K495 C496 F503 C505 N506 N511 H512 Q513	K495-L509 WeakPolarHBondContact O-CD2 3.26Å; C496-L509 HydrophobicContact CB-CD1 3.6Å; F503-L509 HydrophobicContact CB-CB 4.25Å; F503-L509 HydrophobicContact CD2-CB 4.04Å; F503-L509 HydrophobicContact CD2-CD1 3.9Å; F503-L509 HydrophobicContact CE2-CD1 4.15Å; F503-L509 HydrophobicContact CG-CB 4.26Å; C505-L509 PolarHBondContact O-N 3.3Å; N506-L509 PolarHBondContact O-N 3.47Å; L509-N511 VanDerWaalsContact C-N 3.33Å; L509-N511 PolarHBondContact O-N 3.01Å; L509-H512 CarbonylContact O-C 3.5Å; L509-H512 WeakPolarHBondContact O-CA 3.31Å; L509-H512 WeakPolarHBondContact O-CB 3.24Å; L509-H512 PolarHBondContact O-N 2.95Å; L509-Q513 HydrophobicContact CD1-CG 3.99Å; L509-Q513 HydrophobicContact CG-CG 4.43Å; L509-Q513 WeakPolarHBondContact O-CG 3.48Å; L509-Q513 PolarHBondContact O-N 3.4Å
510	S	88.4	Confident	88.4	Confident	48 Å²	48	66.5 Å²	66.5	34%	0.336	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-34.8	-179.6	-55.5	0	0	0	0	113.2	N506 H512	N506-S510 PolarHBondContact ND2-OG 3.28Å; N506-S510 VanDerWaalsContact ND2-OG 3.16Å; N506-S510 PolarHBondContact O-N 3.41Å; N506-S510 PolarHBondContact O-OG 3.32Å; S510-H512 VanDerWaalsContact C-N 3.3Å
511	N	88.5	Confident	88.5	Confident	63 Å²	63	68.3 Å²	68.3	34%	0.337	37%	0.365	S	S	.	.	H	α-helix	trans	-70.4	-26.4	171.4	-77.8	0.8	0	0	0	112.8	S507 L509	S507-N511 WeakPolarHBondContact O-CB 3.28Å; S507-N511 VanDerWaalsContact O-CG 3.3Å; S507-N511 PolarHBondContact O-N 3.32Å; L509-N511 VanDerWaalsContact C-N 3.33Å; L509-N511 PolarHBondContact O-N 3.01Å
512	H	90.4	Very high	88.7	Confident	20 Å²	20	66 Å²	66	9%	0.093	35%	0.353	C	S	.	.	H	α-helix	trans	-79.5	-37.6	176.7	167.7	57.7	0	0	0	112.6	C499 F503 S508 L509 S510 R514 I515 H516	C499-H512 PolarHBondContact SG-NE2 3.24Å; F503-H512 HydrophobicContact CE1-CB 3.97Å; F503-H512 HydrophobicContact CE2-CB 4.08Å; F503-H512 AromaticContact CE2-CD2 3.27Å; F503-H512 WeakPolarHBondContact CE2-CD2 3.14Å; F503-H512 AromaticContact CE2-CG 3.76Å; F503-H512 HydrophobicContact CZ-CB 3.57Å; F503-H512 AromaticContact CZ-CD2 3.26Å; F503-H512 WeakPolarHBondContact CZ-CD2 3.49Å; F503-H512 AromaticContact CZ-CG 3.29Å; F503-H512 AromaticContact CZ-ND1 3.98Å; F503-H512 AromaticContact CZ-NE2 3.92Å; S508-H512 VanDerWaalsContact O-CB 3.25Å; S508-H512 WeakPolarHBondContact O-CB 3.49Å; S508-H512 PolarHBondContact O-N 3.28Å; L509-H512 CarbonylContact O-C 3.5Å; L509-H512 WeakPolarHBondContact O-CA 3.31Å; L509-H512 WeakPolarHBondContact O-CB 3.24Å; L509-H512 PolarHBondContact O-N 2.95Å; S510-H512 VanDerWaalsContact C-N 3.3Å; H512-R514 PolarHBondContact O-N 3.34Å; H512-R514 VanDerWaalsContact O-N 3.17Å; H512-I515 VanDerWaalsContact O-CB 3.25Å; H512-I515 WeakPolarHBondContact O-CB 3.49Å; H512-I515 WeakPolarHBondContact O-CG1 3.47Å; H512-I515 PolarHBondContact O-N 3.05Å; H512-H516 AromaticContact CD2-NE2 3.42Å; H512-H516 PolarHBondContact CD2-NE2 3.18Å; H512-H516 AromaticContact CE1-CE1 3.7Å; H512-H516 AromaticContact CE1-NE2 3.23Å; H512-H516 PolarHBondContact CE1-NE2 2.98Å; H512-H516 AromaticContact NE2-CE1 3.89Å; H512-H516 AromaticContact NE2-NE2 2.57Å; H512-H516 PolarHBondContact NE2-NE2 3.47Å
513	Q	89.4	Confident	88.8	Confident	66 Å²	66	72 Å²	72	31%	0.308	37%	0.37	S	S	.	.	H	α-helix	trans	-58.6	-29.1	177.9	-71	177.8	-80.6	0	0	112.6	L509 I515 H516 T517	L509-Q513 HydrophobicContact CD1-CG 3.99Å; L509-Q513 HydrophobicContact CG-CG 4.43Å; L509-Q513 WeakPolarHBondContact O-CG 3.48Å; L509-Q513 PolarHBondContact O-N 3.4Å; Q513-I515 PolarHBondContact O-N 3.09Å; Q513-I515 VanDerWaalsContact O-N 3.12Å; Q513-H516 PolarHBondContact O-N 3.24Å; Q513-T517 PolarHBondContact O-N 3.13Å; Q513-T517 PolarHBondContact O-OG1 3.44Å
514	R	89.3	Confident	88.9	Confident	55 Å²	55	70.3 Å²	70.3	21%	0.208	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-16.1	171.4	-64.5	-168.9	177	137	8.7	115.3	H512 G518 E519 G532	H512-R514 PolarHBondContact O-N 3.34Å; H512-R514 VanDerWaalsContact O-N 3.17Å; R514-G518 CarbonylContact O-C 3.5Å; R514-G518 WeakPolarHBondContact O-CA 3.33Å; R514-G518 PolarHBondContact O-N 3.12Å; R514-E519 HydrophobicContact CB-CB 4.21Å; R514-E519 HydrophobicContact CG-CB 3.9Å; R514-E519 IonicContact NE-OE2 3.21Å; R514-E519 PolarHBondContact O-N 3.06Å; R514-G532 WeakPolarHBondContact CD-O 3.49Å; R514-G532 PolarHBondContact NH1-O 3.42Å
515	I	87.8	Confident	89.1	Confident	127 Å²	127	73.3 Å²	73.3	65%	0.651	39%	0.39	S	S	*	.	H	α-helix	trans	-73.7	-35.3	173.2	-57.7	-178.8	0	0	0	110	H512 Q513	H512-I515 VanDerWaalsContact O-CB 3.25Å; H512-I515 WeakPolarHBondContact O-CB 3.49Å; H512-I515 WeakPolarHBondContact O-CG1 3.47Å; H512-I515 PolarHBondContact O-N 3.05Å; Q513-I515 PolarHBondContact O-N 3.09Å; Q513-I515 VanDerWaalsContact O-N 3.12Å
516	H	87.9	Confident	89.4	Confident	83 Å²	83	77.7 Å²	77.7	38%	0.384	41%	0.408	S	S	.	.	H	α-helix	trans	-84	-44.1	178.7	-50.2	-49.2	0	0	0	111.7	C496 E498 C499 H512 Q513 G518	C496-H516 PolarHBondContact SG-NE2 2.86Å; E498-H516 WeakPolarHBondContact OE2-CB 3.49Å; E498-H516 IonicContact OE2-CD2 3.7Å; E498-H516 PolarHBondContact OE2-CD2 3.06Å; E498-H516 IonicContact OE2-CG 3.78Å; C499-H516 WeakPolarHBondContact CB-CE1 3.5Å; C499-H516 PolarHBondContact SG-CE1 3.36Å; C499-H516 PolarHBondContact SG-NE2 3.17Å; H512-H516 AromaticContact CD2-NE2 3.42Å; H512-H516 PolarHBondContact CD2-NE2 3.18Å; H512-H516 AromaticContact CE1-CE1 3.7Å; H512-H516 AromaticContact CE1-NE2 3.23Å; H512-H516 PolarHBondContact CE1-NE2 2.98Å; H512-H516 AromaticContact NE2-CE1 3.89Å; H512-H516 AromaticContact NE2-NE2 2.57Å; H512-H516 PolarHBondContact NE2-NE2 3.47Å; Q513-H516 PolarHBondContact O-N 3.24Å; H516-G518 PolarHBondContact O-N 2.89Å
517	T	86.7	Confident	89.6	Confident	81 Å²	81	76 Å²	76	50%	0.497	40%	0.403	S	S	.	.	S	Bend	trans	-76.4	-6.3	178.4	66.7	0	0	0	0	113.9	Q513 E519	Q513-T517 PolarHBondContact O-N 3.13Å; Q513-T517 PolarHBondContact O-OG1 3.44Å; T517-E519 PolarHBondContact O-N 3.02Å; T517-E519 WeakPolarHBondContact OG1-CG 3.02Å
518	G	86.6	Confident	89.7	Confident	44 Å²	44	73.8 Å²	73.8	45%	0.454	39%	0.39	S	S	.	.			trans	66.7	-0.4	-175.3	0	0	0	0	0	115.3	R514 H516 K520	R514-G518 CarbonylContact O-C 3.5Å; R514-G518 WeakPolarHBondContact O-CA 3.33Å; R514-G518 PolarHBondContact O-N 3.12Å; H516-G518 PolarHBondContact O-N 2.89Å; G518-K520 PolarHBondContact O-N 3.25Å
519	E	88.8	Confident	89.8	Confident	103 Å²	103	76.7 Å²	76.7	48%	0.481	40%	0.4	S	S	.	.			trans	-54.7	121.3	-174.1	-89	-173.8	-161.6	0	0	112.8	R514 T517 P521	R514-E519 HydrophobicContact CB-CB 4.21Å; R514-E519 HydrophobicContact CG-CB 3.9Å; R514-E519 IonicContact NE-OE2 3.21Å; R514-E519 PolarHBondContact O-N 3.06Å; T517-E519 PolarHBondContact O-N 3.02Å; T517-E519 WeakPolarHBondContact OG1-CG 3.02Å; E519-P521 WeakPolarHBondContact O-CD 3.45Å
520	K	90.2	Very high	89.8	Confident	138 Å²	138	78.1 Å²	78.1	60%	0.6	41%	0.411	S	S	*	.			trans	-123.9	71.4	176.2	-74	160.5	175.7	177.3	0	111.1	G518 Y522 S530 F531	G518-K520 PolarHBondContact O-N 3.25Å; K520-Y522 PolarHBondContact O-N 3.43Å; K520-S530 WeakPolarHBondContact CD-O 3.18Å; K520-F531 CarbonylContact C-O 3.53Å; K520-F531 WeakPolarHBondContact CA-O 3.29Å
521	P	89.6	Confident	89.8	Confident	72 Å²	72	77.9 Å²	77.9	47%	0.468	40%	0.404	S	S	.	.			trans	-69.5	-7.7	-168.9	-20	34.4	0	0	0	115.5	E519	E519-P521 WeakPolarHBondContact O-CD 3.45Å
522	Y	92.3	Very high	89.8	Confident	78 Å²	78	76 Å²	76	31%	0.306	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	88.4	-173.7	-54.7	-76.1	0	0	0	110.1	K520 F531 S534	K520-Y522 PolarHBondContact O-N 3.43Å; Y522-F531 WeakPolarHBondContact CB-O 3.49Å; Y522-F531 WeakPolarHBondContact CD2-O 3.43Å; Y522-F531 PolarHBondContact N-O 2.82Å; Y522-F531 VanDerWaalsContact N-O 3.1Å; Y522-F531 WeakPolarHBondContact O-CD2 3.41Å; Y522-F531 PolarHBondContact O-N 2.93Å; Y522-S534 VanDerWaalsContact CD2-N 3.31Å
523	R	91.8	Very high	89.7	Confident	177 Å²	177	79.7 Å²	79.7	67%	0.668	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	134	177.8	-174	169.1	-173.2	-147.9	-1.4	111.6	G528 S530	R523-G528 WeakPolarHBondContact CG-O 3.37Å; R523-G528 PolarHBondContact NE-O 3.22Å; R523-S530 WeakPolarHBondContact CG-OG 3.32Å
524	C	93.4	Very high	89.8	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.007	42%	0.421	C	S	.	.			trans	-77.1	131.9	165.1	-179.6	0	0	0	0	109.3	E526 G528 M529 F531 L537 H544	C524-E526 PolarHBondContact SG-OE2 2.7Å; C524-G528 WeakPolarHBondContact O-CA 3.33Å; C524-G528 PolarHBondContact O-N 2.81Å; C524-G528 VanDerWaalsContact O-N 3.08Å; C524-M529 WeakPolarHBondContact CB-O 3.49Å; C524-M529 PolarHBondContact N-O 3.3Å; C524-F531 HydrophobicContact CB-CE2 4.48Å; C524-L537 HydrophobicContact CB-CD1 3.55Å; C524-H544 PolarHBondContact SG-NE2 3.36Å
525	V	91.1	Very high	89.8	Confident	141 Å²	141	79.5 Å²	79.5	86%	0.855	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-38	-179.6	-177	0	0	0	0	110.9
526	E	89.6	Confident	89.9	Confident	110 Å²	110	75.2 Å²	75.2	51%	0.514	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-35.8	-171.7	-63.1	144.9	120.4	0	0	113.4	C524 H544	C524-E526 PolarHBondContact SG-OE2 2.7Å; E526-H544 WeakPolarHBondContact OE1-CB 3.26Å; E526-H544 IonicContact OE2-CD2 3Å; E526-H544 PolarHBondContact OE2-CD2 3.1Å; E526-H544 VanDerWaalsContact OE2-CD2 3.31Å
527	C	91.9	Very high	90.2	Very high	49 Å²	49	72.3 Å²	72.3	33%	0.331	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	3.4	-176.8	70.2	0	0	0	0	114.2	M529 H540 H544	C527-M529 PolarHBondContact O-N 3.12Å; C527-H540 PolarHBondContact SG-NE2 3.25Å; C527-H544 WeakPolarHBondContact CB-CE1 3.18Å; C527-H544 WeakPolarHBondContact CB-NE2 3.38Å; C527-H544 PolarHBondContact SG-NE2 3.26Å
528	G	89.4	Confident	90.3	Very high	24 Å²	24	73 Å²	73	25%	0.247	41%	0.405	C	S	.	.			trans	69.3	-12.5	-178	0	0	0	0	0	116.7	R523 C524 S530	R523-G528 WeakPolarHBondContact CG-O 3.37Å; R523-G528 PolarHBondContact NE-O 3.22Å; C524-G528 WeakPolarHBondContact O-CA 3.33Å; C524-G528 PolarHBondContact O-N 2.81Å; C524-G528 VanDerWaalsContact O-N 3.08Å; G528-S530 PolarHBondContact O-OG 3.31Å
529	M	90.9	Very high	90.5	Very high	115 Å²	115	74.8 Å²	74.8	57%	0.567	40%	0.401	S	S	*	.			trans	-59.3	138.1	-177.7	-70.7	-166.4	173.4	0	0	112.1	C524 C527 F531	C524-M529 WeakPolarHBondContact CB-O 3.49Å; C524-M529 PolarHBondContact N-O 3.3Å; C527-M529 PolarHBondContact O-N 3.12Å; M529-F531 HydrophobicContact CB-CE2 3.96Å; M529-F531 HydrophobicContact CB-CZ 4.02Å
530	S	91.1	Very high	90.6	Very high	45 Å²	45	70.9 Å²	70.9	32%	0.315	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.1	-172.9	-60.6	0	0	0	0	112.6	K520 R523 G528	K520-S530 WeakPolarHBondContact CD-O 3.18Å; R523-S530 WeakPolarHBondContact CG-OG 3.32Å; G528-S530 PolarHBondContact O-OG 3.31Å
531	F	89.9	Confident	90.6	Very high	44 Å²	44	67.7 Å²	67.7	19%	0.193	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	145.9	-171.6	-58.4	-87.6	0	0	0	112	K520 Y522 C524 M529 Q533 A536 L537 H540	K520-F531 CarbonylContact C-O 3.53Å; K520-F531 WeakPolarHBondContact CA-O 3.29Å; Y522-F531 WeakPolarHBondContact CB-O 3.49Å; Y522-F531 WeakPolarHBondContact CD2-O 3.43Å; Y522-F531 PolarHBondContact N-O 2.82Å; Y522-F531 VanDerWaalsContact N-O 3.1Å; Y522-F531 WeakPolarHBondContact O-CD2 3.41Å; Y522-F531 PolarHBondContact O-N 2.93Å; C524-F531 HydrophobicContact CB-CE2 4.48Å; M529-F531 HydrophobicContact CB-CE2 3.96Å; M529-F531 HydrophobicContact CB-CZ 4.02Å; F531-Q533 VanDerWaalsContact C-N 3.27Å; F531-Q533 PolarHBondContact O-N 3.33Å; F531-A536 HydrophobicContact CB-CB 4.24Å; F531-A536 HydrophobicContact CD1-CB 4.02Å; F531-A536 HydrophobicContact CG-CB 4.35Å; F531-L537 HydrophobicContact CB-CB 4.46Å; F531-L537 HydrophobicContact CD2-CB 3.97Å; F531-L537 HydrophobicContact CD2-CD1 3.94Å; F531-L537 HydrophobicContact CE2-CD1 4.1Å; F531-L537 HydrophobicContact CG-CB 4.42Å; F531-H540 HydrophobicContact CE1-CB 4.2Å; F531-H540 HydrophobicContact CE2-CB 3.96Å; F531-H540 AromaticContact CE2-CD2 3.8Å; F531-H540 AromaticContact CE2-CG 3.74Å; F531-H540 HydrophobicContact CZ-CB 3.63Å; F531-H540 AromaticContact CZ-CD2 3.84Å; F531-H540 AromaticContact CZ-CG 3.36Å; F531-H540 AromaticContact CZ-ND1 3.51Å
532	G	87.8	Confident	90.7	Very high	23 Å²	23	67.1 Å²	67.1	24%	0.237	36%	0.359	C	S	.	.	S	Bend	trans	-75.2	-10	175.7	0	0	0	0	0	114.7	R514	R514-G532 WeakPolarHBondContact CD-O 3.49Å; R514-G532 PolarHBondContact NH1-O 3.42Å
533	Q	89.1	Confident	90.6	Very high	98 Å²	98	67.5 Å²	67.5	46%	0.458	37%	0.365	S	S	.	.	S	Bend	trans	-142.3	137.7	-178.2	-57.3	-175.4	29.9	0	0	111.4	F531 A535 A536 L537	F531-Q533 VanDerWaalsContact C-N 3.27Å; F531-Q533 PolarHBondContact O-N 3.33Å; Q533-A535 VanDerWaalsContact C-N 3.31Å; Q533-A535 PolarHBondContact O-N 3.25Å; Q533-A536 WeakPolarHBondContact O-CB 3.49Å; Q533-A536 PolarHBondContact O-N 3.41Å; Q533-L537 PolarHBondContact O-N 2.82Å
534	S	91.5	Very high	90.5	Very high	56 Å²	56	63.2 Å²	63.2	39%	0.392	35%	0.353	S	S	.	.	H	α-helix	trans	-63.6	-33.1	-179.7	52.5	0	0	0	0	113.7	Y522 A536 L537 I538	Y522-S534 VanDerWaalsContact CD2-N 3.31Å; S534-A536 VanDerWaalsContact C-N 3.28Å; S534-A536 PolarHBondContact O-N 3.23Å; S534-L537 PolarHBondContact O-N 2.89Å; S534-I538 WeakPolarHBondContact O-CG1 3.49Å; S534-I538 PolarHBondContact O-N 2.8Å
535	A	88.9	Confident	90.2	Very high	61 Å²	61	66.9 Å²	66.9	50%	0.504	38%	0.375	S	S	.	.	H	α-helix	trans	-62.4	-36.1	176.1	0	0	0	0	0	112.2	Q533 I538 Q539	Q533-A535 VanDerWaalsContact C-N 3.31Å; Q533-A535 PolarHBondContact O-N 3.25Å; A535-I538 PolarHBondContact O-N 3.47Å; A535-Q539 VanDerWaalsContact O-CB 3.27Å; A535-Q539 WeakPolarHBondContact O-CB 3.38Å; A535-Q539 PolarHBondContact O-N 2.86Å
536	A	90.2	Very high	90	Very high	36 Å²	36	62 Å²	62	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-69.9	-38.3	175.5	0	0	0	0	0	111.7	F531 Q533 S534 Q539 H540	F531-A536 HydrophobicContact CB-CB 4.24Å; F531-A536 HydrophobicContact CD1-CB 4.02Å; F531-A536 HydrophobicContact CG-CB 4.35Å; Q533-A536 WeakPolarHBondContact O-CB 3.49Å; Q533-A536 PolarHBondContact O-N 3.41Å; S534-A536 VanDerWaalsContact C-N 3.28Å; S534-A536 PolarHBondContact O-N 3.23Å; A536-Q539 PolarHBondContact O-N 3.24Å; A536-H540 VanDerWaalsContact O-CB 3.29Å; A536-H540 WeakPolarHBondContact O-CB 3.49Å; A536-H540 PolarHBondContact O-N 2.87Å
537	L	92.6	Very high	90	Very high	22 Å²	22	61.3 Å²	61.3	12%	0.115	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-49.1	171.7	173.6	60.1	0	0	0	111.4	C524 F531 Q533 S534 Q539 H540 Q541	C524-L537 HydrophobicContact CB-CD1 3.55Å; F531-L537 HydrophobicContact CB-CB 4.46Å; F531-L537 HydrophobicContact CD2-CB 3.97Å; F531-L537 HydrophobicContact CD2-CD1 3.94Å; F531-L537 HydrophobicContact CE2-CD1 4.1Å; F531-L537 HydrophobicContact CG-CB 4.42Å; Q533-L537 PolarHBondContact O-N 2.82Å; S534-L537 PolarHBondContact O-N 2.89Å; L537-Q539 VanDerWaalsContact C-N 3.3Å; L537-Q539 PolarHBondContact O-N 2.84Å; L537-H540 CarbonylContact O-C 3.06Å; L537-H540 WeakPolarHBondContact O-CA 3.46Å; L537-H540 WeakPolarHBondContact O-CB 3.36Å; L537-H540 PolarHBondContact O-N 3.23Å; L537-Q541 HydrophobicContact CD1-CG 4.03Å; L537-Q541 HydrophobicContact CG-CG 4.42Å; L537-Q541 WeakPolarHBondContact O-CG 3.12Å; L537-Q541 PolarHBondContact O-N 3.21Å
538	I	90.1	Very high	90	Very high	95 Å²	95	64.4 Å²	64.4	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-60.8	-40.5	178.6	-66.2	163	0	0	0	111.1	S534 A535 H540 Q541	S534-I538 WeakPolarHBondContact O-CG1 3.49Å; S534-I538 PolarHBondContact O-N 2.8Å; A535-I538 PolarHBondContact O-N 3.47Å; I538-H540 VanDerWaalsContact C-N 3.31Å; I538-H540 PolarHBondContact O-N 3Å; I538-Q541 PolarHBondContact O-N 3.35Å
539	Q	90.1	Very high	90	Very high	83 Å²	83	66.6 Å²	66.6	39%	0.388	37%	0.368	S	S	.	.	H	α-helix	trans	-65.3	-33	174.7	178.9	176.9	-11.9	0	0	112.7	A535 A536 L537 Q561	A535-Q539 VanDerWaalsContact O-CB 3.27Å; A535-Q539 WeakPolarHBondContact O-CB 3.38Å; A535-Q539 PolarHBondContact O-N 2.86Å; A536-Q539 PolarHBondContact O-N 3.24Å; L537-Q539 VanDerWaalsContact C-N 3.3Å; L537-Q539 PolarHBondContact O-N 2.84Å; Q539-Q561 VanDerWaalsContact NE2-NE2 3.11Å
540	H	91.4	Very high	90.1	Very high	21 Å²	21	64.1 Å²	64.1	10%	0.097	35%	0.354	C	S	.	.	H	α-helix	trans	-75.8	-37.6	175.1	174.7	87.6	0	0	0	112.7	C527 F531 A536 L537 I538 R542 I543 H544	C527-H540 PolarHBondContact SG-NE2 3.25Å; F531-H540 HydrophobicContact CE1-CB 4.2Å; F531-H540 HydrophobicContact CE2-CB 3.96Å; F531-H540 AromaticContact CE2-CD2 3.8Å; F531-H540 AromaticContact CE2-CG 3.74Å; F531-H540 HydrophobicContact CZ-CB 3.63Å; F531-H540 AromaticContact CZ-CD2 3.84Å; F531-H540 AromaticContact CZ-CG 3.36Å; F531-H540 AromaticContact CZ-ND1 3.51Å; A536-H540 VanDerWaalsContact O-CB 3.29Å; A536-H540 WeakPolarHBondContact O-CB 3.49Å; A536-H540 PolarHBondContact O-N 2.87Å; L537-H540 CarbonylContact O-C 3.06Å; L537-H540 WeakPolarHBondContact O-CA 3.46Å; L537-H540 WeakPolarHBondContact O-CB 3.36Å; L537-H540 PolarHBondContact O-N 3.23Å; I538-H540 VanDerWaalsContact C-N 3.31Å; I538-H540 PolarHBondContact O-N 3Å; H540-R542 PolarHBondContact O-N 3.3Å; H540-I543 WeakPolarHBondContact O-CA 3.31Å; H540-I543 WeakPolarHBondContact O-CB 3.47Å; H540-I543 VanDerWaalsContact O-CG1 3.23Å; H540-I543 WeakPolarHBondContact O-CG1 3.47Å; H540-I543 PolarHBondContact O-N 2.99Å; H540-H544 AromaticContact CD2-NE2 3.16Å; H540-H544 PolarHBondContact CD2-NE2 2.71Å; H540-H544 AromaticContact CE1-NE2 3.56Å; H540-H544 AromaticContact NE2-CE1 3.91Å; H540-H544 AromaticContact NE2-NE2 2.49Å; H540-H544 PolarHBondContact NE2-NE2 2.79Å
541	Q	90.8	Very high	90.1	Very high	71 Å²	71	68.2 Å²	68.2	33%	0.332	37%	0.366	S	S	.	.	H	α-helix	trans	-60.5	-29.2	177.8	-73.1	177.3	-73.8	0	0	112.6	L537 I538 I543 H544 T545	L537-Q541 HydrophobicContact CD1-CG 4.03Å; L537-Q541 HydrophobicContact CG-CG 4.42Å; L537-Q541 WeakPolarHBondContact O-CG 3.12Å; L537-Q541 PolarHBondContact O-N 3.21Å; I538-Q541 PolarHBondContact O-N 3.35Å; Q541-I543 PolarHBondContact O-N 3.42Å; Q541-I543 VanDerWaalsContact O-N 3.11Å; Q541-H544 PolarHBondContact O-N 3.12Å; Q541-T545 PolarHBondContact O-N 2.77Å
542	R	91.3	Very high	90.3	Very high	59 Å²	59	66.1 Å²	66.1	22%	0.223	36%	0.357	C	S	.	.	H	α-helix	trans	-62.4	-12.9	170	-62.8	-172.3	176.4	147.5	7.4	114.7	H540 G546 E547 R560	H540-R542 PolarHBondContact O-N 3.3Å; R542-G546 CarbonylContact O-C 3.53Å; R542-G546 PolarHBondContact O-N 2.92Å; R542-E547 HydrophobicContact CB-CB 4Å; R542-E547 HydrophobicContact CG-CB 3.82Å; R542-E547 IonicContact NE-OE2 3.89Å; R542-E547 PolarHBondContact NE-OE2 3.19Å; R542-E547 PolarHBondContact O-N 2.89Å; R542-R560 HydrophobicContact CB-CG 3.74Å; R542-R560 PolarHBondContact NH1-O 2.97Å; R542-R560 PolarHBondContact O-NE 3.06Å; R542-R560 PolarHBondContact O-NH2 3.29Å
543	I	90	Very high	90.5	Very high	87 Å²	87	72 Å²	72	45%	0.446	38%	0.383	S	S	.	.	H	α-helix	trans	-67.7	-52.3	170.3	-58.4	178.4	0	0	0	108.8	H540 Q541 G546 R560	H540-I543 WeakPolarHBondContact O-CA 3.31Å; H540-I543 WeakPolarHBondContact O-CB 3.47Å; H540-I543 VanDerWaalsContact O-CG1 3.23Å; H540-I543 WeakPolarHBondContact O-CG1 3.47Å; H540-I543 PolarHBondContact O-N 2.99Å; Q541-I543 PolarHBondContact O-N 3.42Å; Q541-I543 VanDerWaalsContact O-N 3.11Å; I543-G546 PolarHBondContact O-N 3.06Å; I543-R560 PolarHBondContact O-NH2 3.4Å
544	H	89.4	Confident	90.5	Very high	87 Å²	87	72.2 Å²	72.2	40%	0.403	39%	0.391	S	S	.	.	H	α-helix	trans	-69	-47.2	179.8	-51.6	-45.7	0	0	0	112.3	C524 E526 C527 H540 Q541 G546	C524-H544 PolarHBondContact SG-NE2 3.36Å; E526-H544 WeakPolarHBondContact OE1-CB 3.26Å; E526-H544 IonicContact OE2-CD2 3Å; E526-H544 PolarHBondContact OE2-CD2 3.1Å; E526-H544 VanDerWaalsContact OE2-CD2 3.31Å; C527-H544 WeakPolarHBondContact CB-CE1 3.18Å; C527-H544 WeakPolarHBondContact CB-NE2 3.38Å; C527-H544 PolarHBondContact SG-NE2 3.26Å; H540-H544 AromaticContact CD2-NE2 3.16Å; H540-H544 PolarHBondContact CD2-NE2 2.71Å; H540-H544 AromaticContact CE1-NE2 3.56Å; H540-H544 AromaticContact NE2-CE1 3.91Å; H540-H544 AromaticContact NE2-NE2 2.49Å; H540-H544 PolarHBondContact NE2-NE2 2.79Å; Q541-H544 PolarHBondContact O-N 3.12Å; H544-G546 PolarHBondContact O-N 3.36Å; H544-G546 VanDerWaalsContact O-N 3.17Å
545	T	87.6	Confident	90.4	Very high	78 Å²	78	72 Å²	72	48%	0.479	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-2.4	179.4	70	0	0	0	0	114.4	Q541 E547	Q541-T545 PolarHBondContact O-N 2.77Å; T545-E547 PolarHBondContact O-N 3.16Å; T545-E547 WeakPolarHBondContact OG1-CG 3.4Å; T545-E547 PolarHBondContact OG1-OE1 3.22Å
546	G	87.6	Confident	90.5	Very high	39 Å²	39	70.8 Å²	70.8	40%	0.402	38%	0.383	S	S	.	.			trans	67.6	-5.6	-176.8	0	0	0	0	0	115.7	R542 I543 H544 K548	R542-G546 CarbonylContact O-C 3.53Å; R542-G546 PolarHBondContact O-N 2.92Å; I543-G546 PolarHBondContact O-N 3.06Å; H544-G546 PolarHBondContact O-N 3.36Å; H544-G546 VanDerWaalsContact O-N 3.17Å; G546-K548 PolarHBondContact O-N 3.23Å
547	E	89.1	Confident	90.5	Very high	95 Å²	95	75.5 Å²	75.5	44%	0.444	40%	0.396	S	S	.	.			trans	-50.2	128	-172.3	-90.8	178.9	-137.8	0	0	114.3	R542 T545 P549	R542-E547 HydrophobicContact CB-CB 4Å; R542-E547 HydrophobicContact CG-CB 3.82Å; R542-E547 IonicContact NE-OE2 3.89Å; R542-E547 PolarHBondContact NE-OE2 3.19Å; R542-E547 PolarHBondContact O-N 2.89Å; T545-E547 PolarHBondContact O-N 3.16Å; T545-E547 WeakPolarHBondContact OG1-CG 3.4Å; T545-E547 PolarHBondContact OG1-OE1 3.22Å; E547-P549 HydrophobicContact CB-CG 4.49Å
548	K	90.6	Very high	90.5	Very high	113 Å²	113	77.6 Å²	77.6	49%	0.491	41%	0.41	S	S	.	.			trans	-128.7	72.1	174.2	-66.8	168	-172.1	175.1	0	111.1	G546 F550 T558 F559	G546-K548 PolarHBondContact O-N 3.23Å; K548-F550 PolarHBondContact O-N 3.42Å; K548-F550 VanDerWaalsContact O-N 3.1Å; K548-T558 WeakPolarHBondContact CD-OG1 3.44Å; K548-F559 CarbonylContact C-O 3.59Å; K548-F559 VanDerWaalsContact CA-O 3.27Å; K548-F559 WeakPolarHBondContact CA-O 3.19Å
549	P	90.4	Very high	90.5	Very high	70 Å²	70	75.1 Å²	75.1	46%	0.455	40%	0.396	S	S	.	.			trans	-68.2	-12.1	-169.5	-21.6	35.3	0	0	0	115.4	E547	E547-P549 HydrophobicContact CB-CG 4.49Å
550	F	92.4	Very high	90.4	Very high	64 Å²	64	74.7 Å²	74.7	28%	0.281	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	93.4	-172.9	-57	-76	0	0	0	110.3	K548 T558 F559 L565	K548-F550 PolarHBondContact O-N 3.42Å; K548-F550 VanDerWaalsContact O-N 3.1Å; F550-T558 CarbonylContact O-C 3.59Å; F550-T558 WeakPolarHBondContact O-CA 3.27Å; F550-F559 HydrophobicContact CB-CB 4.3Å; F550-F559 WeakPolarHBondContact CD2-O 3.28Å; F550-F559 PolarHBondContact N-O 3.47Å; F550-F559 VanDerWaalsContact N-O 3.1Å; F550-F559 PolarHBondContact O-N 3.22Å; F550-L565 HydrophobicContact CB-CB 4.07Å; F550-L565 HydrophobicContact CB-CD2 3.85Å
551	K	91.7	Very high	90.3	Very high	130 Å²	130	77.1 Å²	77.1	57%	0.565	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	138.2	176.1	-171.8	176.5	179.7	-177.5	0	111.3	T558 L565	K551-T558 HydrophobicContact CB-CG2 4.13Å; K551-T558 HydrophobicContact CG-CG2 4.09Å; K551-L565 WeakPolarHBondContact O-CD2 3.48Å
552	C	94	Very high	90.4	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	41%	0.406	C	S	.	.			trans	-81.6	123.7	165.2	-175.9	0	0	0	0	109.9	G556 K557 F559 L565	C552-G556 VanDerWaalsContact O-CA 3.23Å; C552-G556 WeakPolarHBondContact O-CA 3.49Å; C552-G556 PolarHBondContact O-N 3.1Å; C552-K557 WeakPolarHBondContact CB-O 3.4Å; C552-K557 PolarHBondContact N-O 3.4Å; C552-F559 HydrophobicContact CB-CE2 4.31Å; C552-L565 HydrophobicContact CB-CD1 3.65Å
553	N	91	Very high	90.3	Very high	147 Å²	147	76.8 Å²	76.8	79%	0.786	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-34.7	-179.7	-66	-4.6	0	0	0	112.1
554	T	89.2	Confident	90.3	Very high	103 Å²	103	74.9 Å²	74.9	63%	0.632	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-37.8	-175.7	-39.7	0	0	0	0	113.6	H572	T554-H572 HydrophobicContact CG2-CB 4.2Å
555	C	91.3	Very high	90.4	Very high	52 Å²	52	71.7 Å²	71.7	35%	0.351	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.4	18	-173.4	79.6	0	0	0	0	114.4	K557 H568 H572	C555-K557 PolarHBondContact O-N 3.02Å; C555-H568 PolarHBondContact SG-NE2 2.93Å; C555-H572 VanDerWaalsContact SG-CE1 3.59Å; C555-H572 PolarHBondContact SG-NE2 3.1Å; C555-H572 VanDerWaalsContact SG-NE2 3.42Å
556	G	89.4	Confident	90.5	Very high	35 Å²	35	72.3 Å²	72.3	36%	0.361	40%	0.396	S	S	.	.			trans	69.6	-19.6	174.8	0	0	0	0	0	117.5	C552	C552-G556 VanDerWaalsContact O-CA 3.23Å; C552-G556 WeakPolarHBondContact O-CA 3.49Å; C552-G556 PolarHBondContact O-N 3.1Å
557	K	91.2	Very high	90.6	Very high	134 Å²	134	71.7 Å²	71.7	58%	0.583	39%	0.388	S	S	*	.			trans	-56.4	135	-174.8	-69.2	-179.3	-178.4	180	0	112	C552 C555 F559	C552-K557 WeakPolarHBondContact CB-O 3.4Å; C552-K557 PolarHBondContact N-O 3.4Å; C555-K557 PolarHBondContact O-N 3.02Å; K557-F559 HydrophobicContact CB-CE2 3.95Å; K557-F559 HydrophobicContact CB-CZ 4.12Å; K557-F559 WeakPolarHBondContact O-CE2 3.46Å
558	T	91.4	Very high	90.6	Very high	67 Å²	67	68.2 Å²	68.2	41%	0.411	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	143.2	-175	57.6	0	0	0	0	112.6	K548 F550 K551	K548-T558 WeakPolarHBondContact CD-OG1 3.44Å; F550-T558 CarbonylContact O-C 3.59Å; F550-T558 WeakPolarHBondContact O-CA 3.27Å; K551-T558 HydrophobicContact CB-CG2 4.13Å; K551-T558 HydrophobicContact CG-CG2 4.09Å
559	F	90.8	Very high	90.6	Very high	42 Å²	42	66.4 Å²	66.4	18%	0.184	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.2	-173.7	-60.3	-89.4	0	0	0	112.2	K548 F550 C552 K557 Q561 L565 H568	K548-F559 CarbonylContact C-O 3.59Å; K548-F559 VanDerWaalsContact CA-O 3.27Å; K548-F559 WeakPolarHBondContact CA-O 3.19Å; F550-F559 HydrophobicContact CB-CB 4.3Å; F550-F559 WeakPolarHBondContact CD2-O 3.28Å; F550-F559 PolarHBondContact N-O 3.47Å; F550-F559 VanDerWaalsContact N-O 3.1Å; F550-F559 PolarHBondContact O-N 3.22Å; C552-F559 HydrophobicContact CB-CE2 4.31Å; K557-F559 HydrophobicContact CB-CE2 3.95Å; K557-F559 HydrophobicContact CB-CZ 4.12Å; K557-F559 WeakPolarHBondContact O-CE2 3.46Å; F559-Q561 VanDerWaalsContact C-N 3.35Å; F559-L565 HydrophobicContact CB-CB 4.33Å; F559-L565 HydrophobicContact CD2-CB 4.05Å; F559-L565 HydrophobicContact CD2-CD1 3.9Å; F559-L565 HydrophobicContact CE2-CD1 4.11Å; F559-L565 HydrophobicContact CG-CB 4.33Å; F559-H568 HydrophobicContact CE1-CB 4.01Å; F559-H568 HydrophobicContact CE2-CB 4.05Å; F559-H568 AromaticContact CE2-CD2 3.36Å; F559-H568 WeakPolarHBondContact CE2-CD2 3.48Å; F559-H568 AromaticContact CE2-CG 3.77Å; F559-H568 HydrophobicContact CZ-CB 3.55Å; F559-H568 AromaticContact CZ-CD2 3.39Å; F559-H568 WeakPolarHBondContact CZ-CD2 3.37Å; F559-H568 AromaticContact CZ-CG 3.31Å; F559-H568 AromaticContact CZ-ND1 3.96Å
560	R	88.8	Confident	90.6	Very high	75 Å²	75	65.2 Å²	65.2	28%	0.283	35%	0.351	S	S	.	.	S	Bend	trans	-75.9	-21.4	178	-174.4	171.6	-72.1	146.2	-8.9	113.4	R542 I543	R542-R560 HydrophobicContact CB-CG 3.74Å; R542-R560 PolarHBondContact NH1-O 2.97Å; R542-R560 PolarHBondContact O-NE 3.06Å; R542-R560 PolarHBondContact O-NH2 3.29Å; I543-R560 PolarHBondContact O-NH2 3.4Å
561	Q	89.4	Confident	90.3	Very high	71 Å²	71	67.9 Å²	67.9	33%	0.332	37%	0.367	S	S	.	.	S	Bend	trans	-133.9	145.3	-177.4	-48.8	-178.8	23.8	0	0	110.8	Q539 F559 S563 S564 L565	Q539-Q561 VanDerWaalsContact NE2-NE2 3.11Å; F559-Q561 VanDerWaalsContact C-N 3.35Å; Q561-S563 VanDerWaalsContact C-N 3.35Å; Q561-S563 WeakPolarHBondContact CB-OG 3.29Å; Q561-S563 PolarHBondContact OE1-OG 3.06Å; Q561-S563 VanDerWaalsContact OE1-OG 3.14Å; Q561-S564 PolarHBondContact O-N 2.89Å; Q561-L565 PolarHBondContact O-N 3.31Å
562	S	91	Very high	90.2	Very high	59 Å²	59	65.3 Å²	65.3	41%	0.413	36%	0.357	S	S	.	.	H	α-helix	trans	-68.7	-32.3	176.1	49.9	0	0	0	0	112.9	S564 L565 I566	S562-S564 VanDerWaalsContact C-N 3.32Å; S562-S564 PolarHBondContact O-N 2.95Å; S562-L565 PolarHBondContact O-N 3.17Å; S562-I566 WeakPolarHBondContact O-CG1 3.46Å; S562-I566 PolarHBondContact O-N 2.8Å
563	S	89.4	Confident	89.8	Confident	64 Å²	64	69.1 Å²	69.1	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-55.4	-45.5	170.9	44.7	0	0	0	0	112.1	Q561 I566 A567	Q561-S563 VanDerWaalsContact C-N 3.35Å; Q561-S563 WeakPolarHBondContact CB-OG 3.29Å; Q561-S563 PolarHBondContact OE1-OG 3.06Å; Q561-S563 VanDerWaalsContact OE1-OG 3.14Å; S563-I566 PolarHBondContact O-N 3.3Å; S563-A567 WeakPolarHBondContact O-CB 3.28Å; S563-A567 PolarHBondContact O-N 3.21Å
564	S	90.4	Very high	89.6	Confident	47 Å²	47	64.6 Å²	64.6	33%	0.329	37%	0.368	S	S	.	.	H	α-helix	trans	-66.2	-39.3	176.7	-51.4	0	0	0	0	112.2	Q561 S562 H568	Q561-S564 PolarHBondContact O-N 2.89Å; S562-S564 VanDerWaalsContact C-N 3.32Å; S562-S564 PolarHBondContact O-N 2.95Å; S564-H568 VanDerWaalsContact O-CB 3.28Å; S564-H568 WeakPolarHBondContact O-CB 3.39Å; S564-H568 PolarHBondContact O-N 2.82Å
565	L	92.3	Very high	89.4	Confident	21 Å²	21	64.2 Å²	64.2	11%	0.11	36%	0.359	C	S	.	.	H	α-helix	trans	-63	-47.3	173.9	173.3	60	0	0	0	111.3	F550 K551 C552 F559 Q561 S562 A567 H568 Q569	F550-L565 HydrophobicContact CB-CB 4.07Å; F550-L565 HydrophobicContact CB-CD2 3.85Å; K551-L565 WeakPolarHBondContact O-CD2 3.48Å; C552-L565 HydrophobicContact CB-CD1 3.65Å; F559-L565 HydrophobicContact CB-CB 4.33Å; F559-L565 HydrophobicContact CD2-CB 4.05Å; F559-L565 HydrophobicContact CD2-CD1 3.9Å; F559-L565 HydrophobicContact CE2-CD1 4.11Å; F559-L565 HydrophobicContact CG-CB 4.33Å; Q561-L565 PolarHBondContact O-N 3.31Å; S562-L565 PolarHBondContact O-N 3.17Å; L565-A567 PolarHBondContact O-N 3.48Å; L565-H568 CarbonylContact O-C 3.54Å; L565-H568 WeakPolarHBondContact O-CB 3.45Å; L565-H568 PolarHBondContact O-N 3.24Å; L565-H568 VanDerWaalsContact O-N 3.15Å; L565-Q569 HydrophobicContact CD1-CG 4Å; L565-Q569 HydrophobicContact CG-CG 4.38Å; L565-Q569 WeakPolarHBondContact O-CG 3.39Å; L565-Q569 PolarHBondContact O-N 3.24Å
566	I	89.8	Confident	89.3	Confident	91 Å²	91	67.5 Å²	67.5	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-43.4	179.3	-67.3	163.2	0	0	0	111	S562 S563 H568 Q569 R570	S562-I566 WeakPolarHBondContact O-CG1 3.46Å; S562-I566 PolarHBondContact O-N 2.8Å; S563-I566 PolarHBondContact O-N 3.3Å; I566-H568 VanDerWaalsContact C-N 3.27Å; I566-H568 PolarHBondContact O-N 2.9Å; I566-Q569 PolarHBondContact O-N 3.19Å; I566-R570 PolarHBondContact O-N 3.17Å
567	A	88.3	Confident	89.2	Confident	26 Å²	26	69.2 Å²	69.2	22%	0.215	37%	0.372	C	S	.	.	H	α-helix	trans	-63.5	-33.6	175.4	0	0	0	0	0	112.5	S563 L565	S563-A567 WeakPolarHBondContact O-CB 3.28Å; S563-A567 PolarHBondContact O-N 3.21Å; L565-A567 PolarHBondContact O-N 3.48Å
568	H	90.4	Very high	89.1	Confident	21 Å²	21	65.9 Å²	65.9	10%	0.097	36%	0.356	C	S	.	.	H	α-helix	trans	-73.8	-36.8	173.8	169.7	61.9	0	0	0	113.1	C555 F559 S564 L565 I566 R570 I571 H572	C555-H568 PolarHBondContact SG-NE2 2.93Å; F559-H568 HydrophobicContact CE1-CB 4.01Å; F559-H568 HydrophobicContact CE2-CB 4.05Å; F559-H568 AromaticContact CE2-CD2 3.36Å; F559-H568 WeakPolarHBondContact CE2-CD2 3.48Å; F559-H568 AromaticContact CE2-CG 3.77Å; F559-H568 HydrophobicContact CZ-CB 3.55Å; F559-H568 AromaticContact CZ-CD2 3.39Å; F559-H568 WeakPolarHBondContact CZ-CD2 3.37Å; F559-H568 AromaticContact CZ-CG 3.31Å; F559-H568 AromaticContact CZ-ND1 3.96Å; S564-H568 VanDerWaalsContact O-CB 3.28Å; S564-H568 WeakPolarHBondContact O-CB 3.39Å; S564-H568 PolarHBondContact O-N 2.82Å; L565-H568 CarbonylContact O-C 3.54Å; L565-H568 WeakPolarHBondContact O-CB 3.45Å; L565-H568 PolarHBondContact O-N 3.24Å; L565-H568 VanDerWaalsContact O-N 3.15Å; I566-H568 VanDerWaalsContact C-N 3.27Å; I566-H568 PolarHBondContact O-N 2.9Å; H568-R570 PolarHBondContact O-N 3.47Å; H568-I571 VanDerWaalsContact O-CB 3.27Å; H568-I571 WeakPolarHBondContact O-CB 3.45Å; H568-I571 WeakPolarHBondContact O-CG1 3.47Å; H568-I571 PolarHBondContact O-N 2.83Å; H568-H572 AromaticContact CD2-NE2 3.94Å; H568-H572 AromaticContact CE1-CE1 3.97Å; H568-H572 AromaticContact CE1-NE2 3.34Å; H568-H572 PolarHBondContact CE1-NE2 3.21Å; H568-H572 VanDerWaalsContact CE1-NE2 3.34Å; H568-H572 AromaticContact NE2-CD2 3.93Å; H568-H572 AromaticContact NE2-CE1 4Å; H568-H572 AromaticContact NE2-NE2 3.05Å; H568-H572 PolarHBondContact NE2-NE2 3.32Å
569	Q	89.9	Confident	89	Confident	75 Å²	75	67.9 Å²	67.9	35%	0.35	36%	0.361	S	S	.	.	H	α-helix	trans	-59.9	-30.2	179.1	-77.7	173	-64.8	0	0	112.6	L565 I566 I571 H572 T573	L565-Q569 HydrophobicContact CD1-CG 4Å; L565-Q569 HydrophobicContact CG-CG 4.38Å; L565-Q569 WeakPolarHBondContact O-CG 3.39Å; L565-Q569 PolarHBondContact O-N 3.24Å; I566-Q569 PolarHBondContact O-N 3.19Å; Q569-I571 PolarHBondContact O-N 3.42Å; Q569-H572 WeakPolarHBondContact O-CB 3.35Å; Q569-H572 PolarHBondContact O-N 2.83Å; Q569-T573 PolarHBondContact O-N 2.96Å; Q569-T573 VanDerWaalsContact O-N 3.07Å
570	R	90	Very high	89	Confident	45 Å²	45	65.9 Å²	65.9	17%	0.17	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-18.2	173.5	-64.1	177.6	177.9	-165.8	-8.8	114.5	I566 H568 H572 G574 E575 S588	I566-R570 PolarHBondContact O-N 3.17Å; H568-R570 PolarHBondContact O-N 3.47Å; R570-H572 VanDerWaalsContact C-N 3.31Å; R570-G574 WeakPolarHBondContact O-CA 3.46Å; R570-G574 PolarHBondContact O-N 3.3Å; R570-E575 HydrophobicContact CB-CB 4.32Å; R570-E575 HydrophobicContact CG-CB 4.02Å; R570-S588 WeakPolarHBondContact CD-O 3.45Å; R570-S588 PolarHBondContact NH1-O 2.82Å
571	I	87.6	Confident	88.9	Confident	121 Å²	121	69.5 Å²	69.5	62%	0.621	38%	0.377	S	S	*	.	H	α-helix	trans	-72	-31.7	172.1	-55.5	176.5	0	0	0	110	H568 Q569	H568-I571 VanDerWaalsContact O-CB 3.27Å; H568-I571 WeakPolarHBondContact O-CB 3.45Å; H568-I571 WeakPolarHBondContact O-CG1 3.47Å; H568-I571 PolarHBondContact O-N 2.83Å; Q569-I571 PolarHBondContact O-N 3.42Å
572	H	88.1	Confident	88.7	Confident	75 Å²	75	69.6 Å²	69.6	35%	0.347	39%	0.39	S	S	.	.	H	α-helix	trans	-86	-33.9	177.3	-54.3	-61.6	0	0	0	112.9	T554 C555 H568 Q569 R570	T554-H572 HydrophobicContact CG2-CB 4.2Å; C555-H572 VanDerWaalsContact SG-CE1 3.59Å; C555-H572 PolarHBondContact SG-NE2 3.1Å; C555-H572 VanDerWaalsContact SG-NE2 3.42Å; H568-H572 AromaticContact CD2-NE2 3.94Å; H568-H572 AromaticContact CE1-CE1 3.97Å; H568-H572 AromaticContact CE1-NE2 3.34Å; H568-H572 PolarHBondContact CE1-NE2 3.21Å; H568-H572 VanDerWaalsContact CE1-NE2 3.34Å; H568-H572 AromaticContact NE2-CD2 3.93Å; H568-H572 AromaticContact NE2-CE1 4Å; H568-H572 AromaticContact NE2-NE2 3.05Å; H568-H572 PolarHBondContact NE2-NE2 3.32Å; Q569-H572 WeakPolarHBondContact O-CB 3.35Å; Q569-H572 PolarHBondContact O-N 2.83Å; R570-H572 VanDerWaalsContact C-N 3.31Å
573	T	87	Confident	88.6	Confident	81 Å²	81	69.3 Å²	69.3	50%	0.497	39%	0.388	S	S	.	.	H	α-helix	trans	-89.7	-8.9	178.9	64.1	0	0	0	0	114.1	Q569 E575	Q569-T573 PolarHBondContact O-N 2.96Å; Q569-T573 VanDerWaalsContact O-N 3.07Å; T573-E575 PolarHBondContact O-N 3.24Å; T573-E575 VanDerWaalsContact O-N 3.13Å; T573-E575 WeakPolarHBondContact OG1-CG 3.26Å; T573-E575 PolarHBondContact OG1-OE1 3.3Å
574	G	84.9	Confident	88.5	Confident	51 Å²	51	68 Å²	68	53%	0.526	39%	0.385	S	S	.	.			trans	69.4	-0.2	-175.5	0	0	0	0	0	114.9	R570 K576	R570-G574 WeakPolarHBondContact O-CA 3.46Å; R570-G574 PolarHBondContact O-N 3.3Å; G574-K576 PolarHBondContact O-N 3.43Å
575	E	87	Confident	88.3	Confident	96 Å²	96	71.7 Å²	71.7	45%	0.449	39%	0.394	S	S	.	.			trans	-56.3	124.7	-176.6	-83.8	170.6	-126	0	0	113.1	R570 T573 P577	R570-E575 HydrophobicContact CB-CB 4.32Å; R570-E575 HydrophobicContact CG-CB 4.02Å; T573-E575 PolarHBondContact O-N 3.24Å; T573-E575 VanDerWaalsContact O-N 3.13Å; T573-E575 WeakPolarHBondContact OG1-CG 3.26Å; T573-E575 PolarHBondContact OG1-OE1 3.3Å; E575-P577 HydrophobicContact CB-CG 4.19Å; E575-P577 WeakPolarHBondContact O-CD 3.23Å
576	K	88.1	Confident	88.1	Confident	120 Å²	120	75 Å²	75	52%	0.522	41%	0.412	S	S	.	.			trans	-123.1	70.1	174.2	-64.8	173.3	-179	-177.5	0	112.2	G574 Y578 L586 F587	G574-K576 PolarHBondContact O-N 3.43Å; K576-Y578 PolarHBondContact O-N 3.36Å; K576-L586 HydrophobicContact CB-CB 3.69Å; K576-L586 HydrophobicContact CD-CB 4.05Å; K576-F587 CarbonylContact C-O 3.54Å; K576-F587 VanDerWaalsContact CA-O 3.28Å; K576-F587 WeakPolarHBondContact CA-O 3.4Å
577	P	88	Confident	88	Confident	71 Å²	71	72.7 Å²	72.7	46%	0.461	40%	0.398	S	S	.	.			trans	-80	18.4	-167.8	-13.7	33.1	0	0	0	115	E575	E575-P577 HydrophobicContact CB-CG 4.19Å; E575-P577 WeakPolarHBondContact O-CD 3.23Å
578	Y	88.1	Confident	87.8	Confident	64 Å²	64	73.2 Å²	73.2	25%	0.251	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	101.1	-178	-58.2	-62.3	0	0	0	109.3	K576 F587 R590	K576-Y578 PolarHBondContact O-N 3.36Å; Y578-F587 WeakPolarHBondContact CB-O 3.44Å; Y578-F587 PolarHBondContact N-O 3.49Å; Y578-F587 PolarHBondContact O-N 3.5Å; Y578-R590 HydrophobicContact CD1-CB 4.36Å; Y578-R590 HydrophobicContact CD2-CB 4.35Å; Y578-R590 VanDerWaalsContact CD2-N 3.31Å; Y578-R590 HydrophobicContact CE1-CB 4.07Å; Y578-R590 HydrophobicContact CE2-CB 4.05Å; Y578-R590 HydrophobicContact CG-CB 4.48Å
579	E	89.7	Confident	87.6	Confident	109 Å²	109	76 Å²	76	51%	0.509	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	147.4	178.6	-173.3	168.7	176.6	0	0	111.6	L586 L593	E579-L586 HydrophobicContact CB-CD2 3.63Å; E579-L586 HydrophobicContact CG-CD2 3.75Å; E579-L593 VanDerWaalsContact O-CD2 3.32Å; E579-L593 WeakPolarHBondContact O-CD2 3.22Å
580	C	91	Very high	87.5	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	43%	0.427	C	S	.	.			trans	-94.2	105	168.2	-174.7	0	0	0	0	110.3	A582 C583 G584 K585 F587 L593 H597	C580-A582 PolarHBondContact O-N 3.05Å; C580-C583 PolarHBondContact O-N 2.91Å; C580-C583 VanDerWaalsContact SG-SG 3.68Å; C580-G584 PolarHBondContact O-N 3.5Å; C580-K585 HydrophobicContact CB-CB 4.48Å; C580-K585 PolarHBondContact N-O 2.86Å; C580-F587 HydrophobicContact CB-CE2 4.26Å; C580-L593 HydrophobicContact CB-CD1 3.57Å; C580-H597 VanDerWaalsContact SG-CD2 3.55Å
581	N	87.4	Confident	87.4	Confident	152 Å²	152	81.3 Å²	81.3	81%	0.813	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-20.9	-178.4	-61.8	23.2	0	0	0	114.3
582	A	84.9	Confident	87.4	Confident	73 Å²	73	77.7 Å²	77.7	60%	0.603	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-19.6	178.4	0	0	0	0	0	114	C580	C580-A582 PolarHBondContact O-N 3.05Å
583	C	89.2	Confident	87.5	Confident	53 Å²	53	75 Å²	75	36%	0.358	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.2	12.5	-173.2	67	0	0	0	0	116.1	C580 K585 H596 H600	C580-C583 PolarHBondContact O-N 2.91Å; C580-C583 VanDerWaalsContact SG-SG 3.68Å; C583-K585 PolarHBondContact O-N 3.23Å; C583-H596 PolarHBondContact SG-NE2 3.17Å; C583-H600 PolarHBondContact SG-NE2 3.24Å; C583-H600 VanDerWaalsContact SG-NE2 3.45Å
584	G	85.4	Confident	87.5	Confident	37 Å²	37	74.8 Å²	74.8	38%	0.381	41%	0.412	S	S	.	.			trans	66.7	-3.1	179.1	0	0	0	0	0	116.1	C580 L586	C580-G584 PolarHBondContact O-N 3.5Å; G584-L586 PolarHBondContact O-N 2.98Å
585	K	87.5	Confident	87.7	Confident	123 Å²	123	77.3 Å²	77.3	54%	0.535	41%	0.414	S	S	.	.			trans	-64.2	123.8	-176.2	-72.7	176.9	-178.3	168	0	111.1	C580 C583 F587	C580-K585 HydrophobicContact CB-CB 4.48Å; C580-K585 PolarHBondContact N-O 2.86Å; C583-K585 PolarHBondContact O-N 3.23Å; K585-F587 HydrophobicContact CB-CE2 3.73Å; K585-F587 HydrophobicContact CB-CZ 4.02Å; K585-F587 VanDerWaalsContact O-CD2 3.26Å; K585-F587 WeakPolarHBondContact O-CD2 3.35Å; K585-F587 WeakPolarHBondContact O-CE2 3.34Å
586	L	88.3	Confident	87.8	Confident	90 Å²	90	73.7 Å²	73.7	47%	0.471	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136.2	-177.7	-59.7	179	0	0	0	112.3	K576 E579 G584	K576-L586 HydrophobicContact CB-CB 3.69Å; K576-L586 HydrophobicContact CD-CB 4.05Å; E579-L586 HydrophobicContact CB-CD2 3.63Å; E579-L586 HydrophobicContact CG-CD2 3.75Å; G584-L586 PolarHBondContact O-N 2.98Å
587	F	86.7	Confident	87.7	Confident	43 Å²	43	71.9 Å²	71.9	19%	0.189	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.7	-178	-61.2	-90.8	0	0	0	112.8	K576 Y578 C580 K585 L593 H596	K576-F587 CarbonylContact C-O 3.54Å; K576-F587 VanDerWaalsContact CA-O 3.28Å; K576-F587 WeakPolarHBondContact CA-O 3.4Å; Y578-F587 WeakPolarHBondContact CB-O 3.44Å; Y578-F587 PolarHBondContact N-O 3.49Å; Y578-F587 PolarHBondContact O-N 3.5Å; C580-F587 HydrophobicContact CB-CE2 4.26Å; K585-F587 HydrophobicContact CB-CE2 3.73Å; K585-F587 HydrophobicContact CB-CZ 4.02Å; K585-F587 VanDerWaalsContact O-CD2 3.26Å; K585-F587 WeakPolarHBondContact O-CD2 3.35Å; K585-F587 WeakPolarHBondContact O-CE2 3.34Å; F587-L593 HydrophobicContact CB-CB 4.33Å; F587-L593 HydrophobicContact CD2-CB 4.11Å; F587-L593 HydrophobicContact CD2-CD1 3.7Å; F587-L593 HydrophobicContact CE2-CD1 3.92Å; F587-L593 HydrophobicContact CG-CB 4.3Å; F587-H596 HydrophobicContact CE1-CB 4.09Å; F587-H596 HydrophobicContact CE2-CB 4.11Å; F587-H596 AromaticContact CE2-CD2 3.43Å; F587-H596 VanDerWaalsContact CE2-CD2 3.43Å; F587-H596 WeakPolarHBondContact CE2-CD2 3.43Å; F587-H596 AromaticContact CE2-CG 3.98Å; F587-H596 HydrophobicContact CZ-CB 3.58Å; F587-H596 AromaticContact CZ-CD2 3.32Å; F587-H596 WeakPolarHBondContact CZ-CD2 3.4Å; F587-H596 AromaticContact CZ-CG 3.46Å; F587-H596 VanDerWaalsContact CZ-CG 3.46Å
588	S	84.9	Confident	87.6	Confident	38 Å²	38	73.9 Å²	73.9	27%	0.266	39%	0.392	S	S	.	.	S	Bend	trans	-78.3	-21.5	176.7	58.2	0	0	0	0	113.6	R570	R570-S588 WeakPolarHBondContact CD-O 3.45Å; R570-S588 PolarHBondContact NH1-O 2.82Å
589	Q	86.4	Confident	87.5	Confident	79 Å²	79	74.5 Å²	74.5	37%	0.369	40%	0.398	S	S	.	.	S	Bend	trans	-129.8	142.7	-179.8	-55.9	-172	31.2	0	0	112.3	S591 S592 L593	Q589-S591 VanDerWaalsContact C-N 3.31Å; Q589-S591 PolarHBondContact O-N 3.32Å; Q589-S591 PolarHBondContact OE1-OG 3.26Å; Q589-S592 WeakPolarHBondContact O-CB 3.34Å; Q589-S592 PolarHBondContact O-N 3.49Å; Q589-L593 PolarHBondContact O-N 3.18Å
590	R	86.4	Confident	87.1	Confident	169 Å²	169	70.9 Å²	70.9	64%	0.638	38%	0.381	S	S	*	.	H	α-helix	trans	-65.4	-34.4	178.6	174.2	173.5	-77.8	-162.5	-7.2	112.1	Y578 S592 L593 T594	Y578-R590 HydrophobicContact CD1-CB 4.36Å; Y578-R590 HydrophobicContact CD2-CB 4.35Å; Y578-R590 VanDerWaalsContact CD2-N 3.31Å; Y578-R590 HydrophobicContact CE1-CB 4.07Å; Y578-R590 HydrophobicContact CE2-CB 4.05Å; Y578-R590 HydrophobicContact CG-CB 4.48Å; R590-S592 VanDerWaalsContact C-N 3.31Å; R590-S592 PolarHBondContact O-N 3.23Å; R590-L593 PolarHBondContact O-N 2.9Å; R590-T594 PolarHBondContact O-N 3.38Å; R590-T594 PolarHBondContact O-OG1 3.22Å; R590-T594 VanDerWaalsContact O-OG1 3.06Å
591	S	87.8	Confident	86.3	Confident	63 Å²	63	74.9 Å²	74.9	44%	0.441	41%	0.406	S	S	.	.	H	α-helix	trans	-57	-43.9	173.6	36.6	0	0	0	0	112	Q589 T594 N595	Q589-S591 VanDerWaalsContact C-N 3.31Å; Q589-S591 PolarHBondContact O-N 3.32Å; Q589-S591 PolarHBondContact OE1-OG 3.26Å; S591-T594 PolarHBondContact O-N 3.35Å; S591-N595 PolarHBondContact O-N 3.4Å
592	S	88.1	Confident	85.5	Confident	44 Å²	44	73 Å²	73	31%	0.308	39%	0.392	S	S	.	.	H	α-helix	trans	-63.1	-43.3	175.8	-50.7	0	0	0	0	111.8	Q589 R590 N595 H596	Q589-S592 WeakPolarHBondContact O-CB 3.34Å; Q589-S592 PolarHBondContact O-N 3.49Å; R590-S592 VanDerWaalsContact C-N 3.31Å; R590-S592 PolarHBondContact O-N 3.23Å; S592-N595 PolarHBondContact O-N 3.03Å; S592-H596 WeakPolarHBondContact O-CB 3.45Å; S592-H596 PolarHBondContact O-N 3.49Å
593	L	89.8	Confident	84.3	Confident	20 Å²	20	73.8 Å²	73.8	11%	0.105	38%	0.383	C	S	.	.	H	α-helix	trans	-62.7	-44.6	174	179.1	65.1	0	0	0	112.1	E579 C580 F587 Q589 R590 N595 H596 H597	E579-L593 VanDerWaalsContact O-CD2 3.32Å; E579-L593 WeakPolarHBondContact O-CD2 3.22Å; C580-L593 HydrophobicContact CB-CD1 3.57Å; F587-L593 HydrophobicContact CB-CB 4.33Å; F587-L593 HydrophobicContact CD2-CB 4.11Å; F587-L593 HydrophobicContact CD2-CD1 3.7Å; F587-L593 HydrophobicContact CE2-CD1 3.92Å; F587-L593 HydrophobicContact CG-CB 4.3Å; Q589-L593 PolarHBondContact O-N 3.18Å; R590-L593 PolarHBondContact O-N 2.9Å; L593-N595 VanDerWaalsContact C-N 3.34Å; L593-N595 PolarHBondContact O-N 3.09Å; L593-H596 PolarHBondContact O-N 3.46Å; L593-H596 VanDerWaalsContact O-N 3.16Å; L593-H597 WeakPolarHBondContact CD1-NE2 3.35Å; L593-H597 PolarHBondContact O-CD2 2.86Å; L593-H597 VanDerWaalsContact O-CD2 3.3Å; L593-H597 PolarHBondContact O-N 3.08Å
594	T	88.4	Confident	82.9	Confident	76 Å²	76	75.6 Å²	75.6	47%	0.466	39%	0.39	S	S	.	.	H	α-helix	trans	-64.2	-37.2	178.6	-60.2	0	0	0	0	112.2	R590 S591	R590-T594 PolarHBondContact O-N 3.38Å; R590-T594 PolarHBondContact O-OG1 3.22Å; R590-T594 VanDerWaalsContact O-OG1 3.06Å; S591-T594 PolarHBondContact O-N 3.35Å
595	N	87.9	Confident	81.6	Confident	104 Å²	104	77.2 Å²	77.2	56%	0.556	40%	0.395	S	S	*	.	H	α-helix	trans	-69.1	-38.2	172.3	-73.3	4.2	0	0	0	111.5	S591 S592 L593 K598	S591-N595 PolarHBondContact O-N 3.4Å; S592-N595 PolarHBondContact O-N 3.03Å; L593-N595 VanDerWaalsContact C-N 3.34Å; L593-N595 PolarHBondContact O-N 3.09Å; N595-K598 WeakPolarHBondContact O-CB 3.14Å; N595-K598 PolarHBondContact O-N 2.88Å
596	H	88.9	Confident	80.2	Confident	20 Å²	20	77.2 Å²	77.2	9%	0.093	40%	0.4	C	S	.	.	H	α-helix	trans	-66.6	-36.5	176	-179.6	44.2	0	0	0	113	C583 F587 S592 L593 K598 I599 H600	C583-H596 PolarHBondContact SG-NE2 3.17Å; F587-H596 HydrophobicContact CE1-CB 4.09Å; F587-H596 HydrophobicContact CE2-CB 4.11Å; F587-H596 AromaticContact CE2-CD2 3.43Å; F587-H596 VanDerWaalsContact CE2-CD2 3.43Å; F587-H596 WeakPolarHBondContact CE2-CD2 3.43Å; F587-H596 AromaticContact CE2-CG 3.98Å; F587-H596 HydrophobicContact CZ-CB 3.58Å; F587-H596 AromaticContact CZ-CD2 3.32Å; F587-H596 WeakPolarHBondContact CZ-CD2 3.4Å; F587-H596 AromaticContact CZ-CG 3.46Å; F587-H596 VanDerWaalsContact CZ-CG 3.46Å; S592-H596 WeakPolarHBondContact O-CB 3.45Å; S592-H596 PolarHBondContact O-N 3.49Å; L593-H596 PolarHBondContact O-N 3.46Å; L593-H596 VanDerWaalsContact O-N 3.16Å; H596-K598 PolarHBondContact O-N 3.36Å; H596-I599 WeakPolarHBondContact O-CB 3.42Å; H596-I599 PolarHBondContact O-N 3.24Å; H596-I599 VanDerWaalsContact O-N 3.09Å; H596-H600 AromaticContact CD2-NE2 3.75Å; H596-H600 AromaticContact CE1-CD2 3.83Å; H596-H600 AromaticContact CE1-NE2 3.18Å; H596-H600 PolarHBondContact CE1-NE2 3.33Å; H596-H600 AromaticContact NE2-CD2 3.8Å; H596-H600 AromaticContact NE2-NE2 2.99Å; H596-H600 PolarHBondContact NE2-NE2 3.39Å; H596-H600 PolarHBondContact O-CD2 3.17Å
597	H	86.3	Confident	78.6	Confident	82 Å²	82	77.9 Å²	77.9	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-59.5	-27.4	173.7	-80.3	-153.1	0	0	0	113	C580 L593 I599 H600 T601	C580-H597 VanDerWaalsContact SG-CD2 3.55Å; L593-H597 WeakPolarHBondContact CD1-NE2 3.35Å; L593-H597 PolarHBondContact O-CD2 2.86Å; L593-H597 VanDerWaalsContact O-CD2 3.3Å; L593-H597 PolarHBondContact O-N 3.08Å; H597-I599 VanDerWaalsContact C-N 3.33Å; H597-H600 PolarHBondContact O-N 3.1Å; H597-T601 PolarHBondContact O-N 3.15Å; H597-T601 PolarHBondContact O-OG1 3.41Å
598	K	86.6	Confident	77	Confident	113 Å²	113	78.8 Å²	78.8	49%	0.491	41%	0.414	S	S	.	.	H	α-helix	trans	-64.3	-39.3	174.5	-64.7	-172.3	172.3	-164.3	0	112.5	N595 H596 H600 T601 E602	N595-K598 WeakPolarHBondContact O-CB 3.14Å; N595-K598 PolarHBondContact O-N 2.88Å; H596-K598 PolarHBondContact O-N 3.36Å; K598-H600 VanDerWaalsContact C-N 3.29Å; K598-H600 PolarHBondContact O-N 3.05Å; K598-T601 WeakPolarHBondContact CA-OG1 3.33Å; K598-T601 CarbonylContact O-C 3.22Å; K598-T601 PolarHBondContact O-N 3.49Å; K598-T601 VanDerWaalsContact O-N 3.09Å; K598-T601 PolarHBondContact O-OG1 3.1Å; K598-E602 WeakPolarHBondContact O-CB 3.29Å; K598-E602 VanDerWaalsContact O-CG 3.31Å; K598-E602 WeakPolarHBondContact O-CG 3.46Å; K598-E602 PolarHBondContact O-N 3Å
599	I	85.7	Confident	75.4	Confident	77 Å²	77	83.3 Å²	83.3	40%	0.395	44%	0.436	S	S	.	.	H	α-helix	trans	-59.4	-44.4	179.4	-54.6	175.1	0	0	0	109.5	H596 H597 E602 E603	H596-I599 WeakPolarHBondContact O-CB 3.42Å; H596-I599 PolarHBondContact O-N 3.24Å; H596-I599 VanDerWaalsContact O-N 3.09Å; H597-I599 VanDerWaalsContact C-N 3.33Å; I599-E602 PolarHBondContact O-N 3.43Å; I599-E603 HydrophobicContact CG2-CG 4.41Å; I599-E603 WeakPolarHBondContact CG2-OE1 3.45Å; I599-E603 WeakPolarHBondContact O-CB 3.44Å; I599-E603 WeakPolarHBondContact O-CG 3.47Å; I599-E603 PolarHBondContact O-N 2.82Å
600	H	81.5	Confident	73.8	Confident	32 Å²	32	84.5 Å²	84.5	15%	0.148	45%	0.449	C	S	.	.	H	α-helix	trans	-61.2	-45.6	173.6	-65.5	-79.5	0	0	0	112.3	C583 H596 H597 K598 E602 E603 D604	C583-H600 PolarHBondContact SG-NE2 3.24Å; C583-H600 VanDerWaalsContact SG-NE2 3.45Å; H596-H600 AromaticContact CD2-NE2 3.75Å; H596-H600 AromaticContact CE1-CD2 3.83Å; H596-H600 AromaticContact CE1-NE2 3.18Å; H596-H600 PolarHBondContact CE1-NE2 3.33Å; H596-H600 AromaticContact NE2-CD2 3.8Å; H596-H600 AromaticContact NE2-NE2 2.99Å; H596-H600 PolarHBondContact NE2-NE2 3.39Å; H596-H600 PolarHBondContact O-CD2 3.17Å; H597-H600 PolarHBondContact O-N 3.1Å; K598-H600 VanDerWaalsContact C-N 3.29Å; K598-H600 PolarHBondContact O-N 3.05Å; H600-E602 VanDerWaalsContact C-N 3.28Å; H600-E602 PolarHBondContact O-N 3.4Å; H600-E603 PolarHBondContact O-N 3.39Å; H600-D604 VanDerWaalsContact O-CB 3.31Å; H600-D604 WeakPolarHBondContact O-CB 3.25Å; H600-D604 PolarHBondContact O-N 3.08Å
601	T	74.7	Confident	72	Confident	84 Å²	84	84.7 Å²	84.7	52%	0.515	46%	0.456	S	S	.	.	H	α-helix	trans	-66.6	-28.2	177.8	52.7	0	0	0	0	113.8	H597 K598 S605	H597-T601 PolarHBondContact O-N 3.15Å; H597-T601 PolarHBondContact O-OG1 3.41Å; K598-T601 WeakPolarHBondContact CA-OG1 3.33Å; K598-T601 CarbonylContact O-C 3.22Å; K598-T601 PolarHBondContact O-N 3.49Å; K598-T601 VanDerWaalsContact O-N 3.09Å; K598-T601 PolarHBondContact O-OG1 3.1Å; T601-S605 WeakPolarHBondContact O-CB 3.29Å; T601-S605 PolarHBondContact O-N 2.82Å; T601-S605 PolarHBondContact O-OG 2.91Å
602	E	69.9	Low	69.9	Low	112 Å²	112	91.1 Å²	91.1	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-77.3	-43.7	176.1	-72.1	159.2	-159	0	0	110.4	K598 I599 H600 S605 L606	K598-E602 WeakPolarHBondContact O-CB 3.29Å; K598-E602 VanDerWaalsContact O-CG 3.31Å; K598-E602 WeakPolarHBondContact O-CG 3.46Å; K598-E602 PolarHBondContact O-N 3Å; I599-E602 PolarHBondContact O-N 3.43Å; H600-E602 VanDerWaalsContact C-N 3.28Å; H600-E602 PolarHBondContact O-N 3.4Å; E602-S605 PolarHBondContact O-N 3.21Å; E602-L606 WeakPolarHBondContact O-CG 3.38Å; E602-L606 PolarHBondContact O-N 3.5Å; E602-L606 VanDerWaalsContact O-N 3.13Å
603	E	60.9	Low	69	Low	90 Å²	90	93.5 Å²	93.5	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-39	172.7	-75.6	-179.2	-151.9	0	0	113.1	I599 H600 L606 K607	I599-E603 HydrophobicContact CG2-CG 4.41Å; I599-E603 WeakPolarHBondContact CG2-OE1 3.45Å; I599-E603 WeakPolarHBondContact O-CB 3.44Å; I599-E603 WeakPolarHBondContact O-CG 3.47Å; I599-E603 PolarHBondContact O-N 2.82Å; H600-E603 PolarHBondContact O-N 3.39Å; E603-L606 PolarHBondContact O-N 2.87Å; E603-K607 WeakPolarHBondContact O-CD 3.16Å; E603-K607 VanDerWaalsContact O-CE 3.26Å; E603-K607 WeakPolarHBondContact O-CE 3.44Å; E603-K607 VanDerWaalsContact O-CG 3.27Å; E603-K607 WeakPolarHBondContact O-CG 3.26Å; E603-K607 PolarHBondContact O-N 3.37Å; E603-K607 IonicContact OE2-NZ 3.79Å
604	D	58.8	Low	67.9	Low	92 Å²	92	97.4 Å²	97.4	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-75.5	-27.6	179.3	-68.1	-18.2	0	0	0	112.3	H600 K607 A608	H600-D604 VanDerWaalsContact O-CB 3.31Å; H600-D604 WeakPolarHBondContact O-CB 3.25Å; H600-D604 PolarHBondContact O-N 3.08Å; D604-K607 IonicContact OD1-NZ 2.93Å; D604-K607 PolarHBondContact OD1-NZ 2.96Å; D604-A608 PolarHBondContact O-N 2.63Å
605	S	58.7	Low	66.7	Low	71 Å²	71	98.6 Å²	98.6	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-48.1	169.9	-59.5	0	0	0	0	110.5	T601 E602 K607 A608 D609	T601-S605 WeakPolarHBondContact O-CB 3.29Å; T601-S605 PolarHBondContact O-N 2.82Å; T601-S605 PolarHBondContact O-OG 2.91Å; E602-S605 PolarHBondContact O-N 3.21Å; S605-K607 PolarHBondContact O-N 3.12Å; S605-A608 WeakPolarHBondContact O-CB 3.14Å; S605-A608 PolarHBondContact O-N 2.91Å; S605-D609 PolarHBondContact O-N 3.04Å
606	L	57.4	Low	65.5	Low	122 Å²	122	98.2 Å²	98.2	64%	0.639	52%	0.524	S	S	*	.	H	α-helix	trans	-63.8	-24.2	-179.4	-71.7	166.4	0	0	0	114	E602 E603	E602-L606 WeakPolarHBondContact O-CG 3.38Å; E602-L606 PolarHBondContact O-N 3.5Å; E602-L606 VanDerWaalsContact O-N 3.13Å; E603-L606 PolarHBondContact O-N 2.87Å
607	K	55.6	Low	64	Low	105 Å²	105	103.1 Å²	103.1	46%	0.457	55%	0.551	S	S	.	*	H	α-helix	trans	-81.7	-20.8	174.7	-67.1	162.3	-153.2	154.8	0	113.3	E603 D604 S605 T610	E603-K607 WeakPolarHBondContact O-CD 3.16Å; E603-K607 VanDerWaalsContact O-CE 3.26Å; E603-K607 WeakPolarHBondContact O-CE 3.44Å; E603-K607 VanDerWaalsContact O-CG 3.27Å; E603-K607 WeakPolarHBondContact O-CG 3.26Å; E603-K607 PolarHBondContact O-N 3.37Å; E603-K607 IonicContact OE2-NZ 3.79Å; D604-K607 IonicContact OD1-NZ 2.93Å; D604-K607 PolarHBondContact OD1-NZ 2.96Å; S605-K607 PolarHBondContact O-N 3.12Å; K607-T610 PolarHBondContact O-OG1 3.49Å; K607-T610 VanDerWaalsContact O-OG1 3.06Å
608	A	52.1	Low	62.5	Low	61 Å²	61	104.5 Å²	104.5	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-75	-41.7	176.9	0	0	0	0	0	111.1	D604 S605 T610 H611	D604-A608 PolarHBondContact O-N 2.63Å; S605-A608 WeakPolarHBondContact O-CB 3.14Å; S605-A608 PolarHBondContact O-N 2.91Å; A608-T610 PolarHBondContact O-N 2.67Å; A608-H611 PolarHBondContact O-N 3.39Å
609	D	51.2	Low	60.8	Low	134 Å²	134	103.9 Å²	103.9	72%	0.717	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-10.8	-179.1	-63.8	-29.1	0	0	0	113.7	S605	S605-D609 PolarHBondContact O-N 3.04Å
610	T	52.8	Low	58.9	Low	104 Å²	104	106 Å²	106	64%	0.638	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	8.8	176.9	53.9	0	0	0	0	114.5	K607 A608	K607-T610 PolarHBondContact O-OG1 3.49Å; K607-T610 VanDerWaalsContact O-OG1 3.06Å; A608-T610 PolarHBondContact O-N 2.67Å
611	H	49.8	Very low	57	Low	172 Å²	172	112.2 Å²	112.2	80%	0.796	62%	0.617	S	S	*	*			trans	-129.1	54.1	-179.7	-88.3	-58.5	0	0	0	112.4	A608	A608-H611 PolarHBondContact O-N 3.39Å
612	V	42.3	Very low	55.4	Low	199 Å²	199	114.7 Å²	114.7	100%	1.206	63%	0.626	S	S	*	*			trans	-128.1	0	171.6	-176.9	0	0	0	0	109.3

Retrieved 612 of 612 residues in 360.3 ms (Link to these results)

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